A0A077ZQ17_TRITR Loading...

DUF4117 and Ftsk gamma and FtsK SpoIIIE domain co ntaining protein

AlphaFold DB , UniProt , Accession A0A077ZQ17, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 1,210 aa.

						>A0A077ZQ17_TRITR|A0A077ZQ17
MALILTSCGLAAINADDIWYFASGGVIGSLLSTTLQPLLHSSGGTIALLCVWAAGLTLFTGWSWVTIAEKLGGWILNILTFASNRTRRDDTWVDEDEYEDDEEYEDENHGKQHESRRARILRGALARRKRLAEKFINPMGRQTDAALFSGKRMDDDEEITYTARGVAADPDDVLFSGNRATQPEYDEYDPLLNGAPITEPVAVAAAATTATQSWAAPVEPVTQTPPVASVDVPPAQPTVAWQPVPGPQTGEPVIAPAPEGYPQQSQYAQPAVQYNEPLQQPVQPQQPYYAPAAEQPAQQPYYAPAPEQPVAGNAWQAEEQQSTFAPQSTYQTEQTYQQPAAQEPLYQQPQPVEQQPVVEPEPVVEETKPARPPLYYFEEVEEKRAREREQLAAWYQPIPEPVKEPEPIKSSLKAPSVAAVPPVEAAAAVSPLASGVKKATLATGAAATVAAPVFSLANSGGPRPQVKEGIGPQLPRPKRIRVPTRRELASYGIKLPSQRAAEEKAREAQRNQYDSGDQYNDDEIDAMQQDELARQFAQTQQQRYGEQYQHDVPVNAEDADAAAEAELARQFAQTQQQRYSGEQPAGANPFSLDDFEFSPMKALLDDGPHEPLFTPIVEPVQQPQQPVAPQQQYQQPQQPVPPQPQYQQPQQPVAPQPQYQQPQQPVAPQQQYQQPQQPVAPQQQYQQPQQPVAPQPQDTLLHPLLMRNGDSRPLHKPTTPLPSLDLLTPPPSEVEPVDTFALEQMARLVEARLADFRIKADVVNYSPGPVITRFELNLAPGVKAARISNLSRDLARSLSTVAVRVVEVIPGKPYVGLELPNKKRQTVYLREVLDNAKFRDNPSPLTVVLGKDIAGEPVVADLAKMPHLLVAGTTGSGKSVGVNAMILSMLYKAQPEDVRFIMIDPKMLELSVYEGIPHLLTEVVTDMKDAANALRWCVNEMERRYKLMSALGVRNLAGYNEKIAEADRMMRPIPDPYWKPGDSMDAQHPVLKKEPYIVVLVDEFADLMMTVGKKVEELIARLAQKARAAGIHLVLATQRPSVDVITGLIKANIPTRIAFTVSSKIDSRTILDQAGAESLLGMGDMLYSGPNSTLPVRVHGAFVRDQEVHAVVQDWKARGRPQYVDGITSDSESEGGAGGFDGAEELDPLFDQAVQFVTEKRKASISGVQRQFRIGYNRAARIIEQMEAQGIVSEQGHNGNREVLAPPPFD
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	81.2	Confident	88.2	Confident	174 Å²	174	51.6 Å²	51.6	86%	0.857	30%	0.298	S	S	*	.				0	-68.5	0	-85.5	-57.3	175.8	0	0	113.3	L3 I4 L5	M1-L3 VanDerWaalsContact C-N 3.33Å; M1-L3 PolarHBondContact O-N 2.83Å; M1-I4 PolarHBondContact O-N 3.01Å; M1-L5 PolarHBondContact O-N 2.77Å; M1-L5 VanDerWaalsContact O-N 3.13Å
2	A	85	Confident	88	Confident	46 Å²	46	48.7 Å²	48.7	38%	0.38	28%	0.284	S	S	.	.	H	α-helix	trans	-51	-46	-173.4	0	0	0	0	0	114.3	I4 L5 T6 V51	A2-I4 PolarHBondContact O-N 3.45Å; A2-L5 PolarHBondContact O-N 2.84Å; A2-T6 WeakPolarHBondContact O-CB 3.42Å; A2-T6 WeakPolarHBondContact O-CG2 3.37Å; A2-T6 PolarHBondContact O-N 3.21Å; A2-T6 PolarHBondContact O-OG1 2.75Å; A2-V51 HydrophobicContact CB-CG1 4.49Å
3	L	89.2	Confident	87.6	Confident	30 Å²	30	47.8 Å²	47.8	16%	0.157	28%	0.278	C	S	.	.	H	α-helix	trans	-53.3	-44.9	172.6	-83.1	171.7	0	0	0	114.1	M1 T6 S7 W52 L56 F59	M1-L3 VanDerWaalsContact C-N 3.33Å; M1-L3 PolarHBondContact O-N 2.83Å; L3-T6 WeakPolarHBondContact CA-OG1 3.44Å; L3-T6 PolarHBondContact O-OG1 3.39Å; L3-T6 VanDerWaalsContact O-OG1 3.14Å; L3-S7 VanDerWaalsContact O-CB 3.24Å; L3-S7 WeakPolarHBondContact O-CB 3.38Å; L3-S7 PolarHBondContact O-N 3.16Å; L3-S7 PolarHBondContact O-OG 2.65Å; L3-W52 HydrophobicContact CD2-CD2 4.36Å; L3-W52 HydrophobicContact CD2-CG 4.2Å; L3-W52 WeakPolarHBondContact CD2-O 3.44Å; L3-L56 HydrophobicContact CD1-CD1 4.5Å; L3-L56 HydrophobicContact CD2-CB 4.06Å; L3-L56 HydrophobicContact CD2-CD1 4.2Å; L3-F59 HydrophobicContact CD1-CB 3.63Å; L3-F59 HydrophobicContact CD1-CD1 3.91Å; L3-F59 HydrophobicContact CD1-CG 3.81Å
4	I	89.4	Confident	87.2	Confident	101 Å²	101	51.6 Å²	51.6	52%	0.518	30%	0.296	S	S	.	.	H	α-helix	trans	-69.7	-48.3	-175.7	-57.8	168.2	0	0	0	109.6	M1 A2 T6 S7 C8	M1-I4 PolarHBondContact O-N 3.01Å; A2-I4 PolarHBondContact O-N 3.45Å; I4-T6 VanDerWaalsContact C-N 3.34Å; I4-T6 PolarHBondContact O-N 3.34Å; I4-S7 PolarHBondContact O-N 3.35Å; I4-C8 PolarHBondContact O-N 2.96Å; I4-C8 PolarHBondContact O-SG 3.2Å
5	L	89.5	Confident	86.6	Confident	75 Å²	75	51.6 Å²	51.6	39%	0.393	31%	0.305	S	S	.	.	H	α-helix	trans	-59.6	-44.8	178	-63.2	176.2	0	0	0	111.6	M1 A2 G9 I27 L31	M1-L5 PolarHBondContact O-N 2.77Å; M1-L5 VanDerWaalsContact O-N 3.13Å; A2-L5 PolarHBondContact O-N 2.84Å; L5-G9 PolarHBondContact O-N 2.82Å; L5-I27 HydrophobicContact CD2-CG2 3.69Å; L5-L31 VanDerWaalsContact O-CD2 3.31Å; L5-L31 WeakPolarHBondContact O-CD2 3.49Å
6	T	90.8	Very high	85.3	Confident	5 Å²	5	58.3 Å²	58.3	3%	0.031	34%	0.339	C	S	.	.	H	α-helix	trans	-71.2	-38	179.2	49	0	0	0	0	113	A2 L3 I4 G9 L10 L48 V51 W52	A2-T6 WeakPolarHBondContact O-CB 3.42Å; A2-T6 WeakPolarHBondContact O-CG2 3.37Å; A2-T6 PolarHBondContact O-N 3.21Å; A2-T6 PolarHBondContact O-OG1 2.75Å; L3-T6 WeakPolarHBondContact CA-OG1 3.44Å; L3-T6 PolarHBondContact O-OG1 3.39Å; L3-T6 VanDerWaalsContact O-OG1 3.14Å; I4-T6 VanDerWaalsContact C-N 3.34Å; I4-T6 PolarHBondContact O-N 3.34Å; T6-G9 PolarHBondContact O-N 3.14Å; T6-L10 WeakPolarHBondContact O-CB 3.38Å; T6-L10 VanDerWaalsContact O-CG 3.26Å; T6-L10 WeakPolarHBondContact O-CG 3.47Å; T6-L10 PolarHBondContact O-N 3.39Å; T6-L48 HydrophobicContact CG2-CD2 3.94Å; T6-V51 HydrophobicContact CG2-CB 3.76Å; T6-V51 HydrophobicContact CG2-CG1 3.63Å; T6-W52 HydrophobicContact CG2-CB 4.49Å; T6-W52 WeakPolarHBondContact OG1-CA 3.48Å
7	S	90.1	Very high	84.6	Confident	52 Å²	52	61.6 Å²	61.6	36%	0.364	36%	0.355	S	S	.	.	H	α-helix	trans	-62.1	-45.4	174	-57.7	0	0	0	0	111.4	L3 I4 G9 L10 A11 W52	L3-S7 VanDerWaalsContact O-CB 3.24Å; L3-S7 WeakPolarHBondContact O-CB 3.38Å; L3-S7 PolarHBondContact O-N 3.16Å; L3-S7 PolarHBondContact O-OG 2.65Å; I4-S7 PolarHBondContact O-N 3.35Å; S7-G9 VanDerWaalsContact C-N 3.35Å; S7-G9 PolarHBondContact O-N 2.92Å; S7-L10 PolarHBondContact O-N 2.93Å; S7-A11 WeakPolarHBondContact O-CB 3.45Å; S7-A11 PolarHBondContact O-N 3.22Å; S7-W52 PolarHBondContact OG-NE1 3.2Å
8	C	90.4	Very high	83.1	Confident	30 Å²	30	64.2 Å²	64.2	20%	0.203	37%	0.366	C	S	.	.	H	α-helix	trans	-61.5	-41.6	173.8	-67.1	0	0	0	0	112	I4 A12 G24 I27 G28	I4-C8 PolarHBondContact O-N 2.96Å; I4-C8 PolarHBondContact O-SG 3.2Å; C8-A12 WeakPolarHBondContact O-CB 3.47Å; C8-A12 PolarHBondContact O-N 2.59Å; C8-G24 WeakPolarHBondContact CB-O 3.46Å; C8-G24 VanDerWaalsContact O-CA 3.27Å; C8-G24 WeakPolarHBondContact O-CA 3.32Å; C8-I27 HydrophobicContact CB-CB 4.36Å; C8-I27 HydrophobicContact CB-CG2 4.05Å; C8-G28 WeakPolarHBondContact O-CA 3.05Å
9	G	87.8	Confident	81.9	Confident	0 Å²	0	73.2 Å²	73.2	0%	0	39%	0.393	C	S	.	.	H	α-helix	trans	-64.1	-41.7	175.4	0	0	0	0	0	113.8	L5 T6 S7 A12 I13	L5-G9 PolarHBondContact O-N 2.82Å; T6-G9 PolarHBondContact O-N 3.14Å; S7-G9 VanDerWaalsContact C-N 3.35Å; S7-G9 PolarHBondContact O-N 2.92Å; G9-A12 PolarHBondContact O-N 2.97Å; G9-I13 VanDerWaalsContact O-CG1 3.31Å; G9-I13 WeakPolarHBondContact O-CG1 3.24Å; G9-I13 PolarHBondContact O-N 3.29Å
10	L	89.3	Confident	80.8	Confident	25 Å²	25	80.2 Å²	80.2	13%	0.131	42%	0.416	C	S	.	.	H	α-helix	trans	-68.2	-41.2	179.6	-74.1	167.3	0	0	0	111.4	T6 S7 I13 N14 T45 L48 L49 W52	T6-L10 WeakPolarHBondContact O-CB 3.38Å; T6-L10 VanDerWaalsContact O-CG 3.26Å; T6-L10 WeakPolarHBondContact O-CG 3.47Å; T6-L10 PolarHBondContact O-N 3.39Å; S7-L10 PolarHBondContact O-N 2.93Å; L10-I13 PolarHBondContact O-N 3.49Å; L10-N14 WeakPolarHBondContact O-CB 3.47Å; L10-N14 PolarHBondContact O-N 2.99Å; L10-N14 PolarHBondContact O-ND2 3.31Å; L10-T45 HydrophobicContact CD2-CG2 4.01Å; L10-L48 HydrophobicContact CD1-CB 4.42Å; L10-L48 HydrophobicContact CD2-CB 3.67Å; L10-L48 HydrophobicContact CD2-CD1 4.32Å; L10-L48 HydrophobicContact CG-CB 3.81Å; L10-L48 HydrophobicContact CG-CD1 4.31Å; L10-L49 HydrophobicContact CD1-CD2 3.9Å; L10-L49 HydrophobicContact CD1-CG 4.41Å; L10-L49 HydrophobicContact CD2-CD2 4.14Å; L10-L49 HydrophobicContact CD2-CG 3.93Å; L10-W52 HydrophobicContact CD1-CB 4.12Å; L10-W52 HydrophobicContact CD1-CG 4.13Å
11	A	87.6	Confident	79.8	Confident	30 Å²	30	83.7 Å²	83.7	25%	0.248	43%	0.428	C	S	.	.	H	α-helix	trans	-56.1	-59.2	170.7	0	0	0	0	0	110.3	S7 I13 N14 A15 S23	S7-A11 WeakPolarHBondContact O-CB 3.45Å; S7-A11 PolarHBondContact O-N 3.22Å; A11-I13 PolarHBondContact O-N 2.85Å; A11-N14 PolarHBondContact O-N 3.18Å; A11-A15 PolarHBondContact O-N 3.3Å; A11-S23 PolarHBondContact O-OG 3.37Å
12	A	85.5	Confident	79.3	Confident	16 Å²	16	76.7 Å²	76.7	13%	0.132	40%	0.398	C	S	.	.	H	α-helix	trans	-66.7	6.8	-177.5	0	0	0	0	0	116.1	C8 G9 A22 S23 G28	C8-A12 WeakPolarHBondContact O-CB 3.47Å; C8-A12 PolarHBondContact O-N 2.59Å; G9-A12 PolarHBondContact O-N 2.97Å; A12-A22 HydrophobicContact CB-CB 4.29Å; A12-S23 PolarHBondContact N-OG 3.32Å; A12-G28 VanDerWaalsContact CB-C 3.45Å
13	I	83.6	Confident	79	Confident	38 Å²	38	75.9 Å²	75.9	20%	0.195	39%	0.389	C	S	.	.	H	α-helix	trans	-120	-27.6	171.5	-65.4	172.9	0	0	0	112	G9 L10 A11 T45 L48	G9-I13 VanDerWaalsContact O-CG1 3.31Å; G9-I13 WeakPolarHBondContact O-CG1 3.24Å; G9-I13 PolarHBondContact O-N 3.29Å; L10-I13 PolarHBondContact O-N 3.49Å; A11-I13 PolarHBondContact O-N 2.85Å; I13-T45 VanDerWaalsContact CG2-OG1 3.29Å; I13-T45 WeakPolarHBondContact CG2-OG1 3.5Å; I13-L48 HydrophobicContact CD1-CD1 3.81Å
14	N	81.8	Confident	78.6	Confident	101 Å²	101	74.9 Å²	74.9	54%	0.54	39%	0.386	S	S	.	.	H	α-helix	trans	-125.9	-9.6	-168.5	-52.5	-87.7	0	0	0	114.9	L10 A11 T45	L10-N14 WeakPolarHBondContact O-CB 3.47Å; L10-N14 PolarHBondContact O-N 2.99Å; L10-N14 PolarHBondContact O-ND2 3.31Å; A11-N14 PolarHBondContact O-N 3.18Å; N14-T45 PolarHBondContact ND2-OG1 3.44Å; N14-T45 PolarHBondContact OD1-OG1 3.07Å
15	A	78.3	Confident	78.4	Confident	51 Å²	51	71.6 Å²	71.6	42%	0.421	38%	0.377	S	S	.	.	S	Bend	trans	-116.5	131.5	176.2	0	0	0	0	0	110.5	A11 S23	A11-A15 PolarHBondContact O-N 3.3Å; A15-S23 PolarHBondContact O-OG 3.08Å
16	D	66.1	Low	78.2	Confident	159 Å²	159	73 Å²	73	85%	0.85	39%	0.389	S	S	*	.			trans	-53.5	148.1	-178.1	-74.1	-46.9	0	0	0	113	I18	D16-I18 PolarHBondContact O-N 3.43Å
17	D	73.4	Confident	78	Confident	114 Å²	114	76.8 Å²	76.8	61%	0.61	41%	0.408	S	S	*	.			trans	-61	128.8	-178.7	-68.7	-29.2	0	0	0	111.6	W19 F21 A22	D17-W19 PolarHBondContact O-N 3.5Å; D17-W19 VanDerWaalsContact O-N 3.07Å; D17-F21 CarbonylContact C-O 3.53Å; D17-F21 WeakPolarHBondContact CA-O 3.38Å; D17-A22 WeakPolarHBondContact OD1-CA 3.18Å
18	I	56.5	Low	77.8	Confident	109 Å²	109	74.3 Å²	74.3	56%	0.559	39%	0.391	S	S	*	.	B	Isolated β-bridge	trans	-81.9	96.3	-178	-64.9	177.5	0	0	0	108.2	D16 Y20 F21	D16-I18 PolarHBondContact O-N 3.43Å; I18-Y20 PolarHBondContact O-N 3.39Å; I18-F21 PolarHBondContact N-O 3.14Å; I18-F21 PolarHBondContact O-N 3.36Å; I18-F21 VanDerWaalsContact O-N 3.14Å
19	W	60.3	Low	77.4	Confident	234 Å²	234	74.8 Å²	74.8	89%	0.886	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	61	-60.8	-175.8	-59	88.3	0	0	0	115.2	D17	D17-W19 PolarHBondContact O-N 3.5Å; D17-W19 VanDerWaalsContact O-N 3.07Å
20	Y	60.7	Low	77.3	Confident	213 Å²	213	80.1 Å²	80.1	84%	0.835	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-146.7	-2.1	-180	-67.7	-72.5	0	0	0	114.1	I18	I18-Y20 PolarHBondContact O-N 3.39Å
21	F	59.8	Low	77.1	Confident	154 Å²	154	81.2 Å²	81.2	68%	0.675	43%	0.428	S	S	*	.	B	Isolated β-bridge	trans	-114	141.4	179.9	-71.4	-86.6	0	0	0	110.7	D17 I18 S23	D17-F21 CarbonylContact C-O 3.53Å; D17-F21 WeakPolarHBondContact CA-O 3.38Å; I18-F21 PolarHBondContact N-O 3.14Å; I18-F21 PolarHBondContact O-N 3.36Å; I18-F21 VanDerWaalsContact O-N 3.14Å; F21-S23 PolarHBondContact O-N 2.98Å
22	A	70.4	Confident	76.9	Confident	27 Å²	27	80.3 Å²	80.3	22%	0.223	42%	0.42	C	S	.	.			trans	-50.9	132.4	166.1	0	0	0	0	0	109.5	A12 D17 G24 G25	A12-A22 HydrophobicContact CB-CB 4.29Å; D17-A22 WeakPolarHBondContact OD1-CA 3.18Å; A22-G24 PolarHBondContact O-N 2.94Å; A22-G25 WeakPolarHBondContact O-CA 3.39Å; A22-G25 PolarHBondContact O-N 3.03Å
23	S	79	Confident	76.8	Confident	29 Å²	29	83.9 Å²	83.9	20%	0.203	44%	0.44	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-22.8	-176.9	49.8	0	0	0	0	113.9	A11 A12 A15 F21	A11-S23 PolarHBondContact O-OG 3.37Å; A12-S23 PolarHBondContact N-OG 3.32Å; A15-S23 PolarHBondContact O-OG 3.08Å; F21-S23 PolarHBondContact O-N 2.98Å
24	G	80.7	Confident	76.8	Confident	9 Å²	9	86 Å²	86	9%	0.093	46%	0.455	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92	8.7	170.6	0	0	0	0	0	116.4	C8 A22 G28	C8-G24 WeakPolarHBondContact CB-O 3.46Å; C8-G24 VanDerWaalsContact O-CA 3.27Å; C8-G24 WeakPolarHBondContact O-CA 3.32Å; A22-G24 PolarHBondContact O-N 2.94Å; G24-G28 WeakPolarHBondContact O-CA 3.49Å; G24-G28 PolarHBondContact O-N 3.34Å
25	G	85.4	Confident	76.8	Confident	32 Å²	32	82.5 Å²	82.5	33%	0.33	44%	0.436	S	S	.	.	H	α-helix	trans	60.7	-163.4	-173.7	0	0	0	0	0	114	A22 I27 G28 S29	A22-G25 WeakPolarHBondContact O-CA 3.39Å; A22-G25 PolarHBondContact O-N 3.03Å; G25-I27 PolarHBondContact O-N 3.29Å; G25-G28 PolarHBondContact O-N 2.92Å; G25-S29 PolarHBondContact O-N 3.33Å; G25-S29 PolarHBondContact O-OG 3.43Å
26	V	85.3	Confident	76.7	Confident	105 Å²	105	85.1 Å²	85.1	64%	0.636	44%	0.44	S	S	*	.	H	α-helix	trans	-59.9	-34.7	-179.7	-176.9	0	0	0	0	112.1	S29 L30	V26-S29 WeakPolarHBondContact CA-OG 3.43Å; V26-S29 PolarHBondContact O-OG 3.16Å; V26-L30 HydrophobicContact CG1-CD1 4.15Å; V26-L30 WeakPolarHBondContact O-CB 3.37Å; V26-L30 VanDerWaalsContact O-CG 3.29Å; V26-L30 WeakPolarHBondContact O-CG 3.33Å; V26-L30 PolarHBondContact O-N 2.79Å
27	I	85.2	Confident	77.4	Confident	85 Å²	85	82.3 Å²	82.3	44%	0.436	43%	0.43	S	S	.	.	H	α-helix	trans	-65.7	-48.4	177.1	-63.1	176.1	0	0	0	110.1	L5 C8 G25 L30 L31	L5-I27 HydrophobicContact CD2-CG2 3.69Å; C8-I27 HydrophobicContact CB-CB 4.36Å; C8-I27 HydrophobicContact CB-CG2 4.05Å; G25-I27 PolarHBondContact O-N 3.29Å; I27-L30 PolarHBondContact O-N 2.87Å; I27-L31 PolarHBondContact O-N 2.83Å; I27-L31 VanDerWaalsContact O-N 3.11Å
28	G	86.4	Confident	77.7	Confident	0 Å²	0	83.4 Å²	83.4	0%	0	44%	0.435	C	S	.	.	H	α-helix	trans	-62.2	-42.3	176.9	0	0	0	0	0	112.7	C8 A12 G24 G25 L31 S32	C8-G28 WeakPolarHBondContact O-CA 3.05Å; A12-G28 VanDerWaalsContact CB-C 3.45Å; G24-G28 WeakPolarHBondContact O-CA 3.49Å; G24-G28 PolarHBondContact O-N 3.34Å; G25-G28 PolarHBondContact O-N 2.92Å; G28-L31 PolarHBondContact O-N 3.32Å; G28-S32 PolarHBondContact O-N 3.17Å; G28-S32 PolarHBondContact O-OG 3.32Å
29	S	82.5	Confident	78.8	Confident	40 Å²	40	82 Å²	82	28%	0.28	43%	0.428	S	S	.	.	H	α-helix	trans	-66.8	-36.9	178.5	63.3	0	0	0	0	113.4	G25 V26 L31 S32 T33	G25-S29 PolarHBondContact O-N 3.33Å; G25-S29 PolarHBondContact O-OG 3.43Å; V26-S29 WeakPolarHBondContact CA-OG 3.43Å; V26-S29 PolarHBondContact O-OG 3.16Å; S29-L31 VanDerWaalsContact C-N 3.34Å; S29-S32 PolarHBondContact O-OG 3.32Å; S29-T33 VanDerWaalsContact O-CB 3.24Å; S29-T33 WeakPolarHBondContact O-CB 3.5Å; S29-T33 PolarHBondContact O-N 2.93Å; S29-T33 PolarHBondContact O-OG1 2.95Å
30	L	86.5	Confident	79.7	Confident	112 Å²	112	77.4 Å²	77.4	59%	0.586	42%	0.416	S	S	*	.	H	α-helix	trans	-64.7	-39.1	172.6	-73.9	167.8	0	0	0	111.6	V26 I27 T34	V26-L30 HydrophobicContact CG1-CD1 4.15Å; V26-L30 WeakPolarHBondContact O-CB 3.37Å; V26-L30 VanDerWaalsContact O-CG 3.29Å; V26-L30 WeakPolarHBondContact O-CG 3.33Å; V26-L30 PolarHBondContact O-N 2.79Å; I27-L30 PolarHBondContact O-N 2.87Å; L30-T34 WeakPolarHBondContact O-CG2 3.46Å; L30-T34 PolarHBondContact O-N 3.11Å; L30-T34 PolarHBondContact O-OG1 2.92Å
31	L	84.7	Confident	80.6	Confident	48 Å²	48	70.9 Å²	70.9	25%	0.251	40%	0.402	S	S	.	.	H	α-helix	trans	-72.9	-40.6	179.7	-149.1	69.3	0	0	0	112	L5 I27 G28 S29 T34 L35 L48	L5-L31 VanDerWaalsContact O-CD2 3.31Å; L5-L31 WeakPolarHBondContact O-CD2 3.49Å; I27-L31 PolarHBondContact O-N 2.83Å; I27-L31 VanDerWaalsContact O-N 3.11Å; G28-L31 PolarHBondContact O-N 3.32Å; S29-L31 VanDerWaalsContact C-N 3.34Å; L31-T34 WeakPolarHBondContact CA-OG1 3.48Å; L31-T34 PolarHBondContact O-N 3.38Å; L31-T34 PolarHBondContact O-OG1 3.49Å; L31-T34 VanDerWaalsContact O-OG1 3.09Å; L31-L35 HydrophobicContact CG-CD1 4.03Å; L31-L35 WeakPolarHBondContact O-CB 3.42Å; L31-L35 WeakPolarHBondContact O-CD1 3.35Å; L31-L35 VanDerWaalsContact O-CG 3.29Å; L31-L35 WeakPolarHBondContact O-CG 3.49Å; L31-L35 PolarHBondContact O-N 3.38Å; L31-L48 HydrophobicContact CD2-CD2 3.57Å; L31-L48 HydrophobicContact CG-CD2 4.37Å
32	S	81.9	Confident	81.7	Confident	11 Å²	11	67.4 Å²	67.4	8%	0.077	40%	0.397	C	S	.	.	H	α-helix	trans	-67.4	-41.5	175.5	67.2	0	0	0	0	112	G28 S29 T34 L35 Q36	G28-S32 PolarHBondContact O-N 3.17Å; G28-S32 PolarHBondContact O-OG 3.32Å; S29-S32 PolarHBondContact O-OG 3.32Å; S32-T34 VanDerWaalsContact C-N 3.26Å; S32-T34 PolarHBondContact O-N 3.48Å; S32-L35 PolarHBondContact O-N 3.2Å; S32-Q36 WeakPolarHBondContact O-CB 3.5Å; S32-Q36 WeakPolarHBondContact O-CG 3.05Å; S32-Q36 PolarHBondContact O-N 2.96Å
33	T	83.8	Confident	82.4	Confident	91 Å²	91	67.1 Å²	67.1	56%	0.558	40%	0.396	S	S	*	.	H	α-helix	trans	-63.1	-31	176.8	-57.1	0	0	0	0	112.6	S29 P37	S29-T33 VanDerWaalsContact O-CB 3.24Å; S29-T33 WeakPolarHBondContact O-CB 3.5Å; S29-T33 PolarHBondContact O-N 2.93Å; S29-T33 PolarHBondContact O-OG1 2.95Å; T33-P37 WeakPolarHBondContact O-CD 3.27Å
34	T	84.9	Confident	82.7	Confident	83 Å²	83	65.8 Å²	65.8	51%	0.509	39%	0.387	S	S	.	.	H	α-helix	trans	-86	-28.9	177.4	47.5	0	0	0	0	113.6	L30 L31 S32 L38	L30-T34 WeakPolarHBondContact O-CG2 3.46Å; L30-T34 PolarHBondContact O-N 3.11Å; L30-T34 PolarHBondContact O-OG1 2.92Å; L31-T34 WeakPolarHBondContact CA-OG1 3.48Å; L31-T34 PolarHBondContact O-N 3.38Å; L31-T34 PolarHBondContact O-OG1 3.49Å; L31-T34 VanDerWaalsContact O-OG1 3.09Å; S32-T34 VanDerWaalsContact C-N 3.26Å; S32-T34 PolarHBondContact O-N 3.48Å; T34-L38 WeakPolarHBondContact O-CD1 3.47Å
35	L	81.7	Confident	83.1	Confident	27 Å²	27	66.4 Å²	66.4	14%	0.141	39%	0.39	C	S	.	.	H	α-helix	trans	-82.8	-36.6	178.1	-73.9	165.8	0	0	0	113.9	L31 S32 L38 L39 L48	L31-L35 HydrophobicContact CG-CD1 4.03Å; L31-L35 WeakPolarHBondContact O-CB 3.42Å; L31-L35 WeakPolarHBondContact O-CD1 3.35Å; L31-L35 VanDerWaalsContact O-CG 3.29Å; L31-L35 WeakPolarHBondContact O-CG 3.49Å; L31-L35 PolarHBondContact O-N 3.38Å; S32-L35 PolarHBondContact O-N 3.2Å; L35-L38 PolarHBondContact O-N 3.47Å; L35-L38 VanDerWaalsContact O-N 3.07Å; L35-L39 HydrophobicContact CD2-CD1 4Å; L35-L39 PolarHBondContact O-N 2.86Å; L35-L48 HydrophobicContact CD1-CD1 3.69Å; L35-L48 HydrophobicContact CD1-CD2 3.74Å; L35-L48 HydrophobicContact CD1-CG 3.66Å
36	Q	75.7	Confident	83.3	Confident	105 Å²	105	70 Å²	70	49%	0.491	40%	0.4	S	S	.	.	H	α-helix	trans	-53.7	-45.5	-177.6	-79.5	172.6	6.1	0	0	113.6	S32 L38 H40	S32-Q36 WeakPolarHBondContact O-CB 3.5Å; S32-Q36 WeakPolarHBondContact O-CG 3.05Å; S32-Q36 PolarHBondContact O-N 2.96Å; Q36-L38 VanDerWaalsContact C-N 3.31Å; Q36-L38 PolarHBondContact O-N 3.42Å; Q36-H40 WeakPolarHBondContact O-CA 3.41Å; Q36-H40 PolarHBondContact O-N 3.03Å
37	P	80	Confident	83.5	Confident	101 Å²	101	66.7 Å²	66.7	66%	0.656	38%	0.384	S	S	*	.	H	α-helix	trans	-68	-27	178.1	-20.1	33.5	0	0	0	114.1	T33	T33-P37 WeakPolarHBondContact O-CD 3.27Å
38	L	81.3	Confident	83.8	Confident	136 Å²	136	63.2 Å²	63.2	71%	0.712	37%	0.366	S	S	*	.	H	α-helix	trans	-91.8	-39	-171.4	-66.1	176.1	0	0	0	113.1	T34 L35 Q36	T34-L38 WeakPolarHBondContact O-CD1 3.47Å; L35-L38 PolarHBondContact O-N 3.47Å; L35-L38 VanDerWaalsContact O-N 3.07Å; Q36-L38 VanDerWaalsContact C-N 3.31Å; Q36-L38 PolarHBondContact O-N 3.42Å
39	L	79.6	Confident	84	Confident	79 Å²	79	67.2 Å²	67.2	41%	0.414	39%	0.387	S	S	.	.	H	α-helix	trans	-130.2	-1.9	-167.6	-65.3	174.9	0	0	0	114.4	L35 G43 A47	L35-L39 HydrophobicContact CD2-CD1 4Å; L35-L39 PolarHBondContact O-N 2.86Å; L39-G43 VanDerWaalsContact O-CA 3.28Å; L39-G43 WeakPolarHBondContact O-CA 3.12Å; L39-G43 PolarHBondContact O-N 3.32Å; L39-A47 HydrophobicContact CD1-CB 3.77Å
40	H	77.6	Confident	84.4	Confident	138 Å²	138	69.1 Å²	69.1	64%	0.639	40%	0.399	S	S	*	.	H	α-helix	trans	57.4	177.2	-164.9	-62.9	34	0	0	0	111.8	Q36 G44	Q36-H40 WeakPolarHBondContact O-CA 3.41Å; Q36-H40 PolarHBondContact O-N 3.03Å; H40-G44 PolarHBondContact O-N 2.79Å
41	S	80.1	Confident	84.7	Confident	76 Å²	76	67.5 Å²	67.5	53%	0.531	39%	0.394	S	S	.	.	H	α-helix	trans	-62.8	-44.6	-177.2	51.9	0	0	0	0	112.8	G44 T45	S41-G44 PolarHBondContact O-N 3.35Å; S41-T45 PolarHBondContact O-N 3.35Å; S41-T45 PolarHBondContact O-OG1 3.12Å
42	S	82.3	Confident	85	Confident	81 Å²	81	69.1 Å²	69.1	57%	0.566	40%	0.397	S	S	*	.	H	α-helix	trans	-65.9	-47.7	-179	51.3	0	0	0	0	113	G44 T45 I46	S42-G44 VanDerWaalsContact C-N 3.33Å; S42-T45 PolarHBondContact O-N 3.27Å; S42-I46 WeakPolarHBondContact O-CG1 3.4Å; S42-I46 PolarHBondContact O-N 3.33Å
43	G	85.9	Confident	85.4	Confident	21 Å²	21	69.8 Å²	69.8	22%	0.216	40%	0.403	C	S	.	.	H	α-helix	trans	-66.8	-34.9	175.7	0	0	0	0	0	112.5	L39 I46 A47	L39-G43 VanDerWaalsContact O-CA 3.28Å; L39-G43 WeakPolarHBondContact O-CA 3.12Å; L39-G43 PolarHBondContact O-N 3.32Å; G43-I46 PolarHBondContact O-N 3.02Å; G43-A47 WeakPolarHBondContact O-CB 3.18Å; G43-A47 PolarHBondContact O-N 3.22Å
44	G	86	Confident	85.6	Confident	1 Å²	1	67.7 Å²	67.7	1%	0.01	40%	0.395	C	S	.	.	H	α-helix	trans	-61	-50.8	172.2	0	0	0	0	0	112.4	H40 S41 S42 I46 A47 L48	H40-G44 PolarHBondContact O-N 2.79Å; S41-G44 PolarHBondContact O-N 3.35Å; S42-G44 VanDerWaalsContact C-N 3.33Å; G44-I46 PolarHBondContact O-N 3.29Å; G44-A47 PolarHBondContact O-N 3.44Å; G44-L48 WeakPolarHBondContact O-CB 3.26Å; G44-L48 WeakPolarHBondContact O-CG 3.45Å; G44-L48 PolarHBondContact O-N 2.89Å
45	T	88.4	Confident	85.9	Confident	23 Å²	23	64.2 Å²	64.2	14%	0.141	38%	0.375	C	S	.	.	H	α-helix	trans	-59.5	-44.1	175.7	-68.3	0	0	0	0	111.7	L10 I13 N14 S41 S42 L48 L49	L10-T45 HydrophobicContact CD2-CG2 4.01Å; I13-T45 VanDerWaalsContact CG2-OG1 3.29Å; I13-T45 WeakPolarHBondContact CG2-OG1 3.5Å; N14-T45 PolarHBondContact ND2-OG1 3.44Å; N14-T45 PolarHBondContact OD1-OG1 3.07Å; S41-T45 PolarHBondContact O-N 3.35Å; S41-T45 PolarHBondContact O-OG1 3.12Å; S42-T45 PolarHBondContact O-N 3.27Å; T45-L48 PolarHBondContact O-N 3.32Å; T45-L49 HydrophobicContact CG2-CD1 3.91Å; T45-L49 HydrophobicContact CG2-CG 4.33Å; T45-L49 WeakPolarHBondContact O-CB 3.43Å; T45-L49 WeakPolarHBondContact O-CG 3.4Å; T45-L49 PolarHBondContact O-N 3.29Å
46	I	90.3	Very high	86.2	Confident	108 Å²	108	64.9 Å²	64.9	55%	0.554	38%	0.379	S	S	*	.	H	α-helix	trans	-62.8	-46.8	177.6	-68.1	165.5	0	0	0	111.3	S42 G43 G44 L48 L49 C50	S42-I46 WeakPolarHBondContact O-CG1 3.4Å; S42-I46 PolarHBondContact O-N 3.33Å; G43-I46 PolarHBondContact O-N 3.02Å; G44-I46 PolarHBondContact O-N 3.29Å; I46-L48 VanDerWaalsContact C-N 3.33Å; I46-L48 PolarHBondContact O-N 3.34Å; I46-L49 PolarHBondContact O-N 2.69Å; I46-C50 PolarHBondContact O-N 3.13Å; I46-C50 PolarHBondContact O-SG 3.17Å; I46-C50 VanDerWaalsContact O-SG 3.33Å
47	A	89.2	Confident	86.7	Confident	35 Å²	35	61.6 Å²	61.6	29%	0.289	37%	0.366	S	S	.	.	H	α-helix	trans	-61.5	-41.3	178.7	0	0	0	0	0	112	L39 G43 G44 C50 V51	L39-A47 HydrophobicContact CD1-CB 3.77Å; G43-A47 WeakPolarHBondContact O-CB 3.18Å; G43-A47 PolarHBondContact O-N 3.22Å; G44-A47 PolarHBondContact O-N 3.44Å; A47-C50 PolarHBondContact O-N 3.4Å; A47-V51 WeakPolarHBondContact O-CG2 3.46Å; A47-V51 PolarHBondContact O-N 2.9Å; A47-V51 VanDerWaalsContact O-N 3.14Å
48	L	91	Very high	87.1	Confident	12 Å²	12	64.1 Å²	64.1	6%	0.063	37%	0.373	C	S	.	.	H	α-helix	trans	-67.2	-41.1	175.4	-70.3	177.2	0	0	0	112.6	T6 L10 I13 L31 L35 G44 T45 I46 C50 V51 W52	T6-L48 HydrophobicContact CG2-CD2 3.94Å; L10-L48 HydrophobicContact CD1-CB 4.42Å; L10-L48 HydrophobicContact CD2-CB 3.67Å; L10-L48 HydrophobicContact CD2-CD1 4.32Å; L10-L48 HydrophobicContact CG-CB 3.81Å; L10-L48 HydrophobicContact CG-CD1 4.31Å; I13-L48 HydrophobicContact CD1-CD1 3.81Å; L31-L48 HydrophobicContact CD2-CD2 3.57Å; L31-L48 HydrophobicContact CG-CD2 4.37Å; L35-L48 HydrophobicContact CD1-CD1 3.69Å; L35-L48 HydrophobicContact CD1-CD2 3.74Å; L35-L48 HydrophobicContact CD1-CG 3.66Å; G44-L48 WeakPolarHBondContact O-CB 3.26Å; G44-L48 WeakPolarHBondContact O-CG 3.45Å; G44-L48 PolarHBondContact O-N 2.89Å; T45-L48 PolarHBondContact O-N 3.32Å; I46-L48 VanDerWaalsContact C-N 3.33Å; I46-L48 PolarHBondContact O-N 3.34Å; L48-C50 VanDerWaalsContact C-N 3.34Å; L48-C50 PolarHBondContact O-N 3.49Å; L48-V51 PolarHBondContact O-N 3.11Å; L48-W52 WeakPolarHBondContact O-CB 3.36Å; L48-W52 PolarHBondContact O-N 3.46Å
49	L	91.6	Very high	87.5	Confident	84 Å²	84	65.4 Å²	65.4	44%	0.44	37%	0.373	S	S	.	.	H	α-helix	trans	-61.1	-41	174.8	-76.7	171.6	0	0	0	111.8	L10 T45 I46 W52 A53	L10-L49 HydrophobicContact CD1-CD2 3.9Å; L10-L49 HydrophobicContact CD1-CG 4.41Å; L10-L49 HydrophobicContact CD2-CD2 4.14Å; L10-L49 HydrophobicContact CD2-CG 3.93Å; T45-L49 HydrophobicContact CG2-CD1 3.91Å; T45-L49 HydrophobicContact CG2-CG 4.33Å; T45-L49 WeakPolarHBondContact O-CB 3.43Å; T45-L49 WeakPolarHBondContact O-CG 3.4Å; T45-L49 PolarHBondContact O-N 3.29Å; I46-L49 PolarHBondContact O-N 2.69Å; L49-W52 PolarHBondContact O-N 3.41Å; L49-A53 VanDerWaalsContact O-CB 3.25Å; L49-A53 WeakPolarHBondContact O-CB 3.26Å; L49-A53 PolarHBondContact O-N 3.27Å
50	C	90.8	Very high	87.8	Confident	80 Å²	80	63.7 Å²	63.7	54%	0.541	37%	0.366	S	S	.	.	H	α-helix	trans	-62.6	-44.7	175.7	-70	0	0	0	0	112.3	I46 A47 L48 A54	I46-C50 PolarHBondContact O-N 3.13Å; I46-C50 PolarHBondContact O-SG 3.17Å; I46-C50 VanDerWaalsContact O-SG 3.33Å; A47-C50 PolarHBondContact O-N 3.4Å; L48-C50 VanDerWaalsContact C-N 3.34Å; L48-C50 PolarHBondContact O-N 3.49Å; C50-A54 WeakPolarHBondContact O-CB 3.39Å; C50-A54 PolarHBondContact O-N 3.43Å
51	V	90.9	Very high	88.1	Confident	78 Å²	78	60.5 Å²	60.5	47%	0.473	37%	0.37	S	S	.	.	H	α-helix	trans	-73.4	-30.3	178.5	178.9	0	0	0	0	111.8	A2 T6 A47 L48 G55	A2-V51 HydrophobicContact CB-CG1 4.49Å; T6-V51 HydrophobicContact CG2-CB 3.76Å; T6-V51 HydrophobicContact CG2-CG1 3.63Å; A47-V51 WeakPolarHBondContact O-CG2 3.46Å; A47-V51 PolarHBondContact O-N 2.9Å; A47-V51 VanDerWaalsContact O-N 3.14Å; L48-V51 PolarHBondContact O-N 3.11Å; V51-G55 PolarHBondContact O-N 3.49Å
52	W	93	Very high	88.3	Confident	82 Å²	82	64.6 Å²	64.6	31%	0.311	37%	0.374	S	S	.	.	H	α-helix	trans	-66.6	-48.9	172.4	-174.8	90.1	0	0	0	110.9	L3 T6 S7 L10 L48 L49 A54 G55 L56	L3-W52 HydrophobicContact CD2-CD2 4.36Å; L3-W52 HydrophobicContact CD2-CG 4.2Å; L3-W52 WeakPolarHBondContact CD2-O 3.44Å; T6-W52 HydrophobicContact CG2-CB 4.49Å; T6-W52 WeakPolarHBondContact OG1-CA 3.48Å; S7-W52 PolarHBondContact OG-NE1 3.2Å; L10-W52 HydrophobicContact CD1-CB 4.12Å; L10-W52 HydrophobicContact CD1-CG 4.13Å; L48-W52 WeakPolarHBondContact O-CB 3.36Å; L48-W52 PolarHBondContact O-N 3.46Å; L49-W52 PolarHBondContact O-N 3.41Å; W52-A54 PolarHBondContact O-N 3.11Å; W52-G55 CarbonylContact O-C 3.6Å; W52-G55 WeakPolarHBondContact O-CA 3.47Å; W52-G55 PolarHBondContact O-N 3.21Å; W52-G55 VanDerWaalsContact O-N 3.1Å; W52-L56 HydrophobicContact CH2-CD2 4.09Å; W52-L56 HydrophobicContact CZ3-CD2 4.07Å; W52-L56 PolarHBondContact O-N 3.27Å
53	A	89	Confident	88.5	Confident	24 Å²	24	63.5 Å²	63.5	20%	0.198	37%	0.366	C	S	.	.	H	α-helix	trans	-63	-40.2	178.3	0	0	0	0	0	112.6	L49 L56 T57 W64	L49-A53 VanDerWaalsContact O-CB 3.25Å; L49-A53 WeakPolarHBondContact O-CB 3.26Å; L49-A53 PolarHBondContact O-N 3.27Å; A53-L56 PolarHBondContact O-N 3.17Å; A53-T57 PolarHBondContact O-N 2.94Å; A53-T57 PolarHBondContact O-OG1 2.89Å; A53-W64 HydrophobicContact CB-CZ2 3.74Å
54	A	88.8	Confident	88.3	Confident	48 Å²	48	68.4 Å²	68.4	40%	0.397	38%	0.378	S	S	.	.	H	α-helix	trans	-69.1	-35	171.8	0	0	0	0	0	112.3	C50 W52 L56 T57 L58	C50-A54 WeakPolarHBondContact O-CB 3.39Å; C50-A54 PolarHBondContact O-N 3.43Å; W52-A54 PolarHBondContact O-N 3.11Å; A54-L56 VanDerWaalsContact C-N 3.31Å; A54-T57 PolarHBondContact O-OG1 2.87Å; A54-L58 VanDerWaalsContact O-CB 3.32Å; A54-L58 WeakPolarHBondContact O-CB 3.46Å; A54-L58 WeakPolarHBondContact O-CD1 3.3Å; A54-L58 WeakPolarHBondContact O-CG 3.44Å; A54-L58 PolarHBondContact O-N 2.93Å; A54-L58 VanDerWaalsContact O-N 3.14Å
55	G	90.1	Very high	88.3	Confident	9 Å²	9	72.6 Å²	72.6	9%	0.093	40%	0.404	C	S	.	.	H	α-helix	trans	-65.4	-33.9	172.4	0	0	0	0	0	112.9	V51 W52 F59	V51-G55 PolarHBondContact O-N 3.49Å; W52-G55 CarbonylContact O-C 3.6Å; W52-G55 WeakPolarHBondContact O-CA 3.47Å; W52-G55 PolarHBondContact O-N 3.21Å; W52-G55 VanDerWaalsContact O-N 3.1Å; G55-F59 VanDerWaalsContact O-CB 3.24Å; G55-F59 WeakPolarHBondContact O-CB 3.46Å; G55-F59 PolarHBondContact O-N 2.83Å; G55-F59 VanDerWaalsContact O-N 3.14Å
56	L	87.7	Confident	88	Confident	42 Å²	42	74.7 Å²	74.7	22%	0.22	42%	0.416	C	S	.	.	H	α-helix	trans	-68.4	-52.3	178.6	-168	69.7	0	0	0	110.8	L3 W52 A53 A54 L58 F59 T60 W64	L3-L56 HydrophobicContact CD1-CD1 4.5Å; L3-L56 HydrophobicContact CD2-CB 4.06Å; L3-L56 HydrophobicContact CD2-CD1 4.2Å; W52-L56 HydrophobicContact CH2-CD2 4.09Å; W52-L56 HydrophobicContact CZ3-CD2 4.07Å; W52-L56 PolarHBondContact O-N 3.27Å; A53-L56 PolarHBondContact O-N 3.17Å; A54-L56 VanDerWaalsContact C-N 3.31Å; L56-L58 VanDerWaalsContact C-N 3.33Å; L56-L58 PolarHBondContact O-N 2.89Å; L56-F59 PolarHBondContact O-N 3.47Å; L56-T60 HydrophobicContact CD1-CG2 4.28Å; L56-T60 PolarHBondContact O-N 3.37Å; L56-T60 PolarHBondContact O-OG1 2.88Å; L56-T60 VanDerWaalsContact O-OG1 3.08Å; L56-W64 HydrophobicContact CD2-CH2 3.93Å; L56-W64 HydrophobicContact CD2-CZ2 4.14Å
57	T	87.5	Confident	87.7	Confident	36 Å²	36	71.5 Å²	71.5	22%	0.221	40%	0.4	C	S	.	.	H	α-helix	trans	-64.2	-36.4	179.2	56.5	0	0	0	0	112.6	A53 A54 F59 G61 W62 W64	A53-T57 PolarHBondContact O-N 2.94Å; A53-T57 PolarHBondContact O-OG1 2.89Å; A54-T57 PolarHBondContact O-OG1 2.87Å; T57-F59 VanDerWaalsContact C-N 3.26Å; T57-F59 PolarHBondContact O-N 2.87Å; T57-G61 VanDerWaalsContact O-CA 3.25Å; T57-G61 WeakPolarHBondContact O-CA 3.11Å; T57-G61 PolarHBondContact O-N 2.9Å; T57-W62 WeakPolarHBondContact CB-O 3.33Å; T57-W62 VanDerWaalsContact CG2-O 3.28Å; T57-W62 WeakPolarHBondContact CG2-O 3.4Å; T57-W64 HydrophobicContact CG2-CG 4.33Å; T57-W64 HydrophobicContact CG2-CZ2 4.49Å
58	L	88.3	Confident	87.6	Confident	153 Å²	153	72.7 Å²	72.7	80%	0.801	41%	0.41	S	S	*	.	H	α-helix	trans	-69.7	-19.3	173.5	-72.8	173.1	0	0	0	113.9	A54 L56	A54-L58 VanDerWaalsContact O-CB 3.32Å; A54-L58 WeakPolarHBondContact O-CB 3.46Å; A54-L58 WeakPolarHBondContact O-CD1 3.3Å; A54-L58 WeakPolarHBondContact O-CG 3.44Å; A54-L58 PolarHBondContact O-N 2.93Å; A54-L58 VanDerWaalsContact O-N 3.14Å; L56-L58 VanDerWaalsContact C-N 3.33Å; L56-L58 PolarHBondContact O-N 2.89Å
59	F	88.9	Confident	87.5	Confident	163 Å²	163	78 Å²	78	72%	0.715	44%	0.435	S	S	*	.	H	α-helix	trans	-95.5	-40.5	179	-178.4	-106.7	0	0	0	112.8	L3 G55 L56 T57	L3-F59 HydrophobicContact CD1-CB 3.63Å; L3-F59 HydrophobicContact CD1-CD1 3.91Å; L3-F59 HydrophobicContact CD1-CG 3.81Å; G55-F59 VanDerWaalsContact O-CB 3.24Å; G55-F59 WeakPolarHBondContact O-CB 3.46Å; G55-F59 PolarHBondContact O-N 2.83Å; G55-F59 VanDerWaalsContact O-N 3.14Å; L56-F59 PolarHBondContact O-N 3.47Å; T57-F59 VanDerWaalsContact C-N 3.26Å; T57-F59 PolarHBondContact O-N 2.87Å
60	T	86.1	Confident	87.2	Confident	44 Å²	44	82.1 Å²	82.1	27%	0.27	45%	0.449	S	S	.	.	H	α-helix	trans	-90.3	-19.2	-179.8	63.4	0	0	0	0	113.6	L56 W62	L56-T60 HydrophobicContact CD1-CG2 4.28Å; L56-T60 PolarHBondContact O-N 3.37Å; L56-T60 PolarHBondContact O-OG1 2.88Å; L56-T60 VanDerWaalsContact O-OG1 3.08Å; T60-W62 HydrophobicContact CG2-CD2 4.31Å; T60-W62 HydrophobicContact CG2-CE3 4.39Å; T60-W62 PolarHBondContact O-N 2.92Å; T60-W62 PolarHBondContact O-NE1 2.92Å; T60-W62 WeakPolarHBondContact OG1-CB 3.24Å; T60-W62 PolarHBondContact OG1-N 2.77Å
61	G	85.2	Confident	87.1	Confident	70 Å²	70	82.5 Å²	82.5	72%	0.722	45%	0.445	S	S	*	.			trans	71.6	7.6	-170.2	0	0	0	0	0	114	T57	T57-G61 VanDerWaalsContact O-CA 3.25Å; T57-G61 WeakPolarHBondContact O-CA 3.11Å; T57-G61 PolarHBondContact O-N 2.9Å
62	W	83.3	Confident	86.9	Confident	162 Å²	162	80.2 Å²	80.2	61%	0.614	44%	0.438	S	S	*	.			trans	-82.8	146	-175	-59.2	-8.6	0	0	0	112.3	T57 T60 I67	T57-W62 WeakPolarHBondContact CB-O 3.33Å; T57-W62 VanDerWaalsContact CG2-O 3.28Å; T57-W62 WeakPolarHBondContact CG2-O 3.4Å; T60-W62 HydrophobicContact CG2-CD2 4.31Å; T60-W62 HydrophobicContact CG2-CE3 4.39Å; T60-W62 PolarHBondContact O-N 2.92Å; T60-W62 PolarHBondContact O-NE1 2.92Å; T60-W62 WeakPolarHBondContact OG1-CB 3.24Å; T60-W62 PolarHBondContact OG1-N 2.77Å; W62-I67 HydrophobicContact CB-CD1 3.93Å; W62-I67 HydrophobicContact CB-CG1 4.28Å; W62-I67 HydrophobicContact CE3-CD1 4.04Å; W62-I67 HydrophobicContact CE3-CG1 4.3Å
63	S	87.1	Confident	86.7	Confident	58 Å²	58	77.8 Å²	77.8	41%	0.406	44%	0.438	S	S	.	.			trans	-89.3	136.9	170.8	178.3	0	0	0	0	110.2	V65 T66 I67	S63-V65 PolarHBondContact O-N 2.87Å; S63-V65 PolarHBondContact OG-N 2.84Å; S63-T66 PolarHBondContact O-N 3.4Å; S63-T66 PolarHBondContact O-OG1 3.02Å; S63-I67 WeakPolarHBondContact O-CG1 3.39Å; S63-I67 PolarHBondContact O-N 2.63Å
64	W	81.5	Confident	86.6	Confident	124 Å²	124	84.6 Å²	84.6	47%	0.47	46%	0.458	S	S	.	.	H	α-helix	trans	-57.9	-27.3	170.8	-75	112	0	0	0	112.7	A53 L56 T57 I67 A68	A53-W64 HydrophobicContact CB-CZ2 3.74Å; L56-W64 HydrophobicContact CD2-CH2 3.93Å; L56-W64 HydrophobicContact CD2-CZ2 4.14Å; T57-W64 HydrophobicContact CG2-CG 4.33Å; T57-W64 HydrophobicContact CG2-CZ2 4.49Å; W64-I67 HydrophobicContact CE3-CD1 4.13Å; W64-I67 HydrophobicContact CZ3-CD1 4.34Å; W64-A68 VanDerWaalsContact O-CB 3.32Å; W64-A68 WeakPolarHBondContact O-CB 3.28Å; W64-A68 PolarHBondContact O-N 2.85Å
65	V	84.8	Confident	86.5	Confident	90 Å²	90	86.4 Å²	86.4	55%	0.545	46%	0.46	S	S	.	.	H	α-helix	trans	-67.6	-50.2	175.6	-175.2	0	0	0	0	110.7	S63 I67 A68 E69	S63-V65 PolarHBondContact O-N 2.87Å; S63-V65 PolarHBondContact OG-N 2.84Å; V65-I67 VanDerWaalsContact C-N 3.3Å; V65-I67 PolarHBondContact O-N 2.79Å; V65-A68 PolarHBondContact O-N 2.81Å; V65-A68 VanDerWaalsContact O-N 3.11Å; V65-E69 HydrophobicContact CG1-CG 4.46Å; V65-E69 WeakPolarHBondContact O-CG 3.37Å; V65-E69 PolarHBondContact O-N 2.97Å
66	T	83.2	Confident	86.4	Confident	66 Å²	66	91.1 Å²	91.1	41%	0.405	48%	0.483	S	S	.	.	H	α-helix	trans	-72.7	-23.6	-178.2	58	0	0	0	0	113.1	S63 E69 K70	S63-T66 PolarHBondContact O-N 3.4Å; S63-T66 PolarHBondContact O-OG1 3.02Å; T66-E69 WeakPolarHBondContact CA-OE2 3.27Å; T66-K70 WeakPolarHBondContact O-CB 3.26Å; T66-K70 WeakPolarHBondContact O-CG 3.44Å; T66-K70 PolarHBondContact O-N 2.92Å
67	I	84	Confident	86.2	Confident	41 Å²	41	94.4 Å²	94.4	21%	0.21	50%	0.501	C	S	.	.	H	α-helix	trans	-67.6	-47.7	166.8	-65.3	167.1	0	0	0	110.2	W62 S63 W64 V65 K70 L71	W62-I67 HydrophobicContact CB-CD1 3.93Å; W62-I67 HydrophobicContact CB-CG1 4.28Å; W62-I67 HydrophobicContact CE3-CD1 4.04Å; W62-I67 HydrophobicContact CE3-CG1 4.3Å; S63-I67 WeakPolarHBondContact O-CG1 3.39Å; S63-I67 PolarHBondContact O-N 2.63Å; W64-I67 HydrophobicContact CE3-CD1 4.13Å; W64-I67 HydrophobicContact CZ3-CD1 4.34Å; V65-I67 VanDerWaalsContact C-N 3.3Å; V65-I67 PolarHBondContact O-N 2.79Å; I67-K70 PolarHBondContact O-N 2.87Å; I67-L71 HydrophobicContact CG2-CD1 4.12Å; I67-L71 PolarHBondContact O-N 2.83Å
68	A	86.8	Confident	86.1	Confident	61 Å²	61	96.7 Å²	96.7	50%	0.504	51%	0.511	S	S	.	.	H	α-helix	trans	-64.4	-40.3	179.6	0	0	0	0	0	112.7	W64 V65 L71 G72	W64-A68 VanDerWaalsContact O-CB 3.32Å; W64-A68 WeakPolarHBondContact O-CB 3.28Å; W64-A68 PolarHBondContact O-N 2.85Å; V65-A68 PolarHBondContact O-N 2.81Å; V65-A68 VanDerWaalsContact O-N 3.11Å; A68-L71 PolarHBondContact O-N 2.68Å; A68-G72 PolarHBondContact O-N 2.7Å
69	E	89.5	Confident	85.9	Confident	123 Å²	123	94.4 Å²	94.4	58%	0.575	50%	0.499	S	S	*	.	H	α-helix	trans	-60.9	-45.5	174.1	-72.3	166.2	166.7	0	0	111.8	V65 T66 G72 G73	V65-E69 HydrophobicContact CG1-CG 4.46Å; V65-E69 WeakPolarHBondContact O-CG 3.37Å; V65-E69 PolarHBondContact O-N 2.97Å; T66-E69 WeakPolarHBondContact CA-OE2 3.27Å; E69-G72 PolarHBondContact O-N 3.33Å; E69-G73 PolarHBondContact O-N 3.49Å
70	K	85.6	Confident	85.6	Confident	170 Å²	170	90 Å²	90	74%	0.739	49%	0.485	S	S	*	.	H	α-helix	trans	-65	-43.8	176.9	-78.7	-176	174.9	-172.2	0	112.7	T66 I67 G73 W74	T66-K70 WeakPolarHBondContact O-CB 3.26Å; T66-K70 WeakPolarHBondContact O-CG 3.44Å; T66-K70 PolarHBondContact O-N 2.92Å; I67-K70 PolarHBondContact O-N 2.87Å; K70-G73 PolarHBondContact O-N 2.96Å; K70-W74 WeakPolarHBondContact O-CB 3.39Å; K70-W74 PolarHBondContact O-N 3.03Å
71	L	87.2	Confident	85.4	Confident	89 Å²	89	94.7 Å²	94.7	47%	0.466	50%	0.502	S	S	.	.	H	α-helix	trans	-63.9	-44	175.6	-92.9	163.2	0	0	0	111.7	I67 A68 W74 I75	I67-L71 HydrophobicContact CG2-CD1 4.12Å; I67-L71 PolarHBondContact O-N 2.83Å; A68-L71 PolarHBondContact O-N 2.68Å; L71-W74 PolarHBondContact O-N 3.14Å; L71-I75 WeakPolarHBondContact O-CB 3.41Å; L71-I75 WeakPolarHBondContact O-CD1 3.34Å; L71-I75 VanDerWaalsContact O-CG1 3.25Å; L71-I75 WeakPolarHBondContact O-CG1 3.46Å; L71-I75 PolarHBondContact O-N 3.27Å
72	G	87.3	Confident	85.1	Confident	30 Å²	30	93.7 Å²	93.7	31%	0.309	49%	0.487	S	S	.	.	H	α-helix	trans	-58.3	-48.4	174.5	0	0	0	0	0	112	A68 E69 W74 I75 L76	A68-G72 PolarHBondContact O-N 2.7Å; E69-G72 PolarHBondContact O-N 3.33Å; G72-W74 PolarHBondContact O-N 2.87Å; G72-I75 PolarHBondContact O-N 2.82Å; G72-L76 VanDerWaalsContact O-CB 3.31Å; G72-L76 WeakPolarHBondContact O-CB 3.44Å; G72-L76 VanDerWaalsContact O-CG 3.24Å; G72-L76 WeakPolarHBondContact O-CG 3.27Å; G72-L76 PolarHBondContact O-N 3.44Å
73	G	89.3	Confident	84.9	Confident	30 Å²	30	88.8 Å²	88.8	31%	0.309	48%	0.477	S	S	.	.	H	α-helix	trans	-62.4	-38.3	176.2	0	0	0	0	0	113.7	E69 K70 N77	E69-G73 PolarHBondContact O-N 3.49Å; K70-G73 PolarHBondContact O-N 2.96Å; G73-N77 WeakPolarHBondContact O-CB 3.34Å; G73-N77 VanDerWaalsContact O-CG 3.27Å; G73-N77 PolarHBondContact O-N 2.8Å; G73-N77 PolarHBondContact O-ND2 3.2Å
74	W	86.4	Confident	84.3	Confident	168 Å²	168	90 Å²	90	64%	0.636	48%	0.479	S	S	*	.	H	α-helix	trans	-69.2	-44.7	176.9	-169.6	61.5	0	0	0	112.1	K70 L71 G72 N77 I78	K70-W74 WeakPolarHBondContact O-CB 3.39Å; K70-W74 PolarHBondContact O-N 3.03Å; L71-W74 PolarHBondContact O-N 3.14Å; G72-W74 PolarHBondContact O-N 2.87Å; W74-N77 PolarHBondContact O-N 3.41Å; W74-I78 HydrophobicContact CD2-CD1 3.74Å; W74-I78 HydrophobicContact CE3-CD1 4Å; W74-I78 HydrophobicContact CG-CD1 4.31Å; W74-I78 HydrophobicContact CH2-CD1 4.12Å; W74-I78 HydrophobicContact CZ2-CD1 3.86Å; W74-I78 HydrophobicContact CZ3-CD1 4.19Å; W74-I78 WeakPolarHBondContact O-CG1 3.4Å; W74-I78 PolarHBondContact O-N 2.86Å
75	I	87	Confident	83.9	Confident	85 Å²	85	91.4 Å²	91.4	44%	0.436	48%	0.484	S	S	.	.	H	α-helix	trans	-62.5	-43.9	175.3	-68.9	165.3	0	0	0	110.7	L71 G72 I78 L79	L71-I75 WeakPolarHBondContact O-CB 3.41Å; L71-I75 WeakPolarHBondContact O-CD1 3.34Å; L71-I75 VanDerWaalsContact O-CG1 3.25Å; L71-I75 WeakPolarHBondContact O-CG1 3.46Å; L71-I75 PolarHBondContact O-N 3.27Å; G72-I75 PolarHBondContact O-N 2.82Å; I75-I78 PolarHBondContact O-N 3.03Å; I75-L79 HydrophobicContact CG2-CD1 3.87Å; I75-L79 HydrophobicContact CG2-CG 4.42Å; I75-L79 WeakPolarHBondContact O-CB 3.38Å; I75-L79 WeakPolarHBondContact O-CG 3.47Å; I75-L79 PolarHBondContact O-N 2.94Å
76	L	87.3	Confident	82.8	Confident	108 Å²	108	91.3 Å²	91.3	57%	0.565	48%	0.484	S	S	*	.	H	α-helix	trans	-63.9	-39.9	175.6	-73.8	170.5	0	0	0	112.1	G72 L79 T80	G72-L76 VanDerWaalsContact O-CB 3.31Å; G72-L76 WeakPolarHBondContact O-CB 3.44Å; G72-L76 VanDerWaalsContact O-CG 3.24Å; G72-L76 WeakPolarHBondContact O-CG 3.27Å; G72-L76 PolarHBondContact O-N 3.44Å; L76-L79 PolarHBondContact O-N 3.45Å; L76-T80 VanDerWaalsContact O-CB 3.22Å; L76-T80 WeakPolarHBondContact O-CB 3.29Å; L76-T80 PolarHBondContact O-N 2.82Å; L76-T80 PolarHBondContact O-OG1 2.87Å
77	N	84.5	Confident	81.6	Confident	112 Å²	112	97.3 Å²	97.3	60%	0.599	50%	0.499	S	S	*	.	H	α-helix	trans	-63.7	-41	174	-80	-26.4	0	0	0	112	G73 W74 T80 F81	G73-N77 WeakPolarHBondContact O-CB 3.34Å; G73-N77 VanDerWaalsContact O-CG 3.27Å; G73-N77 PolarHBondContact O-N 2.8Å; G73-N77 PolarHBondContact O-ND2 3.2Å; W74-N77 PolarHBondContact O-N 3.41Å; N77-T80 PolarHBondContact O-N 2.87Å; N77-F81 VanDerWaalsContact O-CB 3.28Å; N77-F81 WeakPolarHBondContact O-CB 3.28Å; N77-F81 PolarHBondContact O-N 2.98Å
78	I	85	Confident	80.1	Confident	83 Å²	83	104.2 Å²	104.2	43%	0.426	52%	0.523	S	S	.	.	H	α-helix	trans	-65.2	-46.3	176	-70.2	166.5	0	0	0	111	W74 I75 T80 F81 A82	W74-I78 HydrophobicContact CD2-CD1 3.74Å; W74-I78 HydrophobicContact CE3-CD1 4Å; W74-I78 HydrophobicContact CG-CD1 4.31Å; W74-I78 HydrophobicContact CH2-CD1 4.12Å; W74-I78 HydrophobicContact CZ2-CD1 3.86Å; W74-I78 HydrophobicContact CZ3-CD1 4.19Å; W74-I78 WeakPolarHBondContact O-CG1 3.4Å; W74-I78 PolarHBondContact O-N 2.86Å; I75-I78 PolarHBondContact O-N 3.03Å; I78-T80 VanDerWaalsContact C-N 3.33Å; I78-T80 PolarHBondContact O-N 2.94Å; I78-F81 PolarHBondContact O-N 2.93Å; I78-A82 WeakPolarHBondContact O-CB 3.23Å; I78-A82 PolarHBondContact O-N 3.03Å
79	L	84.3	Confident	78.4	Confident	105 Å²	105	106.5 Å²	106.5	55%	0.55	53%	0.526	S	S	.	.	H	α-helix	trans	-62.3	-39.6	175.9	-72.7	169	0	0	0	112	I75 L76 S83	I75-L79 HydrophobicContact CG2-CD1 3.87Å; I75-L79 HydrophobicContact CG2-CG 4.42Å; I75-L79 WeakPolarHBondContact O-CB 3.38Å; I75-L79 WeakPolarHBondContact O-CG 3.47Å; I75-L79 PolarHBondContact O-N 2.94Å; L76-L79 PolarHBondContact O-N 3.45Å; L79-S83 VanDerWaalsContact O-CB 3.22Å; L79-S83 WeakPolarHBondContact O-CB 3.4Å; L79-S83 PolarHBondContact O-N 2.79Å
80	T	82.5	Confident	76.4	Confident	70 Å²	70	106.4 Å²	106.4	43%	0.429	53%	0.53	S	S	.	.	H	α-helix	trans	-68.9	-40.6	176.9	-56.5	0	0	0	0	111.3	L76 N77 I78 N84	L76-T80 VanDerWaalsContact O-CB 3.22Å; L76-T80 WeakPolarHBondContact O-CB 3.29Å; L76-T80 PolarHBondContact O-N 2.82Å; L76-T80 PolarHBondContact O-OG1 2.87Å; N77-T80 PolarHBondContact O-N 2.87Å; I78-T80 VanDerWaalsContact C-N 3.33Å; I78-T80 PolarHBondContact O-N 2.94Å; T80-N84 WeakPolarHBondContact O-CB 3.3Å; T80-N84 VanDerWaalsContact O-CG 3.25Å; T80-N84 PolarHBondContact O-N 3.21Å; T80-N84 PolarHBondContact O-ND2 2.76Å
81	F	81.3	Confident	74.6	Confident	144 Å²	144	102.8 Å²	102.8	63%	0.632	52%	0.522	S	S	*	.	H	α-helix	trans	-65.2	-42.2	174.6	-178.6	-98.2	0	0	0	111.9	N77 I78 R85	N77-F81 VanDerWaalsContact O-CB 3.28Å; N77-F81 WeakPolarHBondContact O-CB 3.28Å; N77-F81 PolarHBondContact O-N 2.98Å; I78-F81 PolarHBondContact O-N 2.93Å; F81-R85 VanDerWaalsContact O-CB 3.28Å; F81-R85 WeakPolarHBondContact O-CB 3.3Å; F81-R85 PolarHBondContact O-N 2.86Å
82	A	80.4	Confident	72.5	Confident	48 Å²	48	108.9 Å²	108.9	40%	0.397	54%	0.539	S	S	.	.	H	α-helix	trans	-63.1	-51.1	174.8	0	0	0	0	0	111.4	I78 N84 R85 T86	I78-A82 WeakPolarHBondContact O-CB 3.23Å; I78-A82 PolarHBondContact O-N 3.03Å; A82-N84 PolarHBondContact O-N 2.55Å; A82-R85 WeakPolarHBondContact O-CB 3.34Å; A82-R85 PolarHBondContact O-N 2.77Å; A82-T86 PolarHBondContact O-N 3.12Å; A82-T86 PolarHBondContact O-OG1 3.38Å
83	S	78.3	Confident	70.3	Confident	59 Å²	59	113.5 Å²	113.5	41%	0.413	56%	0.561	S	S	.	*	H	α-helix	trans	-58.3	-45.6	178	-175.2	0	0	0	0	112.5	L79 R85 T86 R87	L79-S83 VanDerWaalsContact O-CB 3.22Å; L79-S83 WeakPolarHBondContact O-CB 3.4Å; L79-S83 PolarHBondContact O-N 2.79Å; S83-R85 PolarHBondContact O-N 2.87Å; S83-T86 PolarHBondContact O-N 2.8Å; S83-R87 WeakPolarHBondContact O-CB 3.32Å; S83-R87 PolarHBondContact O-N 3.02Å
84	N	75	Confident	68.2	Low	83 Å²	83	119.7 Å²	119.7	44%	0.444	59%	0.587	S	S	.	*	H	α-helix	trans	-73.9	-8.5	177.5	-71.1	-17.7	0	0	0	114.3	T80 A82	T80-N84 WeakPolarHBondContact O-CB 3.3Å; T80-N84 VanDerWaalsContact O-CG 3.25Å; T80-N84 PolarHBondContact O-N 3.21Å; T80-N84 PolarHBondContact O-ND2 2.76Å; A82-N84 PolarHBondContact O-N 2.55Å
85	R	72.3	Confident	66.1	Low	155 Å²	155	120.5 Å²	120.5	59%	0.585	60%	0.598	S	S	*	*	H	α-helix	trans	-90.8	-50.4	170.5	-172.4	173.9	-175.4	125.6	3.8	111	F81 A82 S83 R87 R88 D89	F81-R85 VanDerWaalsContact O-CB 3.28Å; F81-R85 WeakPolarHBondContact O-CB 3.3Å; F81-R85 PolarHBondContact O-N 2.86Å; A82-R85 WeakPolarHBondContact O-CB 3.34Å; A82-R85 PolarHBondContact O-N 2.77Å; S83-R85 PolarHBondContact O-N 2.87Å; R85-R87 VanDerWaalsContact C-N 3.35Å; R85-R87 PolarHBondContact O-N 2.76Å; R85-R88 PolarHBondContact O-N 2.59Å; R85-D89 PolarHBondContact O-N 3.25Å
86	T	61.7	Low	64	Low	87 Å²	87	123.7 Å²	123.7	53%	0.534	62%	0.616	S	S	.	*	H	α-helix	trans	-54.3	-50.6	174.4	-59.4	0	0	0	0	110.9	A82 S83 R88 D89 D90	A82-T86 PolarHBondContact O-N 3.12Å; A82-T86 PolarHBondContact O-OG1 3.38Å; S83-T86 PolarHBondContact O-N 2.8Å; T86-R88 PolarHBondContact O-N 3.3Å; T86-D89 PolarHBondContact O-N 2.74Å; T86-D90 PolarHBondContact O-N 3.19Å
87	R	57.8	Low	61.9	Low	192 Å²	192	127.3 Å²	127.3	73%	0.725	63%	0.63	S	S	*	*	H	α-helix	trans	-63.6	2.8	175.4	-76.5	-176.5	160.9	-167.7	-5.5	115.9	S83 R85	S83-R87 WeakPolarHBondContact O-CB 3.32Å; S83-R87 PolarHBondContact O-N 3.02Å; R85-R87 VanDerWaalsContact C-N 3.35Å; R85-R87 PolarHBondContact O-N 2.76Å
88	R	53	Low	59.9	Low	186 Å²	186	132.5 Å²	132.5	70%	0.702	64%	0.643	S	S	*	*	H	α-helix	trans	-113.8	-15	173.8	-89.5	-171.1	162.5	97.3	-0.2	114.2	R85 T86 T91	R85-R88 PolarHBondContact O-N 2.59Å; T86-R88 PolarHBondContact O-N 3.3Å; R88-T91 PolarHBondContact O-OG1 2.79Å
89	D	51.1	Low	57.7	Low	109 Å²	109	136.4 Å²	136.4	58%	0.583	66%	0.659	S	S	*	*	H	α-helix	trans	-88.9	-23.6	174.1	-66.1	-34.2	0	0	0	111.2	R85 T86 T91	R85-D89 PolarHBondContact O-N 3.25Å; T86-D89 PolarHBondContact O-N 2.74Å; D89-T91 PolarHBondContact O-N 3.01Å
90	D	46.7	Very low	55.7	Low	122 Å²	122	137.4 Å²	137.4	65%	0.652	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.3	34.5	175.9	-56.5	-33	0	0	0	114.9	T86	T86-D90 PolarHBondContact O-N 3.19Å
91	T	48.5	Very low	53.8	Low	94 Å²	94	142.1 Å²	142.1	58%	0.577	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-135.8	13.7	-178.6	46.2	0	0	0	0	114.5	R88 D89	R88-T91 PolarHBondContact O-OG1 2.79Å; D89-T91 PolarHBondContact O-N 3.01Å
92	W	43.6	Very low	51.8	Low	216 Å²	216	144.4 Å²	144.4	82%	0.818	70%	0.7	S	S	*	*	S	Bend	trans	-141.7	37.5	-173	-71.5	94.6	0	0	0	114.9
93	V	39.9	Very low	49.8	Very low	127 Å²	127	151.4 Å²	151.4	77%	0.77	73%	0.725	S	S	*	*	S	Bend	trans	-137.6	165.4	165.1	-158.9	0	0	0	0	107.6
94	D	45.4	Very low	48.1	Very low	161 Å²	161	159 Å²	159	86%	0.861	75%	0.746	S	S	*	*	S	Bend	trans	77.3	42.9	175.2	-50.5	-11.6	0	0	0	117.4
95	E	43.1	Very low	46.4	Very low	184 Å²	184	163.8 Å²	163.8	86%	0.86	77%	0.766	S	S	*	*	S	Bend	trans	-133.5	9.2	165.3	-150.6	-176.9	-148.9	0	0	114
96	D	42.2	Very low	45	Very low	152 Å²	152	164.5 Å²	164.5	81%	0.813	78%	0.781	S	S	*	*	S	Bend	trans	-128.2	20.6	-170.4	-83	-50.4	0	0	0	114.3
97	E	43.2	Very low	43.9	Very low	185 Å²	185	168 Å²	168	86%	0.864	79%	0.791	S	S	*	*			trans	-136.7	43.8	-175.8	-157.2	158.5	-131	0	0	115.4
98	Y	42.8	Very low	43.2	Very low	221 Å²	221	164.5 Å²	164.5	87%	0.867	79%	0.787	S	S	*	*			trans	-140	62.5	169.3	-77.4	-82.1	0	0	0	112
99	E	39.6	Very low	42.8	Very low	164 Å²	164	164.6 Å²	164.6	77%	0.766	80%	0.795	S	S	*	*			trans	-165.9	79.1	171.8	-131.6	-177.8	-124.2	0	0	111.9
100	D	41.1	Very low	42.1	Very low	126 Å²	126	163.3 Å²	163.3	67%	0.674	81%	0.808	S	S	*	*			trans	-178.6	67.5	161.6	-92.2	-23.7	0	0	0	111.4	R116	D100-R116 VanDerWaalsContact CG-NH2 3.28Å; D100-R116 IonicContact OD1-NH2 3Å; D100-R116 PolarHBondContact OD1-NH2 2.93Å; D100-R116 IonicContact OD2-CZ 2.69Å; D100-R116 IonicContact OD2-NH1 3Å; D100-R116 PolarHBondContact OD2-NH1 2.75Å; D100-R116 IonicContact OD2-NH2 3.85Å; D100-R116 PolarHBondContact OD2-NH2 3.4Å
101	D	43.8	Very low	42.1	Very low	169 Å²	169	167 Å²	167	90%	0.904	82%	0.818	S	S	*	*	S	Bend	trans	-165.1	161.6	154.3	-111.6	-29.5	0	0	0	110.5
102	E	39.1	Very low	42.1	Very low	193 Å²	193	172 Å²	172	90%	0.902	84%	0.835	S	S	*	*			trans	60.9	76.6	-175.2	-64.7	-166.2	-170.8	0	0	117.8
103	E	37.9	Very low	42.3	Very low	195 Å²	195	169.6 Å²	169.6	91%	0.911	83%	0.833	S	S	*	*			trans	-140.8	110.9	144.4	-164	171.2	-131.2	0	0	110.8
104	Y	42.9	Very low	43.3	Very low	217 Å²	217	168.3 Å²	168.3	85%	0.851	82%	0.818	S	S	*	*			trans	-127.8	140.3	170.2	-94.2	-88.8	0	0	0	108.9
105	E	39.3	Very low	44.4	Very low	185 Å²	185	164.4 Å²	164.4	86%	0.864	80%	0.803	S	S	*	*			trans	61.2	87.8	166.8	-59.6	-177.2	-174.3	0	0	117.7
106	D	42	Very low	45.4	Very low	169 Å²	169	162.9 Å²	162.9	90%	0.904	79%	0.79	S	S	*	*				-156.9	168.6	113.4	-136.8	-28.8	0	0	0	113.2
107	E	40	Very low	46.7	Very low	161 Å²	161	165.6 Å²	165.6	75%	0.752	79%	0.788	S	S	*	*			trans	-91.9	163.7	-165.4	-55.1	-168.8	143.8	0	0	117.1
108	N	41.7	Very low	48.1	Very low	119 Å²	119	158.4 Å²	158.4	64%	0.636	76%	0.761	S	S	*	*			trans	63.8	96.8	155.6	-67.6	-65.1	0	0	0	119.4
109	H	44.6	Very low	49.7	Very low	187 Å²	187	154.8 Å²	154.8	87%	0.866	75%	0.745	S	S	*	*				175.3	120	105	-91.5	-60	0	0	0	112.9
110	G	36.4	Very low	51.3	Low	83 Å²	83	152.5 Å²	152.5	86%	0.856	74%	0.737	S	S	*	*			trans	-76.1	127	-174	0	0	0	0	0	116.1
111	K	47	Very low	53	Low	199 Å²	199	151.7 Å²	151.7	87%	0.865	73%	0.733	S	S	*	*			trans	-135.7	151.3	154.7	-72.8	-175.5	-178	170	0	109.9	H113	K111-H113 PolarHBondContact O-N 3.02Å
112	Q	48.4	Very low	54.6	Low	198 Å²	198	150.5 Å²	150.5	93%	0.925	72%	0.715	S	S	*	*	P	Polyproline II helix	trans	-68.5	121.6	-170.3	-67.3	167.7	-32.4	0	0	112.1	E114	Q112-E114 PolarHBondContact O-N 2.83Å
113	H	47.4	Very low	56.5	Low	167 Å²	167	142.9 Å²	142.9	77%	0.773	69%	0.688	S	S	*	*	P	Polyproline II helix	trans	-74.3	121.8	171.1	-94.8	-146.3	0	0	0	111.4	K111	K111-H113 PolarHBondContact O-N 3.02Å
114	E	61	Low	58.4	Low	100 Å²	100	136.1 Å²	136.1	47%	0.467	67%	0.666	S	S	.	*	P	Polyproline II helix	trans	-65.5	137.8	161.8	-71.6	-176.4	131.4	0	0	110.1	Q112 A118 R122	Q112-E114 PolarHBondContact O-N 2.83Å; E114-A118 HydrophobicContact CB-CB 4.4Å; E114-R122 IonicContact OE1-CZ 3.33Å; E114-R122 IonicContact OE1-NH1 3.19Å; E114-R122 IonicContact OE1-NH2 3.3Å; E114-R122 PolarHBondContact OE1-NH2 2.83Å; E114-R122 IonicContact OE2-CZ 3.79Å; E114-R122 IonicContact OE2-NH1 3.04Å; E114-R122 PolarHBondContact OE2-NH1 3.47Å; E114-R122 IonicContact OE2-NH2 2.7Å; E114-R122 PolarHBondContact OE2-NH2 2.96Å
115	S	70	Confident	60	Low	78 Å²	78	131.4 Å²	131.4	55%	0.545	66%	0.655	S	S	.	*	P	Polyproline II helix	trans	-63.6	150.3	-175.9	62.9	0	0	0	0	113	R117 A118 R119	S115-R117 PolarHBondContact O-N 3Å; S115-A118 WeakPolarHBondContact O-CA 3.45Å; S115-A118 WeakPolarHBondContact O-CB 3.45Å; S115-A118 PolarHBondContact O-N 3.49Å; S115-R119 PolarHBondContact O-N 3.03Å
116	R	64.3	Low	61.8	Low	152 Å²	152	124.9 Å²	124.9	57%	0.574	63%	0.632	S	S	*	*	H	α-helix	trans	-49.6	-39.6	-178.6	-137.5	174.9	-171.2	165.8	7.8	111.5	D100 A118 R119 I120	D100-R116 VanDerWaalsContact CG-NH2 3.28Å; D100-R116 IonicContact OD1-NH2 3Å; D100-R116 PolarHBondContact OD1-NH2 2.93Å; D100-R116 IonicContact OD2-CZ 2.69Å; D100-R116 IonicContact OD2-NH1 3Å; D100-R116 PolarHBondContact OD2-NH1 2.75Å; D100-R116 IonicContact OD2-NH2 3.85Å; D100-R116 PolarHBondContact OD2-NH2 3.4Å; R116-A118 PolarHBondContact O-N 2.68Å; R116-R119 PolarHBondContact O-N 3.28Å; R116-I120 VanDerWaalsContact O-CG1 3.3Å; R116-I120 WeakPolarHBondContact O-CG1 3.26Å; R116-I120 PolarHBondContact O-N 2.8Å
117	R	67.7	Low	63.2	Low	209 Å²	209	124.3 Å²	124.3	79%	0.789	62%	0.618	S	S	*	*	H	α-helix	trans	-57.5	-42.3	172.6	-100	-174.9	169.8	-170.5	-3	114.6	S115 L121	S115-R117 PolarHBondContact O-N 3Å; R117-L121 WeakPolarHBondContact O-CB 3.24Å; R117-L121 WeakPolarHBondContact O-CG 3.35Å; R117-L121 PolarHBondContact O-N 2.66Å
118	A	74.3	Confident	64.9	Low	34 Å²	34	126 Å²	126	28%	0.281	62%	0.617	S	S	.	*	H	α-helix	trans	-68.8	-38.3	178.7	0	0	0	0	0	111.6	E114 S115 R116 L121 R122	E114-A118 HydrophobicContact CB-CB 4.4Å; S115-A118 WeakPolarHBondContact O-CA 3.45Å; S115-A118 WeakPolarHBondContact O-CB 3.45Å; S115-A118 PolarHBondContact O-N 3.49Å; R116-A118 PolarHBondContact O-N 2.68Å; A118-L121 PolarHBondContact O-N 3.25Å; A118-R122 WeakPolarHBondContact O-CB 3.37Å; A118-R122 PolarHBondContact O-N 2.96Å
119	R	75.8	Confident	66.5	Low	145 Å²	145	126.4 Å²	126.4	55%	0.547	61%	0.613	S	S	.	*	H	α-helix	trans	-62.1	-48.7	174.7	-157.5	-175.2	-63.4	179.6	0.3	111	S115 R116 R122 G123	S115-R119 PolarHBondContact O-N 3.03Å; R116-R119 PolarHBondContact O-N 3.28Å; R119-R122 PolarHBondContact O-N 3.28Å; R119-G123 PolarHBondContact O-N 2.82Å
120	I	73.8	Confident	67.8	Low	116 Å²	116	126.5 Å²	126.5	60%	0.595	61%	0.606	S	S	*	*	H	α-helix	trans	-60.4	-47.2	175.9	-65.7	163.7	0	0	0	111.4	R116 R122 G123 A124	R116-I120 VanDerWaalsContact O-CG1 3.3Å; R116-I120 WeakPolarHBondContact O-CG1 3.26Å; R116-I120 PolarHBondContact O-N 2.8Å; I120-R122 PolarHBondContact O-N 2.78Å; I120-G123 PolarHBondContact O-N 3.46Å; I120-A124 WeakPolarHBondContact O-CB 3.5Å; I120-A124 PolarHBondContact O-N 2.85Å
121	L	76.3	Confident	69.4	Low	110 Å²	110	127.1 Å²	127.1	58%	0.576	59%	0.589	S	S	*	*	H	α-helix	trans	-63.6	-38.4	178.1	-80.6	167.7	0	0	0	112.8	R117 A118 A124 L125	R117-L121 WeakPolarHBondContact O-CB 3.24Å; R117-L121 WeakPolarHBondContact O-CG 3.35Å; R117-L121 PolarHBondContact O-N 2.66Å; A118-L121 PolarHBondContact O-N 3.25Å; L121-A124 PolarHBondContact O-N 3.04Å; L121-L125 WeakPolarHBondContact O-CB 3.43Å; L121-L125 PolarHBondContact O-N 2.69Å
122	R	77.7	Confident	70.4	Confident	144 Å²	144	119.5 Å²	119.5	54%	0.543	56%	0.564	S	S	.	*	H	α-helix	trans	-66.2	-40	174.3	-171.3	177.6	-69.4	142.8	5.8	111.3	E114 A118 R119 I120 L125 A126	E114-R122 IonicContact OE1-CZ 3.33Å; E114-R122 IonicContact OE1-NH1 3.19Å; E114-R122 IonicContact OE1-NH2 3.3Å; E114-R122 PolarHBondContact OE1-NH2 2.83Å; E114-R122 IonicContact OE2-CZ 3.79Å; E114-R122 IonicContact OE2-NH1 3.04Å; E114-R122 PolarHBondContact OE2-NH1 3.47Å; E114-R122 IonicContact OE2-NH2 2.7Å; E114-R122 PolarHBondContact OE2-NH2 2.96Å; A118-R122 WeakPolarHBondContact O-CB 3.37Å; A118-R122 PolarHBondContact O-N 2.96Å; R119-R122 PolarHBondContact O-N 3.28Å; I120-R122 PolarHBondContact O-N 2.78Å; R122-L125 PolarHBondContact O-N 3.33Å; R122-A126 VanDerWaalsContact O-CB 3.31Å; R122-A126 WeakPolarHBondContact O-CB 3.41Å; R122-A126 PolarHBondContact O-N 2.83Å
123	G	78.6	Confident	71.2	Confident	32 Å²	32	114.7 Å²	114.7	33%	0.33	54%	0.541	S	S	.	.	H	α-helix	trans	-61.4	-46.3	172.5	0	0	0	0	0	112.8	R119 I120 A126 R127	R119-G123 PolarHBondContact O-N 2.82Å; I120-G123 PolarHBondContact O-N 3.46Å; G123-A126 PolarHBondContact O-N 3.45Å; G123-R127 WeakPolarHBondContact O-CG 3.34Å; G123-R127 PolarHBondContact O-N 3.29Å
124	A	77.3	Confident	71.6	Confident	54 Å²	54	115.3 Å²	115.3	45%	0.446	54%	0.541	S	S	.	.	H	α-helix	trans	-63.2	-43.1	176.5	0	0	0	0	0	112.3	I120 L121 R127 R128	I120-A124 WeakPolarHBondContact O-CB 3.5Å; I120-A124 PolarHBondContact O-N 2.85Å; L121-A124 PolarHBondContact O-N 3.04Å; A124-R127 PolarHBondContact O-N 3.38Å; A124-R128 VanDerWaalsContact O-CB 3.3Å; A124-R128 WeakPolarHBondContact O-CB 3.14Å; A124-R128 PolarHBondContact O-N 3.01Å
125	L	76.5	Confident	71.4	Confident	117 Å²	117	118.7 Å²	118.7	61%	0.613	56%	0.555	S	S	*	*	H	α-helix	trans	-64.2	-37.6	173.2	-87	165.4	0	0	0	112.4	L121 R122 R128 K129	L121-L125 WeakPolarHBondContact O-CB 3.43Å; L121-L125 PolarHBondContact O-N 2.69Å; R122-L125 PolarHBondContact O-N 3.33Å; L125-R128 PolarHBondContact O-N 3.02Å; L125-K129 WeakPolarHBondContact O-CB 3.37Å; L125-K129 PolarHBondContact O-N 2.97Å
126	A	78.3	Confident	71	Confident	48 Å²	48	121.4 Å²	121.4	40%	0.397	56%	0.562	S	S	.	*	H	α-helix	trans	-66.8	-45	175.6	0	0	0	0	0	112.2	R122 G123 R128 K129 R130	R122-A126 VanDerWaalsContact O-CB 3.31Å; R122-A126 WeakPolarHBondContact O-CB 3.41Å; R122-A126 PolarHBondContact O-N 2.83Å; G123-A126 PolarHBondContact O-N 3.45Å; A126-R128 VanDerWaalsContact C-N 3.35Å; A126-R128 PolarHBondContact O-N 3.39Å; A126-K129 PolarHBondContact O-N 3.33Å; A126-R130 WeakPolarHBondContact O-CG 3.35Å; A126-R130 PolarHBondContact O-N 2.86Å
127	R	71.3	Confident	70	Confident	158 Å²	158	119.1 Å²	119.1	60%	0.596	56%	0.561	S	S	*	*	H	α-helix	trans	-60.2	-44.5	172.6	-66.1	-169.1	-144.8	-152.6	9.6	110.5	G123 A124 R130 L131	G123-R127 WeakPolarHBondContact O-CG 3.34Å; G123-R127 PolarHBondContact O-N 3.29Å; A124-R127 PolarHBondContact O-N 3.38Å; R127-R130 PolarHBondContact O-N 2.85Å; R127-L131 WeakPolarHBondContact O-CB 3.47Å; R127-L131 PolarHBondContact O-N 3.14Å
128	R	75.6	Confident	69	Low	195 Å²	195	114.9 Å²	114.9	74%	0.736	56%	0.561	S	S	*	*	H	α-helix	trans	-67	-34.8	178.6	-160.2	175.9	-169.2	-175.2	3.9	113.1	A124 L125 A126 A132	A124-R128 VanDerWaalsContact O-CB 3.3Å; A124-R128 WeakPolarHBondContact O-CB 3.14Å; A124-R128 PolarHBondContact O-N 3.01Å; L125-R128 PolarHBondContact O-N 3.02Å; A126-R128 VanDerWaalsContact C-N 3.35Å; A126-R128 PolarHBondContact O-N 3.39Å; R128-A132 WeakPolarHBondContact O-CB 3.23Å; R128-A132 PolarHBondContact O-N 3.4Å
129	K	75.1	Confident	67.6	Low	128 Å²	128	120.8 Å²	120.8	56%	0.557	58%	0.584	S	S	*	*	H	α-helix	trans	-70.4	-44.8	174.2	-165.7	-177.9	-171.9	-107.9	0	111.6	L125 A126 L131 A132 E133	L125-K129 WeakPolarHBondContact O-CB 3.37Å; L125-K129 PolarHBondContact O-N 2.97Å; A126-K129 PolarHBondContact O-N 3.33Å; K129-L131 VanDerWaalsContact C-N 3.3Å; K129-L131 PolarHBondContact O-N 3.15Å; K129-A132 WeakPolarHBondContact O-CB 3.37Å; K129-A132 PolarHBondContact O-N 2.79Å; K129-A132 VanDerWaalsContact O-N 3.13Å; K129-E133 VanDerWaalsContact CE-OE1 3.31Å; K129-E133 WeakPolarHBondContact CE-OE1 3.22Å; K129-E133 HydrophobicContact CG-CG 4.47Å; K129-E133 IonicContact NZ-OE1 2.89Å; K129-E133 PolarHBondContact NZ-OE1 3.05Å; K129-E133 WeakPolarHBondContact O-CB 3.45Å; K129-E133 WeakPolarHBondContact O-CG 3.46Å; K129-E133 PolarHBondContact O-N 3.07Å
130	R	71.3	Confident	66.1	Low	189 Å²	189	116 Å²	116	71%	0.713	58%	0.58	S	S	*	*	H	α-helix	trans	-60.2	-38.6	174	-74.8	-178	176.8	-178.4	0.2	112.2	A126 R127 K134	A126-R130 WeakPolarHBondContact O-CG 3.35Å; A126-R130 PolarHBondContact O-N 2.86Å; R127-R130 PolarHBondContact O-N 2.85Å; R130-K134 WeakPolarHBondContact O-CB 3.28Å; R130-K134 PolarHBondContact O-N 3.37Å
131	L	68.7	Low	64.7	Low	96 Å²	96	121.7 Å²	121.7	50%	0.503	59%	0.594	S	S	.	*	H	α-helix	trans	-65.2	-45.8	171.8	-82.1	163.3	0	0	0	111.8	R127 K129 E133 K134 F135	R127-L131 WeakPolarHBondContact O-CB 3.47Å; R127-L131 PolarHBondContact O-N 3.14Å; K129-L131 VanDerWaalsContact C-N 3.3Å; K129-L131 PolarHBondContact O-N 3.15Å; L131-E133 PolarHBondContact O-N 2.93Å; L131-K134 PolarHBondContact O-N 3.09Å; L131-F135 HydrophobicContact CD2-CE2 4.17Å; L131-F135 WeakPolarHBondContact O-CD2 3.3Å; L131-F135 PolarHBondContact O-N 3.34Å; L131-F135 VanDerWaalsContact O-N 3.08Å
132	A	69.1	Low	63	Low	40 Å²	40	124.1 Å²	124.1	33%	0.331	60%	0.603	S	S	.	*	H	α-helix	trans	-59.8	-43.9	175.5	0	0	0	0	0	112	R128 K129 K134 F135 I136	R128-A132 WeakPolarHBondContact O-CB 3.23Å; R128-A132 PolarHBondContact O-N 3.4Å; K129-A132 WeakPolarHBondContact O-CB 3.37Å; K129-A132 PolarHBondContact O-N 2.79Å; K129-A132 VanDerWaalsContact O-N 3.13Å; A132-K134 VanDerWaalsContact C-N 3.35Å; A132-K134 PolarHBondContact O-N 2.92Å; A132-F135 CarbonylContact O-C 3.21Å; A132-F135 PolarHBondContact O-N 3.12Å; A132-I136 HydrophobicContact CB-CD1 4.14Å; A132-I136 VanDerWaalsContact O-CB 3.29Å; A132-I136 WeakPolarHBondContact O-CB 3.2Å; A132-I136 WeakPolarHBondContact O-CD1 3.33Å; A132-I136 WeakPolarHBondContact O-CG1 3.39Å; A132-I136 PolarHBondContact O-N 3.24Å
133	E	64.7	Low	61.1	Low	97 Å²	97	121.6 Å²	121.6	45%	0.453	60%	0.604	S	S	.	*	H	α-helix	trans	-63.2	-37.8	176.5	-72.6	165.6	165.3	0	0	111.8	K129 L131 F135 I136 N137	K129-E133 VanDerWaalsContact CE-OE1 3.31Å; K129-E133 WeakPolarHBondContact CE-OE1 3.22Å; K129-E133 HydrophobicContact CG-CG 4.47Å; K129-E133 IonicContact NZ-OE1 2.89Å; K129-E133 PolarHBondContact NZ-OE1 3.05Å; K129-E133 WeakPolarHBondContact O-CB 3.45Å; K129-E133 WeakPolarHBondContact O-CG 3.46Å; K129-E133 PolarHBondContact O-N 3.07Å; L131-E133 PolarHBondContact O-N 2.93Å; E133-F135 VanDerWaalsContact C-N 3.27Å; E133-F135 PolarHBondContact O-N 2.84Å; E133-I136 PolarHBondContact O-N 2.71Å; E133-N137 PolarHBondContact O-N 3.48Å
134	K	56.8	Low	59.2	Low	179 Å²	179	126.1 Å²	126.1	78%	0.778	62%	0.62	S	S	*	*	H	α-helix	trans	-66	-20.6	170	-80.4	-166.4	171.7	-164.6	0	114.5	R130 L131 A132	R130-K134 WeakPolarHBondContact O-CB 3.28Å; R130-K134 PolarHBondContact O-N 3.37Å; L131-K134 PolarHBondContact O-N 3.09Å; A132-K134 VanDerWaalsContact C-N 3.35Å; A132-K134 PolarHBondContact O-N 2.92Å
135	F	57.3	Low	57.5	Low	172 Å²	172	127 Å²	127	75%	0.754	63%	0.627	S	S	*	*	H	α-helix	trans	-101.6	-12.6	176.3	-70.8	-58.4	0	0	0	114.6	L131 A132 E133	L131-F135 HydrophobicContact CD2-CE2 4.17Å; L131-F135 WeakPolarHBondContact O-CD2 3.3Å; L131-F135 PolarHBondContact O-N 3.34Å; L131-F135 VanDerWaalsContact O-N 3.08Å; A132-F135 CarbonylContact O-C 3.21Å; A132-F135 PolarHBondContact O-N 3.12Å; E133-F135 VanDerWaalsContact C-N 3.27Å; E133-F135 PolarHBondContact O-N 2.84Å
136	I	60	Low	55.7	Low	134 Å²	134	124.8 Å²	124.8	69%	0.687	63%	0.626	S	S	*	*	H	α-helix	trans	-97.4	-18	-175.6	-73.8	167.4	0	0	0	112.8	A132 E133 P138	A132-I136 HydrophobicContact CB-CD1 4.14Å; A132-I136 VanDerWaalsContact O-CB 3.29Å; A132-I136 WeakPolarHBondContact O-CB 3.2Å; A132-I136 WeakPolarHBondContact O-CD1 3.33Å; A132-I136 WeakPolarHBondContact O-CG1 3.39Å; A132-I136 PolarHBondContact O-N 3.24Å; E133-I136 PolarHBondContact O-N 2.71Å; I136-P138 VanDerWaalsContact O-CD 3.3Å; I136-P138 WeakPolarHBondContact O-CD 3.38Å
137	N	44.7	Very low	54.1	Low	105 Å²	105	129.3 Å²	129.3	56%	0.561	64%	0.643	S	S	*	*			trans	-97.1	104.2	178.8	-169.7	-0.5	0	0	0	112.4	E133 M139 G140	E133-N137 PolarHBondContact O-N 3.48Å; N137-M139 PolarHBondContact O-N 3.11Å; N137-M139 VanDerWaalsContact O-N 3.12Å; N137-G140 PolarHBondContact O-N 3Å
138	P	45.7	Very low	52.6	Low	120 Å²	120	131.6 Å²	131.6	78%	0.779	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.8	-9.9	-172.1	28.7	-36.2	0	0	0	115	I136	I136-P138 VanDerWaalsContact O-CD 3.3Å; I136-P138 WeakPolarHBondContact O-CD 3.38Å
139	M	45.4	Very low	51.1	Low	157 Å²	157	125.8 Å²	125.8	77%	0.773	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.1	-8.4	175.4	-78.3	-67.8	-178	0	0	114.1	N137 R141	N137-M139 PolarHBondContact O-N 3.11Å; N137-M139 VanDerWaalsContact O-N 3.12Å; M139-R141 PolarHBondContact O-N 3.16Å
140	G	45	Very low	49.2	Very low	45 Å²	45	124.1 Å²	124.1	46%	0.464	67%	0.666	S	S	.	*	T	Hydrogen-bonded Turn	trans	-71.4	3.1	-176	0	0	0	0	0	116.5	N137	N137-G140 PolarHBondContact O-N 3Å
141	R	42.9	Very low	47.4	Very low	235 Å²	235	124.3 Å²	124.3	89%	0.887	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.8	5.9	-171.6	-85.5	-173.9	169.6	-174.2	-3.6	115.9	M139	M139-R141 PolarHBondContact O-N 3.16Å
142	Q	40.5	Very low	45.8	Very low	161 Å²	161	131.2 Å²	131.2	75%	0.752	69%	0.692	S	S	*	*	S	Bend	trans	-109.8	-8.4	-179.5	-71.2	-171.7	-15.8	0	0	115.1
143	T	38.6	Very low	44.1	Very low	92 Å²	92	137.6 Å²	137.6	56%	0.564	72%	0.717	S	S	*	*	S	Bend	trans	-69.8	-35.7	-178.6	49	0	0	0	0	113.4	A145 A146	T143-A145 PolarHBondContact O-N 3.24Å; T143-A146 WeakPolarHBondContact O-CB 3.49Å; T143-A146 PolarHBondContact O-N 3.01Å; T143-A146 VanDerWaalsContact O-N 3.12Å
144	D	39.4	Very low	43	Very low	126 Å²	126	140 Å²	140	67%	0.674	73%	0.732	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.4	-15	-172.5	-57.8	-4.2	0	0	0	112	A146	D144-A146 VanDerWaalsContact C-N 3.31Å
145	A	40.6	Very low	42.4	Very low	73 Å²	73	138.9 Å²	138.9	60%	0.603	74%	0.735	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77	-14.6	171.6	0	0	0	0	0	113.5	T143 S149	T143-A145 PolarHBondContact O-N 3.24Å; A145-S149 WeakPolarHBondContact O-CB 3.43Å
146	A	39.8	Very low	41.4	Very low	71 Å²	71	138 Å²	138	59%	0.587	74%	0.739	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.7	-20.9	179.5	0	0	0	0	0	113.4	T143 D144	T143-A146 WeakPolarHBondContact O-CB 3.49Å; T143-A146 PolarHBondContact O-N 3.01Å; T143-A146 VanDerWaalsContact O-N 3.12Å; D144-A146 VanDerWaalsContact C-N 3.31Å
147	L	43.1	Very low	40.4	Very low	143 Å²	143	140.7 Å²	140.7	75%	0.749	75%	0.748	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.7	-14.8	-178.5	-81.9	164	0	0	0	114.3
148	F	41.3	Very low	39.8	Very low	205 Å²	205	143.3 Å²	143.3	90%	0.899	76%	0.757	S	S	*	*	T	Hydrogen-bonded Turn	trans	-124.2	20.7	174.7	-82.2	-89	0	0	0	113
149	S	42.8	Very low	39.1	Very low	73 Å²	73	143.9 Å²	143.9	51%	0.51	75%	0.752	S	S	.	*	S	Bend	trans	-123.5	111.3	171	-162.3	0	0	0	0	109.5	A145 K151	A145-S149 WeakPolarHBondContact O-CB 3.43Å; S149-K151 PolarHBondContact O-N 3.33Å
150	G	35	Very low	38.5	Very low	94 Å²	94	141.3 Å²	141.3	97%	0.969	75%	0.745	S	S	*	*			trans	-72.7	61.7	-170.1	0	0	0	0	0	114.8
151	K	34.9	Very low	37.9	Very low	192 Å²	192	148.7 Å²	148.7	84%	0.835	76%	0.76	S	S	*	*			trans	-136.1	109.4	-174.8	-157	169.3	-173.1	177	0	111.6	S149	S149-K151 PolarHBondContact O-N 3.33Å
152	R	34.2	Very low	37.5	Very low	242 Å²	242	143.4 Å²	143.4	91%	0.913	75%	0.754	S	S	*	*			trans	-76.7	152.1	-178.4	-56.8	177.4	-173.7	165.8	1	111.9
153	M	33.8	Very low	37	Very low	174 Å²	174	139.8 Å²	139.8	86%	0.857	75%	0.752	S	S	*	*			trans	-147.3	176.9	153.4	-138.4	143.3	-178.7	0	0	107.8
154	D	42.5	Very low	36.6	Very low	146 Å²	146	147.6 Å²	147.6	78%	0.781	77%	0.771	S	S	*	*			trans	71.2	119.9	-160.5	-43	-14.4	0	0	0	110.3
155	D	42.2	Very low	36.4	Very low	157 Å²	157	145.4 Å²	145.4	84%	0.84	78%	0.778	S	S	*	*			cis	-134	175.6	1.9	-74.7	-51.2	0	0	0	111.6
156	D	38.2	Very low	35.9	Very low	154 Å²	154	148.8 Å²	148.8	82%	0.824	79%	0.791	S	S	*	*			trans	-88.3	178.7	-170.6	-71.3	-64.2	0	0	0	116.5
157	E	38.7	Very low	35.4	Very low	190 Å²	190	149.5 Å²	149.5	89%	0.888	80%	0.797	S	S	*	*			trans	70.5	137.6	170	-59.3	-175.9	-179.7	0	0	117.7
158	E	32.1	Very low	34.7	Very low	160 Å²	160	147.3 Å²	147.3	75%	0.748	80%	0.8	S	S	*	*			cis	-161.4	164.4	-25.1	-143.4	-161	162.5	0	0	108.8
159	I	31.4	Very low	34.4	Very low	132 Å²	132	145.2 Å²	145.2	68%	0.677	80%	0.798	S	S	*	*			trans	65.9	135.7	156.8	-63.2	162.6	0	0	0	119.4
160	T	31.6	Very low	33.9	Very low	102 Å²	102	146.3 Å²	146.3	63%	0.626	80%	0.804	S	S	*	*			cis	-166.5	155.6	-30	42	0	0	0	0	110.4
161	Y	32.9	Very low	33.7	Very low	200 Å²	200	148.7 Å²	148.7	78%	0.784	79%	0.794	S	S	*	*			trans	27.3	117.6	151.8	-53.3	-58	0	0	0	120.8
162	T	33.5	Very low	33.9	Very low	124 Å²	124	146.4 Å²	146.4	76%	0.761	79%	0.791	S	S	*	*				57.9	128.4	63.9	75.6	0	0	0	0	117.4
163	A	31.1	Very low	34	Very low	86 Å²	86	140.1 Å²	140.1	71%	0.711	78%	0.779	S	S	*	*				161.2	138.9	103.9	0	0	0	0	0	116
164	R	30.8	Very low	34.1	Very low	255 Å²	255	137.7 Å²	137.7	96%	0.962	77%	0.769	S	S	*	*			trans	60.9	129.5	155.1	-65.9	172.6	171.5	173.1	-3.2	120.2
165	G	33.2	Very low	33.9	Very low	80 Å²	80	140.3 Å²	140.3	83%	0.825	77%	0.774	S	S	*	*			trans	175.9	91.8	165.4	0	0	0	0	0	114.9
166	V	30.9	Very low	33.4	Very low	144 Å²	144	138.2 Å²	138.2	87%	0.873	77%	0.772	S	S	*	*			trans	-75.2	132	-172.2	168.9	0	0	0	0	114.5
167	A	29.5	Very low	33.2	Very low	86 Å²	86	134.5 Å²	134.5	71%	0.711	77%	0.769	S	S	*	*			trans	50.2	137.1	147.5	0	0	0	0	0	124.4
168	A	29.2	Very low	32.8	Very low	97 Å²	97	133.2 Å²	133.2	80%	0.802	77%	0.768	S	S	*	*			trans	58.4	117.8	139.1	0	0	0	0	0	122.1
169	D	33.8	Very low	32.6	Very low	161 Å²	161	137 Å²	137	86%	0.861	78%	0.776	S	S	*	*				-157.3	166.4	117.4	-126.1	4.3	0	0	0	110.1
170	P	33.3	Very low	32.4	Very low	97 Å²	97	134.4 Å²	134.4	63%	0.63	77%	0.774	S	S	*	*			trans	-99.1	-169.8	-179.1	40.2	-35	0	0	0	113.6
171	D	29.3	Very low	32.5	Very low	143 Å²	143	135.6 Å²	135.6	77%	0.765	78%	0.781	S	S	*	*			trans	65.6	65.7	161.6	-61.2	-20.9	0	0	0	119.8
172	D	40.5	Very low	32.5	Very low	144 Å²	144	134.7 Å²	134.7	77%	0.77	78%	0.784	S	S	*	*			trans	-155.7	113.9	138	-127.7	-16.3	0	0	0	107.8
173	V	34.7	Very low	32.7	Very low	110 Å²	110	133.2 Å²	133.2	67%	0.667	78%	0.777	S	S	*	*			cis	80.6	153.9	33.2	-166	0	0	0	0	112.7
174	L	37.3	Very low	32.8	Very low	123 Å²	123	136.2 Å²	136.2	64%	0.644	78%	0.776	S	S	*	*			trans	75.5	127.3	-171.5	-46.3	176.5	0	0	0	114.4
175	F	37.1	Very low	33.3	Very low	201 Å²	201	133.3 Å²	133.3	88%	0.882	77%	0.767	S	S	*	*			cis	-116.2	137.9	7.7	-86.3	-96.5	0	0	0	113.3
176	S	32.5	Very low	33.8	Very low	114 Å²	114	135.7 Å²	135.7	80%	0.797	76%	0.76	S	S	*	*			trans	-123.2	161.8	177.7	58.3	0	0	0	0	111.1
177	G	33.5	Very low	34.2	Very low	75 Å²	75	136.5 Å²	136.5	77%	0.773	76%	0.755	S	S	*	*			trans	-163.2	63.3	-169.9	0	0	0	0	0	115.7
178	N	30.2	Very low	35	Very low	163 Å²	163	141.4 Å²	141.4	87%	0.872	76%	0.756	S	S	*	*			trans	-61.2	153.4	168.1	-69	-20.1	0	0	0	111.5
179	R	27.5	Very low	35.9	Very low	240 Å²	240	143 Å²	143	91%	0.906	75%	0.751	S	S	*	*				152.5	128.1	110.6	-175.7	165.4	-171.6	157.8	2.9	116.7
180	A	28.5	Very low	36.4	Very low	78 Å²	78	139.5 Å²	139.5	65%	0.645	74%	0.738	S	S	*	*			trans	83.5	131.6	145.7	0	0	0	0	0	124
181	T	33.7	Very low	36.6	Very low	126 Å²	126	143.1 Å²	143.1	77%	0.773	75%	0.75	S	S	*	*			trans	65.4	108.1	139.4	51.7	0	0	0	0	122.8
182	Q	32.3	Very low	36.8	Very low	181 Å²	181	144.1 Å²	144.1	85%	0.846	76%	0.755	S	S	*	*				43.9	157.8	112.9	-84	-165	19.3	0	0	122
183	P	36.9	Very low	36.4	Very low	93 Å²	93	145.2 Å²	145.2	60%	0.604	76%	0.761	S	S	*	*			cis	-137.6	-158.1	-17.1	28.8	-2.9	0	0	0	113.5
184	E	34.7	Very low	36.2	Very low	150 Å²	150	143.5 Å²	143.5	70%	0.701	77%	0.765	S	S	*	*			trans	79.6	109.5	158.9	-56.7	-167	147.2	0	0	117.5
185	Y	40.5	Very low	36	Very low	194 Å²	194	142.2 Å²	142.2	76%	0.761	77%	0.772	S	S	*	*				86.5	138.4	89.4	-70.2	-40.8	0	0	0	113
186	D	43.2	Very low	36.2	Very low	129 Å²	129	137.7 Å²	137.7	69%	0.69	76%	0.763	S	S	*	*			cis	-162.8	-160.2	-23.4	-135.4	-23.9	0	0	0	106.3
187	E	40.1	Very low	36.1	Very low	162 Å²	162	138.8 Å²	138.8	76%	0.757	76%	0.759	S	S	*	*			cis	-152.8	131.2	5.6	108.9	-178.2	-95.6	0	0	111.4
188	Y	46.7	Very low	35.9	Very low	189 Å²	189	141.7 Å²	141.7	74%	0.741	76%	0.761	S	S	*	*			trans	58.8	156.1	149.8	-72.5	-110.4	0	0	0	122.8
189	D	48.8	Very low	36.2	Very low	130 Å²	130	142 Å²	142	70%	0.695	76%	0.758	S	S	*	*			cis	-163.6	-168.1	-33.6	-146.4	12.4	0	0	0	108.5
190	P	42.3	Very low	36.8	Very low	88 Å²	88	136.3 Å²	136.3	57%	0.571	75%	0.752	S	S	*	*				-129.4	179.8	-125.4	41.1	-19.8	0	0	0	115.6
191	L	37.5	Very low	36.9	Very low	172 Å²	172	138.5 Å²	138.5	90%	0.901	76%	0.757	S	S	*	*	S	Bend	trans	-164.6	13.7	133.4	-110.2	173.9	0	0	0	114.8
192	L	33.5	Very low	36.7	Very low	164 Å²	164	136.6 Å²	136.6	86%	0.859	75%	0.754	S	S	*	*			trans	-129.4	89.9	174.4	-78.3	172	0	0	0	110.8
193	N	32.6	Very low	36.7	Very low	168 Å²	168	134.8 Å²	134.8	90%	0.898	76%	0.755	S	S	*	*			trans	-164.2	134.6	163.9	-92.8	-38.9	0	0	0	107.2
194	G	31.5	Very low	36.6	Very low	73 Å²	73	135 Å²	135	75%	0.753	77%	0.765	S	S	*	*			cis	-165.8	176.4	-5.9	0	0	0	0	0	110.8
195	A	33.2	Very low	36.3	Very low	96 Å²	96	132.3 Å²	132.3	79%	0.793	77%	0.768	S	S	*	*			trans	-95	-153.5	169.9	0	0	0	0	0	109.1
196	P	41	Very low	35.8	Very low	107 Å²	107	128.2 Å²	128.2	70%	0.695	78%	0.775	S	S	*	*			cis	-131.3	-141.1	-21.9	22	5.4	0	0	0	110.8
197	I	30.2	Very low	35.4	Very low	137 Å²	137	126.1 Å²	126.1	70%	0.703	78%	0.775	S	S	*	*			trans	91.2	101.2	147.7	-66.2	165.6	0	0	0	120.4
198	T	29.4	Very low	35.3	Very low	135 Å²	135	124.2 Å²	124.2	83%	0.828	78%	0.775	S	S	*	*			trans	65.5	162.2	140.4	63.1	0	0	0	0	124
199	E	35.7	Very low	34.5	Very low	170 Å²	170	121.1 Å²	121.1	79%	0.794	78%	0.776	S	S	*	*			trans	-69.2	171.6	-179.1	-45.6	-174.7	137.1	0	0	114.7
200	P	40.2	Very low	33.7	Very low	121 Å²	121	119.4 Å²	119.4	79%	0.786	78%	0.78	S	S	*	*				-150	146	92.5	38.6	-21.6	0	0	0	118.2
201	V	32.1	Very low	33.4	Very low	123 Å²	123	120.9 Å²	120.9	75%	0.745	79%	0.787	S	S	*	*				29	100.9	129	-171.4	0	0	0	0	120.4
202	A	29.1	Very low	33.2	Very low	87 Å²	87	121.1 Å²	121.1	72%	0.719	78%	0.784	S	S	*	*				65.7	163.2	129.5	0	0	0	0	0	125
203	V	31.3	Very low	33.1	Very low	143 Å²	143	117.3 Å²	117.3	87%	0.867	77%	0.771	S	S	*	*			trans	85.6	94.3	161.7	-166	0	0	0	0	120
204	A	34.8	Very low	33.1	Very low	97 Å²	97	121.2 Å²	121.2	80%	0.802	77%	0.773	S	S	*	*			trans	163.8	111.5	133.4	0	0	0	0	0	109.4
205	A	28.5	Very low	33.2	Very low	94 Å²	94	121.8 Å²	121.8	78%	0.777	77%	0.771	S	S	*	*			cis	95.4	126.7	22.3	0	0	0	0	0	115.6
206	A	30.4	Very low	33.5	Very low	108 Å²	108	121.5 Å²	121.5	89%	0.893	77%	0.768	S	S	*	*			trans	66.9	148.1	-176.7	0	0	0	0	0	115.2
207	A	34.7	Very low	33.9	Very low	85 Å²	85	122 Å²	122	70%	0.702	77%	0.771	S	S	*	*			cis	-156.3	166.6	5.3	0	0	0	0	0	109.2
208	T	37.6	Very low	34.2	Very low	122 Å²	122	121.8 Å²	121.8	75%	0.748	78%	0.776	S	S	*	*			cis	-158.4	135.7	-3.4	-6.1	0	0	0	0	111.3
209	T	30.7	Very low	34.7	Very low	124 Å²	124	123.7 Å²	123.7	76%	0.761	78%	0.776	S	S	*	*			trans	28.9	126.9	142.9	58.3	0	0	0	0	124.1
210	A	31.6	Very low	35.1	Very low	94 Å²	94	120.6 Å²	120.6	78%	0.777	77%	0.771	S	S	*	*			trans	68.1	163.7	137	0	0	0	0	0	119.1
211	T	36.2	Very low	34.8	Very low	119 Å²	119	121 Å²	121	73%	0.73	77%	0.77	S	S	*	*			cis	-149.5	162.9	15.8	-10.7	0	0	0	0	112
212	Q	32.5	Very low	34.8	Very low	177 Å²	177	120.5 Å²	120.5	83%	0.827	77%	0.768	S	S	*	*			trans	9	153.4	137.7	-69.3	176.5	4	0	0	120.6
213	S	31.5	Very low	34.9	Very low	84 Å²	84	125.2 Å²	125.2	59%	0.587	78%	0.775	S	S	*	*			cis	-176.6	174.3	-1.1	48.8	0	0	0	0	110.8
214	W	33.7	Very low	35.3	Very low	250 Å²	250	124.5 Å²	124.5	95%	0.947	77%	0.771	S	S	*	*			trans	64.6	158.4	165.8	-90.9	-47.1	0	0	0	117
215	A	33.8	Very low	36	Very low	85 Å²	85	125.4 Å²	125.4	70%	0.702	77%	0.769	S	S	*	*			cis	-151.3	158.3	-13.7	0	0	0	0	0	110.4
216	A	38.3	Very low	36.7	Very low	90 Å²	90	126.4 Å²	126.4	74%	0.744	77%	0.767	S	S	*	*			trans	-109.8	-166.4	159.2	0	0	0	0	0	107.9
217	P	49.5	Very low	37.1	Very low	117 Å²	117	127.9 Å²	127.9	76%	0.76	77%	0.765	S	S	*	*			cis	-134.4	-152	-9.9	37.3	-15.8	0	0	0	112.6
218	V	37	Very low	37.2	Very low	133 Å²	133	128.9 Å²	128.9	81%	0.806	77%	0.773	S	S	*	*			trans	124.1	127.1	149.7	177.3	0	0	0	0	115.8
219	E	39.2	Very low	36.9	Very low	174 Å²	174	128.2 Å²	128.2	81%	0.813	77%	0.773	S	S	*	*			trans	-92.6	-146.3	172.9	-42.4	175.7	112.8	0	0	109.7
220	P	45.1	Very low	37.1	Very low	106 Å²	106	129.4 Å²	129.4	69%	0.688	78%	0.78	S	S	*	*			cis	-128.4	-154.7	-29.8	24.5	0	0	0	0	111.5
221	V	32.4	Very low	37.1	Very low	129 Å²	129	132.1 Å²	132.1	78%	0.782	78%	0.782	S	S	*	*			trans	99.6	128.6	155	-173.2	0	0	0	0	118.3
222	T	33	Very low	36.9	Very low	112 Å²	112	132.7 Å²	132.7	69%	0.687	79%	0.785	S	S	*	*			trans	-44.2	152.1	177	57.5	0	0	0	0	118.3
223	Q	31.8	Very low	37.4	Very low	186 Å²	186	129.5 Å²	129.5	87%	0.869	78%	0.779	S	S	*	*				-169.5	153	120.7	-105.1	160.9	42.9	0	0	115
224	T	39.4	Very low	37.8	Very low	129 Å²	129	131 Å²	131	79%	0.791	79%	0.787	S	S	*	*			trans	-129.6	170.5	168.8	49.7	0	0	0	0	108.6
225	P	49.6	Very low	37.7	Very low	116 Å²	116	123.8 Å²	123.8	75%	0.753	78%	0.781	S	S	*	*			cis	-103.3	-92.9	-4.3	18.1	5.5	0	0	0	111.7
226	P	42.5	Very low	37.8	Very low	115 Å²	115	127.6 Å²	127.6	75%	0.747	78%	0.784	S	S	*	*			cis	-99.1	-156.3	-7.4	42.6	-35.8	0	0	0	112.8
227	V	39.5	Very low	37.9	Very low	139 Å²	139	129.7 Å²	129.7	84%	0.842	79%	0.79	S	S	*	*			trans	-128.5	143.9	168	173.2	0	0	0	0	108.8
228	A	35.4	Very low	37.2	Very low	105 Å²	105	129 Å²	129	87%	0.868	78%	0.784	S	S	*	*			trans	-145.5	118.6	168.7	0	0	0	0	0	111.3
229	S	32.7	Very low	37.2	Very low	108 Å²	108	129.8 Å²	129.8	76%	0.755	79%	0.789	S	S	*	*			trans	-109.9	134.5	-177.4	52.5	0	0	0	0	111.8
230	V	35.2	Very low	37	Very low	149 Å²	149	124.2 Å²	124.2	90%	0.903	77%	0.772	S	S	*	*			trans	-141.8	141	161.5	-172.8	0	0	0	0	109.4
231	D	30.4	Very low	36.4	Very low	152 Å²	152	129.7 Å²	129.7	81%	0.813	78%	0.779	S	S	*	*			trans	-81.6	-173.3	-178.8	-98.6	-67	0	0	0	114.6
232	V	32.7	Very low	36.7	Very low	131 Å²	131	131.2 Å²	131.2	79%	0.794	78%	0.778	S	S	*	*			trans	105.9	122.9	152.8	-170.9	0	0	0	0	116.4
233	P	43	Very low	37.1	Very low	110 Å²	110	130.7 Å²	130.7	71%	0.714	78%	0.776	S	S	*	*			trans	-89.4	-165.5	177.8	43	-41.2	0	0	0	111.1
234	P	40.4	Very low	37.4	Very low	116 Å²	116	128.1 Å²	128.1	75%	0.753	77%	0.773	S	S	*	*			cis	-145.3	-160.7	9.4	44	-22.1	0	0	0	116.6
235	A	30.3	Very low	37.3	Very low	98 Å²	98	127.7 Å²	127.7	81%	0.81	77%	0.773	S	S	*	*			trans	88.9	159.8	150.2	0	0	0	0	0	120.7
236	Q	37	Very low	36.8	Very low	165 Å²	165	125.4 Å²	125.4	77%	0.771	77%	0.77	S	S	*	*			trans	-110.2	169.3	-171.8	-56.8	167.3	-36	0	0	111.2
237	P	40.6	Very low	36.9	Very low	133 Å²	133	126 Å²	126	86%	0.864	77%	0.774	S	S	*	*			trans	-102.7	125.7	144.6	33.3	-26.9	0	0	0	111.7
238	T	33.5	Very low	36.7	Very low	103 Å²	103	128.4 Å²	128.4	63%	0.632	78%	0.776	S	S	*	*			trans	-85.8	153.4	-175.2	-52.6	0	0	0	0	113.3	A240	T238-A240 HydrophobicContact CG2-CB 4.1Å
239	V	38.7	Very low	36.6	Very low	150 Å²	150	129.9 Å²	129.9	91%	0.909	77%	0.774	S	S	*	*			trans	-124.7	133.7	149.8	-178.1	0	0	0	0	108.7
240	A	34.5	Very low	36.8	Very low	57 Å²	57	128.3 Å²	128.3	47%	0.471	78%	0.776	S	S	.	*			trans	-144.8	171.2	-175.3	0	0	0	0	0	108.6	T238	T238-A240 HydrophobicContact CG2-CB 4.1Å
241	W	33	Very low	36.9	Very low	220 Å²	220	130.4 Å²	130.4	83%	0.833	78%	0.775	S	S	*	*			cis	-130	-149.4	16.2	-62.7	83.6	0	0	0	109.7
242	Q	36.7	Very low	37.1	Very low	161 Å²	161	128.7 Å²	128.7	75%	0.752	77%	0.773	S	S	*	*			cis	-155.1	152.7	7.1	-155.9	86.2	61.9	0	0	109.4
243	P	42.8	Very low	37.4	Very low	101 Å²	101	128.6 Å²	128.6	66%	0.656	77%	0.772	S	S	*	*			trans	-121.2	-174.7	-168.5	35.2	-17.3	0	0	0	116.2
244	V	38	Very low	37.2	Very low	132 Å²	132	130.8 Å²	130.8	80%	0.8	78%	0.776	S	S	*	*			trans	84.1	145.3	164.7	-173.3	0	0	0	0	115.8
245	P	37.1	Very low	37.6	Very low	121 Å²	121	129.3 Å²	129.3	79%	0.786	77%	0.774	S	S	*	*			cis	-119.7	-177.4	-14.9	33.6	-15.6	0	0	0	114.3
246	G	38.6	Very low	38.2	Very low	68 Å²	68	130.8 Å²	130.8	70%	0.701	78%	0.775	S	S	*	*			trans	-125.6	-161.7	152.8	0	0	0	0	0	110
247	P	44.8	Very low	38.2	Very low	127 Å²	127	127.2 Å²	127.2	83%	0.825	77%	0.774	S	S	*	*			cis	-111.4	-170.5	-13.8	41.6	-30.4	0	0	0	111.4
248	Q	34.5	Very low	38.9	Very low	189 Å²	189	127.1 Å²	127.1	88%	0.883	77%	0.773	S	S	*	*			trans	176.5	168.8	142	-86.5	-99.3	1.3	0	0	109.9
249	T	34.3	Very low	39	Very low	136 Å²	136	131.9 Å²	131.9	83%	0.834	79%	0.788	S	S	*	*			trans	-90.1	148.1	-168.4	49.2	0	0	0	0	115.4
250	G	37.7	Very low	39.4	Very low	76 Å²	76	128 Å²	128	78%	0.784	78%	0.778	S	S	*	*			trans	-166.7	149.6	170.5	0	0	0	0	0	112.8
251	E	35.9	Very low	39.6	Very low	192 Å²	192	135.6 Å²	135.6	90%	0.897	80%	0.797	S	S	*	*			trans	-77.9	159.8	-162.8	-64.4	167.6	113.2	0	0	116.7
252	P	34.5	Very low	40.2	Very low	117 Å²	117	131.2 Å²	131.2	76%	0.76	80%	0.796	S	S	*	*			trans	-103.5	145	174.1	38.1	-31.8	0	0	0	114.9
253	V	39.4	Very low	40.1	Very low	129 Å²	129	132.6 Å²	132.6	78%	0.782	80%	0.803	S	S	*	*			trans	-141.8	109.4	171.7	-179.5	0	0	0	0	106.3
254	I	39.8	Very low	39.7	Very low	155 Å²	155	136.8 Å²	136.8	80%	0.795	81%	0.813	S	S	*	*				67.8	124.7	77.7	-63.6	165.2	0	0	0	110
255	A	47.6	Very low	39.7	Very low	85 Å²	85	135.9 Å²	135.9	70%	0.702	81%	0.813	S	S	*	*			cis	-151.3	-160.6	23.5	0	0	0	0	0	112.1
256	P	43.2	Very low	39.4	Very low	129 Å²	129	139.1 Å²	139.1	84%	0.838	82%	0.818	S	S	*	*				-133	-170.7	-78.9	41.9	-24.6	0	0	0	114.3
257	A	37.8	Very low	39.4	Very low	90 Å²	90	146.9 Å²	146.9	74%	0.744	83%	0.828	S	S	*	*			trans	-118	166.6	169.6	0	0	0	0	0	111.7
258	P	53.5	Low	39.1	Very low	131 Å²	131	145.3 Å²	145.3	85%	0.851	83%	0.825	S	S	*	*			trans	-95.7	133.3	175.5	34.7	-30.8	0	0	0	113.6
259	E	36.3	Very low	39.1	Very low	203 Å²	203	145.4 Å²	145.4	95%	0.949	83%	0.826	S	S	*	*			trans	-112	167	166.7	-73.9	-164.3	112.4	0	0	111.4
260	G	47.3	Very low	39.4	Very low	68 Å²	68	145 Å²	145	70%	0.701	83%	0.825	S	S	*	*			trans	-174.9	64.5	-179	0	0	0	0	0	116.1
261	Y	37.8	Very low	39.2	Very low	218 Å²	218	145.3 Å²	145.3	86%	0.855	82%	0.821	S	S	*	*			trans	-143.2	123.8	164.1	-91.7	-88.1	0	0	0	109.7
262	P	46	Very low	39.1	Very low	128 Å²	128	142.6 Å²	142.6	83%	0.831	82%	0.817	S	S	*	*			trans	-86.1	134.9	171.7	32.7	-31.3	0	0	0	111.4
263	Q	34.9	Very low	39.1	Very low	189 Å²	189	145.7 Å²	145.7	88%	0.883	82%	0.821	S	S	*	*			trans	-134.6	162.7	162.8	-124.2	-173.4	-2.6	0	0	110.7
264	Q	34.6	Very low	38.8	Very low	189 Å²	189	149.6 Å²	149.6	88%	0.883	82%	0.823	S	S	*	*			trans	-70.8	149.3	-165.6	-62.4	155.9	-57.6	0	0	113.3
265	S	37.6	Very low	38.6	Very low	114 Å²	114	150 Å²	150	80%	0.797	83%	0.827	S	S	*	*			trans	-137	129.3	161.1	-74.3	0	0	0	0	109.9
266	Q	30.9	Very low	38	Very low	188 Å²	188	154.5 Å²	154.5	88%	0.879	83%	0.834	S	S	*	*			trans	-82.3	135.4	162.9	-67.1	173.6	-32.1	0	0	108.8
267	Y	39.4	Very low	37.9	Very low	232 Å²	232	152.4 Å²	152.4	91%	0.91	82%	0.82	S	S	*	*			trans	-146.6	156.3	155.6	-97	-71.6	0	0	0	111.1
268	A	37.8	Very low	37.9	Very low	94 Å²	94	154.7 Å²	154.7	78%	0.777	82%	0.819	S	S	*	*			trans	-92.4	173.3	-165.7	0	0	0	0	0	114.2
269	Q	35.3	Very low	37.2	Very low	190 Å²	190	155.2 Å²	155.2	89%	0.888	81%	0.81	S	S	*	*			trans	-58	151.2	176.8	-62.3	173.8	-16.3	0	0	113.3
270	P	39.7	Very low	37.5	Very low	128 Å²	128	153.7 Å²	153.7	83%	0.831	80%	0.803	S	S	*	*				-121	162.2	128.1	36.2	-31.4	0	0	0	111.8
271	A	33.1	Very low	37.4	Very low	83 Å²	83	155.7 Å²	155.7	69%	0.686	80%	0.804	S	S	*	*			trans	-124.6	172	178.7	0	0	0	0	0	111.4
272	V	35.1	Very low	37.6	Very low	134 Å²	134	152 Å²	152	81%	0.812	80%	0.804	S	S	*	*			trans	62.4	147	-179.7	-108.6	0	0	0	0	114.1
273	Q	33.2	Very low	37.1	Very low	182 Å²	182	154.2 Å²	154.2	85%	0.85	80%	0.803	S	S	*	*			cis	-150	164.5	16.5	-162.9	159.1	-20.7	0	0	113.3
274	Y	33.4	Very low	37.5	Very low	211 Å²	211	150 Å²	150	83%	0.827	79%	0.792	S	S	*	*			trans	-72.3	148.3	-175.6	-78.8	-114	0	0	0	115
275	N	35.6	Very low	37.7	Very low	165 Å²	165	150 Å²	150	88%	0.882	79%	0.792	S	S	*	*				-173.1	152.7	112.8	-95.5	-12.9	0	0	0	114.7
276	E	35.5	Very low	37.7	Very low	178 Å²	178	152.2 Å²	152.2	83%	0.832	79%	0.79	S	S	*	*			trans	-114.9	-162.4	176.7	-128.6	-167.2	104.5	0	0	108
277	P	41.9	Very low	38.6	Very low	85 Å²	85	149.4 Å²	149.4	55%	0.552	79%	0.788	S	S	*	*			cis	-138.2	-162.5	-11.9	24.9	2.5	0	0	0	114.9
278	L	37.4	Very low	38.7	Very low	138 Å²	138	147 Å²	147	72%	0.723	78%	0.778	S	S	*	*			trans	83.4	146.4	156.5	-46.6	-176.1	0	0	0	117.7
279	Q	39.5	Very low	39	Very low	143 Å²	143	152.9 Å²	152.9	67%	0.668	78%	0.782	S	S	*	*			cis	-161.2	128.6	-4.3	-119.4	168.7	11.6	0	0	110.7
280	Q	41.9	Very low	39.6	Very low	170 Å²	170	147.5 Å²	147.5	79%	0.794	77%	0.77	S	S	*	*				101	164	103.8	-97.6	-170.4	12.8	0	0	117.1
281	P	45.5	Very low	39.7	Very low	110 Å²	110	147.8 Å²	147.8	71%	0.714	77%	0.772	S	S	*	*				-137.3	-170.5	-124.8	46.4	-28.7	0	0	0	117
282	V	41.3	Very low	40.2	Very low	142 Å²	142	148.7 Å²	148.7	86%	0.861	78%	0.779	S	S	*	*			trans	-167.3	159.3	142.1	133.9	0	0	0	0	111.1
283	Q	36.6	Very low	40.5	Very low	173 Å²	173	147.1 Å²	147.1	81%	0.808	78%	0.78	S	S	*	*			trans	-121.5	-156.9	-177	-45.4	176.7	-36.6	0	0	110.4
284	P	42.6	Very low	40.8	Very low	100 Å²	100	147.5 Å²	147.5	65%	0.649	78%	0.782	S	S	*	*			cis	-136.6	172	-21.3	34.5	-15.1	0	0	0	115.7
285	Q	38.5	Very low	41.2	Very low	191 Å²	191	146.7 Å²	146.7	89%	0.893	79%	0.786	S	S	*	*				169	158.7	123.3	-90.5	175.7	4.9	0	0	113.6
286	Q	38.4	Very low	41.4	Very low	159 Å²	159	145 Å²	145	74%	0.743	78%	0.784	S	S	*	*			trans	-133.6	172.7	-179	-60.2	-175.4	-36.3	0	0	110.9
287	P	48.8	Very low	41.7	Very low	129 Å²	129	141.2 Å²	141.2	84%	0.838	78%	0.783	S	S	*	*				-149.2	-159.3	90.1	40.5	-22.4	0	0	0	114
288	Y	40.8	Very low	41.5	Very low	182 Å²	182	145.8 Å²	145.8	71%	0.714	80%	0.797	S	S	*	*				-156.2	175.5	-88.8	-158	-94.6	0	0	0	110.3
289	Y	44.7	Very low	41.6	Very low	218 Å²	218	148.1 Å²	148.1	86%	0.855	80%	0.804	S	S	*	*			trans	92.6	141.6	178.7	-74.5	-96.2	0	0	0	117.8
290	A	48.6	Very low	41.7	Very low	77 Å²	77	146.7 Å²	146.7	64%	0.636	81%	0.807	S	S	*	*			cis	-172.5	140.2	-31.3	0	0	0	0	0	110.9
291	P	40.6	Very low	41.5	Very low	134 Å²	134	148.8 Å²	148.8	87%	0.87	81%	0.809	S	S	*	*			trans	-126.5	151	163.9	38.1	-26.3	0	0	0	114.6
292	A	44.8	Very low	41.3	Very low	101 Å²	101	154.6 Å²	154.6	84%	0.835	82%	0.818	S	S	*	*			trans	-166.2	155.3	177	0	0	0	0	0	109.9
293	A	40.8	Very low	41.3	Very low	101 Å²	101	151.1 Å²	151.1	84%	0.835	81%	0.805	S	S	*	*			cis	-162	170.2	-17.4	0	0	0	0	0	109.3
294	E	40.3	Very low	41.5	Very low	190 Å²	190	148.7 Å²	148.7	89%	0.888	80%	0.804	S	S	*	*			trans	-85.5	148	-176.9	-58.8	163.7	98.1	0	0	114.3
295	Q	40.9	Very low	41.4	Very low	195 Å²	195	148.2 Å²	148.2	91%	0.911	81%	0.809	S	S	*	*			trans	-150.9	134.5	155.8	-76.8	-161.5	-14.8	0	0	112.3
296	P	39.7	Very low	41.6	Very low	129 Å²	129	144.9 Å²	144.9	84%	0.838	80%	0.804	S	S	*	*			trans	-117.8	141.5	174.9	38.1	-28.7	0	0	0	115.4
297	A	41.4	Very low	41.6	Very low	98 Å²	98	146.8 Å²	146.8	81%	0.81	81%	0.812	S	S	*	*			trans	-151.2	118.5	163	0	0	0	0	0	108.4
298	Q	39.5	Very low	41	Very low	182 Å²	182	148.3 Å²	148.3	85%	0.85	81%	0.808	S	S	*	*				77.4	81.9	68	-71.1	-163.4	14.7	0	0	116.4
299	Q	39.3	Very low	41	Very low	187 Å²	187	144.7 Å²	144.7	87%	0.874	81%	0.807	S	S	*	*			trans	62	171	135.5	-66.3	-170.2	8.4	0	0	119.5
300	P	40.3	Very low	40.7	Very low	113 Å²	113	138.1 Å²	138.1	73%	0.734	79%	0.79	S	S	*	*			cis	-125.5	169.2	-4.8	34.5	-16	0	0	0	116.8
301	Y	38.3	Very low	40.2	Very low	213 Å²	213	138.6 Å²	138.6	84%	0.835	79%	0.793	S	S	*	*			trans	-15.4	137.9	149	-114.2	-115.6	0	0	0	118.1
302	Y	42	Very low	40	Very low	232 Å²	232	135.1 Å²	135.1	91%	0.91	78%	0.782	S	S	*	*				-159.7	138.2	126.8	-120.5	-80.8	0	0	0	112.9
303	A	40.4	Very low	39.5	Very low	69 Å²	69	137.4 Å²	137.4	57%	0.57	78%	0.78	S	S	*	*			trans	-139.8	168.3	167.2	0	0	0	0	0	105.6
304	P	41.9	Very low	39.2	Very low	122 Å²	122	136.9 Å²	136.9	79%	0.792	78%	0.776	S	S	*	*			cis	-153.8	-156	32.8	43.2	-19.5	0	0	0	115.9
305	A	39.7	Very low	39	Very low	91 Å²	91	139.3 Å²	139.3	75%	0.752	78%	0.777	S	S	*	*			trans	91.6	136.1	149.1	0	0	0	0	0	119.8
306	P	42.5	Very low	38.7	Very low	121 Å²	121	138.5 Å²	138.5	79%	0.786	77%	0.773	S	S	*	*			trans	-109.4	168.2	175.1	41.6	-34	0	0	0	113.4
307	E	39.2	Very low	38.5	Very low	198 Å²	198	136.5 Å²	136.5	93%	0.925	77%	0.768	S	S	*	*			trans	-161.6	153.2	145.5	-117.2	162.6	-163.1	0	0	113.3
308	Q	36.1	Very low	38.2	Very low	162 Å²	162	139.5 Å²	139.5	76%	0.757	77%	0.765	S	S	*	*			trans	-89.8	172.9	172.1	-88.8	-179.8	-17.7	0	0	109.4
309	P	41.1	Very low	37.9	Very low	105 Å²	105	136 Å²	136	68%	0.682	75%	0.748	S	S	*	*			cis	-161.7	169.6	43.5	45.6	-22.7	0	0	0	122.1
310	V	36.9	Very low	37.8	Very low	81 Å²	81	132.8 Å²	132.8	49%	0.491	73%	0.733	S	S	.	*			trans	60.1	135.3	135.5	169.3	0	0	0	0	123.2
311	A	38.8	Very low	37.6	Very low	86 Å²	86	135.3 Å²	135.3	71%	0.711	74%	0.735	S	S	*	*			trans	69.1	151.5	160.9	0	0	0	0	0	118.7
312	G	36.1	Very low	37.4	Very low	61 Å²	61	131 Å²	131	63%	0.629	74%	0.736	S	S	*	*			cis	166.5	162	-8.4	0	0	0	0	0	113.8
313	N	35.5	Very low	36.9	Very low	150 Å²	150	126 Å²	126	80%	0.802	73%	0.73	S	S	*	*			trans	69.3	105.3	164.9	-59.8	9.6	0	0	0	121
314	A	34.5	Very low	36.7	Very low	90 Å²	90	132.4 Å²	132.4	74%	0.744	75%	0.746	S	S	*	*				41.9	112.3	122.9	0	0	0	0	0	122.9
315	W	36.1	Very low	36.6	Very low	241 Å²	241	130.5 Å²	130.5	91%	0.913	74%	0.74	S	S	*	*			trans	-147.1	134.7	140	-65	97.5	0	0	0	105
316	Q	34.4	Very low	36.6	Very low	178 Å²	178	132.5 Å²	132.5	83%	0.832	75%	0.745	S	S	*	*			cis	64.5	115.4	31.3	-84	-166.7	-11.9	0	0	115.6
317	A	35.1	Very low	36.4	Very low	87 Å²	87	136.1 Å²	136.1	72%	0.719	75%	0.752	S	S	*	*			trans	65.2	149.1	176.6	0	0	0	0	0	115.5
318	E	33.8	Very low	36.3	Very low	161 Å²	161	132 Å²	132	75%	0.752	74%	0.744	S	S	*	*			cis	-155.7	-173.3	-9.1	-119.7	162.1	153.6	0	0	110.1
319	E	34.7	Very low	36.2	Very low	108 Å²	108	129.2 Å²	129.2	51%	0.505	74%	0.739	S	S	.	*			trans	-37.4	172.7	166.2	-55.9	-177.2	120.1	0	0	118.1	Y659	E319-Y659 HydrophobicContact CB-CE2 3.94Å; E319-Y659 WeakPolarHBondContact CB-OH 3.22Å; E319-Y659 PolarHBondContact OE2-OH 2.93Å
320	Q	36.1	Very low	36	Very low	120 Å²	120	133.8 Å²	133.8	56%	0.561	74%	0.744	S	S	*	*			cis	-155.1	-176.4	5.9	-133.7	169.1	50.9	0	0	112	Y659	Q320-Y659 HydrophobicContact CB-CD2 4.47Å; Q320-Y659 HydrophobicContact CB-CE2 4.17Å
321	Q	35.5	Very low	35.9	Very low	165 Å²	165	137.8 Å²	137.8	77%	0.771	76%	0.757	S	S	*	*			trans	-73	177.3	-174.8	-65.5	156.9	-34	0	0	115.5
322	S	34.1	Very low	35.8	Very low	122 Å²	122	139.5 Å²	139.5	85%	0.853	76%	0.759	S	S	*	*			trans	-148	122.4	159.6	-75.6	0	0	0	0	111.7
323	T	32.1	Very low	35.6	Very low	129 Å²	129	144.7 Å²	144.7	79%	0.791	77%	0.767	S	S	*	*			trans	-131.7	145.2	-179.5	-45.4	0	0	0	0	109.2
324	F	36.3	Very low	35.6	Very low	203 Å²	203	147 Å²	147	89%	0.89	77%	0.773	S	S	*	*			trans	-128.2	163.2	-174.9	-105.2	-93.4	0	0	0	111.3
325	A	40.2	Very low	35.5	Very low	82 Å²	82	147.6 Å²	147.6	68%	0.678	77%	0.768	S	S	*	*				-151.3	147	-84.5	0	0	0	0	0	108.9
326	P	38.8	Very low	35.5	Very low	133 Å²	133	146.4 Å²	146.4	86%	0.864	76%	0.764	S	S	*	*			trans	-86.2	167	-171.1	34.3	-36.6	0	0	0	114.7
327	Q	39.5	Very low	35.5	Very low	197 Å²	197	146 Å²	146	92%	0.921	76%	0.763	S	S	*	*			trans	-105.7	156.6	179.1	-69.8	-175.2	-26.8	0	0	113.7
328	S	36	Very low	35.5	Very low	110 Å²	110	151.1 Å²	151.1	77%	0.769	77%	0.772	S	S	*	*			trans	-80.1	173.5	175.5	-41.7	0	0	0	0	112.1
329	T	33.6	Very low	35.7	Very low	105 Å²	105	149.7 Å²	149.7	64%	0.644	78%	0.777	S	S	*	*			cis	-152.8	171.2	13.4	-22.3	0	0	0	0	108.4
330	Y	38.5	Very low	35.6	Very low	200 Å²	200	149.6 Å²	149.6	78%	0.784	79%	0.794	S	S	*	*				-177.2	-163.7	84	-102.2	-66.2	0	0	0	112.7
331	Q	34.6	Very low	35.8	Very low	165 Å²	165	147.9 Å²	147.9	77%	0.771	80%	0.801	S	S	*	*			trans	-86.6	171.7	-179.6	-66.1	145.2	-51	0	0	111.5
332	T	35.4	Very low	35.8	Very low	123 Å²	123	149.4 Å²	149.4	76%	0.755	81%	0.808	S	S	*	*			cis	-157.2	174.7	36.1	-37.8	0	0	0	0	112.6
333	E	33.6	Very low	35.8	Very low	169 Å²	169	152.7 Å²	152.7	79%	0.79	81%	0.81	S	S	*	*			trans	-74.2	157	-169.6	-54.1	140	83.5	0	0	116.9
334	Q	35.4	Very low	36.1	Very low	200 Å²	200	152.9 Å²	152.9	94%	0.935	81%	0.813	S	S	*	*				-164.2	167.6	112.3	-104	177.2	39.8	0	0	113
335	T	31.2	Very low	35.8	Very low	102 Å²	102	149.5 Å²	149.5	63%	0.626	80%	0.803	S	S	*	*			trans	-123.8	152.5	-161.6	-67.7	0	0	0	0	112.5	Q337	T335-Q337 HydrophobicContact CG2-CG 4.49Å
336	Y	36.2	Very low	35.7	Very low	215 Å²	215	155.7 Å²	155.7	84%	0.843	81%	0.811	S	S	*	*			trans	163	96.2	141.1	-82.7	-57	0	0	0	109
337	Q	35.4	Very low	35.6	Very low	170 Å²	170	156.2 Å²	156.2	79%	0.794	80%	0.802	S	S	*	*				65.4	119.7	82.9	-77.7	-169.8	-26.7	0	0	117.6	T335	T335-Q337 HydrophobicContact CG2-CG 4.49Å
338	Q	33.9	Very low	35.3	Very low	194 Å²	194	154.9 Å²	154.9	91%	0.907	80%	0.795	S	S	*	*			trans	-87.6	156.2	162.8	-74.3	178.4	-32.2	0	0	111.8
339	P	39.7	Very low	35.5	Very low	132 Å²	132	154.4 Å²	154.4	86%	0.857	79%	0.789	S	S	*	*			trans	-126.8	160.9	150.1	37.5	-26.4	0	0	0	113.1
340	A	32	Very low	35.6	Very low	105 Å²	105	157.7 Å²	157.7	87%	0.868	80%	0.798	S	S	*	*			trans	-138.7	136.8	176.1	0	0	0	0	0	112.4
341	A	39.2	Very low	35.6	Very low	85 Å²	85	153.4 Å²	153.4	70%	0.702	79%	0.794	S	S	*	*			trans	-161.7	120.8	171.6	0	0	0	0	0	109
342	Q	35.9	Very low	35.6	Very low	196 Å²	196	151.5 Å²	151.5	92%	0.916	79%	0.793	S	S	*	*				87	133.1	90.1	-72.8	174.7	1.5	0	0	115.8
343	E	34.2	Very low	35.7	Very low	192 Å²	192	154.7 Å²	154.7	90%	0.897	80%	0.8	S	S	*	*			trans	-90.5	169.2	174.2	-58.6	174.8	111.6	0	0	112.4
344	P	38.9	Very low	35.7	Very low	132 Å²	132	154.2 Å²	154.2	86%	0.857	80%	0.798	S	S	*	*				-143.8	-177.7	125.5	36	-19.7	0	0	0	116
345	L	30.3	Very low	35.5	Very low	132 Å²	132	153.3 Å²	153.3	69%	0.691	79%	0.793	S	S	*	*			trans	-135.4	141.2	-150.3	-176	171.8	0	0	0	113.8	Q347	L345-Q347 HydrophobicContact CD2-CG 4.01Å
346	Y	37.8	Very low	35.8	Very low	212 Å²	212	154.1 Å²	154.1	83%	0.831	80%	0.801	S	S	*	*			trans	-149.3	111.5	162.8	-64.1	-77.1	0	0	0	109.7
347	Q	35.6	Very low	35.7	Very low	145 Å²	145	150.2 Å²	150.2	68%	0.678	80%	0.799	S	S	*	*				66	107.7	78.2	-67.9	-175.9	-56.6	0	0	115.3	L345	L345-Q347 HydrophobicContact CD2-CG 4.01Å
348	Q	34.3	Very low	35.8	Very low	169 Å²	169	148 Å²	148	79%	0.79	80%	0.797	S	S	*	*				87.4	163.5	75.2	-104.7	-167.5	3.5	0	0	114.6
349	P	40.5	Very low	36	Very low	99 Å²	99	147 Å²	147	64%	0.643	79%	0.792	S	S	*	*			cis	-140.9	166.6	-9	40.6	-22.3	0	0	0	118.4
350	Q	35.3	Very low	36	Very low	175 Å²	175	146.9 Å²	146.9	82%	0.818	79%	0.791	S	S	*	*			trans	35.2	174.4	139.8	-65.5	-167.2	-10	0	0	124.4
351	P	38.4	Very low	36.5	Very low	110 Å²	110	150.2 Å²	150.2	71%	0.714	79%	0.789	S	S	*	*			cis	-135	158.8	-4	35.8	-15.1	0	0	0	119.8
352	V	35	Very low	36.5	Very low	124 Å²	124	151 Å²	151	75%	0.752	79%	0.787	S	S	*	*			trans	22.9	127.7	136.3	-171.7	0	0	0	0	123.8
353	E	37	Very low	36.5	Very low	190 Å²	190	148.7 Å²	148.7	89%	0.888	79%	0.786	S	S	*	*				-166.2	-170	119	-126.1	178.1	144.3	0	0	114.5
354	Q	34.4	Very low	36.4	Very low	160 Å²	160	145.9 Å²	145.9	75%	0.748	78%	0.781	S	S	*	*			trans	-130.7	138.8	-152.4	-56.7	178	-1.6	0	0	118.6
355	Q	31.4	Very low	36.4	Very low	180 Å²	180	148.7 Å²	148.7	84%	0.841	78%	0.783	S	S	*	*			trans	59.2	172	149.3	-66.7	-172.8	2.6	0	0	119.1
356	P	37	Very low	36.5	Very low	120 Å²	120	150.6 Å²	150.6	78%	0.779	79%	0.789	S	S	*	*			cis	-127.4	-167.8	-2.3	43.9	-27.2	0	0	0	116.7
357	V	33.3	Very low	36.2	Very low	133 Å²	133	146.9 Å²	146.9	81%	0.806	79%	0.788	S	S	*	*			trans	-58.5	146.2	-172.5	-163.8	0	0	0	0	117.7
358	V	38.1	Very low	36.3	Very low	124 Å²	124	149 Å²	149	75%	0.752	80%	0.795	S	S	*	*				159.9	120.2	125	163.8	0	0	0	0	113.2
359	E	38.6	Very low	36.6	Very low	171 Å²	171	147.3 Å²	147.3	80%	0.799	80%	0.798	S	S	*	*			trans	22.8	132.1	139.1	-140.4	146.6	-135.2	0	0	120
360	P	39.6	Very low	36.7	Very low	131 Å²	131	147.2 Å²	147.2	85%	0.851	81%	0.806	S	S	*	*				-144.9	172.2	66	39.5	-20.2	0	0	0	119.6
361	E	41.2	Very low	36.7	Very low	175 Å²	175	149.6 Å²	149.6	82%	0.818	81%	0.808	S	S	*	*			trans	-81.5	-178.5	-180	-117.1	-163.2	170.9	0	0	114
362	P	38.8	Very low	37	Very low	102 Å²	102	149.7 Å²	149.7	66%	0.662	81%	0.808	S	S	*	*				-129.6	-170.3	-70.3	33.4	-11.4	0	0	0	112.3
363	V	36.2	Very low	37.6	Very low	146 Å²	146	149 Å²	149	89%	0.885	81%	0.806	S	S	*	*			trans	179.9	159.7	139.6	142.9	0	0	0	0	110
364	V	33.8	Very low	37.8	Very low	133 Å²	133	147.4 Å²	147.4	81%	0.806	80%	0.803	S	S	*	*			trans	-113.2	142.3	-161.5	177.7	0	0	0	0	113.2
365	E	37.9	Very low	38	Very low	192 Å²	192	148.7 Å²	148.7	90%	0.897	80%	0.802	S	S	*	*			trans	-147.6	163.9	149.9	-145.7	174.5	-177.1	0	0	110.9
366	E	32.6	Very low	38.5	Very low	172 Å²	172	148.4 Å²	148.4	80%	0.804	80%	0.795	S	S	*	*			trans	-90.2	165.1	-158	-50.4	-179.6	110.4	0	0	116
367	T	31.7	Very low	39.1	Very low	134 Å²	134	149.9 Å²	149.9	82%	0.822	79%	0.789	S	S	*	*				-175.5	154.4	115.5	22.5	0	0	0	0	115.3
368	K	36.7	Very low	40.2	Very low	190 Å²	190	149.7 Å²	149.7	83%	0.826	78%	0.779	S	S	*	*			trans	73.7	106.2	163.6	-71.9	173.1	-177.6	169.5	0	118.4
369	P	41	Very low	41.4	Very low	132 Å²	132	149.6 Å²	149.6	86%	0.857	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-68.4	140.5	160.4	30.4	-34	0	0	0	110.8
370	A	42.4	Very low	42.8	Very low	98 Å²	98	145 Å²	145	81%	0.81	75%	0.754	S	S	*	*	P	Polyproline II helix	trans	-75.1	135.6	175.7	0	0	0	0	0	111.1
371	R	36.5	Very low	44.3	Very low	225 Å²	225	143.8 Å²	143.8	85%	0.849	74%	0.737	S	S	*	*	P	Polyproline II helix	trans	-68.4	138.4	161	-79.7	-173.7	174.2	-174.5	-2.2	108.6
372	P	43.7	Very low	45.8	Very low	112 Å²	112	140.1 Å²	140.1	73%	0.727	72%	0.72	S	S	*	*	P	Polyproline II helix	trans	-60.2	152.6	161.9	28.9	-34.2	0	0	0	109.5	L374	P372-L374 PolarHBondContact O-N 3.04Å
373	P	47.4	Very low	47.6	Very low	108 Å²	108	141.5 Å²	141.5	70%	0.701	72%	0.716	S	S	*	*	P	Polyproline II helix	trans	-62.2	136.7	-178.2	25.8	-34.1	0	0	0	111.1	Y375	P373-Y375 PolarHBondContact O-N 2.83Å; P373-Y375 VanDerWaalsContact O-N 3.13Å
374	L	41.2	Very low	49.6	Very low	157 Å²	157	140.5 Å²	140.5	82%	0.822	70%	0.696	S	S	*	*			trans	-62.7	111	163.3	-85.2	156.7	0	0	0	107.7	P372 Y376	P372-L374 PolarHBondContact O-N 3.04Å; L374-Y376 PolarHBondContact O-N 3.41Å
375	Y	39.3	Very low	51.9	Low	188 Å²	188	136.5 Å²	136.5	74%	0.737	68%	0.677	S	S	*	*			trans	-61.7	120.2	169.6	-99.5	-94.9	0	0	0	108.8	P373 F377	P373-Y375 PolarHBondContact O-N 2.83Å; P373-Y375 VanDerWaalsContact O-N 3.13Å; Y375-F377 PolarHBondContact O-N 2.85Å
376	Y	41.8	Very low	53.9	Low	173 Å²	173	133 Å²	133	68%	0.678	66%	0.655	S	S	*	*			trans	-71.9	125.5	177.5	-136.9	-109.9	0	0	0	108.4	L374 E378	L374-Y376 PolarHBondContact O-N 3.41Å; Y376-E378 HydrophobicContact CD1-CB 4.18Å; Y376-E378 HydrophobicContact CD1-CG 3.88Å; Y376-E378 VanDerWaalsContact CD1-OE2 3.22Å; Y376-E378 WeakPolarHBondContact CD1-OE2 3.32Å; Y376-E378 HydrophobicContact CE1-CG 4.11Å; Y376-E378 WeakPolarHBondContact CE1-OE2 3.35Å; Y376-E378 PolarHBondContact O-N 2.68Å; Y376-E378 VanDerWaalsContact O-N 3.16Å
377	F	49	Very low	56.1	Low	151 Å²	151	130.6 Å²	130.6	66%	0.662	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.3	-18.2	-171.1	-94.7	-107.1	0	0	0	113.5	Y375 E379 V380 E381	Y375-F377 PolarHBondContact O-N 2.85Å; F377-E379 VanDerWaalsContact C-N 3.3Å; F377-E379 PolarHBondContact O-N 3.35Å; F377-V380 PolarHBondContact O-N 3.33Å; F377-E381 WeakPolarHBondContact O-CG 3.44Å; F377-E381 PolarHBondContact O-N 2.75Å
378	E	57	Low	58.4	Low	129 Å²	129	133.8 Å²	133.8	60%	0.603	64%	0.641	S	S	*	*	H	α-helix	trans	-53.3	-37.3	179.4	-70	-176.8	137.3	0	0	113.8	Y376 V380 E381 E382	Y376-E378 HydrophobicContact CD1-CB 4.18Å; Y376-E378 HydrophobicContact CD1-CG 3.88Å; Y376-E378 VanDerWaalsContact CD1-OE2 3.22Å; Y376-E378 WeakPolarHBondContact CD1-OE2 3.32Å; Y376-E378 HydrophobicContact CE1-CG 4.11Å; Y376-E378 WeakPolarHBondContact CE1-OE2 3.35Å; Y376-E378 PolarHBondContact O-N 2.68Å; Y376-E378 VanDerWaalsContact O-N 3.16Å; E378-V380 VanDerWaalsContact C-N 3.31Å; E378-V380 PolarHBondContact O-N 3Å; E378-E381 PolarHBondContact O-N 2.69Å; E378-E382 VanDerWaalsContact O-CB 3.26Å; E378-E382 WeakPolarHBondContact O-CB 3.3Å; E378-E382 WeakPolarHBondContact O-CG 3.21Å; E378-E382 PolarHBondContact O-N 3.38Å
379	E	63.8	Low	60.3	Low	123 Å²	123	131.2 Å²	131.2	58%	0.575	63%	0.632	S	S	*	*	H	α-helix	trans	-67	-31.7	177.4	-77.6	-162.5	-174.1	0	0	113.2	F377 K383	F377-E379 VanDerWaalsContact C-N 3.3Å; F377-E379 PolarHBondContact O-N 3.35Å; E379-K383 WeakPolarHBondContact O-CB 3.5Å; E379-K383 WeakPolarHBondContact O-CG 3.4Å; E379-K383 PolarHBondContact O-N 3.19Å; E379-K383 VanDerWaalsContact O-N 3.08Å
380	V	66.9	Low	61.9	Low	73 Å²	73	131.2 Å²	131.2	44%	0.442	62%	0.62	S	S	.	*	H	α-helix	trans	-78.6	-35.7	177.7	-179.2	0	0	0	0	109.9	F377 E378 R384	F377-V380 PolarHBondContact O-N 3.33Å; E378-V380 VanDerWaalsContact C-N 3.31Å; E378-V380 PolarHBondContact O-N 3Å; V380-R384 VanDerWaalsContact O-CB 3.26Å; V380-R384 WeakPolarHBondContact O-CB 3.44Å; V380-R384 PolarHBondContact O-N 2.84Å
381	E	70.6	Confident	63.4	Low	106 Å²	106	131.7 Å²	131.7	50%	0.495	61%	0.609	S	S	.	*	H	α-helix	trans	-74.7	-37.8	176.6	-54.3	-136.5	116.9	0	0	111.9	F377 E378 R384 A385	F377-E381 WeakPolarHBondContact O-CG 3.44Å; F377-E381 PolarHBondContact O-N 2.75Å; E378-E381 PolarHBondContact O-N 2.69Å; E381-R384 PolarHBondContact O-N 3.01Å; E381-R384 IonicContact OE1-NH1 3.12Å; E381-R384 PolarHBondContact OE1-NH1 2.55Å; E381-A385 WeakPolarHBondContact O-CB 3.33Å; E381-A385 PolarHBondContact O-N 3.28Å
382	E	74	Confident	65.4	Low	98 Å²	98	123.9 Å²	123.9	46%	0.458	59%	0.592	S	S	.	*	H	α-helix	trans	-61.6	-44.1	168.8	-86	-147.7	141.2	0	0	111.8	E378 A385 R386	E378-E382 VanDerWaalsContact O-CB 3.26Å; E378-E382 WeakPolarHBondContact O-CB 3.3Å; E378-E382 WeakPolarHBondContact O-CG 3.21Å; E378-E382 PolarHBondContact O-N 3.38Å; E382-A385 PolarHBondContact O-N 3.27Å; E382-R386 WeakPolarHBondContact O-CB 3.31Å; E382-R386 WeakPolarHBondContact O-CG 3.42Å; E382-R386 PolarHBondContact O-N 3.01Å; E382-R386 IonicContact OE1-CZ 3.66Å; E382-R386 IonicContact OE1-NH2 3.86Å; E382-R386 PolarHBondContact OE1-NH2 3Å; E382-R386 IonicContact OE2-CZ 2.89Å; E382-R386 IonicContact OE2-NH1 3.52Å; E382-R386 PolarHBondContact OE2-NH1 3.36Å; E382-R386 IonicContact OE2-NH2 3.99Å; E382-R386 PolarHBondContact OE2-NH2 3.2Å
383	K	77	Confident	66.9	Low	132 Å²	132	121.1 Å²	121.1	57%	0.574	58%	0.579	S	S	*	*	H	α-helix	trans	-62.4	-46.5	175.4	-83.2	172.2	179	160.3	0	111	E379 A385 R386 E387	E379-K383 WeakPolarHBondContact O-CB 3.5Å; E379-K383 WeakPolarHBondContact O-CG 3.4Å; E379-K383 PolarHBondContact O-N 3.19Å; E379-K383 VanDerWaalsContact O-N 3.08Å; K383-A385 VanDerWaalsContact C-N 3.29Å; K383-A385 PolarHBondContact O-N 3.47Å; K383-R386 PolarHBondContact O-N 3.38Å; K383-E387 WeakPolarHBondContact O-CG 3.33Å; K383-E387 PolarHBondContact O-N 3.25Å
384	R	78.2	Confident	68	Low	125 Å²	125	126.9 Å²	126.9	47%	0.472	59%	0.587	S	S	.	*	H	α-helix	trans	-63.3	-34.3	176.5	-163.1	-171.5	-58.5	131.5	-1.3	112	V380 E381 R388	V380-R384 VanDerWaalsContact O-CB 3.26Å; V380-R384 WeakPolarHBondContact O-CB 3.44Å; V380-R384 PolarHBondContact O-N 2.84Å; E381-R384 PolarHBondContact O-N 3.01Å; E381-R384 IonicContact OE1-NH1 3.12Å; E381-R384 PolarHBondContact OE1-NH1 2.55Å; R384-R388 WeakPolarHBondContact O-CB 3.3Å; R384-R388 PolarHBondContact O-N 3.07Å
385	A	80.4	Confident	68.8	Low	48 Å²	48	129 Å²	129	40%	0.397	59%	0.585	S	S	.	*	H	α-helix	trans	-69.6	-46.7	174.4	0	0	0	0	0	111.6	E381 E382 K383 E387 R388 E389	E381-A385 WeakPolarHBondContact O-CB 3.33Å; E381-A385 PolarHBondContact O-N 3.28Å; E382-A385 PolarHBondContact O-N 3.27Å; K383-A385 VanDerWaalsContact C-N 3.29Å; K383-A385 PolarHBondContact O-N 3.47Å; A385-E387 VanDerWaalsContact C-N 3.35Å; A385-E387 PolarHBondContact O-N 3Å; A385-R388 CarbonylContact O-C 3.57Å; A385-R388 WeakPolarHBondContact O-CA 3.29Å; A385-R388 WeakPolarHBondContact O-CB 3.42Å; A385-R388 PolarHBondContact O-N 2.73Å; A385-E389 PolarHBondContact O-N 2.78Å
386	R	80.4	Confident	69.3	Low	118 Å²	118	126.9 Å²	126.9	45%	0.445	58%	0.583	S	S	.	*	H	α-helix	trans	-63.8	-36.4	175.2	-71.7	-177.2	-172.1	107.9	8.9	112.5	E382 K383 R388 E389 Q390	E382-R386 WeakPolarHBondContact O-CB 3.31Å; E382-R386 WeakPolarHBondContact O-CG 3.42Å; E382-R386 PolarHBondContact O-N 3.01Å; E382-R386 IonicContact OE1-CZ 3.66Å; E382-R386 IonicContact OE1-NH2 3.86Å; E382-R386 PolarHBondContact OE1-NH2 3Å; E382-R386 IonicContact OE2-CZ 2.89Å; E382-R386 IonicContact OE2-NH1 3.52Å; E382-R386 PolarHBondContact OE2-NH1 3.36Å; E382-R386 IonicContact OE2-NH2 3.99Å; E382-R386 PolarHBondContact OE2-NH2 3.2Å; K383-R386 PolarHBondContact O-N 3.38Å; R386-R388 VanDerWaalsContact C-N 3.33Å; R386-E389 PolarHBondContact O-N 3.33Å; R386-Q390 WeakPolarHBondContact O-CB 3.43Å; R386-Q390 VanDerWaalsContact O-CG 3.27Å; R386-Q390 WeakPolarHBondContact O-CG 3.44Å; R386-Q390 PolarHBondContact O-N 3.13Å
387	E	79.1	Confident	69.7	Low	123 Å²	123	124.5 Å²	124.5	58%	0.575	59%	0.588	S	S	*	*	H	α-helix	trans	-63.3	-39.6	168.9	-76.6	-174.9	142.5	0	0	111.4	K383 A385 Q390 L391	K383-E387 WeakPolarHBondContact O-CG 3.33Å; K383-E387 PolarHBondContact O-N 3.25Å; A385-E387 VanDerWaalsContact C-N 3.35Å; A385-E387 PolarHBondContact O-N 3Å; E387-Q390 PolarHBondContact O-N 2.86Å; E387-L391 WeakPolarHBondContact O-CB 3.3Å; E387-L391 VanDerWaalsContact O-CG 3.26Å; E387-L391 WeakPolarHBondContact O-CG 3.33Å; E387-L391 PolarHBondContact O-N 3.3Å
388	R	79.7	Confident	70.1	Confident	201 Å²	201	124.7 Å²	124.7	76%	0.758	59%	0.594	S	S	*	*	H	α-helix	trans	-67.4	-37.2	176.4	-142.8	172.3	-170.2	172.6	1.6	112.5	R384 A385 R386 A392	R384-R388 WeakPolarHBondContact O-CB 3.3Å; R384-R388 PolarHBondContact O-N 3.07Å; A385-R388 CarbonylContact O-C 3.57Å; A385-R388 WeakPolarHBondContact O-CA 3.29Å; A385-R388 WeakPolarHBondContact O-CB 3.42Å; A385-R388 PolarHBondContact O-N 2.73Å; R386-R388 VanDerWaalsContact C-N 3.33Å; R388-A392 VanDerWaalsContact O-CB 3.28Å; R388-A392 WeakPolarHBondContact O-CB 3.25Å; R388-A392 PolarHBondContact O-N 2.75Å
389	E	78	Confident	70.1	Confident	136 Å²	136	124 Å²	124	64%	0.636	60%	0.601	S	S	*	*	H	α-helix	trans	-69.1	-41.6	172.8	-72	-175.5	136.6	0	0	112	A385 R386 A392 A393	A385-E389 PolarHBondContact O-N 2.78Å; R386-E389 PolarHBondContact O-N 3.33Å; E389-A392 PolarHBondContact O-N 2.7Å; E389-A393 WeakPolarHBondContact O-CB 3.32Å; E389-A393 PolarHBondContact O-N 3.04Å
390	Q	73.9	Confident	69.5	Low	131 Å²	131	126.6 Å²	126.6	61%	0.612	61%	0.613	S	S	*	*	H	α-helix	trans	-64.1	-42.2	174.2	-74.7	177.5	22.8	0	0	111.5	R386 E387 A393 W394	R386-Q390 WeakPolarHBondContact O-CB 3.43Å; R386-Q390 VanDerWaalsContact O-CG 3.27Å; R386-Q390 WeakPolarHBondContact O-CG 3.44Å; R386-Q390 PolarHBondContact O-N 3.13Å; E387-Q390 PolarHBondContact O-N 2.86Å; Q390-A393 PolarHBondContact O-N 3.35Å; Q390-W394 PolarHBondContact O-N 3.17Å
391	L	74.5	Confident	68.9	Low	109 Å²	109	128.8 Å²	128.8	57%	0.571	63%	0.629	S	S	*	*	H	α-helix	trans	-65.1	-38.4	173.1	-72.9	167.7	0	0	0	111.9	E387 W394 Y395	E387-L391 WeakPolarHBondContact O-CB 3.3Å; E387-L391 VanDerWaalsContact O-CG 3.26Å; E387-L391 WeakPolarHBondContact O-CG 3.33Å; E387-L391 PolarHBondContact O-N 3.3Å; L391-W394 PolarHBondContact O-N 3.39Å; L391-Y395 WeakPolarHBondContact O-CD2 3.36Å; L391-Y395 PolarHBondContact O-N 3.44Å
392	A	77.6	Confident	67.9	Low	60 Å²	60	130.1 Å²	130.1	50%	0.496	64%	0.644	S	S	.	*	H	α-helix	trans	-65.5	-37.5	173.8	0	0	0	0	0	112.4	R388 E389 Y395 Q396	R388-A392 VanDerWaalsContact O-CB 3.28Å; R388-A392 WeakPolarHBondContact O-CB 3.25Å; R388-A392 PolarHBondContact O-N 2.75Å; E389-A392 PolarHBondContact O-N 2.7Å; A392-Y395 CarbonylContact O-C 3.55Å; A392-Y395 PolarHBondContact O-N 2.97Å; A392-Y395 VanDerWaalsContact O-N 3.12Å; A392-Q396 PolarHBondContact O-N 3.4Å
393	A	75.1	Confident	66.5	Low	55 Å²	55	135.1 Å²	135.1	46%	0.455	66%	0.664	S	S	.	*	H	α-helix	trans	-64.1	-39.8	173.9	0	0	0	0	0	111.9	E389 Q390 Y395 Q396	E389-A393 WeakPolarHBondContact O-CB 3.32Å; E389-A393 PolarHBondContact O-N 3.04Å; Q390-A393 PolarHBondContact O-N 3.35Å; A393-Y395 PolarHBondContact O-N 3.43Å; A393-Q396 PolarHBondContact O-N 2.8Å
394	W	71.1	Confident	65.2	Low	229 Å²	229	137 Å²	137	87%	0.867	68%	0.675	S	S	*	*	H	α-helix	trans	-66.6	-15.6	172.1	-89.2	75.1	0	0	0	114.4	Q390 L391	Q390-W394 PolarHBondContact O-N 3.17Å; L391-W394 PolarHBondContact O-N 3.39Å
395	Y	58.3	Low	63.5	Low	200 Å²	200	135.1 Å²	135.1	78%	0.784	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103	10.3	176.3	-91.9	-83.8	0	0	0	114	L391 A392 A393	L391-Y395 WeakPolarHBondContact O-CD2 3.36Å; L391-Y395 PolarHBondContact O-N 3.44Å; A392-Y395 CarbonylContact O-C 3.55Å; A392-Y395 PolarHBondContact O-N 2.97Å; A392-Y395 VanDerWaalsContact O-N 3.12Å; A393-Y395 PolarHBondContact O-N 3.43Å
396	Q	50	Low	62	Low	145 Å²	145	141.4 Å²	141.4	68%	0.678	70%	0.7	S	S	*	*	S	Bend	trans	-64.1	130.5	168.9	-69.9	-173.6	3.8	0	0	110.2	A392 A393 I398	A392-Q396 PolarHBondContact O-N 3.4Å; A393-Q396 PolarHBondContact O-N 2.8Å; Q396-I398 PolarHBondContact O-N 2.86Å
397	P	49	Very low	60.3	Low	122 Å²	122	140.8 Å²	140.8	79%	0.792	71%	0.712	S	S	*	*	P	Polyproline II helix	trans	-66.6	126.7	179.6	27.2	-33.5	0	0	0	110	P399	P397-P399 WeakPolarHBondContact O-CD 3.39Å
398	I	58.2	Low	58.4	Low	156 Å²	156	141 Å²	141	80%	0.8	72%	0.716	S	S	*	*	P	Polyproline II helix	trans	-60	121.6	173.2	-58.9	173	0	0	0	107.6	Q396 E400	Q396-I398 PolarHBondContact O-N 2.86Å; I398-E400 PolarHBondContact O-N 2.84Å
399	P	56.3	Low	56.4	Low	115 Å²	115	141.2 Å²	141.2	75%	0.747	72%	0.722	S	S	*	*	P	Polyproline II helix	trans	-65.5	128.1	178	26.4	-33.2	0	0	0	109.8	P397	P397-P399 WeakPolarHBondContact O-CD 3.39Å
400	E	51.6	Low	54.4	Low	176 Å²	176	139.7 Å²	139.7	82%	0.822	73%	0.726	S	S	*	*	P	Polyproline II helix	trans	-63.3	136	-179.7	-66.6	-167.7	131.9	0	0	111.1	I398 V402	I398-E400 PolarHBondContact O-N 2.84Å; E400-V402 PolarHBondContact O-N 3.02Å; E400-V402 VanDerWaalsContact O-N 3.14Å
401	P	54.9	Low	52.8	Low	120 Å²	120	138 Å²	138	78%	0.779	73%	0.729	S	S	*	*			trans	-68.6	113.9	177.5	27.4	-33.4	0	0	0	110.4	K403	P401-K403 PolarHBondContact O-N 2.94Å
402	V	47.9	Very low	51.1	Low	134 Å²	134	139.8 Å²	139.8	81%	0.812	74%	0.738	S	S	*	*			trans	-59.2	119.2	176.8	179.7	0	0	0	0	109.8	E400 E404	E400-V402 PolarHBondContact O-N 3.02Å; E400-V402 VanDerWaalsContact O-N 3.14Å; V402-E404 PolarHBondContact O-N 3.19Å
403	K	46.4	Very low	49.2	Very low	203 Å²	203	145.9 Å²	145.9	88%	0.883	75%	0.754	S	S	*	*			trans	-78.7	108.3	172	-78.1	-177.5	174.5	176.4	0	110.4	P401	P401-K403 PolarHBondContact O-N 2.94Å
404	E	48.6	Very low	47.4	Very low	170 Å²	170	147.6 Å²	147.6	79%	0.794	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-68.7	147.8	166.7	-62.5	-167.8	139.8	0	0	111.3	V402	V402-E404 PolarHBondContact O-N 3.19Å
405	P	43.4	Very low	46	Very low	87 Å²	87	142.1 Å²	142.1	57%	0.565	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-85.2	129.9	-175.4	32.2	-34.1	0	0	0	113.2
406	E	47.5	Very low	45.1	Very low	179 Å²	179	137.5 Å²	137.5	84%	0.836	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-66.6	133.6	175.8	-68.6	-168.6	153.3	0	0	113.2
407	P	45.1	Very low	44.6	Very low	106 Å²	106	136.7 Å²	136.7	69%	0.688	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-91.3	125.1	173.8	33.6	-32	0	0	0	112.9
408	I	38.7	Very low	44.2	Very low	127 Å²	127	135.4 Å²	135.4	65%	0.651	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-68.6	132.7	178.2	-58.2	165.1	0	0	0	111.9
409	K	38.9	Very low	43.4	Very low	206 Å²	206	132.1 Å²	132.1	90%	0.896	76%	0.759	S	S	*	*			trans	-159.1	161	152.1	-112.3	154.6	-168.7	168.8	0	112.4
410	S	36.1	Very low	43	Very low	103 Å²	103	133.1 Å²	133.1	72%	0.72	76%	0.763	S	S	*	*			trans	-147.3	163.3	-153.2	57.5	0	0	0	0	116.3
411	S	39.3	Very low	42.6	Very low	95 Å²	95	130 Å²	130	66%	0.664	76%	0.758	S	S	*	*			trans	95.3	144	147.5	85.5	0	0	0	0	120.9
412	L	39.3	Very low	42.2	Very low	147 Å²	147	129.7 Å²	129.7	77%	0.77	76%	0.756	S	S	*	*			trans	72.2	142.8	160.2	-51.7	167.7	0	0	0	116.8
413	K	38.3	Very low	41.9	Very low	189 Å²	189	129.2 Å²	129.2	82%	0.822	75%	0.753	S	S	*	*			cis	-157.2	161.6	-4.1	-130.6	167.4	-178.1	172.6	0	110.8
414	A	37	Very low	41.4	Very low	91 Å²	91	128.2 Å²	128.2	75%	0.752	75%	0.751	S	S	*	*			trans	-89.6	-177.1	177.1	0	0	0	0	0	112.5
415	P	42.4	Very low	40.8	Very low	113 Å²	113	124.5 Å²	124.5	73%	0.734	75%	0.749	S	S	*	*				-156.6	159.6	60.4	44	-23	0	0	0	120.5
416	S	38.1	Very low	40.3	Very low	103 Å²	103	125 Å²	125	72%	0.72	76%	0.762	S	S	*	*			trans	43.3	147.5	141.2	65.6	0	0	0	0	123.1
417	V	40.5	Very low	39.7	Very low	129 Å²	129	121.5 Å²	121.5	78%	0.782	76%	0.763	S	S	*	*				-170.9	142.3	62.8	165.1	0	0	0	0	112.3
418	A	40.7	Very low	39.4	Very low	95 Å²	95	121.6 Å²	121.6	79%	0.785	77%	0.773	S	S	*	*			trans	61.5	156.7	156	0	0	0	0	0	122.4
419	A	40.4	Very low	39.2	Very low	86 Å²	86	122 Å²	122	71%	0.711	78%	0.78	S	S	*	*			cis	-173.5	144.9	-27.2	0	0	0	0	0	113.3
420	V	47.9	Very low	39	Very low	137 Å²	137	117.5 Å²	117.5	83%	0.83	78%	0.775	S	S	*	*			trans	60.7	145	132.7	168.2	0	0	0	0	121
421	P	44.4	Very low	39.3	Very low	111 Å²	111	118.2 Å²	118.2	72%	0.721	78%	0.778	S	S	*	*			cis	-136.8	-167.7	-28	39.4	-18.1	0	0	0	114.5
422	P	46.2	Very low	39	Very low	113 Å²	113	122 Å²	122	73%	0.734	79%	0.789	S	S	*	*			trans	-110.4	-166.7	171.3	40.2	-31.8	0	0	0	115.5
423	V	39.9	Very low	38.9	Very low	124 Å²	124	119.4 Å²	119.4	75%	0.752	79%	0.789	S	S	*	*			trans	83.2	143	179	-175	0	0	0	0	113.7
424	E	37.4	Very low	38.7	Very low	181 Å²	181	115.7 Å²	115.7	85%	0.846	79%	0.787	S	S	*	*			cis	-142.6	167.2	7.7	-138.7	137.7	-129.6	0	0	108.3
425	A	34.9	Very low	38.6	Very low	92 Å²	92	115.1 Å²	115.1	76%	0.76	79%	0.79	S	S	*	*			cis	115.6	156.9	5.5	0	0	0	0	0	117.2
426	A	34.3	Very low	38.4	Very low	99 Å²	99	115.8 Å²	115.8	82%	0.818	79%	0.792	S	S	*	*			trans	76.2	113.8	169.4	0	0	0	0	0	123.8
427	A	33.8	Very low	38	Very low	105 Å²	105	119.9 Å²	119.9	87%	0.868	80%	0.797	S	S	*	*			trans	53.8	133.3	130.6	0	0	0	0	0	125.7
428	A	38.3	Very low	37.6	Very low	108 Å²	108	123.5 Å²	123.5	89%	0.893	80%	0.802	S	S	*	*			trans	-162	155.3	141	0	0	0	0	0	113.2
429	V	35.4	Very low	37.1	Very low	134 Å²	134	123 Å²	123	81%	0.812	80%	0.798	S	S	*	*			trans	-114.9	143.4	-166.2	-85.1	0	0	0	0	115.8
430	S	34.4	Very low	36.9	Very low	112 Å²	112	125.2 Å²	125.2	78%	0.783	80%	0.803	S	S	*	*			trans	57.4	175.8	139.3	-58.6	0	0	0	0	119.5
431	P	42.9	Very low	36.2	Very low	119 Å²	119	126.6 Å²	126.6	77%	0.773	81%	0.805	S	S	*	*			cis	-140.2	164.7	5.8	44.8	-26.9	0	0	0	119.5
432	L	32.2	Very low	35.8	Very low	173 Å²	173	125 Å²	125	91%	0.906	80%	0.801	S	S	*	*			trans	25.7	120.5	135.1	-169.1	79.2	0	0	0	122.8
433	A	37.6	Very low	35.2	Very low	93 Å²	93	126.7 Å²	126.7	77%	0.769	81%	0.81	S	S	*	*			trans	-176.7	166.3	143.2	0	0	0	0	0	112.1
434	S	35	Very low	35.1	Very low	111 Å²	111	124 Å²	124	78%	0.776	81%	0.807	S	S	*	*				-169.9	119	-65.3	53	0	0	0	0	113.1
435	G	34.6	Very low	35.1	Very low	80 Å²	80	120.4 Å²	120.4	83%	0.825	81%	0.808	S	S	*	*			trans	77.1	177.2	161.2	0	0	0	0	0	118.2
436	V	36.8	Very low	35.2	Very low	126 Å²	126	120.8 Å²	120.8	76%	0.764	81%	0.811	S	S	*	*			cis	-148.5	119.6	3.2	175.4	0	0	0	0	113.3
437	K	30.2	Very low	35.3	Very low	189 Å²	189	119.8 Å²	119.8	82%	0.822	80%	0.803	S	S	*	*			trans	32.5	150.4	138.9	-47.3	175.6	-179.3	175.6	0	124.6
438	K	31.6	Very low	35.4	Very low	205 Å²	205	121.1 Å²	121.1	89%	0.891	80%	0.8	S	S	*	*			trans	87.8	160.1	149.2	-74.1	179.2	173.1	-175.3	0	119.8
439	A	31.8	Very low	35.4	Very low	86 Å²	86	122.2 Å²	122.2	71%	0.711	80%	0.796	S	S	*	*				168.3	121.9	-52.4	0	0	0	0	0	113.6
440	T	35.3	Very low	35.3	Very low	132 Å²	132	120.6 Å²	120.6	81%	0.81	80%	0.796	S	S	*	*			trans	-165.3	136	165.5	14.9	0	0	0	0	106.7
441	L	33.1	Very low	35.5	Very low	165 Å²	165	119.6 Å²	119.6	86%	0.864	80%	0.795	S	S	*	*			cis	63.6	131.7	48	-65.3	167.3	0	0	0	113.3
442	A	36.3	Very low	35.5	Very low	79 Å²	79	120.2 Å²	120.2	65%	0.653	80%	0.799	S	S	*	*			cis	-166.5	-175.7	-12.3	0	0	0	0	0	107.5
443	T	33.6	Very low	35.5	Very low	148 Å²	148	117.9 Å²	117.9	91%	0.908	79%	0.791	S	S	*	*			cis	-163	161.9	10.2	-25.5	0	0	0	0	110.2
444	G	37.5	Very low	35.5	Very low	67 Å²	67	123.3 Å²	123.3	69%	0.691	80%	0.798	S	S	*	*			trans	115.8	113.7	163.7	0	0	0	0	0	114.1
445	A	37.9	Very low	35.3	Very low	106 Å²	106	123 Å²	123	88%	0.876	80%	0.795	S	S	*	*				86.9	127.3	51.3	0	0	0	0	0	112.8
446	A	36.2	Very low	35.3	Very low	100 Å²	100	127.3 Å²	127.3	83%	0.826	80%	0.799	S	S	*	*			cis	-159.8	-169.4	-8.7	0	0	0	0	0	108.2
447	A	37.9	Very low	35.2	Very low	77 Å²	77	125.8 Å²	125.8	64%	0.636	80%	0.8	S	S	*	*			cis	-162	168.7	9.1	0	0	0	0	0	112.3
448	T	34.4	Very low	35.4	Very low	134 Å²	134	124.2 Å²	124.2	82%	0.822	80%	0.8	S	S	*	*			trans	32.8	140.4	139.9	58.7	0	0	0	0	122.4
449	V	38.2	Very low	35.5	Very low	131 Å²	131	119.6 Å²	119.6	79%	0.794	79%	0.794	S	S	*	*			cis	-145.1	123	14.1	-178.3	0	0	0	0	106.7
450	A	34.8	Very low	35.7	Very low	99 Å²	99	119.6 Å²	119.6	82%	0.818	80%	0.802	S	S	*	*				79.8	131.9	67	0	0	0	0	0	116.7
451	A	38.7	Very low	36	Very low	91 Å²	91	116.9 Å²	116.9	75%	0.752	80%	0.8	S	S	*	*			trans	-113.5	-172.5	176	0	0	0	0	0	111.1
452	P	41	Very low	36.2	Very low	132 Å²	132	114.9 Å²	114.9	86%	0.857	80%	0.797	S	S	*	*				-148.7	-177.9	113.1	38.5	-21.7	0	0	0	116.1
453	V	34	Very low	36.3	Very low	124 Å²	124	122.1 Å²	122.1	75%	0.752	81%	0.807	S	S	*	*			trans	-124.1	150.7	-174.1	173.7	0	0	0	0	110.3
454	F	36.5	Very low	36.5	Very low	208 Å²	208	120.1 Å²	120.1	91%	0.912	80%	0.797	S	S	*	*			trans	-155.8	170.5	153.3	-103.1	-67.9	0	0	0	111.9
455	S	31.6	Very low	36.3	Very low	103 Å²	103	125.3 Å²	125.3	72%	0.72	80%	0.804	S	S	*	*			trans	-141.5	155.5	-159.4	60.8	0	0	0	0	116.4
456	L	33.1	Very low	36.1	Very low	172 Å²	172	126.8 Å²	126.8	90%	0.901	80%	0.801	S	S	*	*			trans	60.4	113	145.3	-167.3	76.4	0	0	0	120.4
457	A	35.8	Very low	36.1	Very low	94 Å²	94	131.9 Å²	131.9	78%	0.777	81%	0.805	S	S	*	*			trans	-178.6	131.4	131	0	0	0	0	0	115.3
458	N	33.7	Very low	36.1	Very low	155 Å²	155	137.1 Å²	137.1	83%	0.829	82%	0.816	S	S	*	*			trans	43.1	125.7	145.8	-96.4	28	0	0	0	126.3
459	S	35.1	Very low	36.3	Very low	108 Å²	108	134.1 Å²	134.1	76%	0.755	81%	0.812	S	S	*	*				65.2	115.7	128.6	68.5	0	0	0	0	123.8
460	G	34.9	Very low	36.3	Very low	87 Å²	87	136.5 Å²	136.5	90%	0.897	82%	0.818	S	S	*	*				101.1	108.3	126.4	0	0	0	0	0	119.2
461	G	41	Very low	36.7	Very low	74 Å²	74	134.3 Å²	134.3	76%	0.763	81%	0.805	S	S	*	*			trans	152.2	141.1	168.4	0	0	0	0	0	113.7
462	P	38.4	Very low	36.8	Very low	123 Å²	123	136.3 Å²	136.3	80%	0.799	81%	0.81	S	S	*	*			trans	-109	123.6	-167	37.2	-30.1	0	0	0	117
463	R	37.6	Very low	36.8	Very low	231 Å²	231	138.4 Å²	138.4	87%	0.872	81%	0.809	S	S	*	*			trans	62.7	172.1	158.5	-68.8	-178.3	174.9	176.1	-0.3	115.9
464	P	38.5	Very low	37.6	Very low	107 Å²	107	139.9 Å²	139.9	70%	0.695	81%	0.812	S	S	*	*			cis	-123.5	179.4	-2.5	42.7	-28.6	0	0	0	115.6
465	Q	34	Very low	38.1	Very low	176 Å²	176	135.5 Å²	135.5	82%	0.822	80%	0.804	S	S	*	*			trans	50.7	111.3	150.3	-75.6	170.4	-19.5	0	0	121.8
466	V	33.4	Very low	39.1	Very low	136 Å²	136	141.1 Å²	141.1	82%	0.824	81%	0.81	S	S	*	*			trans	38.7	113.5	132.8	-170.7	0	0	0	0	118.5
467	K	34.6	Very low	39.8	Very low	208 Å²	208	138.8 Å²	138.8	90%	0.904	81%	0.805	S	S	*	*			trans	-143.7	125.9	151.8	-165.3	169.1	-175.3	175.9	0	111.5
468	E	38.1	Very low	40.1	Very low	187 Å²	187	143.6 Å²	143.6	87%	0.874	81%	0.808	S	S	*	*			trans	-81	156.7	178.8	-59.2	171	117	0	0	112.4
469	G	38.7	Very low	40.6	Very low	71 Å²	71	148.1 Å²	148.1	73%	0.732	81%	0.813	S	S	*	*			trans	166.1	144.8	169.4	0	0	0	0	0	112.1
470	I	38.3	Very low	41.2	Very low	181 Å²	181	150.6 Å²	150.6	93%	0.928	82%	0.817	S	S	*	*			cis	-140.1	136.1	-2.7	-76.4	153.4	0	0	0	107.8
471	G	44.1	Very low	42.1	Very low	53 Å²	53	155.3 Å²	155.3	55%	0.546	81%	0.807	S	S	.	*			trans	-151.4	155.7	171.3	0	0	0	0	0	110.4	Q473	G471-Q473 PolarHBondContact O-N 2.81Å
472	P	39.8	Very low	43.1	Very low	132 Å²	132	157.6 Å²	157.6	86%	0.857	81%	0.806	S	S	*	*			trans	-66.3	121.5	-173.2	26.1	-33.7	0	0	0	111.5	L474	P472-L474 PolarHBondContact O-N 3.01Å
473	Q	41.5	Very low	44	Very low	176 Å²	176	154.7 Å²	154.7	82%	0.822	79%	0.787	S	S	*	*			trans	-74.1	112.7	178.8	-68.3	-170.3	39.2	0	0	110.9	G471	G471-Q473 PolarHBondContact O-N 2.81Å
474	L	51.1	Low	45.3	Very low	156 Å²	156	147.1 Å²	147.1	82%	0.817	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-61	141.1	163.8	-75.5	164.1	0	0	0	110.1	P472 R476	P472-L474 PolarHBondContact O-N 3.01Å; L474-R476 PolarHBondContact O-N 3.18Å
475	P	47.8	Very low	46.3	Very low	116 Å²	116	151.6 Å²	151.6	75%	0.753	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-64.7	119.8	179.9	26.6	-33.7	0	0	0	110
476	R	51.2	Low	48	Very low	221 Å²	221	153.7 Å²	153.7	83%	0.834	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-57.8	127.1	178.1	-64	-174.8	-176.4	-164.1	-0.4	109.4	L474 K478	L474-R476 PolarHBondContact O-N 3.18Å; R476-K478 PolarHBondContact O-N 3.45Å
477	P	47.4	Very low	49.6	Very low	123 Å²	123	150 Å²	150	80%	0.799	74%	0.744	S	S	*	*	P	Polyproline II helix	trans	-59.3	130.9	175.9	23.9	-32.7	0	0	0	109.5	R479	P477-R479 PolarHBondContact O-N 3.05Å
478	K	42.2	Very low	50.8	Low	195 Å²	195	142.5 Å²	142.5	85%	0.848	71%	0.713	S	S	*	*	P	Polyproline II helix	trans	-57.6	128.7	177.1	-72.6	-179	178.2	176.9	0	108.6	R476 I480	R476-K478 PolarHBondContact O-N 3.45Å; K478-I480 PolarHBondContact O-N 2.78Å
479	R	45.9	Very low	52	Low	249 Å²	249	136.9 Å²	136.9	94%	0.94	70%	0.699	S	S	*	*			trans	-59.2	106.6	171.8	-83.5	-177.1	169.5	-108.5	2	108.9	P477 R481	P477-R479 PolarHBondContact O-N 3.05Å; R479-R481 PolarHBondContact O-N 2.69Å; R479-R481 VanDerWaalsContact O-N 3.12Å
480	I	47.1	Very low	53.5	Low	160 Å²	160	138 Å²	138	82%	0.821	70%	0.696	S	S	*	*			trans	-66.3	110.3	169.6	-59.1	175.5	0	0	0	106.5	K478 V482	K478-I480 PolarHBondContact O-N 2.78Å; I480-V482 PolarHBondContact O-N 3.25Å
481	R	52.5	Low	54.4	Low	187 Å²	187	138.1 Å²	138.1	71%	0.706	69%	0.686	S	S	*	*			trans	-77.3	106.9	173.8	-169	-171.8	-158.8	-160	13	107.4	R479 P483 E487	R479-R481 PolarHBondContact O-N 2.69Å; R479-R481 VanDerWaalsContact O-N 3.12Å; R481-P483 WeakPolarHBondContact O-CD 3.37Å; R481-E487 IonicContact CZ-OE1 2.65Å; R481-E487 IonicContact NH1-OE1 2.66Å; R481-E487 PolarHBondContact NH1-OE1 2.8Å
482	V	62.1	Low	54.8	Low	121 Å²	121	138.7 Å²	138.7	73%	0.733	69%	0.692	S	S	*	*	P	Polyproline II helix	trans	-58.4	121.3	172.2	-176.9	0	0	0	0	107.8	I480 T484	I480-V482 PolarHBondContact O-N 3.25Å; V482-T484 PolarHBondContact O-N 3.47Å
483	P	57.2	Low	55	Low	63 Å²	63	137.1 Å²	137.1	41%	0.409	68%	0.675	S	S	.	*	P	Polyproline II helix	trans	-61	131	-177.5	-25.9	36	0	0	0	111.4	R481 E487 L488	R481-P483 WeakPolarHBondContact O-CD 3.37Å; P483-E487 HydrophobicContact CB-CB 4.11Å; P483-L488 HydrophobicContact CB-CD2 4.45Å; P483-L488 HydrophobicContact CB-CG 4.19Å
484	T	65.4	Low	55.5	Low	72 Å²	72	138.3 Å²	138.3	44%	0.442	68%	0.678	S	S	.	*	P	Polyproline II helix	trans	-67.2	160.8	176	62.3	0	0	0	0	111	V482 R486 E487 L488	V482-T484 PolarHBondContact O-N 3.47Å; T484-R486 PolarHBondContact O-N 2.74Å; T484-E487 VanDerWaalsContact CB-OE2 3.3Å; T484-E487 WeakPolarHBondContact CB-OE2 3.29Å; T484-E487 WeakPolarHBondContact CG2-OE2 3.4Å; T484-E487 PolarHBondContact N-OE2 3.08Å; T484-E487 PolarHBondContact O-N 2.85Å; T484-E487 PolarHBondContact OG1-OE2 2.8Å; T484-L488 PolarHBondContact O-N 3.47Å
485	R	60.7	Low	55.5	Low	200 Å²	200	136.1 Å²	136.1	76%	0.755	67%	0.666	S	S	*	*	H	α-helix	trans	-54.1	-22.3	177.7	-163	176	-174.8	-175.8	1.1	113.7
486	R	69.3	Low	55.8	Low	221 Å²	221	135.4 Å²	135.4	83%	0.834	66%	0.661	S	S	*	*	H	α-helix	trans	-84.7	-32.7	175.8	-165.8	175.4	-176.4	177.8	1.2	113.1	T484	T484-R486 PolarHBondContact O-N 2.74Å
487	E	66.5	Low	56.5	Low	58 Å²	58	127.3 Å²	127.3	27%	0.271	64%	0.639	S	S	.	*	H	α-helix	trans	-75.6	-35.3	175.3	-71.9	157.5	134.3	0	0	111.3	R481 P483 T484 A489 S490 Y491	R481-E487 IonicContact CZ-OE1 2.65Å; R481-E487 IonicContact NH1-OE1 2.66Å; R481-E487 PolarHBondContact NH1-OE1 2.8Å; P483-E487 HydrophobicContact CB-CB 4.11Å; T484-E487 VanDerWaalsContact CB-OE2 3.3Å; T484-E487 WeakPolarHBondContact CB-OE2 3.29Å; T484-E487 WeakPolarHBondContact CG2-OE2 3.4Å; T484-E487 PolarHBondContact N-OE2 3.08Å; T484-E487 PolarHBondContact O-N 2.85Å; T484-E487 PolarHBondContact OG1-OE2 2.8Å; E487-A489 VanDerWaalsContact C-N 3.31Å; E487-A489 PolarHBondContact O-N 2.93Å; E487-S490 PolarHBondContact O-N 2.75Å; E487-S490 PolarHBondContact O-OG 3.39Å; E487-Y491 VanDerWaalsContact O-CD2 3.28Å; E487-Y491 WeakPolarHBondContact O-CD2 3.29Å
488	L	60	Low	57	Low	50 Å²	50	129.5 Å²	129.5	26%	0.262	64%	0.638	S	S	.	*	H	α-helix	trans	-61.2	-37.6	173.1	-75.7	163.6	0	0	0	112.6	P483 T484 S490 Y491 L495	P483-L488 HydrophobicContact CB-CD2 4.45Å; P483-L488 HydrophobicContact CB-CG 4.19Å; T484-L488 PolarHBondContact O-N 3.47Å; L488-S490 VanDerWaalsContact C-N 3.3Å; L488-S490 PolarHBondContact O-N 2.94Å; L488-Y491 PolarHBondContact O-N 2.74Å; L488-L495 HydrophobicContact CB-CD1 4.43Å; L488-L495 HydrophobicContact CD1-CD1 4.13Å; L488-L495 HydrophobicContact CD2-CD1 4.38Å
489	A	62.3	Low	58	Low	70 Å²	70	129.7 Å²	129.7	58%	0.579	63%	0.634	S	S	*	*	H	α-helix	trans	-63.4	-32.7	177.5	0	0	0	0	0	113.1	E487 Y491 G492	E487-A489 VanDerWaalsContact C-N 3.31Å; E487-A489 PolarHBondContact O-N 2.93Å; A489-Y491 VanDerWaalsContact C-N 3.3Å; A489-Y491 PolarHBondContact O-N 3.1Å; A489-G492 PolarHBondContact O-N 2.76Å
490	S	70.9	Confident	59.1	Low	95 Å²	95	119.7 Å²	119.7	66%	0.664	60%	0.604	S	S	*	*	H	α-helix	trans	-72.7	-16.9	175.8	34.1	0	0	0	0	114.6	E487 L488 G492	E487-S490 PolarHBondContact O-N 2.75Å; E487-S490 PolarHBondContact O-OG 3.39Å; L488-S490 VanDerWaalsContact C-N 3.3Å; L488-S490 PolarHBondContact O-N 2.94Å; S490-G492 VanDerWaalsContact C-N 3.32Å
491	Y	56.7	Low	59.9	Low	183 Å²	183	114.5 Å²	114.5	72%	0.718	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.3	9	173.9	-72.9	-72.6	0	0	0	113.3	E487 L488 A489 I493	E487-Y491 VanDerWaalsContact O-CD2 3.28Å; E487-Y491 WeakPolarHBondContact O-CD2 3.29Å; L488-Y491 PolarHBondContact O-N 2.74Å; A489-Y491 VanDerWaalsContact C-N 3.3Å; A489-Y491 PolarHBondContact O-N 3.1Å; Y491-I493 PolarHBondContact O-N 3.38Å
492	G	52.8	Low	60.7	Low	65 Å²	65	111.5 Å²	111.5	67%	0.67	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	75	-2.6	-178.2	0	0	0	0	0	114.7	A489 S490 K494	A489-G492 PolarHBondContact O-N 2.76Å; S490-G492 VanDerWaalsContact C-N 3.32Å; G492-K494 PolarHBondContact O-N 2.88Å; G492-K494 VanDerWaalsContact O-N 3.09Å
493	I	44.7	Very low	61.2	Low	99 Å²	99	111.6 Å²	111.6	51%	0.508	57%	0.572	S	S	.	*			trans	-82.7	90.5	-176.4	-45.2	-178.6	0	0	0	109.6	Y491 L495	Y491-I493 PolarHBondContact O-N 3.38Å; I493-L495 HydrophobicContact CB-CD1 4.44Å; I493-L495 HydrophobicContact CG2-CD1 3.81Å; I493-L495 PolarHBondContact O-N 2.77Å
494	K	51.8	Low	61.9	Low	201 Å²	201	115.7 Å²	115.7	87%	0.874	58%	0.583	S	S	*	*			trans	-72.5	89.5	171.5	-71.2	-177.6	177.4	178.6	0	110.6	G492 P496	G492-K494 PolarHBondContact O-N 2.88Å; G492-K494 VanDerWaalsContact O-N 3.09Å; K494-P496 WeakPolarHBondContact O-CD 3.27Å
495	L	51.4	Low	62.1	Low	110 Å²	110	114.7 Å²	114.7	58%	0.576	58%	0.582	S	S	*	*	P	Polyproline II helix	trans	-65.8	128.3	164.9	-79.8	80.7	0	0	0	109.4	L488 I493	L488-L495 HydrophobicContact CB-CD1 4.43Å; L488-L495 HydrophobicContact CD1-CD1 4.13Å; L488-L495 HydrophobicContact CD2-CD1 4.38Å; I493-L495 HydrophobicContact CB-CD1 4.44Å; I493-L495 HydrophobicContact CG2-CD1 3.81Å; I493-L495 PolarHBondContact O-N 2.77Å
496	P	54.3	Low	62.6	Low	100 Å²	100	114.5 Å²	114.5	65%	0.649	58%	0.582	S	S	*	*	P	Polyproline II helix	trans	-56.8	147.9	168.9	-23.7	34.5	0	0	0	111.6	K494 A501	K494-P496 WeakPolarHBondContact O-CD 3.27Å; P496-A501 HydrophobicContact CB-CB 4.5Å
497	S	65.6	Low	62.6	Low	51 Å²	51	109.3 Å²	109.3	36%	0.357	57%	0.567	S	S	.	*	P	Polyproline II helix	trans	-66.4	146.1	161	38.3	0	0	0	0	109.3	R499 A500 A501	S497-R499 PolarHBondContact O-N 3.36Å; S497-A500 PolarHBondContact O-N 2.61Å; S497-A500 VanDerWaalsContact OG-CB 3.3Å; S497-A500 WeakPolarHBondContact OG-CB 3.5Å; S497-A501 PolarHBondContact O-N 3.2Å
498	Q	56.9	Low	62.6	Low	170 Å²	170	109.5 Å²	109.5	79%	0.794	58%	0.578	S	S	*	*	H	α-helix	trans	-49.9	-47.4	175.6	-79.5	172.5	-47.2	0	0	111.5	A500 A501 E502	Q498-A500 VanDerWaalsContact C-N 3.3Å; Q498-A500 PolarHBondContact O-N 3.32Å; Q498-A501 CarbonylContact O-C 3.55Å; Q498-A501 WeakPolarHBondContact O-CA 3.46Å; Q498-A501 WeakPolarHBondContact O-CB 3.27Å; Q498-A501 PolarHBondContact O-N 2.98Å; Q498-E502 PolarHBondContact O-N 3.47Å
499	R	64.2	Low	62.5	Low	198 Å²	198	113.2 Å²	113.2	75%	0.747	59%	0.594	S	S	*	*	H	α-helix	trans	-54.8	-40.2	175.6	-170.5	172.1	-69.7	161.4	-4.5	113.8	S497 E503	S497-R499 PolarHBondContact O-N 3.36Å; R499-E503 WeakPolarHBondContact O-CB 3.33Å; R499-E503 PolarHBondContact O-N 3.39Å
500	A	67.9	Low	62.4	Low	39 Å²	39	119.7 Å²	119.7	32%	0.322	60%	0.604	S	S	.	*	H	α-helix	trans	-78.6	-18.8	177	0	0	0	0	0	113.3	S497 Q498 K504	S497-A500 PolarHBondContact O-N 2.61Å; S497-A500 VanDerWaalsContact OG-CB 3.3Å; S497-A500 WeakPolarHBondContact OG-CB 3.5Å; Q498-A500 VanDerWaalsContact C-N 3.3Å; Q498-A500 PolarHBondContact O-N 3.32Å; A500-K504 WeakPolarHBondContact O-CB 3.23Å; A500-K504 PolarHBondContact O-N 2.89Å
501	A	65	Low	61.5	Low	51 Å²	51	121 Å²	121	42%	0.421	60%	0.603	S	S	.	*	H	α-helix	trans	-79.7	-40.4	170	0	0	0	0	0	111.3	P496 S497 Q498 A505	P496-A501 HydrophobicContact CB-CB 4.5Å; S497-A501 PolarHBondContact O-N 3.2Å; Q498-A501 CarbonylContact O-C 3.55Å; Q498-A501 WeakPolarHBondContact O-CA 3.46Å; Q498-A501 WeakPolarHBondContact O-CB 3.27Å; Q498-A501 PolarHBondContact O-N 2.98Å; A501-A505 VanDerWaalsContact O-CB 3.25Å; A501-A505 WeakPolarHBondContact O-CB 3.29Å; A501-A505 PolarHBondContact O-N 3.14Å
502	E	69.1	Low	61.3	Low	125 Å²	125	119.9 Å²	119.9	58%	0.584	61%	0.605	S	S	*	*	H	α-helix	trans	-64.2	-46.6	171.7	-70.5	173.2	103.5	0	0	111.7	Q498 K504 A505 R506	Q498-E502 PolarHBondContact O-N 3.47Å; E502-K504 VanDerWaalsContact C-N 3.34Å; E502-K504 PolarHBondContact O-N 3.07Å; E502-A505 PolarHBondContact O-N 2.78Å; E502-R506 WeakPolarHBondContact O-CB 3.36Å; E502-R506 PolarHBondContact O-N 3.38Å
503	E	72.9	Confident	61	Low	123 Å²	123	126.3 Å²	126.3	58%	0.575	61%	0.61	S	S	*	*	H	α-helix	trans	-61.1	-43.6	178.2	-172.2	162.9	-125	0	0	110.9	R499 R506 E507	R499-E503 WeakPolarHBondContact O-CB 3.33Å; R499-E503 PolarHBondContact O-N 3.39Å; E503-R506 WeakPolarHBondContact O-CB 3.23Å; E503-R506 PolarHBondContact O-N 2.95Å; E503-E507 WeakPolarHBondContact O-CG 3.31Å; E503-E507 PolarHBondContact O-N 3.39Å
504	K	71.9	Confident	60.7	Low	148 Å²	148	128 Å²	128	64%	0.643	62%	0.621	S	S	*	*	H	α-helix	trans	-74.3	-26.2	176.1	-162.8	164.2	-167.9	169.2	0	114	A500 E502 A508	A500-K504 WeakPolarHBondContact O-CB 3.23Å; A500-K504 PolarHBondContact O-N 2.89Å; E502-K504 VanDerWaalsContact C-N 3.34Å; E502-K504 PolarHBondContact O-N 3.07Å; K504-A508 VanDerWaalsContact O-CB 3.31Å; K504-A508 WeakPolarHBondContact O-CB 3.46Å; K504-A508 PolarHBondContact O-N 3.29Å
505	A	70	Confident	60.3	Low	51 Å²	51	124.1 Å²	124.1	42%	0.421	62%	0.618	S	S	.	*	H	α-helix	trans	-70.4	-38.4	168.5	0	0	0	0	0	111.2	A501 E502 A508 Q509	A501-A505 VanDerWaalsContact O-CB 3.25Å; A501-A505 WeakPolarHBondContact O-CB 3.29Å; A501-A505 PolarHBondContact O-N 3.14Å; E502-A505 PolarHBondContact O-N 2.78Å; A505-A508 PolarHBondContact O-N 2.87Å; A505-Q509 WeakPolarHBondContact O-CG 3.33Å; A505-Q509 PolarHBondContact O-N 3.39Å
506	R	70.1	Confident	59.4	Low	197 Å²	197	122.6 Å²	122.6	74%	0.743	63%	0.629	S	S	*	*	H	α-helix	trans	-64	-43.9	170.7	-94.7	-177.8	162.7	178.8	-4.7	112.2	E502 E503 A508 Q509 R510	E502-R506 WeakPolarHBondContact O-CB 3.36Å; E502-R506 PolarHBondContact O-N 3.38Å; E503-R506 WeakPolarHBondContact O-CB 3.23Å; E503-R506 PolarHBondContact O-N 2.95Å; R506-A508 VanDerWaalsContact C-N 3.34Å; R506-Q509 PolarHBondContact O-N 3.43Å; R506-R510 VanDerWaalsContact O-CB 3.26Å; R506-R510 WeakPolarHBondContact O-CB 3.37Å; R506-R510 PolarHBondContact O-N 3.32Å
507	E	69.9	Low	58.8	Low	111 Å²	111	124.8 Å²	124.8	52%	0.519	64%	0.635	S	S	.	*	H	α-helix	trans	-61.1	-42	172.5	-72.7	-176.7	141.2	0	0	111.8	E503 Q509 R510 N511	E503-E507 WeakPolarHBondContact O-CG 3.31Å; E503-E507 PolarHBondContact O-N 3.39Å; E507-Q509 PolarHBondContact O-N 2.86Å; E507-R510 PolarHBondContact O-N 3.24Å; E507-N511 WeakPolarHBondContact O-CB 3.34Å; E507-N511 PolarHBondContact O-N 3.46Å
508	A	65.6	Low	57.6	Low	63 Å²	63	131.2 Å²	131.2	52%	0.521	66%	0.66	S	S	.	*	H	α-helix	trans	-63.5	-39.6	176.9	0	0	0	0	0	112.6	K504 A505 R506	K504-A508 VanDerWaalsContact O-CB 3.31Å; K504-A508 WeakPolarHBondContact O-CB 3.46Å; K504-A508 PolarHBondContact O-N 3.29Å; A505-A508 PolarHBondContact O-N 2.87Å; R506-A508 VanDerWaalsContact C-N 3.34Å
509	Q	58.4	Low	57.3	Low	127 Å²	127	129.5 Å²	129.5	59%	0.593	65%	0.647	S	S	*	*	H	α-helix	trans	-67.4	-41	171.2	-74.5	-178.3	-50.4	0	0	111.9	A505 R506 E507 Q512 Y513	A505-Q509 WeakPolarHBondContact O-CG 3.33Å; A505-Q509 PolarHBondContact O-N 3.39Å; R506-Q509 PolarHBondContact O-N 3.43Å; E507-Q509 PolarHBondContact O-N 2.86Å; Q509-Q512 WeakPolarHBondContact O-CB 3.26Å; Q509-Q512 PolarHBondContact O-N 2.9Å; Q509-Y513 VanDerWaalsContact O-CD2 3.25Å; Q509-Y513 WeakPolarHBondContact O-CD2 3.27Å
510	R	60.2	Low	57	Low	206 Å²	206	124.9 Å²	124.9	78%	0.777	64%	0.637	S	S	*	*	H	α-helix	trans	-68.3	-39.7	-176	-155.4	174.2	-169.4	-173	0.6	112.5	R506 E507 Q512 Y513	R506-R510 VanDerWaalsContact O-CB 3.26Å; R506-R510 WeakPolarHBondContact O-CB 3.37Å; R506-R510 PolarHBondContact O-N 3.32Å; E507-R510 PolarHBondContact O-N 3.24Å; R510-Q512 PolarHBondContact O-N 3.38Å; R510-Y513 PolarHBondContact O-N 3.12Å
511	N	53.1	Low	56.3	Low	123 Å²	123	129.1 Å²	129.1	66%	0.658	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.3	0.9	177.1	-65.7	1.9	0	0	0	113.3	E507	E507-N511 WeakPolarHBondContact O-CB 3.34Å; E507-N511 PolarHBondContact O-N 3.46Å
512	Q	51.6	Low	56.2	Low	160 Å²	160	132.4 Å²	132.4	75%	0.748	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.5	-7.3	176.2	-158.3	162.2	24.3	0	0	113.2	Q509 R510	Q509-Q512 WeakPolarHBondContact O-CB 3.26Å; Q509-Q512 PolarHBondContact O-N 2.9Å; R510-Q512 PolarHBondContact O-N 3.38Å
513	Y	47.2	Very low	56.2	Low	199 Å²	199	131.5 Å²	131.5	78%	0.78	66%	0.661	S	S	*	*	S	Bend	trans	-107.9	3.4	175.8	-66.1	-87.2	0	0	0	113.6	Q509 R510 S515	Q509-Y513 VanDerWaalsContact O-CD2 3.25Å; Q509-Y513 WeakPolarHBondContact O-CD2 3.27Å; R510-Y513 PolarHBondContact O-N 3.12Å; Y513-S515 PolarHBondContact O-N 2.93Å
514	D	37.8	Very low	56	Low	136 Å²	136	128.8 Å²	128.8	73%	0.727	65%	0.65	S	S	*	*			trans	-98.8	68.1	-177.4	-165.5	20.5	0	0	0	111.8
515	S	42.9	Very low	56	Low	118 Å²	118	126.2 Å²	126.2	83%	0.825	64%	0.643	S	S	*	*	S	Bend	trans	-162	97.9	170.7	-76.8	0	0	0	0	108.4	Y513	Y513-S515 PolarHBondContact O-N 2.93Å
516	G	33.3	Very low	56.2	Low	78 Å²	78	126.4 Å²	126.4	80%	0.804	64%	0.644	S	S	*	*			trans	-86.6	138.8	-164.4	0	0	0	0	0	115.8
517	D	41.2	Very low	56.5	Low	146 Å²	146	121.2 Å²	121.2	78%	0.781	63%	0.63	S	S	*	*				-136.2	153.9	126.6	-107.4	-37.7	0	0	0	107.7	Y519	D517-Y519 HydrophobicContact CB-CE2 4.39Å; D517-Y519 PolarHBondContact O-N 3.33Å
518	Q	40.7	Very low	56.9	Low	187 Å²	187	121.1 Å²	121.1	87%	0.874	63%	0.629	S	S	*	*			trans	-77.6	109.1	-168.9	-74.3	-175.8	-17.6	0	0	113.2
519	Y	51.4	Low	57.4	Low	134 Å²	134	124.2 Å²	124.2	53%	0.525	63%	0.633	S	S	.	*			trans	-138.2	141.8	161.7	-61.6	-80.5	0	0	0	108.6	D517 M527	D517-Y519 HydrophobicContact CB-CE2 4.39Å; D517-Y519 PolarHBondContact O-N 3.33Å; Y519-M527 HydrophobicContact CD1-CE 3.39Å; Y519-M527 HydrophobicContact CD1-SD 4.36Å; Y519-M527 HydrophobicContact CD2-CE 4.15Å; Y519-M527 HydrophobicContact CE1-CE 3.64Å; Y519-M527 HydrophobicContact CE1-SD 4.12Å; Y519-M527 HydrophobicContact CE2-CE 4.37Å; Y519-M527 HydrophobicContact CG-CE 3.67Å
520	N	56.8	Low	58.3	Low	101 Å²	101	121.7 Å²	121.7	54%	0.54	62%	0.624	S	S	.	*			trans	-71.1	155.6	171.5	-132.6	38.2	0	0	0	110	D522 E523 I524	N520-D522 PolarHBondContact ND2-OD2 2.98Å; N520-D522 PolarHBondContact O-N 2.8Å; N520-E523 HydrophobicContact CB-CG 4.24Å; N520-E523 PolarHBondContact N-OE2 3.02Å; N520-E523 WeakPolarHBondContact O-CA 3.44Å; N520-E523 WeakPolarHBondContact O-CB 3.26Å; N520-E523 PolarHBondContact O-N 2.99Å; N520-I524 PolarHBondContact O-N 3.29Å
521	D	52.3	Low	59.2	Low	127 Å²	127	117.6 Å²	117.6	68%	0.679	61%	0.613	S	S	*	*	H	α-helix	trans	-53.5	-40.5	176.1	-72.9	-36.9	0	0	0	111.3	E523 I524 D525	D521-E523 VanDerWaalsContact C-N 3.31Å; D521-E523 PolarHBondContact O-N 3.44Å; D521-I524 PolarHBondContact O-N 3.35Å; D521-D525 PolarHBondContact O-N 3.39Å
522	D	64.3	Low	60.4	Low	121 Å²	121	117 Å²	117	65%	0.647	61%	0.61	S	S	*	*	H	α-helix	trans	-61.2	-33.5	174.9	-50.7	-65.6	0	0	0	113.6	N520 A526	N520-D522 PolarHBondContact ND2-OD2 2.98Å; N520-D522 PolarHBondContact O-N 2.8Å; D522-A526 WeakPolarHBondContact O-CB 3.48Å; D522-A526 PolarHBondContact O-N 3.38Å
523	E	68.3	Low	61.7	Low	105 Å²	105	112 Å²	112	49%	0.491	60%	0.596	S	S	.	*	H	α-helix	trans	-79.1	-34.2	178	-69.5	-179.6	122.6	0	0	111.7	N520 D521 A526 M527	N520-E523 HydrophobicContact CB-CG 4.24Å; N520-E523 PolarHBondContact N-OE2 3.02Å; N520-E523 WeakPolarHBondContact O-CA 3.44Å; N520-E523 WeakPolarHBondContact O-CB 3.26Å; N520-E523 PolarHBondContact O-N 2.99Å; D521-E523 VanDerWaalsContact C-N 3.31Å; D521-E523 PolarHBondContact O-N 3.44Å; E523-A526 PolarHBondContact O-N 2.88Å; E523-M527 WeakPolarHBondContact O-CB 3.06Å; E523-M527 WeakPolarHBondContact O-CG 3.5Å; E523-M527 PolarHBondContact O-N 3.36Å
524	I	68.1	Low	63.2	Low	67 Å²	67	109.9 Å²	109.9	34%	0.344	59%	0.586	S	S	.	*	H	α-helix	trans	-65.4	-45.1	173.7	-63.9	173.2	0	0	0	109.7	N520 D521 M527 Q528	N520-I524 PolarHBondContact O-N 3.29Å; D521-I524 PolarHBondContact O-N 3.35Å; I524-M527 PolarHBondContact O-N 3.45Å; I524-Q528 WeakPolarHBondContact O-CB 3.45Å; I524-Q528 WeakPolarHBondContact O-CG 3.37Å; I524-Q528 PolarHBondContact O-N 3.03Å
525	D	71.8	Confident	65.1	Low	94 Å²	94	108.2 Å²	108.2	50%	0.503	57%	0.574	S	S	.	*	H	α-helix	trans	-66.3	-39.6	176.2	-120.4	41.4	0	0	0	111.6	D521 Q528 Q529	D521-D525 PolarHBondContact O-N 3.39Å; D525-Q528 PolarHBondContact O-N 3.42Å; D525-Q529 WeakPolarHBondContact O-CB 3.35Å; D525-Q529 VanDerWaalsContact O-CG 3.3Å; D525-Q529 WeakPolarHBondContact O-CG 3.32Å; D525-Q529 PolarHBondContact O-N 3.43Å
526	A	75.8	Confident	66.5	Low	55 Å²	55	109 Å²	109	46%	0.455	56%	0.563	S	S	.	*	H	α-helix	trans	-64.3	-41.7	174.6	0	0	0	0	0	112.8	D522 E523 Q529 D530	D522-A526 WeakPolarHBondContact O-CB 3.48Å; D522-A526 PolarHBondContact O-N 3.38Å; E523-A526 PolarHBondContact O-N 2.88Å; A526-Q529 PolarHBondContact O-N 2.79Å; A526-D530 PolarHBondContact O-N 2.89Å
527	M	75.2	Confident	68.5	Low	88 Å²	88	107.3 Å²	107.3	43%	0.433	54%	0.542	S	S	.	.	H	α-helix	trans	-67.3	-40.8	175	-75.3	-168.8	-65.4	0	0	112	Y519 E523 I524 Q529 D530 E531	Y519-M527 HydrophobicContact CD1-CE 3.39Å; Y519-M527 HydrophobicContact CD1-SD 4.36Å; Y519-M527 HydrophobicContact CD2-CE 4.15Å; Y519-M527 HydrophobicContact CE1-CE 3.64Å; Y519-M527 HydrophobicContact CE1-SD 4.12Å; Y519-M527 HydrophobicContact CE2-CE 4.37Å; Y519-M527 HydrophobicContact CG-CE 3.67Å; E523-M527 WeakPolarHBondContact O-CB 3.06Å; E523-M527 WeakPolarHBondContact O-CG 3.5Å; E523-M527 PolarHBondContact O-N 3.36Å; I524-M527 PolarHBondContact O-N 3.45Å; M527-Q529 VanDerWaalsContact C-N 3.32Å; M527-Q529 PolarHBondContact O-N 2.89Å; M527-D530 PolarHBondContact O-N 2.91Å; M527-E531 WeakPolarHBondContact O-CB 3.44Å; M527-E531 PolarHBondContact O-N 3.18Å
528	Q	78.9	Confident	70	Confident	109 Å²	109	105.7 Å²	105.7	51%	0.509	53%	0.529	S	S	.	.	H	α-helix	trans	-63.9	-37.3	173.9	-76.1	-173.8	53.2	0	0	111.9	I524 D525 L532	I524-Q528 WeakPolarHBondContact O-CB 3.45Å; I524-Q528 WeakPolarHBondContact O-CG 3.37Å; I524-Q528 PolarHBondContact O-N 3.03Å; D525-Q528 PolarHBondContact O-N 3.42Å; Q528-L532 VanDerWaalsContact O-CB 3.25Å; Q528-L532 WeakPolarHBondContact O-CB 3.4Å; Q528-L532 VanDerWaalsContact O-CG 3.3Å; Q528-L532 WeakPolarHBondContact O-CG 3.46Å; Q528-L532 PolarHBondContact O-N 2.77Å
529	Q	75.3	Confident	71.5	Confident	127 Å²	127	99.3 Å²	99.3	59%	0.593	50%	0.503	S	S	*	.	H	α-helix	trans	-68.8	-40.7	175.4	-74.4	-178.9	39.6	0	0	112.7	D525 A526 M527 A533	D525-Q529 WeakPolarHBondContact O-CB 3.35Å; D525-Q529 VanDerWaalsContact O-CG 3.3Å; D525-Q529 WeakPolarHBondContact O-CG 3.32Å; D525-Q529 PolarHBondContact O-N 3.43Å; A526-Q529 PolarHBondContact O-N 2.79Å; M527-Q529 VanDerWaalsContact C-N 3.32Å; M527-Q529 PolarHBondContact O-N 2.89Å; Q529-A533 WeakPolarHBondContact O-CB 3.49Å; Q529-A533 PolarHBondContact O-N 3.33Å
530	D	79	Confident	72	Confident	75 Å²	75	96.6 Å²	96.6	40%	0.401	50%	0.495	S	S	.	.	H	α-helix	trans	-69.8	-38	174.5	-175.8	38.1	0	0	0	112	A526 M527 A533 R534	A526-D530 PolarHBondContact O-N 2.89Å; M527-D530 PolarHBondContact O-N 2.91Å; D530-A533 PolarHBondContact O-N 3.03Å; D530-R534 VanDerWaalsContact CG-NE 3.29Å; D530-R534 WeakPolarHBondContact O-CB 3.41Å; D530-R534 WeakPolarHBondContact O-CG 3.46Å; D530-R534 PolarHBondContact O-N 2.69Å; D530-R534 IonicContact OD1-CZ 2.73Å; D530-R534 IonicContact OD1-NE 2.68Å; D530-R534 PolarHBondContact OD1-NE 3.35Å; D530-R534 VanDerWaalsContact OD1-NE 3.11Å; D530-R534 IonicContact OD1-NH2 2.7Å; D530-R534 IonicContact OD2-CZ 3.31Å; D530-R534 IonicContact OD2-NE 2.61Å; D530-R534 PolarHBondContact OD2-NE 2.65Å; D530-R534 IonicContact OD2-NH2 3.11Å; D530-R534 PolarHBondContact OD2-NH2 2.92Å
531	E	78.7	Confident	72.3	Confident	119 Å²	119	98.3 Å²	98.3	56%	0.556	50%	0.5	S	S	*	.	H	α-helix	trans	-66	-44.1	173.8	-173.2	167.6	-178.3	0	0	111.8	M527 A533 R534 Q535	M527-E531 WeakPolarHBondContact O-CB 3.44Å; M527-E531 PolarHBondContact O-N 3.18Å; E531-A533 VanDerWaalsContact C-N 3.34Å; E531-A533 PolarHBondContact O-N 3.15Å; E531-R534 PolarHBondContact O-N 2.86Å; E531-Q535 HydrophobicContact CG-CG 4.38Å; E531-Q535 WeakPolarHBondContact O-CB 3.42Å; E531-Q535 WeakPolarHBondContact O-CG 3.38Å; E531-Q535 PolarHBondContact O-N 3.01Å; E531-Q535 PolarHBondContact OE1-NE2 2.84Å; E531-Q535 VanDerWaalsContact OE1-NE2 3.15Å
532	L	78	Confident	72.8	Confident	112 Å²	112	99.7 Å²	99.7	59%	0.586	50%	0.502	S	S	*	.	H	α-helix	trans	-61.5	-40.2	172.3	-79.3	167.2	0	0	0	111.9	Q528 Q535 F536	Q528-L532 VanDerWaalsContact O-CB 3.25Å; Q528-L532 WeakPolarHBondContact O-CB 3.4Å; Q528-L532 VanDerWaalsContact O-CG 3.3Å; Q528-L532 WeakPolarHBondContact O-CG 3.46Å; Q528-L532 PolarHBondContact O-N 2.77Å; L532-Q535 PolarHBondContact O-N 3.02Å; L532-F536 WeakPolarHBondContact O-CB 3.42Å; L532-F536 PolarHBondContact O-N 2.73Å
533	A	77.8	Confident	72.3	Confident	55 Å²	55	102.5 Å²	102.5	46%	0.455	50%	0.504	S	S	.	.	H	α-helix	trans	-64.4	-41	176	0	0	0	0	0	111.8	Q529 D530 E531 F536 A537	Q529-A533 WeakPolarHBondContact O-CB 3.49Å; Q529-A533 PolarHBondContact O-N 3.33Å; D530-A533 PolarHBondContact O-N 3.03Å; E531-A533 VanDerWaalsContact C-N 3.34Å; E531-A533 PolarHBondContact O-N 3.15Å; A533-F536 PolarHBondContact O-N 3.28Å; A533-A537 VanDerWaalsContact O-CB 3.26Å; A533-A537 WeakPolarHBondContact O-CB 3.12Å; A533-A537 PolarHBondContact O-N 3.27Å
534	R	79.6	Confident	71.5	Confident	153 Å²	153	106 Å²	106	58%	0.577	51%	0.514	S	S	*	.	H	α-helix	trans	-68.2	-42.8	175.1	-70.6	170.9	-169.1	-149.2	11	112.2	D530 E531 F536 A537 Q538	D530-R534 VanDerWaalsContact CG-NE 3.29Å; D530-R534 WeakPolarHBondContact O-CB 3.41Å; D530-R534 WeakPolarHBondContact O-CG 3.46Å; D530-R534 PolarHBondContact O-N 2.69Å; D530-R534 IonicContact OD1-CZ 2.73Å; D530-R534 IonicContact OD1-NE 2.68Å; D530-R534 PolarHBondContact OD1-NE 3.35Å; D530-R534 VanDerWaalsContact OD1-NE 3.11Å; D530-R534 IonicContact OD1-NH2 2.7Å; D530-R534 IonicContact OD2-CZ 3.31Å; D530-R534 IonicContact OD2-NE 2.61Å; D530-R534 PolarHBondContact OD2-NE 2.65Å; D530-R534 IonicContact OD2-NH2 3.11Å; D530-R534 PolarHBondContact OD2-NH2 2.92Å; E531-R534 PolarHBondContact O-N 2.86Å; R534-F536 VanDerWaalsContact C-N 3.33Å; R534-A537 PolarHBondContact O-N 2.77Å; R534-Q538 WeakPolarHBondContact O-CB 3.32Å; R534-Q538 WeakPolarHBondContact O-CG 3.49Å; R534-Q538 PolarHBondContact O-N 3.17Å
535	Q	77.1	Confident	70.4	Confident	101 Å²	101	105.3 Å²	105.3	47%	0.472	52%	0.523	S	S	.	.	H	α-helix	trans	-64	-39.1	174.2	-71.6	-174.5	23.2	0	0	111.2	E531 L532 T539	E531-Q535 HydrophobicContact CG-CG 4.38Å; E531-Q535 WeakPolarHBondContact O-CB 3.42Å; E531-Q535 WeakPolarHBondContact O-CG 3.38Å; E531-Q535 PolarHBondContact O-N 3.01Å; E531-Q535 PolarHBondContact OE1-NE2 2.84Å; E531-Q535 VanDerWaalsContact OE1-NE2 3.15Å; L532-Q535 PolarHBondContact O-N 3.02Å; Q535-T539 VanDerWaalsContact O-CB 3.26Å; Q535-T539 WeakPolarHBondContact O-CB 3.37Å; Q535-T539 PolarHBondContact O-N 3.41Å; Q535-T539 PolarHBondContact O-OG1 3.44Å
536	F	73.4	Confident	68.9	Low	134 Å²	134	108.5 Å²	108.5	59%	0.588	54%	0.535	S	S	*	.	H	α-helix	trans	-67	-43.7	174.7	-167.2	-97.1	0	0	0	111.5	L532 A533 R534 T539 Q540	L532-F536 WeakPolarHBondContact O-CB 3.42Å; L532-F536 PolarHBondContact O-N 2.73Å; A533-F536 PolarHBondContact O-N 3.28Å; R534-F536 VanDerWaalsContact C-N 3.33Å; F536-T539 CarbonylContact O-C 3.42Å; F536-T539 PolarHBondContact O-N 3.13Å; F536-Q540 HydrophobicContact CD1-CG 3.94Å; F536-Q540 HydrophobicContact CE1-CG 3.85Å; F536-Q540 VanDerWaalsContact CE1-NE2 3.27Å; F536-Q540 VanDerWaalsContact CZ-NE2 3.29Å; F536-Q540 WeakPolarHBondContact O-CB 3.44Å; F536-Q540 VanDerWaalsContact O-CG 3.22Å; F536-Q540 WeakPolarHBondContact O-CG 3.4Å; F536-Q540 PolarHBondContact O-N 3.32Å
537	A	74.2	Confident	67	Low	44 Å²	44	114 Å²	114	36%	0.364	55%	0.551	S	S	.	*	H	α-helix	trans	-62.6	-43.5	175.6	0	0	0	0	0	112.3	A533 R534 T539 Q540 Q541	A533-A537 VanDerWaalsContact O-CB 3.26Å; A533-A537 WeakPolarHBondContact O-CB 3.12Å; A533-A537 PolarHBondContact O-N 3.27Å; R534-A537 PolarHBondContact O-N 2.77Å; A537-T539 VanDerWaalsContact C-N 3.35Å; A537-Q540 PolarHBondContact O-N 3.14Å; A537-Q541 WeakPolarHBondContact O-CB 3.4Å; A537-Q541 WeakPolarHBondContact O-CG 3.43Å; A537-Q541 PolarHBondContact O-N 3.33Å
538	Q	73.7	Confident	64.8	Low	112 Å²	112	120.7 Å²	120.7	52%	0.523	57%	0.574	S	S	.	*	H	α-helix	trans	-63.7	-39.4	171.9	-73.6	-174.2	7.9	0	0	111.8	R534 Q540 Q541 Q542	R534-Q538 WeakPolarHBondContact O-CB 3.32Å; R534-Q538 WeakPolarHBondContact O-CG 3.49Å; R534-Q538 PolarHBondContact O-N 3.17Å; Q538-Q540 VanDerWaalsContact C-N 3.33Å; Q538-Q540 PolarHBondContact O-N 2.9Å; Q538-Q541 PolarHBondContact O-N 2.98Å; Q538-Q542 WeakPolarHBondContact O-CB 3.19Å; Q538-Q542 VanDerWaalsContact O-CG 3.23Å; Q538-Q542 WeakPolarHBondContact O-CG 3.31Å; Q538-Q542 PolarHBondContact O-N 2.98Å
539	T	71.2	Confident	62.4	Low	52 Å²	52	124 Å²	124	32%	0.319	59%	0.589	S	S	.	*	H	α-helix	trans	-67	-33	175.9	-60	0	0	0	0	112.3	Q535 F536 A537 R543	Q535-T539 VanDerWaalsContact O-CB 3.26Å; Q535-T539 WeakPolarHBondContact O-CB 3.37Å; Q535-T539 PolarHBondContact O-N 3.41Å; Q535-T539 PolarHBondContact O-OG1 3.44Å; F536-T539 CarbonylContact O-C 3.42Å; F536-T539 PolarHBondContact O-N 3.13Å; A537-T539 VanDerWaalsContact C-N 3.35Å; T539-R543 WeakPolarHBondContact O-CB 3.44Å; T539-R543 VanDerWaalsContact O-CG 3.26Å; T539-R543 WeakPolarHBondContact O-CG 3.44Å; T539-R543 PolarHBondContact O-N 3.21Å
540	Q	62.3	Low	60.3	Low	77 Å²	77	125.2 Å²	125.2	36%	0.36	59%	0.594	S	S	.	*	H	α-helix	trans	-68.9	-47	172.1	-70.8	-76.6	-11.2	0	0	110.6	F536 A537 Q538 Q542 R543 Y544	F536-Q540 HydrophobicContact CD1-CG 3.94Å; F536-Q540 HydrophobicContact CE1-CG 3.85Å; F536-Q540 VanDerWaalsContact CE1-NE2 3.27Å; F536-Q540 VanDerWaalsContact CZ-NE2 3.29Å; F536-Q540 WeakPolarHBondContact O-CB 3.44Å; F536-Q540 VanDerWaalsContact O-CG 3.22Å; F536-Q540 WeakPolarHBondContact O-CG 3.4Å; F536-Q540 PolarHBondContact O-N 3.32Å; A537-Q540 PolarHBondContact O-N 3.14Å; Q538-Q540 VanDerWaalsContact C-N 3.33Å; Q538-Q540 PolarHBondContact O-N 2.9Å; Q540-Q542 VanDerWaalsContact C-N 3.34Å; Q540-Q542 PolarHBondContact O-N 3.34Å; Q540-R543 PolarHBondContact O-N 2.74Å; Q540-R543 VanDerWaalsContact O-N 3.08Å; Q540-Y544 WeakPolarHBondContact O-CD2 3.15Å; Q540-Y544 PolarHBondContact O-N 3.16Å; Q540-Y544 VanDerWaalsContact OE1-CD2 3.29Å
541	Q	63.9	Low	58.2	Low	138 Å²	138	128.4 Å²	128.4	65%	0.645	61%	0.611	S	S	*	*	H	α-helix	trans	-62.8	-38.4	176.3	-72.2	174.1	-6.9	0	0	112.2	A537 Q538 R543 G545	A537-Q541 WeakPolarHBondContact O-CB 3.4Å; A537-Q541 WeakPolarHBondContact O-CG 3.43Å; A537-Q541 PolarHBondContact O-N 3.33Å; Q538-Q541 PolarHBondContact O-N 2.98Å; Q541-R543 VanDerWaalsContact C-N 3.27Å; Q541-R543 PolarHBondContact O-N 3.38Å; Q541-G545 WeakPolarHBondContact O-CA 3.37Å; Q541-G545 PolarHBondContact O-N 3.19Å
542	Q	62.5	Low	56	Low	155 Å²	155	128.2 Å²	128.2	72%	0.724	62%	0.618	S	S	*	*	H	α-helix	trans	-71.7	-14.6	174	-71.3	171.7	24.9	0	0	114.1	Q538 Q540	Q538-Q542 WeakPolarHBondContact O-CB 3.19Å; Q538-Q542 VanDerWaalsContact O-CG 3.23Å; Q538-Q542 WeakPolarHBondContact O-CG 3.31Å; Q538-Q542 PolarHBondContact O-N 2.98Å; Q540-Q542 VanDerWaalsContact C-N 3.34Å; Q540-Q542 PolarHBondContact O-N 3.34Å
543	R	52.9	Low	54.1	Low	180 Å²	180	129 Å²	129	68%	0.679	63%	0.63	S	S	*	*	H	α-helix	trans	-99	-30.4	175.3	-75.9	-179.9	-157.6	-155.3	8.3	114.2	T539 Q540 Q541	T539-R543 WeakPolarHBondContact O-CB 3.44Å; T539-R543 VanDerWaalsContact O-CG 3.26Å; T539-R543 WeakPolarHBondContact O-CG 3.44Å; T539-R543 PolarHBondContact O-N 3.21Å; Q540-R543 PolarHBondContact O-N 2.74Å; Q540-R543 VanDerWaalsContact O-N 3.08Å; Q541-R543 VanDerWaalsContact C-N 3.27Å; Q541-R543 PolarHBondContact O-N 3.38Å
544	Y	52.8	Low	52.3	Low	179 Å²	179	131.6 Å²	131.6	70%	0.702	64%	0.64	S	S	*	*	H	α-helix	trans	-125.1	7	-170.1	-59	-66.6	0	0	0	113.6	Q540	Q540-Y544 WeakPolarHBondContact O-CD2 3.15Å; Q540-Y544 PolarHBondContact O-N 3.16Å; Q540-Y544 VanDerWaalsContact OE1-CD2 3.29Å
545	G	44.4	Very low	50.6	Low	53 Å²	53	129.5 Å²	129.5	55%	0.546	64%	0.64	S	S	.	*			trans	-115	46.5	-173	0	0	0	0	0	115.5	Q541	Q541-G545 WeakPolarHBondContact O-CA 3.37Å; Q541-G545 PolarHBondContact O-N 3.19Å
546	E	41.1	Very low	49.1	Very low	161 Å²	161	128.3 Å²	128.3	75%	0.752	65%	0.647	S	S	*	*	S	Bend	trans	-167.4	123.7	140.7	-106.2	-163.3	126.7	0	0	114.2
547	Q	35.7	Very low	47.9	Very low	169 Å²	169	130.3 Å²	130.3	79%	0.79	66%	0.659	S	S	*	*			trans	65.9	140.2	150.5	-49.8	-171	31.1	0	0	121.2
548	Y	29.3	Very low	46.9	Very low	230 Å²	230	132.8 Å²	132.8	90%	0.902	67%	0.666	S	S	*	*			trans	-81.9	135.6	176.8	-85.6	-130.7	0	0	0	111.8
549	Q	27.9	Very low	45.8	Very low	179 Å²	179	129.6 Å²	129.6	84%	0.836	66%	0.659	S	S	*	*				-177.2	138.9	124.6	-105.4	175.6	-13.1	0	0	114.9
550	H	30.9	Very low	45.2	Very low	151 Å²	151	133.1 Å²	133.1	70%	0.699	68%	0.675	S	S	*	*			trans	58.8	127.9	154.4	-86.3	-74.2	0	0	0	123.8
551	D	34	Very low	45.4	Very low	142 Å²	142	132.4 Å²	132.4	76%	0.759	68%	0.683	S	S	*	*			trans	76.2	156.6	143.6	-54.4	-15.8	0	0	0	121
552	V	33.2	Very low	45.7	Very low	116 Å²	116	128.5 Å²	128.5	70%	0.703	67%	0.674	S	S	*	*			trans	-116	157.4	-152.2	-138.5	0	0	0	0	112.5	V554	V552-V554 HydrophobicContact CG1-CG2 3.84Å
553	P	37.7	Very low	46.3	Very low	128 Å²	128	123.5 Å²	123.5	83%	0.831	66%	0.66	S	S	*	*				-137.9	152.5	103.9	37.6	-27	0	0	0	114.5
554	V	40.2	Very low	47.4	Very low	109 Å²	109	122.1 Å²	122.1	66%	0.661	66%	0.661	S	S	*	*			trans	-92.2	155.8	-177.6	-173.1	0	0	0	0	111.1	V552	V552-V554 HydrophobicContact CG1-CG2 3.84Å
555	N	44.1	Very low	48.5	Very low	109 Å²	109	115.9 Å²	115.9	58%	0.583	65%	0.646	S	S	*	*			trans	-56.6	141.3	174.5	-62.9	-36.3	0	0	0	112.2	E557 D558 A559	N555-E557 VanDerWaalsContact C-N 3.35Å; N555-E557 PolarHBondContact O-N 2.98Å; N555-D558 HydrophobicContact CB-CB 4.29Å; N555-D558 VanDerWaalsContact CB-OD2 3.32Å; N555-D558 WeakPolarHBondContact CB-OD2 3.4Å; N555-D558 PolarHBondContact ND2-OD2 2.81Å; N555-A559 WeakPolarHBondContact O-CB 3.25Å; N555-A559 PolarHBondContact O-N 2.8Å
556	A	46.5	Very low	50.1	Low	76 Å²	76	119.1 Å²	119.1	63%	0.628	65%	0.647	S	S	*	*	H	α-helix	trans	-67.2	-32.2	176.5	0	0	0	0	0	113.5	A559 D560	A556-A559 WeakPolarHBondContact O-CB 3.42Å; A556-A559 PolarHBondContact O-N 3.4Å; A556-D560 PolarHBondContact O-N 2.89Å
557	E	46.9	Very low	52	Low	177 Å²	177	117 Å²	117	83%	0.827	64%	0.64	S	S	*	*	H	α-helix	trans	-77.7	-31	-176.4	-62.7	177.2	156.5	0	0	112.2	N555 A559	N555-E557 VanDerWaalsContact C-N 3.35Å; N555-E557 PolarHBondContact O-N 2.98Å; E557-A559 VanDerWaalsContact C-N 3.33Å
558	D	53.2	Low	54.1	Low	95 Å²	95	111.7 Å²	111.7	51%	0.508	63%	0.626	S	S	.	*	H	α-helix	trans	-71.3	-30	167	-66.9	-61.2	0	0	0	111.5	N555 A562	N555-D558 HydrophobicContact CB-CB 4.29Å; N555-D558 VanDerWaalsContact CB-OD2 3.32Å; N555-D558 WeakPolarHBondContact CB-OD2 3.4Å; N555-D558 PolarHBondContact ND2-OD2 2.81Å; D558-A562 VanDerWaalsContact O-CB 3.25Å; D558-A562 WeakPolarHBondContact O-CB 3.07Å; D558-A562 PolarHBondContact O-N 3.44Å
559	A	51.2	Low	56.6	Low	46 Å²	46	109.2 Å²	109.2	38%	0.38	61%	0.614	S	S	.	*	H	α-helix	trans	-70.3	-41.4	-178.5	0	0	0	0	0	112.9	N555 A556 E557 A562 A563	N555-A559 WeakPolarHBondContact O-CB 3.25Å; N555-A559 PolarHBondContact O-N 2.8Å; A556-A559 WeakPolarHBondContact O-CB 3.42Å; A556-A559 PolarHBondContact O-N 3.4Å; E557-A559 VanDerWaalsContact C-N 3.33Å; A559-A562 PolarHBondContact O-N 2.95Å; A559-A563 VanDerWaalsContact O-CB 3.23Å; A559-A563 WeakPolarHBondContact O-CB 3.24Å; A559-A563 PolarHBondContact O-N 2.94Å
560	D	58.3	Low	59.2	Low	125 Å²	125	106.1 Å²	106.1	67%	0.668	60%	0.6	S	S	*	*	H	α-helix	trans	-67.4	-39.7	175.9	-79.2	-23	0	0	0	111.6	A556 A563 E564	A556-D560 PolarHBondContact O-N 2.89Å; D560-A563 PolarHBondContact O-N 2.67Å; D560-E564 WeakPolarHBondContact O-CB 3.42Å; D560-E564 PolarHBondContact O-N 3.34Å
561	A	66	Low	61.4	Low	63 Å²	63	105.2 Å²	105.2	52%	0.521	59%	0.594	S	S	.	*	H	α-helix	trans	-65.9	-38.5	174.5	0	0	0	0	0	112.5	A565	A561-A565 VanDerWaalsContact O-CB 3.32Å; A561-A565 WeakPolarHBondContact O-CB 3.36Å; A561-A565 PolarHBondContact O-N 2.73Å
562	A	71.1	Confident	63.4	Low	55 Å²	55	100.6 Å²	100.6	46%	0.455	58%	0.576	S	S	.	*	H	α-helix	trans	-67.6	-39.9	172.9	0	0	0	0	0	111.9	D558 A559 A565 E566	D558-A562 VanDerWaalsContact O-CB 3.25Å; D558-A562 WeakPolarHBondContact O-CB 3.07Å; D558-A562 PolarHBondContact O-N 3.44Å; A559-A562 PolarHBondContact O-N 2.95Å; A562-A565 PolarHBondContact O-N 2.8Å; A562-E566 PolarHBondContact O-N 3.17Å
563	A	74.6	Confident	65.4	Low	51 Å²	51	100.3 Å²	100.3	42%	0.421	57%	0.567	S	S	.	*	H	α-helix	trans	-67	-42	177.2	0	0	0	0	0	111.8	A559 D560 A565 E566 L567	A559-A563 VanDerWaalsContact O-CB 3.23Å; A559-A563 WeakPolarHBondContact O-CB 3.24Å; A559-A563 PolarHBondContact O-N 2.94Å; D560-A563 PolarHBondContact O-N 2.67Å; A563-A565 VanDerWaalsContact C-N 3.35Å; A563-E566 PolarHBondContact O-N 3.01Å; A563-L567 VanDerWaalsContact O-CB 3.26Å; A563-L567 WeakPolarHBondContact O-CB 3.23Å; A563-L567 PolarHBondContact O-N 3.48Å
564	E	75.6	Confident	67.3	Low	151 Å²	151	97.2 Å²	97.2	71%	0.706	55%	0.546	S	S	*	.	H	α-helix	trans	-64.9	-39.2	173.6	-172.2	170.2	-145.9	0	0	111.2	D560 L567 A568	D560-E564 WeakPolarHBondContact O-CB 3.42Å; D560-E564 PolarHBondContact O-N 3.34Å; E564-L567 PolarHBondContact O-N 2.85Å; E564-A568 WeakPolarHBondContact O-CB 3.25Å; E564-A568 PolarHBondContact O-N 2.56Å
565	A	77.5	Confident	68.8	Low	47 Å²	47	96.3 Å²	96.3	39%	0.388	53%	0.534	S	S	.	.	H	α-helix	trans	-66.3	-37.5	173.8	0	0	0	0	0	113.1	A561 A562 A563 R569	A561-A565 VanDerWaalsContact O-CB 3.32Å; A561-A565 WeakPolarHBondContact O-CB 3.36Å; A561-A565 PolarHBondContact O-N 2.73Å; A562-A565 PolarHBondContact O-N 2.8Å; A563-A565 VanDerWaalsContact C-N 3.35Å; A565-R569 WeakPolarHBondContact O-CB 3.32Å; A565-R569 VanDerWaalsContact O-CG 3.22Å; A565-R569 WeakPolarHBondContact O-CG 3.32Å; A565-R569 PolarHBondContact O-N 2.81Å
566	E	78.4	Confident	70	Confident	121 Å²	121	97.3 Å²	97.3	57%	0.565	54%	0.535	S	S	*	.	H	α-helix	trans	-69.6	-41.2	172.1	-79.9	-150.1	132.9	0	0	112.2	A562 A563 R569 Q570	A562-E566 PolarHBondContact O-N 3.17Å; A563-E566 PolarHBondContact O-N 3.01Å; E566-R569 CarbonylContact O-C 3.37Å; E566-R569 WeakPolarHBondContact O-CB 3.45Å; E566-R569 PolarHBondContact O-N 2.66Å; E566-Q570 WeakPolarHBondContact O-CB 3.4Å; E566-Q570 WeakPolarHBondContact O-CG 3.15Å; E566-Q570 PolarHBondContact O-N 3.39Å
567	L	80.9	Confident	70.8	Confident	116 Å²	116	100.1 Å²	100.1	61%	0.607	54%	0.536	S	S	*	.	H	α-helix	trans	-68.1	-39.4	178.9	-151.9	164.8	0	0	0	110.3	A563 E564 Q570 F571	A563-L567 VanDerWaalsContact O-CB 3.26Å; A563-L567 WeakPolarHBondContact O-CB 3.23Å; A563-L567 PolarHBondContact O-N 3.48Å; E564-L567 PolarHBondContact O-N 2.85Å; L567-Q570 PolarHBondContact O-N 2.62Å; L567-F571 VanDerWaalsContact O-CB 3.27Å; L567-F571 WeakPolarHBondContact O-CB 3.34Å; L567-F571 PolarHBondContact O-N 2.79Å
568	A	79.6	Confident	71.1	Confident	59 Å²	59	101.2 Å²	101.2	49%	0.488	53%	0.532	S	S	.	.	H	α-helix	trans	-61.6	-41.5	169.6	0	0	0	0	0	112.2	E564 F571 A572	E564-A568 WeakPolarHBondContact O-CB 3.25Å; E564-A568 PolarHBondContact O-N 2.56Å; A568-F571 PolarHBondContact O-N 2.65Å; A568-A572 VanDerWaalsContact O-CB 3.23Å; A568-A572 WeakPolarHBondContact O-CB 3.34Å; A568-A572 PolarHBondContact O-N 3.15Å
569	R	82	Confident	71	Confident	177 Å²	177	105.8 Å²	105.8	67%	0.668	54%	0.544	S	S	*	.	H	α-helix	trans	-65.9	-41.4	173.6	-78.2	171.1	177.6	-179.6	1.6	112.6	A565 E566 A572 Q573	A565-R569 WeakPolarHBondContact O-CB 3.32Å; A565-R569 VanDerWaalsContact O-CG 3.22Å; A565-R569 WeakPolarHBondContact O-CG 3.32Å; A565-R569 PolarHBondContact O-N 2.81Å; E566-R569 CarbonylContact O-C 3.37Å; E566-R569 WeakPolarHBondContact O-CB 3.45Å; E566-R569 PolarHBondContact O-N 2.66Å; R569-A572 PolarHBondContact O-N 3.05Å; R569-Q573 VanDerWaalsContact O-CB 3.31Å; R569-Q573 WeakPolarHBondContact O-CB 3.33Å; R569-Q573 WeakPolarHBondContact O-CG 3.28Å; R569-Q573 PolarHBondContact O-N 3.33Å
570	Q	80.8	Confident	71.1	Confident	115 Å²	115	108 Å²	108	54%	0.537	56%	0.556	S	S	.	*	H	α-helix	trans	-67.2	-38	175.9	-74.1	-177.8	26.2	0	0	111.3	E566 L567 T574	E566-Q570 WeakPolarHBondContact O-CB 3.4Å; E566-Q570 WeakPolarHBondContact O-CG 3.15Å; E566-Q570 PolarHBondContact O-N 3.39Å; L567-Q570 PolarHBondContact O-N 2.62Å; Q570-T574 VanDerWaalsContact O-CB 3.23Å; Q570-T574 WeakPolarHBondContact O-CB 3.39Å; Q570-T574 PolarHBondContact O-N 3.17Å; Q570-T574 PolarHBondContact O-OG1 3.32Å
571	F	77.4	Confident	70.4	Confident	131 Å²	131	104.6 Å²	104.6	58%	0.575	55%	0.551	S	S	*	*	H	α-helix	trans	-69.2	-42.8	175.6	-161.6	-99.6	0	0	0	111.1	L567 A568 T574 Q575	L567-F571 VanDerWaalsContact O-CB 3.27Å; L567-F571 WeakPolarHBondContact O-CB 3.34Å; L567-F571 PolarHBondContact O-N 2.79Å; A568-F571 PolarHBondContact O-N 2.65Å; F571-T574 PolarHBondContact O-N 3.24Å; F571-Q575 HydrophobicContact CD1-CG 4.42Å; F571-Q575 HydrophobicContact CE1-CG 4.34Å; F571-Q575 VanDerWaalsContact CE1-NE2 3.27Å; F571-Q575 WeakPolarHBondContact O-CG 3.34Å; F571-Q575 PolarHBondContact O-N 3.06Å
572	A	76.3	Confident	69.3	Low	46 Å²	46	111 Å²	111	38%	0.38	57%	0.57	S	S	.	*	H	α-helix	trans	-62	-44.2	172.4	0	0	0	0	0	112.2	A568 R569 T574 Q575 Q576	A568-A572 VanDerWaalsContact O-CB 3.23Å; A568-A572 WeakPolarHBondContact O-CB 3.34Å; A568-A572 PolarHBondContact O-N 3.15Å; R569-A572 PolarHBondContact O-N 3.05Å; A572-T574 VanDerWaalsContact C-N 3.35Å; A572-Q575 PolarHBondContact O-N 2.78Å; A572-Q576 WeakPolarHBondContact O-CB 3.19Å; A572-Q576 VanDerWaalsContact O-CG 3.3Å; A572-Q576 WeakPolarHBondContact O-CG 3.22Å; A572-Q576 PolarHBondContact O-N 2.66Å
573	Q	75.8	Confident	67.9	Low	110 Å²	110	116.7 Å²	116.7	51%	0.514	59%	0.587	S	S	.	*	H	α-helix	trans	-66.4	-34.4	173.6	-77.3	-175.4	-2.2	0	0	112.3	R569 Q576 Q577	R569-Q573 VanDerWaalsContact O-CB 3.31Å; R569-Q573 WeakPolarHBondContact O-CB 3.33Å; R569-Q573 WeakPolarHBondContact O-CG 3.28Å; R569-Q573 PolarHBondContact O-N 3.33Å; Q573-Q576 PolarHBondContact O-N 2.9Å; Q573-Q577 VanDerWaalsContact O-CB 3.28Å; Q573-Q577 WeakPolarHBondContact O-CB 3.22Å; Q573-Q577 VanDerWaalsContact O-CG 3.22Å; Q573-Q577 WeakPolarHBondContact O-CG 3.49Å; Q573-Q577 PolarHBondContact O-N 2.84Å
574	T	77.8	Confident	66.4	Low	62 Å²	62	119.7 Å²	119.7	38%	0.38	60%	0.602	S	S	.	*	H	α-helix	trans	-69.8	-38.3	175.6	-60.8	0	0	0	0	111.1	Q570 F571 A572 R578	Q570-T574 VanDerWaalsContact O-CB 3.23Å; Q570-T574 WeakPolarHBondContact O-CB 3.39Å; Q570-T574 PolarHBondContact O-N 3.17Å; Q570-T574 PolarHBondContact O-OG1 3.32Å; F571-T574 PolarHBondContact O-N 3.24Å; A572-T574 VanDerWaalsContact C-N 3.35Å; T574-R578 WeakPolarHBondContact O-CB 3.37Å; T574-R578 VanDerWaalsContact O-CG 3.24Å; T574-R578 WeakPolarHBondContact O-CG 3.35Å; T574-R578 PolarHBondContact O-N 3.21Å
575	Q	71.3	Confident	64.5	Low	90 Å²	90	117.9 Å²	117.9	42%	0.421	61%	0.613	S	S	.	*	H	α-helix	trans	-67.8	-45.9	171.5	-69.4	-147.2	10.3	0	0	111.2	F571 A572 Q577 R578 Y579	F571-Q575 HydrophobicContact CD1-CG 4.42Å; F571-Q575 HydrophobicContact CE1-CG 4.34Å; F571-Q575 VanDerWaalsContact CE1-NE2 3.27Å; F571-Q575 WeakPolarHBondContact O-CG 3.34Å; F571-Q575 PolarHBondContact O-N 3.06Å; A572-Q575 PolarHBondContact O-N 2.78Å; Q575-Q577 PolarHBondContact O-N 2.92Å; Q575-R578 CarbonylContact O-C 3.54Å; Q575-R578 PolarHBondContact O-N 2.83Å; Q575-R578 VanDerWaalsContact O-N 3.14Å; Q575-Y579 HydrophobicContact CB-CD2 4.38Å; Q575-Y579 HydrophobicContact CB-CE2 4.46Å; Q575-Y579 WeakPolarHBondContact O-CD2 3.35Å; Q575-Y579 PolarHBondContact O-N 2.92Å
576	Q	68.5	Low	63.1	Low	130 Å²	130	119.3 Å²	119.3	61%	0.607	63%	0.632	S	S	*	*	H	α-helix	trans	-58.1	-49.4	175.6	-74.9	175.4	-5.5	0	0	111	A572 Q573 R578 Y579 S580	A572-Q576 WeakPolarHBondContact O-CB 3.19Å; A572-Q576 VanDerWaalsContact O-CG 3.3Å; A572-Q576 WeakPolarHBondContact O-CG 3.22Å; A572-Q576 PolarHBondContact O-N 2.66Å; Q573-Q576 PolarHBondContact O-N 2.9Å; Q576-R578 VanDerWaalsContact C-N 3.29Å; Q576-R578 PolarHBondContact O-N 2.75Å; Q576-Y579 CarbonylContact O-C 3.58Å; Q576-Y579 PolarHBondContact O-N 3.21Å; Q576-S580 WeakPolarHBondContact O-CA 3.2Å; Q576-S580 WeakPolarHBondContact O-CB 3.43Å; Q576-S580 PolarHBondContact O-N 2.89Å; Q576-S580 PolarHBondContact O-OG 3.38Å
577	Q	64	Low	61.2	Low	135 Å²	135	117.4 Å²	117.4	63%	0.631	64%	0.637	S	S	*	*	H	α-helix	trans	-63.2	-29.3	176.5	-71.4	173.5	20.2	0	0	113.6	Q573 Q575 G581	Q573-Q577 VanDerWaalsContact O-CB 3.28Å; Q573-Q577 WeakPolarHBondContact O-CB 3.22Å; Q573-Q577 VanDerWaalsContact O-CG 3.22Å; Q573-Q577 WeakPolarHBondContact O-CG 3.49Å; Q573-Q577 PolarHBondContact O-N 2.84Å; Q575-Q577 PolarHBondContact O-N 2.92Å; Q577-G581 PolarHBondContact O-N 3.3Å
578	R	53.4	Low	59.5	Low	200 Å²	200	118.4 Å²	118.4	76%	0.755	64%	0.643	S	S	*	*	H	α-helix	trans	-74	-22.9	170.8	-76.7	178.6	-173.8	-136.8	5.8	113.8	T574 Q575 Q576	T574-R578 WeakPolarHBondContact O-CB 3.37Å; T574-R578 VanDerWaalsContact O-CG 3.24Å; T574-R578 WeakPolarHBondContact O-CG 3.35Å; T574-R578 PolarHBondContact O-N 3.21Å; Q575-R578 CarbonylContact O-C 3.54Å; Q575-R578 PolarHBondContact O-N 2.83Å; Q575-R578 VanDerWaalsContact O-N 3.14Å; Q576-R578 VanDerWaalsContact C-N 3.29Å; Q576-R578 PolarHBondContact O-N 2.75Å
579	Y	49.9	Very low	57.7	Low	192 Å²	192	121.6 Å²	121.6	75%	0.753	66%	0.659	S	S	*	*	H	α-helix	trans	-111.6	2.2	-180	-64.2	-58	0	0	0	114	Q575 Q576	Q575-Y579 HydrophobicContact CB-CD2 4.38Å; Q575-Y579 HydrophobicContact CB-CE2 4.46Å; Q575-Y579 WeakPolarHBondContact O-CD2 3.35Å; Q575-Y579 PolarHBondContact O-N 2.92Å; Q576-Y579 CarbonylContact O-C 3.58Å; Q576-Y579 PolarHBondContact O-N 3.21Å
580	S	53.8	Low	55.6	Low	92 Å²	92	121.7 Å²	121.7	64%	0.643	66%	0.664	S	S	*	*	S	Bend	trans	-124.8	9.2	179.2	84.5	0	0	0	0	113.4	Q576	Q576-S580 WeakPolarHBondContact O-CA 3.2Å; Q576-S580 WeakPolarHBondContact O-CB 3.43Å; Q576-S580 PolarHBondContact O-N 2.89Å; Q576-S580 PolarHBondContact O-OG 3.38Å
581	G	44	Very low	53.8	Low	53 Å²	53	120.9 Å²	120.9	55%	0.546	67%	0.672	S	S	.	*	S	Bend	trans	-88	140	164.7	0	0	0	0	0	110.3	Q577 Q583	Q577-G581 PolarHBondContact O-N 3.3Å; G581-Q583 PolarHBondContact O-N 3.06Å
582	E	43.3	Very low	51.9	Low	198 Å²	198	122.6 Å²	122.6	93%	0.925	69%	0.686	S	S	*	*	P	Polyproline II helix	trans	-60.3	127.7	-178	-71	170.5	92.5	0	0	112.1	P584	E582-P584 WeakPolarHBondContact O-CD 3.48Å
583	Q	41.2	Very low	50.4	Low	174 Å²	174	128.3 Å²	128.3	81%	0.813	71%	0.71	S	S	*	*	P	Polyproline II helix	trans	-73.6	124.5	-174.2	-171.3	171.2	-5.6	0	0	111	G581 A585	G581-Q583 PolarHBondContact O-N 3.06Å; Q583-A585 PolarHBondContact O-N 3.23Å
584	P	43.6	Very low	48.7	Very low	114 Å²	114	128.3 Å²	128.3	74%	0.74	71%	0.714	S	S	*	*	P	Polyproline II helix	trans	-62.5	127.7	-178	-24.8	34.8	0	0	0	112.9	E582 G586	E582-P584 WeakPolarHBondContact O-CD 3.48Å; P584-G586 PolarHBondContact O-N 3Å
585	A	35.9	Very low	46.8	Very low	113 Å²	113	133.4 Å²	133.4	93%	0.934	73%	0.731	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.3	113.7	176.8	0	0	0	0	0	111	Q583	Q583-A585 PolarHBondContact O-N 3.23Å
586	G	47.4	Very low	45.3	Very low	77 Å²	77	138 Å²	138	79%	0.794	75%	0.752	S	S	*	*	T	Hydrogen-bonded Turn	trans	161	-16.3	177.9	0	0	0	0	0	116.2	P584	P584-G586 PolarHBondContact O-N 3Å
587	A	38.7	Very low	43.8	Very low	81 Å²	81	140.8 Å²	140.8	67%	0.669	76%	0.763	S	S	*	*			trans	-89.8	112.9	175.9	0	0	0	0	0	111.5
588	N	45.5	Very low	42.6	Very low	137 Å²	137	139.2 Å²	139.2	73%	0.733	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-69.8	148.8	169	-71.8	-29.9	0	0	0	110.6	F590	N588-F590 PolarHBondContact O-N 3.43Å
589	P	41.9	Very low	41.7	Very low	126 Å²	126	136 Å²	136	82%	0.818	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-70.9	123	174.9	29.4	-33.4	0	0	0	110.4
590	F	38	Very low	41.3	Very low	179 Å²	179	135.3 Å²	135.3	79%	0.785	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-75.6	126.4	172.2	-81.7	-94.3	0	0	0	110.4	N588	N588-F590 PolarHBondContact O-N 3.43Å
591	S	41.9	Very low	40.6	Very low	99 Å²	99	141 Å²	141	69%	0.692	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-75.7	155.4	169.2	46.3	0	0	0	0	111.3	D593	S591-D593 PolarHBondContact O-N 3Å; S591-D593 VanDerWaalsContact O-N 3.16Å
592	L	37.6	Very low	40.4	Very low	167 Å²	167	143 Å²	143	87%	0.874	80%	0.802	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.7	112.4	164	-79.2	77	0	0	0	108.7
593	D	44.1	Very low	40.2	Very low	165 Å²	165	141.5 Å²	141.5	88%	0.882	80%	0.8	S	S	*	*	T	Hydrogen-bonded Turn	trans	179.7	-13.3	156.1	-98.1	-24.6	0	0	0	111.5	S591	S591-D593 PolarHBondContact O-N 3Å; S591-D593 VanDerWaalsContact O-N 3.16Å
594	D	41.4	Very low	40.1	Very low	111 Å²	111	141.8 Å²	141.8	59%	0.594	81%	0.805	S	S	*	*			trans	-97.2	123.6	-169.2	-120	4.1	0	0	0	114.9
595	F	37.6	Very low	40	Very low	168 Å²	168	144 Å²	144	74%	0.737	81%	0.811	S	S	*	*			trans	70.1	104.3	161.3	-68.4	-76.6	0	0	0	122.2
596	E	39.8	Very low	40.2	Very low	187 Å²	187	146.3 Å²	146.3	87%	0.874	81%	0.808	S	S	*	*			trans	-44.4	132.6	136	-54.9	173.2	98.2	0	0	111.7
597	F	36.9	Very low	40	Very low	189 Å²	189	146 Å²	146	83%	0.829	81%	0.805	S	S	*	*			trans	-146	102.7	158	-140.3	-91.9	0	0	0	112.4	P599	F597-P599 WeakPolarHBondContact O-CD 3.07Å
598	S	38	Very low	40	Very low	101 Å²	101	148 Å²	148	71%	0.706	81%	0.811	S	S	*	*			trans	-84	119.9	175.6	-75.8	0	0	0	0	111	M600	S598-M600 PolarHBondContact O-N 2.95Å
599	P	35.9	Very low	40	Very low	132 Å²	132	151 Å²	151	86%	0.857	82%	0.82	S	S	*	*	S	Bend	trans	-79.5	60.9	-177.7	34	-36.9	0	0	0	112	F597	F597-P599 WeakPolarHBondContact O-CD 3.07Å
600	M	41.7	Very low	40	Very low	178 Å²	178	154.2 Å²	154.2	88%	0.877	82%	0.824	S	S	*	*			trans	-149.8	46	-174.6	-152.8	-171.5	-61.1	0	0	114.3	S598	S598-M600 PolarHBondContact O-N 2.95Å
601	K	37.8	Very low	40.1	Very low	211 Å²	211	151 Å²	151	92%	0.917	82%	0.821	S	S	*	*			trans	-153	33.8	177.8	-139.8	172	-174	176.5	0	117
602	A	39.8	Very low	39.9	Very low	95 Å²	95	154.4 Å²	154.4	79%	0.785	83%	0.831	S	S	*	*	S	Bend	trans	-125.3	1.9	-172.5	0	0	0	0	0	116.6
603	L	38.6	Very low	39.6	Very low	168 Å²	168	155.2 Å²	155.2	88%	0.88	83%	0.828	S	S	*	*			trans	-138.1	92.6	173.6	-80.9	101.7	0	0	0	111
604	L	41	Very low	39.4	Very low	179 Å²	179	153.9 Å²	153.9	94%	0.937	83%	0.825	S	S	*	*			trans	-159.8	89	162.5	-160.8	82.4	0	0	0	110.1
605	D	40.4	Very low	39.1	Very low	160 Å²	160	154 Å²	154	86%	0.856	83%	0.832	S	S	*	*			trans	-153.8	163.8	159.5	-147.3	-21.9	0	0	0	109.6
606	D	41	Very low	39.1	Very low	163 Å²	163	154.2 Å²	154.2	87%	0.872	84%	0.84	S	S	*	*			trans	-89.6	159.6	-150.8	-81.7	-39.7	0	0	0	118
607	G	42.7	Very low	38.9	Very low	71 Å²	71	151.4 Å²	151.4	73%	0.732	84%	0.835	S	S	*	*			trans	117.9	114.4	148.2	0	0	0	0	0	117.7
608	P	38.8	Very low	39.3	Very low	122 Å²	122	151.3 Å²	151.3	79%	0.792	84%	0.837	S	S	*	*			trans	-99.1	143.6	177.6	36.4	-32.2	0	0	0	114.3
609	H	44.7	Very low	39.3	Very low	201 Å²	201	151.7 Å²	151.7	93%	0.931	84%	0.837	S	S	*	*			trans	-140.8	153.4	160.2	-84.6	-64.5	0	0	0	111.3
610	E	43.2	Very low	39.1	Very low	192 Å²	192	151.8 Å²	151.8	90%	0.897	84%	0.835	S	S	*	*			trans	-86.6	156	-162.6	-69.1	-178.3	121.3	0	0	115
611	P	39.3	Very low	38.9	Very low	112 Å²	112	152.8 Å²	152.8	73%	0.727	84%	0.837	S	S	*	*			trans	-89.2	162.2	-174.2	36.6	-37.1	0	0	0	113.9
612	L	38.4	Very low	38.8	Very low	170 Å²	170	151.4 Å²	151.4	89%	0.89	83%	0.834	S	S	*	*			trans	-138.2	117.4	170.9	-129.9	162.5	0	0	0	110.6
613	F	30.3	Very low	38.6	Very low	185 Å²	185	151.9 Å²	151.9	81%	0.811	83%	0.829	S	S	*	*			trans	-85.4	138.7	177.3	-88.4	-104	0	0	0	111.7
614	T	39.3	Very low	38.5	Very low	136 Å²	136	153.4 Å²	153.4	83%	0.834	83%	0.832	S	S	*	*			trans	-162.9	127.8	137.8	18.9	0	0	0	0	110.8
615	P	35.1	Very low	38.3	Very low	114 Å²	114	153.6 Å²	153.6	74%	0.74	83%	0.828	S	S	*	*			trans	-95	148.7	172.8	35.9	-32.3	0	0	0	112.2
616	I	38.4	Very low	38.3	Very low	173 Å²	173	151.6 Å²	151.6	89%	0.887	82%	0.824	S	S	*	*			trans	-133.7	143.4	164.6	-62.6	-178.2	0	0	0	108.2
617	V	36.8	Very low	38.1	Very low	127 Å²	127	150.6 Å²	150.6	77%	0.77	82%	0.823	S	S	*	*			trans	-121.2	138.2	-178.2	176	0	0	0	0	108.2
618	E	43.9	Very low	37.9	Very low	188 Å²	188	151.3 Å²	151.3	88%	0.879	82%	0.822	S	S	*	*			trans	179.9	166.1	142	-100	-173.3	174.4	0	0	111
619	P	37.8	Very low	37.9	Very low	108 Å²	108	151.7 Å²	151.7	70%	0.701	83%	0.825	S	S	*	*				-129.1	167.7	-129.3	43.9	-30.7	0	0	0	118.3
620	V	33.2	Very low	37.3	Very low	134 Å²	134	150.3 Å²	150.3	81%	0.812	82%	0.818	S	S	*	*			trans	46.2	115.1	146.9	177.3	0	0	0	0	119.3
621	Q	37.5	Very low	37.1	Very low	199 Å²	199	149.8 Å²	149.8	93%	0.93	82%	0.816	S	S	*	*			trans	-151.7	160.6	140.2	-112.5	166.2	40	0	0	111
622	Q	34.2	Very low	36.7	Very low	182 Å²	182	152 Å²	152	85%	0.85	82%	0.816	S	S	*	*			trans	-139	179.6	-165.1	-133.7	-165.3	18.1	0	0	110.9
623	P	36	Very low	36.7	Very low	105 Å²	105	153 Å²	153	68%	0.682	81%	0.81	S	S	*	*				-116.5	163.6	-105.4	40.3	-27.6	0	0	0	115.3
624	Q	36.3	Very low	37	Very low	201 Å²	201	152.9 Å²	152.9	94%	0.939	81%	0.812	S	S	*	*			trans	-144.1	142.1	162.4	-68.3	-167.8	-14.9	0	0	112.4
625	Q	36.3	Very low	36.7	Very low	182 Å²	182	155.3 Å²	155.3	85%	0.85	81%	0.814	S	S	*	*			trans	-97.3	165.7	165.6	-60.2	179.1	-20.6	0	0	109.5
626	P	40.3	Very low	36.9	Very low	119 Å²	119	155.8 Å²	155.8	77%	0.773	82%	0.817	S	S	*	*				-153.5	146.3	94	37.4	-18.7	0	0	0	118.1
627	V	37.9	Very low	36.8	Very low	142 Å²	142	155.6 Å²	155.6	86%	0.861	81%	0.812	S	S	*	*			trans	45.5	134.8	131.4	-170.8	0	0	0	0	121.6
628	A	37.8	Very low	36.8	Very low	85 Å²	85	157.5 Å²	157.5	70%	0.702	81%	0.813	S	S	*	*			trans	-110.7	177.6	173.1	0	0	0	0	0	113.2
629	P	39.2	Very low	36.7	Very low	131 Å²	131	154.3 Å²	154.3	85%	0.851	81%	0.808	S	S	*	*			trans	-125.2	157.2	156.2	36.6	-25	0	0	0	114.5
630	Q	33.2	Very low	36.8	Very low	171 Å²	171	155.3 Å²	155.3	80%	0.799	81%	0.812	S	S	*	*			trans	-104.8	168.3	-177.6	-59.4	170.8	-23.5	0	0	112.7
631	Q	37.6	Very low	37.5	Very low	182 Å²	182	154.2 Å²	154.2	85%	0.85	81%	0.808	S	S	*	*			trans	-140.7	154.7	146.6	-72.5	-159.9	-2.7	0	0	111.3
632	Q	32.1	Very low	37.8	Very low	157 Å²	157	150.6 Å²	150.6	73%	0.734	80%	0.801	S	S	*	*			trans	-129	143	-172.1	-49.5	161.6	-63.8	0	0	110.9
633	Y	36.9	Very low	38	Very low	193 Å²	193	150.1 Å²	150.1	76%	0.757	80%	0.799	S	S	*	*			trans	-153.6	108.7	153.6	-76.6	-68.7	0	0	0	108
634	Q	37.9	Very low	38.2	Very low	181 Å²	181	150.1 Å²	150.1	85%	0.846	80%	0.799	S	S	*	*				82.1	131.2	88.4	-77.5	-177.5	-2.8	0	0	115
635	Q	31.7	Very low	38.2	Very low	187 Å²	187	148.4 Å²	148.4	87%	0.874	79%	0.791	S	S	*	*			trans	-143.9	130.1	-166.7	-178.5	-169.7	68.3	0	0	111.4
636	P	40.6	Very low	38.2	Very low	125 Å²	125	149.5 Å²	149.5	81%	0.812	79%	0.789	S	S	*	*			trans	-95.6	177.4	169.3	-8.4	28.8	0	0	0	114.4
637	Q	36	Very low	38.1	Very low	168 Å²	168	152.1 Å²	152.1	79%	0.785	79%	0.791	S	S	*	*			trans	-111.5	158.2	-158.2	-61.2	171.1	-35.4	0	0	116.2
638	Q	36.6	Very low	37.9	Very low	168 Å²	168	153.8 Å²	153.8	79%	0.785	79%	0.789	S	S	*	*			trans	69.9	164.1	148.9	-79.7	173.9	14.4	0	0	118.3
639	P	42.4	Very low	37.9	Very low	120 Å²	120	155.8 Å²	155.8	78%	0.779	80%	0.795	S	S	*	*			cis	-122.9	-175.7	12	41.6	-26.4	0	0	0	116.6
640	V	40	Very low	37.9	Very low	129 Å²	129	157.4 Å²	157.4	78%	0.782	79%	0.792	S	S	*	*			trans	-110.8	132.3	-165.6	173	0	0	0	0	113.1
641	P	47.7	Very low	37.9	Very low	112 Å²	112	158.3 Å²	158.3	73%	0.727	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-84	153.1	159.5	-9.8	28.4	0	0	0	112.4
642	P	43.7	Very low	38.1	Very low	122 Å²	122	154.9 Å²	154.9	79%	0.792	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-82	151	-160.7	31.9	-37.1	0	0	0	116.1
643	Q	37.3	Very low	38.4	Very low	173 Å²	173	154.4 Å²	154.4	81%	0.808	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-72.1	137.2	165.9	-69.7	-179.8	-23.5	0	0	111.8
644	P	41.3	Very low	38.6	Very low	105 Å²	105	148.7 Å²	148.7	68%	0.682	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-77.9	119	157.7	-8.1	25.7	0	0	0	110.1	Y646	P644-Y646 HydrophobicContact CB-CD2 4.1Å; P644-Y646 HydrophobicContact CB-CE2 3.78Å
645	Q	36.2	Very low	38.7	Very low	165 Å²	165	145.7 Å²	145.7	77%	0.771	79%	0.785	S	S	*	*			trans	-86	115	167.7	-74.1	-175.3	-31.8	0	0	110.4
646	Y	36.1	Very low	38.7	Very low	205 Å²	205	144.7 Å²	144.7	80%	0.804	78%	0.781	S	S	*	*			trans	-134	90.5	161	-60.9	-73.1	0	0	0	106.3	P644	P644-Y646 HydrophobicContact CB-CD2 4.1Å; P644-Y646 HydrophobicContact CB-CE2 3.78Å
647	Q	38.9	Very low	38.6	Very low	174 Å²	174	141.6 Å²	141.6	81%	0.813	76%	0.761	S	S	*	*				57.7	119.9	90.3	-68.9	-167.7	-13.9	0	0	113.2
648	Q	33.8	Very low	38.4	Very low	176 Å²	176	140.8 Å²	140.8	82%	0.822	76%	0.757	S	S	*	*			trans	-58.5	137.9	167.4	-68	172.8	-40.1	0	0	109.9	Q650	Q648-Q650 VanDerWaalsContact C-N 3.31Å; Q648-Q650 PolarHBondContact O-N 3.17Å
649	P	36.9	Very low	38.3	Very low	127 Å²	127	138.3 Å²	138.3	83%	0.825	74%	0.741	S	S	*	*			trans	-65.8	93.7	157.8	-15.8	30.8	0	0	0	108.9
650	Q	39.1	Very low	38	Very low	166 Å²	166	139.9 Å²	139.9	78%	0.776	74%	0.738	S	S	*	*			trans	-58.2	145.8	154.1	-72.3	-175	-23.6	0	0	108.2	Q648 P652	Q648-Q650 VanDerWaalsContact C-N 3.31Å; Q648-Q650 PolarHBondContact O-N 3.17Å; Q650-P652 WeakPolarHBondContact O-CD 3.15Å
651	Q	34	Very low	37.6	Very low	189 Å²	189	141.6 Å²	141.6	88%	0.883	74%	0.738	S	S	*	*			trans	-51.3	110	178.1	-68.2	170.3	-47.9	0	0	110.8	V653	Q651-V653 PolarHBondContact O-N 3.28Å
652	P	41.4	Very low	37	Very low	110 Å²	110	142.1 Å²	142.1	71%	0.714	74%	0.741	S	S	*	*			trans	-78.5	113.4	171.6	-5.1	24.6	0	0	0	106.7	Q650 A654	Q650-P652 WeakPolarHBondContact O-CD 3.15Å; P652-A654 PolarHBondContact O-N 3.39Å
653	V	39	Very low	36.5	Very low	147 Å²	147	144.7 Å²	144.7	89%	0.891	74%	0.743	S	S	*	*			trans	-71.7	78.7	162.3	-178.4	0	0	0	0	107	Q651	Q651-V653 PolarHBondContact O-N 3.28Å
654	A	40.7	Very low	36.5	Very low	73 Å²	73	144.8 Å²	144.8	60%	0.603	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-67.5	147	170.3	0	0	0	0	0	109.1	P652	P652-A654 PolarHBondContact O-N 3.39Å
655	P	39.2	Very low	36.4	Very low	118 Å²	118	145.6 Å²	145.6	77%	0.766	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-69.2	158.2	-167.1	28.8	-36.1	0	0	0	112.4
656	Q	32.4	Very low	36.3	Very low	167 Å²	167	145 Å²	145	78%	0.78	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-49.8	134.6	158.5	-70.1	179	-30.2	0	0	108.9	Q658	Q656-Q658 PolarHBondContact O-N 2.98Å
657	P	36.9	Very low	36.6	Very low	59 Å²	59	139 Å²	139	38%	0.383	75%	0.749	S	S	.	*			trans	-63.6	107.4	156.4	28.3	-31.1	0	0	0	106.8	Y659	P657-Y659 HydrophobicContact CB-CD2 3.71Å; P657-Y659 HydrophobicContact CB-CE2 3.4Å; P657-Y659 VanDerWaalsContact CB-CE2 3.4Å; P657-Y659 HydrophobicContact CG-CD2 4Å; P657-Y659 HydrophobicContact CG-CE2 3.78Å; P657-Y659 PolarHBondContact O-N 3.33Å
658	Q	33.5	Very low	36.6	Very low	151 Å²	151	136.6 Å²	136.6	71%	0.706	75%	0.748	S	S	*	*			trans	-67.3	82.1	158.2	-79	-165.9	-16.2	0	0	107.2	Q656 Q660	Q656-Q658 PolarHBondContact O-N 2.98Å; Q658-Q660 HydrophobicContact CB-CG 4.44Å; Q658-Q660 PolarHBondContact O-N 3.29Å
659	Y	34.2	Very low	36.5	Very low	116 Å²	116	136.6 Å²	136.6	46%	0.455	75%	0.748	S	S	.	*			trans	-65.6	77.2	155	-75.9	-62.8	0	0	0	107.7	E319 Q320 P657 Q661	E319-Y659 HydrophobicContact CB-CE2 3.94Å; E319-Y659 WeakPolarHBondContact CB-OH 3.22Å; E319-Y659 PolarHBondContact OE2-OH 2.93Å; Q320-Y659 HydrophobicContact CB-CD2 4.47Å; Q320-Y659 HydrophobicContact CB-CE2 4.17Å; P657-Y659 HydrophobicContact CB-CD2 3.71Å; P657-Y659 HydrophobicContact CB-CE2 3.4Å; P657-Y659 VanDerWaalsContact CB-CE2 3.4Å; P657-Y659 HydrophobicContact CG-CD2 4Å; P657-Y659 HydrophobicContact CG-CE2 3.78Å; P657-Y659 PolarHBondContact O-N 3.33Å; Y659-Q661 PolarHBondContact O-N 2.9Å
660	Q	36	Very low	36.6	Very low	153 Å²	153	138.8 Å²	138.8	72%	0.715	75%	0.747	S	S	*	*			trans	-47.9	133.2	157.2	-64.3	-177.9	2.1	0	0	106.4	Q658	Q658-Q660 HydrophobicContact CB-CG 4.44Å; Q658-Q660 PolarHBondContact O-N 3.29Å
661	Q	30.8	Very low	36.4	Very low	166 Å²	166	137.3 Å²	137.3	78%	0.776	74%	0.74	S	S	*	*			trans	-46.8	138.5	-179.7	-65.6	171.2	-29.9	0	0	109.8	Y659 Q663	Y659-Q661 PolarHBondContact O-N 2.9Å; Q661-Q663 VanDerWaalsContact C-N 3.27Å; Q661-Q663 PolarHBondContact O-N 3.35Å
662	P	35.6	Very low	36.5	Very low	123 Å²	123	136.8 Å²	136.8	80%	0.799	73%	0.732	S	S	*	*			trans	-54.7	101.1	157.6	-20.9	32.7	0	0	0	107	Q664	P662-Q664 VanDerWaalsContact C-N 3.32Å; P662-Q664 PolarHBondContact O-N 3.42Å
663	Q	34.3	Very low	36.5	Very low	176 Å²	176	139.9 Å²	139.9	82%	0.822	74%	0.736	S	S	*	*			trans	-64.8	100.1	177	-75.3	-170.4	-9.8	0	0	106.5	Q661	Q661-Q663 VanDerWaalsContact C-N 3.27Å; Q661-Q663 PolarHBondContact O-N 3.35Å
664	Q	35.4	Very low	36.5	Very low	174 Å²	174	140 Å²	140	81%	0.813	73%	0.727	S	S	*	*			trans	-53.1	129	174.6	-74.5	-173.7	-22.5	0	0	107.9	P662 V666	P662-Q664 VanDerWaalsContact C-N 3.32Å; P662-Q664 PolarHBondContact O-N 3.42Å; Q664-V666 PolarHBondContact O-N 3.32Å
665	P	40.3	Very low	36.7	Very low	122 Å²	122	142.3 Å²	142.3	79%	0.792	74%	0.736	S	S	*	*			trans	-54.9	116.5	-177.6	-28.7	35.7	0	0	0	110.9	A667	P665-A667 PolarHBondContact O-N 3.11Å
666	V	34	Very low	36.8	Very low	152 Å²	152	143 Å²	143	92%	0.921	73%	0.729	S	S	*	*			trans	-71.9	85.8	175.4	-178.9	0	0	0	0	108.3	Q664	Q664-V666 PolarHBondContact O-N 3.32Å
667	A	43.1	Very low	37.7	Very low	81 Å²	81	142.6 Å²	142.6	67%	0.669	73%	0.727	S	S	*	*	P	Polyproline II helix	trans	-101.3	148.9	172.8	0	0	0	0	0	110.2	P665	P665-A667 PolarHBondContact O-N 3.11Å
668	P	38.5	Very low	38.3	Very low	122 Å²	122	144.5 Å²	144.5	79%	0.792	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-84.7	154.6	-138.8	-19.2	34.9	0	0	0	116.8	Q670	P668-Q670 PolarHBondContact O-N 2.92Å
669	Q	31.5	Very low	38.9	Very low	177 Å²	177	144 Å²	144	83%	0.827	75%	0.746	S	S	*	*	P	Polyproline II helix	trans	-69.1	121.1	166.9	-65.3	178.8	-7.9	0	0	111.9
670	Q	38	Very low	39.9	Very low	173 Å²	173	142.6 Å²	142.6	81%	0.808	76%	0.759	S	S	*	*			trans	-142.2	112.9	149.6	-60	-173.9	6.7	0	0	104.5	P668	P668-Q670 PolarHBondContact O-N 2.92Å
671	Q	35	Very low	40.3	Very low	134 Å²	134	140.5 Å²	140.5	63%	0.626	76%	0.759	S	S	*	*				59.6	140.8	53.3	-66.1	-156.5	0.6	0	0	114.8
672	Y	37.1	Very low	40.7	Very low	179 Å²	179	141.7 Å²	141.7	70%	0.702	76%	0.764	S	S	*	*			trans	73.5	136.1	-179.7	-39.9	-63.5	0	0	0	115.3
673	Q	41.2	Very low	41	Very low	175 Å²	175	144.6 Å²	144.6	82%	0.818	77%	0.767	S	S	*	*			cis	-161.4	150.4	-12.3	-122.6	154.4	-2.4	0	0	110.6
674	Q	39.6	Very low	41.1	Very low	150 Å²	150	145.6 Å²	145.6	70%	0.701	77%	0.771	S	S	*	*			trans	-87.5	154	169.4	-76.9	-167.8	-4	0	0	111.5
675	P	43.2	Very low	41.3	Very low	120 Å²	120	148 Å²	148	78%	0.779	78%	0.775	S	S	*	*				-137	149.1	90.4	38.6	-24.9	0	0	0	112.6
676	Q	43	Very low	41.3	Very low	133 Å²	133	151.3 Å²	151.3	62%	0.621	78%	0.78	S	S	*	*				55.6	131.9	63.4	-59.3	-165.2	35.7	0	0	112.6
677	Q	50.5	Low	41.4	Very low	159 Å²	159	152.4 Å²	152.4	74%	0.743	78%	0.775	S	S	*	*			cis	-167.6	-167.5	10.9	-116.9	178.5	43.7	0	0	106.9
678	P	49.5	Very low	41.6	Very low	98 Å²	98	154.5 Å²	154.5	64%	0.636	78%	0.782	S	S	*	*			cis	-135	157.6	-28.3	34	-14.7	0	0	0	116.4
679	V	46.9	Very low	41.6	Very low	140 Å²	140	157.7 Å²	157.7	85%	0.848	79%	0.786	S	S	*	*			trans	30.9	126.1	134.9	-162.2	0	0	0	0	119.6
680	A	53.8	Low	41.9	Very low	87 Å²	87	157.5 Å²	157.5	72%	0.719	79%	0.785	S	S	*	*				-179.3	175.6	77.5	0	0	0	0	0	112.7
681	P	45	Very low	42.3	Very low	110 Å²	110	155.3 Å²	155.3	71%	0.714	79%	0.786	S	S	*	*				-133.7	143.1	-55.1	37.6	-21.7	0	0	0	115.3
682	Q	39.2	Very low	42.6	Very low	190 Å²	190	155.2 Å²	155.2	89%	0.888	79%	0.794	S	S	*	*			trans	37.3	118	146.2	-61.9	-179.8	-9.9	0	0	122.2
683	Q	42	Very low	42.8	Very low	184 Å²	184	150.4 Å²	150.4	86%	0.86	79%	0.791	S	S	*	*				-122.6	161.3	129.4	-74.1	-166.7	-1.8	0	0	109.4
684	Q	35.6	Very low	43	Very low	197 Å²	197	146.8 Å²	146.8	92%	0.921	78%	0.783	S	S	*	*			trans	-78.3	122.4	-168.7	-68.3	169.2	-34.2	0	0	112.4
685	Y	40.1	Very low	43	Very low	224 Å²	224	147.6 Å²	147.6	88%	0.878	79%	0.787	S	S	*	*			trans	-106.1	125.1	161.1	-76.2	-90	0	0	0	108.9
686	Q	40.1	Very low	43	Very low	193 Å²	193	147.3 Å²	147.3	90%	0.902	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-70.4	136.9	172.2	-73.6	156	-41.4	0	0	109.2
687	Q	36.5	Very low	43.1	Very low	175 Å²	175	146.9 Å²	146.9	82%	0.818	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-63.7	139.6	175.8	-70.7	174.9	-36.9	0	0	109.7	Q689	Q687-Q689 PolarHBondContact O-N 3.08Å; Q687-Q689 VanDerWaalsContact O-N 3.13Å
688	P	46.7	Very low	42.8	Very low	125 Å²	125	147 Å²	147	81%	0.812	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-61.5	118.2	160.9	27.9	-31.8	0	0	0	107.3	Q690	P688-Q690 PolarHBondContact O-N 3.09Å
689	Q	40	Very low	43	Very low	188 Å²	188	145.5 Å²	145.5	88%	0.879	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-60	124.8	172.7	-73	177.9	-36.1	0	0	107.9	Q687	Q687-Q689 PolarHBondContact O-N 3.08Å; Q687-Q689 VanDerWaalsContact O-N 3.13Å
690	Q	37.6	Very low	43.6	Very low	173 Å²	173	147.7 Å²	147.7	81%	0.808	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-57.4	140.7	170.3	-69.7	175.4	-51.9	0	0	108.3	P688 V692	P688-Q690 PolarHBondContact O-N 3.09Å; Q690-V692 PolarHBondContact O-N 2.95Å
691	P	45.8	Very low	44	Very low	128 Å²	128	147.8 Å²	147.8	83%	0.831	77%	0.772	S	S	*	*			trans	-56.8	111	164.6	-19.2	31.6	0	0	0	107.3	A693	P691-A693 PolarHBondContact O-N 2.83Å
692	V	42.3	Very low	44.9	Very low	131 Å²	131	147.8 Å²	147.8	79%	0.794	76%	0.762	S	S	*	*			trans	-63.7	106.3	171.7	177	0	0	0	0	105.3	Q690 P694	Q690-V692 PolarHBondContact O-N 2.95Å; V692-P694 VanDerWaalsContact O-N 3.17Å
693	A	39.8	Very low	46	Very low	78 Å²	78	143.4 Å²	143.4	65%	0.645	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-52.8	125.3	170.5	0	0	0	0	0	106.6	P691 Q695	P691-A693 PolarHBondContact O-N 2.83Å; A693-Q695 PolarHBondContact O-N 2.79Å
694	P	45.4	Very low	46.9	Very low	99 Å²	99	141.9 Å²	141.9	64%	0.643	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-57.6	121.4	-176.8	23.9	-32.9	0	0	0	107.3	V692	V692-P694 VanDerWaalsContact O-N 3.17Å
695	Q	39.8	Very low	48.2	Very low	167 Å²	167	138.3 Å²	138.3	78%	0.78	73%	0.733	S	S	*	*	P	Polyproline II helix	trans	-53.8	134.4	171.7	-74	-177.6	-34.8	0	0	107.3	A693 Q697	A693-Q695 PolarHBondContact O-N 2.79Å; Q695-Q697 PolarHBondContact O-N 2.83Å
696	P	44.2	Very low	48.8	Very low	114 Å²	114	130 Å²	130	74%	0.74	70%	0.703	S	S	*	*			trans	-58.7	111.3	166	26.7	-31.6	0	0	0	105.9
697	Q	45	Very low	49.5	Very low	124 Å²	124	129.4 Å²	129.4	58%	0.579	69%	0.693	S	S	*	*			trans	-66.5	134.2	167.2	-64.6	174.2	-77.3	0	0	105.6	Q695 T699	Q695-Q697 PolarHBondContact O-N 2.83Å; Q697-T699 PolarHBondContact O-N 2.69Å
698	D	43	Very low	50.1	Low	163 Å²	163	127 Å²	127	87%	0.872	69%	0.686	S	S	*	*			trans	-72.5	47	-179.7	-67.9	-59.5	0	0	0	112.4	L700	D698-L700 PolarHBondContact O-N 2.88Å
699	T	54.2	Low	50.3	Low	66 Å²	66	123.4 Å²	123.4	41%	0.405	67%	0.671	S	S	.	*			trans	-69.3	120.3	162.6	-43.6	0	0	0	0	107.1	Q697 L701	Q697-T699 PolarHBondContact O-N 2.69Å; T699-L701 HydrophobicContact CG2-CB 3.89Å; T699-L701 HydrophobicContact CG2-CD1 4.04Å; T699-L701 HydrophobicContact CG2-CG 4.02Å; T699-L701 PolarHBondContact O-N 2.99Å
700	L	59.4	Low	50.6	Low	185 Å²	185	118.1 Å²	118.1	97%	0.969	65%	0.648	S	S	*	*	S	Bend	trans	-64.4	-3.3	177.7	-64.8	171.1	0	0	0	113.8	D698	D698-L700 PolarHBondContact O-N 2.88Å
701	L	62	Low	51	Low	89 Å²	89	114.9 Å²	114.9	47%	0.466	65%	0.645	S	S	.	*	S	Bend	trans	-82.6	118.8	173.7	-60.8	173	0	0	0	110.2	T699	T699-L701 HydrophobicContact CG2-CB 3.89Å; T699-L701 HydrophobicContact CG2-CD1 4.04Å; T699-L701 HydrophobicContact CG2-CG 4.02Å; T699-L701 PolarHBondContact O-N 2.99Å
702	H	64.3	Low	51.2	Low	110 Å²	110	116.8 Å²	116.8	51%	0.509	64%	0.636	S	S	.	*			trans	-50.2	144.6	173.4	-179.8	-104.9	0	0	0	111.5	L704 L705 M706	H702-L704 PolarHBondContact ND1-N 3.18Å; H702-L704 PolarHBondContact O-N 2.99Å; H702-L705 HydrophobicContact CB-CB 4.3Å; H702-L705 HydrophobicContact CB-CD1 3.97Å; H702-L705 HydrophobicContact CB-CG 4.05Å; H702-L705 CarbonylContact O-C 3.58Å; H702-L705 WeakPolarHBondContact O-CA 3.38Å; H702-L705 WeakPolarHBondContact O-CB 3.24Å; H702-L705 PolarHBondContact O-N 3.11Å; H702-M706 PolarHBondContact O-N 3.31Å; H702-M706 VanDerWaalsContact O-N 3.1Å
703	P	61.8	Low	51.4	Low	98 Å²	98	116.3 Å²	116.3	64%	0.636	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.9	-21.3	-174.5	-29.7	37.1	0	0	0	116.4
704	L	61.1	Low	52.4	Low	153 Å²	153	117 Å²	117	80%	0.801	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.6	-11.1	172.8	-56.2	-179	0	0	0	114	H702	H702-L704 PolarHBondContact ND1-N 3.18Å; H702-L704 PolarHBondContact O-N 2.99Å
705	L	63.4	Low	53.3	Low	121 Å²	121	121 Å²	121	63%	0.634	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.3	-10	171.1	-61.8	179.2	0	0	0	112.3	H702 R707	H702-L705 HydrophobicContact CB-CB 4.3Å; H702-L705 HydrophobicContact CB-CD1 3.97Å; H702-L705 HydrophobicContact CB-CG 4.05Å; H702-L705 CarbonylContact O-C 3.58Å; H702-L705 WeakPolarHBondContact O-CA 3.38Å; H702-L705 WeakPolarHBondContact O-CB 3.24Å; H702-L705 PolarHBondContact O-N 3.11Å; L705-R707 PolarHBondContact O-N 3.31Å
706	M	52.2	Low	55	Low	50 Å²	50	120.1 Å²	120.1	25%	0.246	63%	0.631	C	S	.	*	S	Bend	trans	-61.4	99.8	163.4	-63.7	-171.9	76.4	0	0	108.5	H702 N708	H702-M706 PolarHBondContact O-N 3.31Å; H702-M706 VanDerWaalsContact O-N 3.1Å; M706-N708 PolarHBondContact O-N 3.32Å
707	R	54.6	Low	56.6	Low	180 Å²	180	116 Å²	116	68%	0.679	60%	0.604	S	S	*	*			trans	-58.7	134.1	174.8	-162.5	170.8	-179.9	179.7	-3.5	106.5	L705 G709 D710	L705-R707 PolarHBondContact O-N 3.31Å; R707-G709 PolarHBondContact O-N 2.85Å; R707-D710 PolarHBondContact O-N 2.87Å
708	N	49.9	Very low	58.3	Low	126 Å²	126	117.1 Å²	117.1	67%	0.674	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.2	30.1	-163.3	-79.1	-52.3	0	0	0	116.3	M706 Q1113	M706-N708 PolarHBondContact O-N 3.32Å; N708-Q1113 PolarHBondContact O-NE2 3.42Å
709	G	49.9	Very low	60.3	Low	48 Å²	48	112.5 Å²	112.5	50%	0.495	60%	0.597	S	S	.	*	T	Hydrogen-bonded Turn	trans	-130.4	6.9	174.8	0	0	0	0	0	115.3	R707 S711	R707-G709 PolarHBondContact O-N 2.85Å; G709-S711 PolarHBondContact O-N 3.04Å
710	D	46.1	Very low	61.9	Low	77 Å²	77	113.8 Å²	113.8	41%	0.412	61%	0.607	S	S	.	*	S	Bend	trans	-72.9	109.2	-173.6	-75.5	-30.8	0	0	0	114.3	R707 R712	R707-D710 PolarHBondContact O-N 2.87Å; D710-R712 VanDerWaalsContact C-N 3.25Å; D710-R712 PolarHBondContact O-N 3.48Å
711	S	46.8	Very low	63.5	Low	105 Å²	105	107.5 Å²	107.5	73%	0.734	57%	0.574	S	S	*	*	S	Bend	trans	59.4	-15.2	152.4	73.5	0	0	0	0	120.8	G709	G709-S711 PolarHBondContact O-N 3.04Å
712	R	49.6	Very low	65.1	Low	168 Å²	168	103.8 Å²	103.8	63%	0.634	56%	0.555	S	S	*	*			trans	-70.2	128.9	174.4	-66.6	-175.1	-177.1	170.7	4.8	110	D710 L714	D710-R712 VanDerWaalsContact C-N 3.25Å; D710-R712 PolarHBondContact O-N 3.48Å; R712-L714 PolarHBondContact O-N 2.83Å
713	P	47.9	Very low	66.5	Low	121 Å²	121	100.9 Å²	100.9	79%	0.786	55%	0.547	S	S	*	.			trans	-70	94.2	176.9	28.3	-33.7	0	0	0	110	H715	P713-H715 PolarHBondContact O-N 2.81Å
714	L	59.6	Low	68.1	Low	93 Å²	93	98.4 Å²	98.4	49%	0.487	53%	0.529	S	S	.	.			trans	-51.8	131.4	169.6	-70.3	144.1	0	0	0	109.2	R712 K716 A1117	R712-L714 PolarHBondContact O-N 2.83Å; L714-K716 PolarHBondContact O-N 2.99Å; L714-A1117 HydrophobicContact CB-CB 3.62Å; L714-A1117 HydrophobicContact CD1-CB 4.27Å; L714-A1117 HydrophobicContact CG-CB 4.44Å
715	H	64.9	Low	69.7	Low	183 Å²	183	96.3 Å²	96.3	85%	0.847	52%	0.518	S	S	*	.			trans	-60.3	109.8	174.9	-77.2	-175.6	0	0	0	109.1	P713 P717	P713-H715 PolarHBondContact O-N 2.81Å; H715-P717 VanDerWaalsContact O-CD 3.31Å; H715-P717 WeakPolarHBondContact O-CD 3.44Å; H715-P717 VanDerWaalsContact O-N 3.15Å
716	K	75.8	Confident	71.2	Confident	149 Å²	149	93 Å²	93	65%	0.648	50%	0.501	S	S	*	.			trans	-55.2	119.6	-179	176.2	156.9	177	156.6	0	110	L714 A1117 R1118	L714-K716 PolarHBondContact O-N 2.99Å; K716-A1117 WeakPolarHBondContact CG-O 3.25Å; K716-R1118 WeakPolarHBondContact CE-O 3.42Å; K716-R1118 PolarHBondContact NZ-O 3.25Å
717	P	77.4	Confident	73.3	Confident	27 Å²	27	90.8 Å²	90.8	18%	0.175	49%	0.49	C	S	.	.			trans	-58.8	140.7	-178.8	-25.9	34.2	0	0	0	111.8	H715 T719 D1114 A1117 R1118	H715-P717 VanDerWaalsContact O-CD 3.31Å; H715-P717 WeakPolarHBondContact O-CD 3.44Å; H715-P717 VanDerWaalsContact O-N 3.15Å; P717-T719 VanDerWaalsContact C-N 3.27Å; P717-D1114 WeakPolarHBondContact CG-OD1 3.49Å; P717-A1117 HydrophobicContact CG-CB 4.38Å; P717-R1118 HydrophobicContact CB-CG 4.43Å; P717-R1118 VanDerWaalsContact CB-NH2 3.32Å; P717-R1118 HydrophobicContact CG-CG 4.13Å
718	T	79.6	Confident	75.3	Confident	148 Å²	148	84 Å²	84	91%	0.908	47%	0.468	S	S	*	.	S	Bend	trans	-77.5	-14.6	175	51.8	0	0	0	0	112.7
719	T	85.2	Confident	77.5	Confident	65 Å²	65	81.5 Å²	81.5	40%	0.399	46%	0.459	S	S	.	.	S	Bend	trans	-89.2	143.3	176.2	60.4	0	0	0	0	111.6	P717 L721 R1118	P717-T719 VanDerWaalsContact C-N 3.27Å; T719-L721 VanDerWaalsContact C-N 3.32Å; T719-L721 WeakPolarHBondContact CB-O 2.87Å; T719-L721 PolarHBondContact O-N 3.1Å; T719-L721 PolarHBondContact OG1-O 2.86Å; T719-R1118 PolarHBondContact O-NE 2.7Å; T719-R1118 PolarHBondContact OG1-NH2 2.64Å
720	P	87.9	Confident	79.5	Confident	94 Å²	94	81.4 Å²	81.4	61%	0.61	45%	0.45	S	S	*	.	S	Bend	trans	-70.5	-28.2	176.5	29.2	-35.2	0	0	0	112.7	Q894 R1118	P720-Q894 PolarHBondContact O-NE2 3.44Å; P720-R1118 WeakPolarHBondContact O-CD 3.36Å
721	L	93.7	Very high	81.6	Confident	52 Å²	52	81.8 Å²	81.8	27%	0.272	46%	0.456	S	S	.	.	S	Bend	trans	-117.1	156.5	178.9	-70.9	173.6	0	0	0	110.9	T719 W1115 R1118	T719-L721 VanDerWaalsContact C-N 3.32Å; T719-L721 WeakPolarHBondContact CB-O 2.87Å; T719-L721 PolarHBondContact O-N 3.1Å; T719-L721 PolarHBondContact OG1-O 2.86Å; L721-W1115 HydrophobicContact CD2-CH2 4.07Å; L721-W1115 HydrophobicContact CD2-CZ2 3.81Å; L721-R1118 PolarHBondContact O-NH2 2.91Å; L721-R1118 VanDerWaalsContact O-NH2 3.15Å
722	P	94.6	Very high	83.4	Confident	11 Å²	11	82.6 Å²	82.6	7%	0.071	46%	0.462	C	S	.	.			trans	-60.1	150.7	172.2	25.8	-36	0	0	0	112.5	L726 L890 Y891 V1111 D1114	P722-L726 HydrophobicContact CB-CD1 4.15Å; P722-L890 WeakPolarHBondContact CD-O 3.35Å; P722-L890 VanDerWaalsContact CG-O 3.25Å; P722-L890 WeakPolarHBondContact CG-O 3.46Å; P722-Y891 HydrophobicContact CB-CD1 4.31Å; P722-Y891 HydrophobicContact CB-CE1 3.76Å; P722-Y891 HydrophobicContact CG-CD1 3.73Å; P722-Y891 HydrophobicContact CG-CE1 3.7Å; P722-Y891 HydrophobicContact CG-CG 4.21Å; P722-Y891 WeakPolarHBondContact O-CE1 3.39Å; P722-V1111 HydrophobicContact CG-CG1 4.49Å; P722-D1114 VanDerWaalsContact CA-OD2 3.23Å; P722-D1114 WeakPolarHBondContact CA-OD2 3.4Å; P722-D1114 VanDerWaalsContact CB-OD2 3.24Å; P722-D1114 WeakPolarHBondContact CB-OD2 3.21Å
723	S	94.7	Very high	84.6	Confident	49 Å²	49	82.8 Å²	82.8	34%	0.343	47%	0.47	S	S	.	.			trans	-87	151.1	175.2	-174.6	0	0	0	0	111.5	D725 Y891	S723-D725 VanDerWaalsContact CB-OD1 3.25Å; S723-D725 WeakPolarHBondContact CB-OD1 3.43Å; S723-D725 VanDerWaalsContact CB-OD2 3.29Å; S723-D725 WeakPolarHBondContact CB-OD2 3.42Å; S723-D725 PolarHBondContact O-N 2.78Å; S723-D725 PolarHBondContact OG-OD1 3.21Å; S723-D725 PolarHBondContact OG-OD2 2.79Å; S723-Y891 VanDerWaalsContact O-CE1 3.32Å; S723-Y891 WeakPolarHBondContact O-CE1 3.31Å; S723-Y891 PolarHBondContact O-OH 2.82Å
724	L	95.5	Very high	85.9	Confident	47 Å²	47	82 Å²	82	25%	0.246	46%	0.463	C	S	.	.	G	3₁₀ helix	trans	-75.5	-6.8	177.1	-68	174	0	0	0	112.8	L726 L727 R830 L833 D834 Y891	L724-L726 VanDerWaalsContact C-N 3.3Å; L724-L727 HydrophobicContact CD2-CD1 4.27Å; L724-L727 PolarHBondContact O-N 2.61Å; L724-R830 HydrophobicContact CB-CG 4.49Å; L724-R830 VanDerWaalsContact O-CD 3.28Å; L724-R830 WeakPolarHBondContact O-CD 3.47Å; L724-R830 PolarHBondContact O-NE 2.87Å; L724-R830 PolarHBondContact O-NH1 3Å; L724-R830 VanDerWaalsContact O-NH1 3.12Å; L724-L833 HydrophobicContact CD2-CB 3.86Å; L724-L833 HydrophobicContact CD2-CD1 3.88Å; L724-D834 HydrophobicContact CD1-CB 4.38Å; L724-Y891 HydrophobicContact CD2-CD1 3.81Å; L724-Y891 HydrophobicContact CD2-CE1 3.69Å; L724-Y891 HydrophobicContact CD2-CG 4.39Å; L724-Y891 HydrophobicContact CG-CE1 4.3Å
725	D	95	Very high	86.8	Confident	108 Å²	108	83 Å²	83	58%	0.578	47%	0.465	S	S	*	.	G	3₁₀ helix	trans	-68.8	-24.4	172.8	50.3	39.4	0	0	0	113.7	S723 L727	S723-D725 VanDerWaalsContact CB-OD1 3.25Å; S723-D725 WeakPolarHBondContact CB-OD1 3.43Å; S723-D725 VanDerWaalsContact CB-OD2 3.29Å; S723-D725 WeakPolarHBondContact CB-OD2 3.42Å; S723-D725 PolarHBondContact O-N 2.78Å; S723-D725 PolarHBondContact OG-OD1 3.21Å; S723-D725 PolarHBondContact OG-OD2 2.79Å; D725-L727 PolarHBondContact O-N 3.42Å; D725-L727 VanDerWaalsContact O-N 3.16Å
726	L	94.7	Very high	87.5	Confident	52 Å²	52	79.7 Å²	79.7	27%	0.272	46%	0.46	S	S	.	.	G	3₁₀ helix	trans	-61.9	-15.9	169.9	-55.3	179.7	0	0	0	113.1	P722 L724 A1110 V1111 D1114	P722-L726 HydrophobicContact CB-CD1 4.15Å; L724-L726 VanDerWaalsContact C-N 3.3Å; L726-A1110 HydrophobicContact CB-CB 4.48Å; L726-V1111 HydrophobicContact CB-CG2 4.35Å; L726-V1111 HydrophobicContact CD1-CG2 4.16Å; L726-D1114 HydrophobicContact CD1-CB 3.77Å
727	L	97	Very high	87.9	Confident	4 Å²	4	76.5 Å²	76.5	2%	0.021	45%	0.453	C	S	.	.	S	Bend	trans	-109.5	147.5	179.1	-54	-177.2	0	0	0	111.7	L724 D725 L829 R830 L833 L887 Y891 E1107 V1111	L724-L727 HydrophobicContact CD2-CD1 4.27Å; L724-L727 PolarHBondContact O-N 2.61Å; D725-L727 PolarHBondContact O-N 3.42Å; D725-L727 VanDerWaalsContact O-N 3.16Å; L727-L829 HydrophobicContact CD1-CD2 4.29Å; L727-L829 HydrophobicContact CD1-CG 4.23Å; L727-R830 HydrophobicContact CB-CB 3.8Å; L727-R830 HydrophobicContact CB-CG 4.32Å; L727-R830 HydrophobicContact CD1-CB 4.19Å; L727-R830 VanDerWaalsContact O-CD 3.23Å; L727-R830 WeakPolarHBondContact O-CD 3.44Å; L727-R830 PolarHBondContact O-NH1 3.21Å; L727-L833 HydrophobicContact CD1-CD1 3.56Å; L727-L887 HydrophobicContact CD2-CD2 4.26Å; L727-Y891 HydrophobicContact CD1-CD2 4.48Å; L727-Y891 HydrophobicContact CD1-CE2 3.71Å; L727-Y891 HydrophobicContact CD2-CE2 4.3Å; L727-Y891 HydrophobicContact CG-CE2 4.1Å; L727-E1107 HydrophobicContact CD2-CB 3.86Å; L727-E1107 HydrophobicContact CD2-CG 4.43Å; L727-V1111 HydrophobicContact CD2-CG2 4.23Å
728	T	96.2	Very high	88.5	Confident	36 Å²	36	79.7 Å²	79.7	22%	0.221	47%	0.469	C	S	.	.	P	Polyproline II helix	trans	-66.2	129	-179.8	-48.9	0	0	0	0	111	Y828 R830 R1104 E1107	T728-Y828 HydrophobicContact CG2-CD1 4.33Å; T728-Y828 HydrophobicContact CG2-CE1 4.05Å; T728-R830 WeakPolarHBondContact O-CB 3.43Å; T728-R1104 PolarHBondContact OG1-NH1 3.48Å; T728-R1104 PolarHBondContact OG1-NH2 2.95Å; T728-E1107 VanDerWaalsContact CB-OE1 3.27Å; T728-E1107 WeakPolarHBondContact CB-OE1 3.45Å; T728-E1107 PolarHBondContact N-OE1 3.46Å; T728-E1107 PolarHBondContact OG1-OE1 2.82Å
729	P	94.8	Very high	89	Confident	74 Å²	74	76.8 Å²	76.8	48%	0.481	45%	0.451	S	S	.	.	P	Polyproline II helix	trans	-66.9	147.4	169.9	30.1	-34.3	0	0	0	110.6
730	P	93	Very high	89.4	Confident	47 Å²	47	80 Å²	80	31%	0.305	46%	0.46	S	S	.	.	P	Polyproline II helix	trans	-60.7	154.7	166.9	29.4	-35.6	0	0	0	110.5	Y828 E831	P730-Y828 HydrophobicContact CB-CD2 4.01Å; P730-E831 HydrophobicContact CB-CB 4.39Å; P730-E831 HydrophobicContact CB-CG 4.43Å; P730-E831 HydrophobicContact CG-CB 4.11Å; P730-E831 HydrophobicContact CG-CG 4.11Å
731	P	90.6	Very high	89.6	Confident	84 Å²	84	77.1 Å²	77.1	55%	0.545	44%	0.444	S	S	.	.	P	Polyproline II helix	trans	-61	141.6	176.5	26.6	-35	0	0	0	111.3	E733	P731-E733 VanDerWaalsContact C-N 3.3Å; P731-E733 PolarHBondContact O-N 3.08Å
732	S	84.1	Confident	89.6	Confident	123 Å²	123	75.7 Å²	75.7	86%	0.86	44%	0.436	S	S	*	.	S	Bend	trans	-71.5	-21.9	-177.6	51.5	0	0	0	0	114.3
733	E	75.4	Confident	89.6	Confident	172 Å²	172	79.1 Å²	79.1	80%	0.804	45%	0.451	S	S	*	.			trans	-111.3	114.8	-179.3	-66.3	-177.3	-174.5	0	0	110.1	P731	P731-E733 VanDerWaalsContact C-N 3.3Å; P731-E733 PolarHBondContact O-N 3.08Å
734	V	75.2	Confident	89.6	Confident	105 Å²	105	81.9 Å²	81.9	64%	0.636	46%	0.459	S	S	*	.	P	Polyproline II helix	trans	-95.5	123.2	171.1	-177.2	0	0	0	0	107.9
735	E	76.9	Confident	89.6	Confident	112 Å²	112	81.7 Å²	81.7	52%	0.523	46%	0.457	S	S	.	.	P	Polyproline II helix	trans	-63.7	129.6	178.8	-170.5	175.5	159.9	0	0	110.5	K823	E735-K823 WeakPolarHBondContact OE2-CD 3.38Å; E735-K823 WeakPolarHBondContact OE2-CE 3.37Å; E735-K823 IonicContact OE2-NZ 2.65Å; E735-K823 PolarHBondContact OE2-NZ 3.41Å
736	P	81	Confident	89.6	Confident	114 Å²	114	76.9 Å²	76.9	74%	0.74	43%	0.432	S	S	*	.	P	Polyproline II helix	trans	-66.7	144.8	-177.8	27.9	-35.3	0	0	0	111.4	D738	P736-D738 PolarHBondContact O-N 3.23Å
737	V	83.6	Confident	89.7	Confident	83 Å²	83	81.8 Å²	81.8	50%	0.503	45%	0.447	S	S	.	.	P	Polyproline II helix	trans	-72.4	118.6	-179.5	-178.2	0	0	0	0	110.6	T739 L742 P767	V737-T739 PolarHBondContact O-N 3.46Å; V737-L742 HydrophobicContact CG1-CD1 3.55Å; V737-L742 HydrophobicContact CG1-CG 4.26Å; V737-P767 HydrophobicContact CG1-CB 4.01Å; V737-P767 HydrophobicContact CG1-CG 3.99Å; V737-P767 HydrophobicContact CG2-CB 4.37Å; V737-P767 HydrophobicContact CG2-CG 4.32Å
738	D	89.6	Confident	89.6	Confident	94 Å²	94	84.4 Å²	84.4	50%	0.503	46%	0.461	S	S	.	.			trans	-70	95.2	171.3	-179	-4.8	0	0	0	110.9	P736 F740 A741 L742	P736-D738 PolarHBondContact O-N 3.23Å; D738-F740 PolarHBondContact O-N 2.82Å; D738-F740 WeakPolarHBondContact OD1-CA 3.35Å; D738-F740 WeakPolarHBondContact OD1-CB 3.41Å; D738-F740 PolarHBondContact OD1-N 3.22Å; D738-A741 HydrophobicContact CB-CB 4.02Å; D738-A741 VanDerWaalsContact CG-CB 3.46Å; D738-A741 PolarHBondContact O-N 3.36Å; D738-A741 PolarHBondContact OD1-N 3.13Å; D738-A741 VanDerWaalsContact OD2-CB 3.24Å; D738-A741 WeakPolarHBondContact OD2-CB 3.48Å; D738-L742 WeakPolarHBondContact O-CG 3.4Å; D738-L742 PolarHBondContact O-N 3.03Å; D738-L742 VanDerWaalsContact O-N 3.14Å
739	T	91.2	Very high	89.6	Confident	87 Å²	87	82.7 Å²	82.7	53%	0.534	45%	0.451	S	S	.	.	H	α-helix	trans	-64.8	-25.7	177.5	53	0	0	0	0	113.3	V737 L742 E743	V737-T739 PolarHBondContact O-N 3.46Å; T739-L742 PolarHBondContact O-N 3.31Å; T739-E743 PolarHBondContact O-N 3.34Å
740	F	92.7	Very high	89.7	Confident	133 Å²	133	82.3 Å²	82.3	58%	0.583	44%	0.442	S	S	*	.	H	α-helix	trans	-75.8	-39.6	178.3	175	-122	0	0	0	111.2	D738 L742 E743 Q744	D738-F740 PolarHBondContact O-N 2.82Å; D738-F740 WeakPolarHBondContact OD1-CA 3.35Å; D738-F740 WeakPolarHBondContact OD1-CB 3.41Å; D738-F740 PolarHBondContact OD1-N 3.22Å; F740-L742 VanDerWaalsContact C-N 3.31Å; F740-L742 PolarHBondContact O-N 2.82Å; F740-E743 PolarHBondContact O-N 2.85Å; F740-Q744 HydrophobicContact CE2-CG 4.43Å; F740-Q744 WeakPolarHBondContact O-CG 3.42Å; F740-Q744 PolarHBondContact O-N 3.27Å
741	A	91.9	Very high	89.9	Confident	33 Å²	33	82.1 Å²	82.1	27%	0.273	45%	0.445	S	S	.	.	H	α-helix	trans	-63.6	-35.8	168.9	0	0	0	0	0	112.4	D738 M745	D738-A741 HydrophobicContact CB-CB 4.02Å; D738-A741 VanDerWaalsContact CG-CB 3.46Å; D738-A741 PolarHBondContact O-N 3.36Å; D738-A741 PolarHBondContact OD1-N 3.13Å; D738-A741 VanDerWaalsContact OD2-CB 3.24Å; D738-A741 WeakPolarHBondContact OD2-CB 3.48Å; A741-M745 WeakPolarHBondContact O-CB 3.43Å; A741-M745 PolarHBondContact O-N 3.44Å
742	L	93.6	Very high	90.1	Very high	22 Å²	22	82.1 Å²	82.1	12%	0.115	43%	0.434	C	S	.	.	H	α-helix	trans	-67.5	-40.5	173.9	-67.3	-172.1	0	0	0	112.6	V737 D738 T739 F740 M745 A746 Y765 P767 T772 F774	V737-L742 HydrophobicContact CG1-CD1 3.55Å; V737-L742 HydrophobicContact CG1-CG 4.26Å; D738-L742 WeakPolarHBondContact O-CG 3.4Å; D738-L742 PolarHBondContact O-N 3.03Å; D738-L742 VanDerWaalsContact O-N 3.14Å; T739-L742 PolarHBondContact O-N 3.31Å; F740-L742 VanDerWaalsContact C-N 3.31Å; F740-L742 PolarHBondContact O-N 2.82Å; L742-M745 PolarHBondContact O-N 3.12Å; L742-A746 WeakPolarHBondContact O-CB 3.46Å; L742-A746 PolarHBondContact O-N 3.02Å; L742-Y765 HydrophobicContact CB-CD2 4.22Å; L742-Y765 HydrophobicContact CB-CE1 4.46Å; L742-Y765 HydrophobicContact CB-CE2 4.01Å; L742-Y765 HydrophobicContact CD1-CD2 3.76Å; L742-Y765 HydrophobicContact CD1-CE2 3.81Å; L742-P767 HydrophobicContact CD1-CB 3.96Å; L742-P767 HydrophobicContact CD1-CG 4.07Å; L742-T772 HydrophobicContact CD1-CG2 4.46Å; L742-T772 HydrophobicContact CD2-CG2 3.99Å; L742-F774 HydrophobicContact CD2-CZ 4.28Å
743	E	94.8	Very high	90.7	Very high	82 Å²	82	76.3 Å²	76.3	38%	0.383	39%	0.393	S	S	.	.	H	α-helix	trans	-67.6	-39.4	176.5	-159	-165.6	160.5	0	0	112	T739 F740 M745 A746 R747	T739-E743 PolarHBondContact O-N 3.34Å; F740-E743 PolarHBondContact O-N 2.85Å; E743-M745 VanDerWaalsContact C-N 3.34Å; E743-M745 PolarHBondContact O-N 2.91Å; E743-A746 PolarHBondContact O-N 2.68Å; E743-R747 WeakPolarHBondContact O-CG 3.48Å; E743-R747 PolarHBondContact O-N 2.65Å; E743-R747 VanDerWaalsContact O-N 3.08Å; E743-R747 IonicContact OE1-CZ 3.36Å; E743-R747 IonicContact OE1-NE 2.59Å; E743-R747 PolarHBondContact OE1-NE 3.42Å; E743-R747 IonicContact OE1-NH2 2.65Å; E743-R747 PolarHBondContact OE1-NH2 2.84Å
744	Q	94.9	Very high	91.6	Very high	108 Å²	108	71 Å²	71	51%	0.505	38%	0.378	S	S	.	.	H	α-helix	trans	-60.2	-43.6	170.8	-74.7	-176.4	52.2	0	0	111.8	F740 R747 L748	F740-Q744 HydrophobicContact CE2-CG 4.43Å; F740-Q744 WeakPolarHBondContact O-CG 3.42Å; F740-Q744 PolarHBondContact O-N 3.27Å; Q744-R747 PolarHBondContact O-N 3.06Å; Q744-L748 WeakPolarHBondContact O-CB 3.47Å; Q744-L748 PolarHBondContact O-N 2.73Å
745	M	94.7	Very high	92.6	Very high	42 Å²	42	70.9 Å²	70.9	21%	0.207	37%	0.374	C	S	.	.	H	α-helix	trans	-64.3	-41	176.9	-174.9	57.8	70.5	0	0	111.7	A741 L742 E743 L748 V749 F774 L798 L819	A741-M745 WeakPolarHBondContact O-CB 3.43Å; A741-M745 PolarHBondContact O-N 3.44Å; L742-M745 PolarHBondContact O-N 3.12Å; E743-M745 VanDerWaalsContact C-N 3.34Å; E743-M745 PolarHBondContact O-N 2.91Å; M745-L748 WeakPolarHBondContact O-CB 3.36Å; M745-L748 PolarHBondContact O-N 3.02Å; M745-L748 HydrophobicContact SD-CD2 4.23Å; M745-V749 WeakPolarHBondContact O-CG2 3.44Å; M745-V749 PolarHBondContact O-N 3.14Å; M745-F774 HydrophobicContact CB-CE1 4.34Å; M745-F774 HydrophobicContact CB-CZ 3.93Å; M745-F774 HydrophobicContact CG-CE1 4.28Å; M745-F774 HydrophobicContact CG-CE2 4.04Å; M745-F774 HydrophobicContact CG-CZ 3.59Å; M745-L798 HydrophobicContact SD-CD2 4.36Å; M745-L819 HydrophobicContact CG-CD1 3.54Å; M745-L819 HydrophobicContact SD-CD1 3.57Å; M745-L819 VanDerWaalsContact SD-CD1 3.57Å
746	A	96.3	Very high	93.4	Very high	8 Å²	8	68.4 Å²	68.4	7%	0.066	36%	0.362	C	S	.	.	H	α-helix	trans	-56.6	-51.8	174.7	0	0	0	0	0	111.8	L742 E743 L748 V749 E750 V762 F774	L742-A746 WeakPolarHBondContact O-CB 3.46Å; L742-A746 PolarHBondContact O-N 3.02Å; E743-A746 PolarHBondContact O-N 2.68Å; A746-L748 VanDerWaalsContact C-N 3.26Å; A746-L748 PolarHBondContact O-N 3.26Å; A746-V749 WeakPolarHBondContact O-CB 3.38Å; A746-V749 PolarHBondContact O-N 3.47Å; A746-V749 VanDerWaalsContact O-N 3.11Å; A746-E750 PolarHBondContact O-N 3.15Å; A746-V762 HydrophobicContact CB-CB 4.12Å; A746-V762 HydrophobicContact CB-CG1 3.79Å; A746-V762 HydrophobicContact CB-CG2 4.24Å; A746-F774 HydrophobicContact CB-CD1 4.05Å; A746-F774 HydrophobicContact CB-CE1 3.99Å
747	R	96.3	Very high	94	Very high	154 Å²	154	73.2 Å²	73.2	58%	0.581	37%	0.365	S	S	*	.	H	α-helix	trans	-61.2	-33.8	177	-64.2	173.3	-172.8	-165.5	4.4	112.4	E743 Q744 A751	E743-R747 WeakPolarHBondContact O-CG 3.48Å; E743-R747 PolarHBondContact O-N 2.65Å; E743-R747 VanDerWaalsContact O-N 3.08Å; E743-R747 IonicContact OE1-CZ 3.36Å; E743-R747 IonicContact OE1-NE 2.59Å; E743-R747 PolarHBondContact OE1-NE 3.42Å; E743-R747 IonicContact OE1-NH2 2.65Å; E743-R747 PolarHBondContact OE1-NH2 2.84Å; Q744-R747 PolarHBondContact O-N 3.06Å; R747-A751 WeakPolarHBondContact O-CB 3.36Å; R747-A751 PolarHBondContact O-N 3.11Å; R747-A751 VanDerWaalsContact O-N 3.07Å
748	L	95.7	Very high	94.6	Very high	60 Å²	60	69.3 Å²	69.3	31%	0.314	34%	0.341	S	S	.	.	H	α-helix	trans	-69.4	-39.2	174.6	-173.5	66.2	0	0	0	112	Q744 M745 A746 A751 R752 L798	Q744-L748 WeakPolarHBondContact O-CB 3.47Å; Q744-L748 PolarHBondContact O-N 2.73Å; M745-L748 WeakPolarHBondContact O-CB 3.36Å; M745-L748 PolarHBondContact O-N 3.02Å; M745-L748 HydrophobicContact SD-CD2 4.23Å; A746-L748 VanDerWaalsContact C-N 3.26Å; A746-L748 PolarHBondContact O-N 3.26Å; L748-A751 PolarHBondContact O-N 2.87Å; L748-R752 WeakPolarHBondContact O-CG 3.48Å; L748-R752 PolarHBondContact O-N 2.91Å; L748-L798 HydrophobicContact CB-CD2 4.43Å; L748-L798 HydrophobicContact CD2-CD2 3.81Å; L748-L798 HydrophobicContact CG-CD2 3.68Å
749	V	96.3	Very high	94.9	Very high	0 Å²	0	71.5 Å²	71.5	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-61.4	-45.4	173.7	172.3	0	0	0	0	110.9	M745 A746 R752 L753 V762 L776 L798 L817 L819	M745-V749 WeakPolarHBondContact O-CG2 3.44Å; M745-V749 PolarHBondContact O-N 3.14Å; A746-V749 WeakPolarHBondContact O-CB 3.38Å; A746-V749 PolarHBondContact O-N 3.47Å; A746-V749 VanDerWaalsContact O-N 3.11Å; V749-R752 PolarHBondContact O-N 3.15Å; V749-L753 HydrophobicContact CG1-CD1 3.83Å; V749-L753 HydrophobicContact CG1-CG 4.46Å; V749-L753 WeakPolarHBondContact O-CB 3.42Å; V749-L753 WeakPolarHBondContact O-CG 3.42Å; V749-L753 PolarHBondContact O-N 2.76Å; V749-V762 HydrophobicContact CG1-CG2 4.44Å; V749-L776 HydrophobicContact CG1-CD2 4.11Å; V749-L798 HydrophobicContact CG2-CD1 3.95Å; V749-L798 HydrophobicContact CG2-CD2 4.31Å; V749-L817 HydrophobicContact CG1-CD1 3.93Å; V749-L817 HydrophobicContact CG2-CD2 4.49Å; V749-L819 HydrophobicContact CG2-CD1 3.97Å
750	E	96.8	Very high	95.1	Very high	66 Å²	66	67.6 Å²	67.6	31%	0.308	32%	0.323	S	S	.	.	H	α-helix	trans	-58.4	-48.1	175.1	-65.6	179.5	154.7	0	0	111.6	A746 R752 L753 A754 D761 V762	A746-E750 PolarHBondContact O-N 3.15Å; E750-R752 PolarHBondContact O-N 2.83Å; E750-L753 PolarHBondContact O-N 2.89Å; E750-A754 WeakPolarHBondContact O-CB 3.48Å; E750-A754 PolarHBondContact O-N 2.94Å; E750-D761 WeakPolarHBondContact OE1-CA 3.26Å; E750-V762 HydrophobicContact CG-CB 4.29Å; E750-V762 HydrophobicContact CG-CG2 3.72Å; E750-V762 PolarHBondContact OE1-N 3.44Å
751	A	96.5	Very high	95.4	Very high	43 Å²	43	64.2 Å²	64.2	36%	0.355	31%	0.311	S	S	.	.	H	α-helix	trans	-60.6	-45.1	178.2	0	0	0	0	0	112.3	R747 L748 L753 A754 D755	R747-A751 WeakPolarHBondContact O-CB 3.36Å; R747-A751 PolarHBondContact O-N 3.11Å; R747-A751 VanDerWaalsContact O-N 3.07Å; L748-A751 PolarHBondContact O-N 2.87Å; A751-L753 PolarHBondContact O-N 3.31Å; A751-A754 WeakPolarHBondContact O-CB 3.37Å; A751-A754 PolarHBondContact O-N 3.08Å; A751-D755 PolarHBondContact O-N 3.27Å
752	R	95.1	Very high	95.6	Very high	83 Å²	83	63.9 Å²	63.9	31%	0.313	31%	0.306	S	S	.	.	H	α-helix	trans	-68.6	-31.6	178.1	-66.8	-45.2	-180	-141.4	-8.4	113.6	L748 V749 E750 D755 F756 S797 L798	L748-R752 WeakPolarHBondContact O-CG 3.48Å; L748-R752 PolarHBondContact O-N 2.91Å; V749-R752 PolarHBondContact O-N 3.15Å; E750-R752 PolarHBondContact O-N 2.83Å; R752-D755 WeakPolarHBondContact CD-OD2 3.45Å; R752-D755 IonicContact CZ-OD2 2.71Å; R752-D755 IonicContact NE-OD2 3.51Å; R752-D755 IonicContact NH1-OD2 3.51Å; R752-D755 PolarHBondContact NH1-OD2 2.99Å; R752-F756 WeakPolarHBondContact O-CD2 3.33Å; R752-S797 PolarHBondContact NE-O 3.45Å; R752-S797 VanDerWaalsContact NE-O 3.16Å; R752-L798 HydrophobicContact CB-CD2 4.32Å; R752-L798 HydrophobicContact CG-CD2 3.77Å; R752-L798 HydrophobicContact CG-CG 4.45Å
753	L	95.9	Very high	95.8	Very high	1 Å²	1	66 Å²	66	1%	0.005	32%	0.319	C	S	.	.	H	α-helix	trans	-68.7	-40.2	170.8	-71.9	168.6	0	0	0	111	V749 E750 A751 D755 F756 I758 A760 L776 I787 L794	V749-L753 HydrophobicContact CG1-CD1 3.83Å; V749-L753 HydrophobicContact CG1-CG 4.46Å; V749-L753 WeakPolarHBondContact O-CB 3.42Å; V749-L753 WeakPolarHBondContact O-CG 3.42Å; V749-L753 PolarHBondContact O-N 2.76Å; E750-L753 PolarHBondContact O-N 2.89Å; A751-L753 PolarHBondContact O-N 3.31Å; L753-D755 PolarHBondContact O-N 3.08Å; L753-F756 PolarHBondContact O-N 3.15Å; L753-I758 CarbonylContact C-O 3.58Å; L753-I758 HydrophobicContact CB-CB 4.31Å; L753-I758 HydrophobicContact CB-CG2 4.37Å; L753-I758 WeakPolarHBondContact CB-O 3.39Å; L753-I758 HydrophobicContact CD2-CB 4.43Å; L753-I758 HydrophobicContact CD2-CG2 4.19Å; L753-I758 CarbonylContact O-C 3.59Å; L753-I758 WeakPolarHBondContact O-CA 3.41Å; L753-I758 WeakPolarHBondContact O-CB 3.47Å; L753-I758 PolarHBondContact O-N 3.27Å; L753-I758 VanDerWaalsContact O-O 3.05Å; L753-A760 HydrophobicContact CD1-CB 4.02Å; L753-L776 HydrophobicContact CD1-CD1 3.72Å; L753-L776 HydrophobicContact CD1-CD2 4.19Å; L753-I787 HydrophobicContact CD2-CD1 4.47Å; L753-I787 HydrophobicContact CD2-CG1 4.4Å; L753-I787 HydrophobicContact CD2-CG2 4.08Å; L753-L794 HydrophobicContact CD2-CD1 3.74Å
754	A	95.4	Very high	95.8	Very high	60 Å²	60	65.3 Å²	65.3	50%	0.496	32%	0.318	S	S	.	.	H	α-helix	trans	-61.7	-40.3	175.5	0	0	0	0	0	112.7	E750 A751 F756 R757 I758	E750-A754 WeakPolarHBondContact O-CB 3.48Å; E750-A754 PolarHBondContact O-N 2.94Å; A751-A754 WeakPolarHBondContact O-CB 3.37Å; A751-A754 PolarHBondContact O-N 3.08Å; A754-F756 VanDerWaalsContact C-N 3.25Å; A754-F756 PolarHBondContact O-N 2.84Å; A754-R757 WeakPolarHBondContact O-CA 3.4Å; A754-R757 PolarHBondContact O-N 3.05Å; A754-I758 PolarHBondContact N-O 2.97Å
755	D	94.9	Very high	95.8	Very high	103 Å²	103	63.5 Å²	63.5	55%	0.551	31%	0.307	S	S	*	.	H	α-helix	trans	-53	-41.5	174.1	-69.6	-29.9	0	0	0	111.6	A751 R752 L753 R757	A751-D755 PolarHBondContact O-N 3.27Å; R752-D755 WeakPolarHBondContact CD-OD2 3.45Å; R752-D755 IonicContact CZ-OD2 2.71Å; R752-D755 IonicContact NE-OD2 3.51Å; R752-D755 IonicContact NH1-OD2 3.51Å; R752-D755 PolarHBondContact NH1-OD2 2.99Å; L753-D755 PolarHBondContact O-N 3.08Å; D755-R757 PolarHBondContact O-N 2.8Å
756	F	93.9	Very high	95.8	Very high	60 Å²	60	63.2 Å²	63.2	26%	0.263	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82	13.3	176.1	-65.6	-67.1	0	0	0	114.6	R752 L753 A754 I758 R786 L790 D793	R752-F756 WeakPolarHBondContact O-CD2 3.33Å; L753-F756 PolarHBondContact O-N 3.15Å; A754-F756 VanDerWaalsContact C-N 3.25Å; A754-F756 PolarHBondContact O-N 2.84Å; F756-I758 VanDerWaalsContact C-N 3.32Å; F756-I758 PolarHBondContact O-N 3.39Å; F756-R786 PolarHBondContact O-NH2 2.87Å; F756-L790 HydrophobicContact CB-CD1 3.78Å; F756-L790 HydrophobicContact CD1-CD1 4.42Å; F756-L790 HydrophobicContact CD1-CD2 3.92Å; F756-L790 HydrophobicContact CD2-CD1 4.44Å; F756-L790 HydrophobicContact CE1-CD2 4.2Å; F756-L790 HydrophobicContact CG-CD1 3.98Å; F756-L790 HydrophobicContact CG-CD2 4.25Å; F756-D793 HydrophobicContact CE1-CB 4.27Å; F756-D793 HydrophobicContact CZ-CB 3.78Å
757	R	94.4	Very high	95.7	Very high	216 Å²	216	65.3 Å²	65.3	82%	0.815	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.2	41.9	-172.8	-51.3	179.9	-175.2	178.6	1.3	112.8	A754 D755 R786	A754-R757 WeakPolarHBondContact O-CA 3.4Å; A754-R757 PolarHBondContact O-N 3.05Å; D755-R757 PolarHBondContact O-N 2.8Å; R757-R786 VanDerWaalsContact O-CZ 3.32Å; R757-R786 PolarHBondContact O-NH1 3.03Å; R757-R786 PolarHBondContact O-NH2 2.86Å
758	I	95.6	Very high	95.6	Very high	0 Å²	0	58.6 Å²	58.6	0%	0	30%	0.301	C	S	.	.			trans	-116.9	103.6	172.2	-63.3	-176.4	0	0	0	107.8	L753 A754 F756 A760 V782 R786 I787 L790	L753-I758 CarbonylContact C-O 3.58Å; L753-I758 HydrophobicContact CB-CB 4.31Å; L753-I758 HydrophobicContact CB-CG2 4.37Å; L753-I758 WeakPolarHBondContact CB-O 3.39Å; L753-I758 HydrophobicContact CD2-CB 4.43Å; L753-I758 HydrophobicContact CD2-CG2 4.19Å; L753-I758 CarbonylContact O-C 3.59Å; L753-I758 WeakPolarHBondContact O-CA 3.41Å; L753-I758 WeakPolarHBondContact O-CB 3.47Å; L753-I758 PolarHBondContact O-N 3.27Å; L753-I758 VanDerWaalsContact O-O 3.05Å; A754-I758 PolarHBondContact N-O 2.97Å; F756-I758 VanDerWaalsContact C-N 3.32Å; F756-I758 PolarHBondContact O-N 3.39Å; I758-A760 PolarHBondContact O-N 3.48Å; I758-V782 HydrophobicContact CG2-CG1 3.93Å; I758-R786 HydrophobicContact CD1-CB 4.43Å; I758-R786 HydrophobicContact CD1-CG 3.93Å; I758-I787 HydrophobicContact CD1-CG1 3.92Å; I758-I787 HydrophobicContact CG2-CD1 4.2Å; I758-I787 HydrophobicContact CG2-CG1 4.17Å; I758-L790 HydrophobicContact CD1-CD1 3.53Å
759	K	95.8	Very high	95.4	Very high	141 Å²	141	56.1 Å²	56.1	61%	0.613	29%	0.288	S	S	*	.			trans	-78.7	118.1	170.4	-173.8	174.6	-179.1	179.9	0	109.5	A779	K759-A779 HydrophobicContact CB-CB 3.91Å; K759-A779 HydrophobicContact CD-CB 4.49Å; K759-A779 HydrophobicContact CG-CB 4.2Å; K759-A779 VanDerWaalsContact O-CB 3.3Å; K759-A779 WeakPolarHBondContact O-CB 3.12Å; K759-A779 PolarHBondContact O-N 3.06Å
760	A	96.5	Very high	95.4	Very high	5 Å²	5	56.8 Å²	56.8	4%	0.041	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	143.4	172.7	0	0	0	0	0	108.7	L753 I758 N777 L778	L753-A760 HydrophobicContact CD1-CB 4.02Å; I758-A760 PolarHBondContact O-N 3.48Å; A760-N777 CarbonylContact C-O 3.5Å; A760-N777 VanDerWaalsContact CA-O 3.26Å; A760-N777 WeakPolarHBondContact CA-O 3.32Å; A760-L778 HydrophobicContact CB-CD2 3.55Å
761	D	97.6	Very high	95.4	Very high	62 Å²	62	53.7 Å²	53.7	33%	0.332	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	135.6	-178.9	-34.9	-55.1	0	0	0	108.5	E750 V763 N777	E750-D761 WeakPolarHBondContact OE1-CA 3.26Å; D761-V763 PolarHBondContact O-N 3.06Å; D761-N777 PolarHBondContact N-O 3.05Å; D761-N777 PolarHBondContact O-N 3.11Å
762	V	97.5	Very high	95.4	Very high	25 Å²	25	51.9 Å²	51.9	15%	0.152	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	104	177.6	176.4	0	0	0	0	108.8	A746 V749 E750 F774 L776	A746-V762 HydrophobicContact CB-CB 4.12Å; A746-V762 HydrophobicContact CB-CG1 3.79Å; A746-V762 HydrophobicContact CB-CG2 4.24Å; V749-V762 HydrophobicContact CG1-CG2 4.44Å; E750-V762 HydrophobicContact CG-CB 4.29Å; E750-V762 HydrophobicContact CG-CG2 3.72Å; E750-V762 PolarHBondContact OE1-N 3.44Å; V762-F774 HydrophobicContact CG1-CB 4.39Å; V762-F774 HydrophobicContact CG1-CD1 4.11Å; V762-L776 HydrophobicContact CG2-CD2 3.57Å
763	V	96.9	Very high	95.5	Very high	67 Å²	67	49.7 Å²	49.7	41%	0.406	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	-19.9	-176.2	-61.2	0	0	0	0	113.6	D761 E775 N777 Y814	D761-V763 PolarHBondContact O-N 3.06Å; V763-E775 HydrophobicContact CG2-CB 4.26Å; V763-E775 WeakPolarHBondContact CG2-O 3.42Å; V763-E775 PolarHBondContact N-O 2.93Å; V763-N777 HydrophobicContact CG1-CB 3.5Å; V763-N777 VanDerWaalsContact CG1-CB 3.5Å; V763-Y814 HydrophobicContact CG2-CD1 3.99Å; V763-Y814 HydrophobicContact CG2-CD2 3.78Å; V763-Y814 HydrophobicContact CG2-CE1 3.86Å; V763-Y814 HydrophobicContact CG2-CE2 3.66Å; V763-Y814 HydrophobicContact CG2-CG 3.96Å
764	N	96	Very high	95.5	Very high	68 Å²	68	49.8 Å²	49.8	36%	0.364	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-164.6	163.3	-177.9	-173.4	33.8	0	0	0	110.8	E775	N764-E775 HydrophobicContact CB-CB 4.18Å; N764-E775 HydrophobicContact CB-CG 4.31Å; N764-E775 WeakPolarHBondContact CB-OE2 3.32Å; N764-E775 PolarHBondContact ND2-OE2 3.14Å; N764-E775 PolarHBondContact O-N 3.07Å
765	Y	95.1	Very high	95.6	Very high	70 Å²	70	47.1 Å²	47.1	28%	0.275	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	154.8	168	49.5	-104.4	0	0	0	111.2	L742 R773 F774	L742-Y765 HydrophobicContact CB-CD2 4.22Å; L742-Y765 HydrophobicContact CB-CE1 4.46Å; L742-Y765 HydrophobicContact CB-CE2 4.01Å; L742-Y765 HydrophobicContact CD1-CD2 3.76Å; L742-Y765 HydrophobicContact CD1-CE2 3.81Å; Y765-R773 CarbonylContact C-O 3.6Å; Y765-R773 WeakPolarHBondContact CA-O 3.31Å; Y765-F774 HydrophobicContact CD1-CE1 4.47Å; Y765-F774 HydrophobicContact CG-CE1 4.43Å
766	S	93.9	Very high	95.8	Very high	36 Å²	36	42.2 Å²	42.2	25%	0.252	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	99.9	-177.8	-62	0	0	0	0	109.1	R773	S766-R773 PolarHBondContact N-O 2.86Å; S766-R773 PolarHBondContact O-N 3.05Å
767	P	94.3	Very high	95.9	Very high	51 Å²	51	42.3 Å²	42.3	33%	0.331	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	141.1	178.4	31.8	-33	0	0	0	111.1	V737 L742 T772	V737-P767 HydrophobicContact CG1-CB 4.01Å; V737-P767 HydrophobicContact CG1-CG 3.99Å; V737-P767 HydrophobicContact CG2-CB 4.37Å; V737-P767 HydrophobicContact CG2-CG 4.32Å; L742-P767 HydrophobicContact CD1-CB 3.96Å; L742-P767 HydrophobicContact CD1-CG 4.07Å; P767-T772 HydrophobicContact CB-CG2 4.31Å
768	G	93.3	Very high	96	Very high	13 Å²	13	33.6 Å²	33.6	13%	0.134	18%	0.178	C	C	.	.			trans	-133	-167.4	173	0	0	0	0	0	112.3	I771 N821 I853	G768-I771 CarbonylContact C-O 3.08Å; G768-I771 WeakPolarHBondContact CA-O 3.23Å; G768-I771 PolarHBondContact N-O 3.11Å; G768-N821 PolarHBondContact O-ND2 3.46Å; G768-I853 WeakPolarHBondContact CA-O 3.48Å
769	P	93	Very high	96	Very high	8 Å²	8	34.8 Å²	34.8	5%	0.052	19%	0.188	C	C	.	.	S	Bend	trans	-67.2	-39.1	-172.7	-22.1	33.3	0	0	0	114.3	N821 Q825 K851	P769-N821 PolarHBondContact O-ND2 3.24Å; P769-Q825 HydrophobicContact CB-CB 4.1Å; P769-Q825 PolarHBondContact O-N 3.46Å; P769-K851 HydrophobicContact CG-CD 4.22Å
770	V	95.4	Very high	96	Very high	15 Å²	15	34.6 Å²	34.6	9%	0.091	20%	0.202	C	C	.	.	S	Bend	trans	-114.1	-33.3	-173.9	-176.2	0	0	0	0	112.5	N821 R824 L1080 H1099	V770-N821 PolarHBondContact O-N 3.3Å; V770-R824 HydrophobicContact CG1-CG 4.13Å; V770-L1080 HydrophobicContact CG1-CD1 4.05Å; V770-H1099 HydrophobicContact CG2-CB 3.85Å
771	I	96	Very high	95.8	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	162.5	-177.9	72	83.4	0	0	0	111.6	G768 R773 E818 L819 N821 I853 L1080	G768-I771 CarbonylContact C-O 3.08Å; G768-I771 WeakPolarHBondContact CA-O 3.23Å; G768-I771 PolarHBondContact N-O 3.11Å; I771-R773 HydrophobicContact CD1-CB 4.25Å; I771-E818 HydrophobicContact CD1-CB 4.01Å; I771-E818 HydrophobicContact CD1-CG 3.98Å; I771-L819 CarbonylContact C-O 3.51Å; I771-L819 WeakPolarHBondContact CA-O 3.4Å; I771-L819 VanDerWaalsContact CB-O 3.26Å; I771-L819 WeakPolarHBondContact CB-O 3.22Å; I771-N821 PolarHBondContact O-OD1 2.98Å; I771-I853 HydrophobicContact CD1-CB 3.91Å; I771-I853 HydrophobicContact CD1-CG2 4.08Å; I771-I853 HydrophobicContact CG1-CB 4.21Å; I771-I853 HydrophobicContact CG1-CG2 4.03Å; I771-L1080 HydrophobicContact CG2-CD1 3.45Å; I771-L1080 VanDerWaalsContact CG2-CD1 3.45Å
772	T	96.5	Very high	95.6	Very high	5 Å²	5	37 Å²	37	3%	0.031	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	129.3	163.7	-64	0	0	0	0	108.8	L742 P767 F774 L819 N821	L742-T772 HydrophobicContact CD1-CG2 4.46Å; L742-T772 HydrophobicContact CD2-CG2 3.99Å; P767-T772 HydrophobicContact CB-CG2 4.31Å; T772-F774 HydrophobicContact CG2-CD2 4.24Å; T772-F774 HydrophobicContact CG2-CE1 4.45Å; T772-F774 HydrophobicContact CG2-CE2 3.64Å; T772-F774 HydrophobicContact CG2-CZ 3.77Å; T772-L819 PolarHBondContact N-O 2.95Å; T772-L819 PolarHBondContact O-N 2.87Å; T772-N821 PolarHBondContact N-OD1 3.36Å; T772-N821 VanDerWaalsContact N-OD1 3.17Å; T772-N821 PolarHBondContact OG1-OD1 2.85Å
773	R	97.1	Very high	95.5	Very high	38 Å²	38	43.7 Å²	43.7	14%	0.143	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	121.1	173.5	-175.1	-175.4	-70.9	161.6	-1.7	109.8	Y765 S766 I771 E818 I853	Y765-R773 CarbonylContact C-O 3.6Å; Y765-R773 WeakPolarHBondContact CA-O 3.31Å; S766-R773 PolarHBondContact N-O 2.86Å; S766-R773 PolarHBondContact O-N 3.05Å; I771-R773 HydrophobicContact CD1-CB 4.25Å; R773-E818 HydrophobicContact CB-CG 4.1Å; R773-E818 HydrophobicContact CG-CG 4Å; R773-E818 IonicContact CZ-OE1 2.76Å; R773-E818 VanDerWaalsContact CZ-OE1 3.3Å; R773-E818 IonicContact NE-OE1 2.68Å; R773-E818 PolarHBondContact NE-OE1 3.41Å; R773-E818 IonicContact NH2-OE1 3.27Å; R773-E818 PolarHBondContact NH2-OE1 2.82Å; R773-I853 VanDerWaalsContact CZ-CD1 3.49Å
774	F	97.5	Very high	95.3	Very high	2 Å²	2	41.4 Å²	41.4	1%	0.009	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	136.8	167.8	-61.9	-93.5	0	0	0	108.8	L742 M745 A746 V762 Y765 T772 G816 L817 L819	L742-F774 HydrophobicContact CD2-CZ 4.28Å; M745-F774 HydrophobicContact CB-CE1 4.34Å; M745-F774 HydrophobicContact CB-CZ 3.93Å; M745-F774 HydrophobicContact CG-CE1 4.28Å; M745-F774 HydrophobicContact CG-CE2 4.04Å; M745-F774 HydrophobicContact CG-CZ 3.59Å; A746-F774 HydrophobicContact CB-CD1 4.05Å; A746-F774 HydrophobicContact CB-CE1 3.99Å; V762-F774 HydrophobicContact CG1-CB 4.39Å; V762-F774 HydrophobicContact CG1-CD1 4.11Å; Y765-F774 HydrophobicContact CD1-CE1 4.47Å; Y765-F774 HydrophobicContact CG-CE1 4.43Å; T772-F774 HydrophobicContact CG2-CD2 4.24Å; T772-F774 HydrophobicContact CG2-CE1 4.45Å; T772-F774 HydrophobicContact CG2-CE2 3.64Å; T772-F774 HydrophobicContact CG2-CZ 3.77Å; F774-G816 WeakPolarHBondContact O-CA 3.34Å; F774-L817 PolarHBondContact N-O 3.12Å; F774-L817 PolarHBondContact O-N 2.79Å; F774-L819 HydrophobicContact CD2-CD1 4Å; F774-L819 HydrophobicContact CD2-CG 4.02Å; F774-L819 HydrophobicContact CE2-CB 4.18Å; F774-L819 HydrophobicContact CE2-CD1 3.62Å; F774-L819 HydrophobicContact CE2-CG 3.92Å; F774-L819 HydrophobicContact CZ-CD1 4.42Å
775	E	97.6	Very high	95	Very high	5 Å²	5	40.3 Å²	40.3	2%	0.023	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	115.7	-179.5	-52.5	-164.9	130.7	0	0	109.2	V763 N764 I809 K812 Y814	V763-E775 HydrophobicContact CG2-CB 4.26Å; V763-E775 WeakPolarHBondContact CG2-O 3.42Å; V763-E775 PolarHBondContact N-O 2.93Å; N764-E775 HydrophobicContact CB-CB 4.18Å; N764-E775 HydrophobicContact CB-CG 4.31Å; N764-E775 WeakPolarHBondContact CB-OE2 3.32Å; N764-E775 PolarHBondContact ND2-OE2 3.14Å; N764-E775 PolarHBondContact O-N 3.07Å; E775-I809 HydrophobicContact CB-CD1 4.24Å; E775-I809 HydrophobicContact CG-CD1 3.85Å; E775-I809 WeakPolarHBondContact OE1-CD1 3.4Å; E775-K812 WeakPolarHBondContact OE1-CD 3.35Å; E775-K812 IonicContact OE1-NZ 2.68Å; E775-K812 PolarHBondContact OE1-NZ 3.29Å; E775-K812 IonicContact OE2-NZ 3.58Å; E775-K812 PolarHBondContact OE2-NZ 3.07Å; E775-Y814 HydrophobicContact CB-CD2 4.26Å
776	L	97.3	Very high	94.9	Very high	0 Å²	0	42 Å²	42	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	122.8	-172.2	-56.4	179.1	0	0	0	111.5	V749 L753 V762 L778 I787 Y814 V815 L817	V749-L776 HydrophobicContact CG1-CD2 4.11Å; L753-L776 HydrophobicContact CD1-CD1 3.72Å; L753-L776 HydrophobicContact CD1-CD2 4.19Å; V762-L776 HydrophobicContact CG2-CD2 3.57Å; L776-L778 HydrophobicContact CB-CD2 3.96Å; L776-I787 HydrophobicContact CD1-CD1 4.41Å; L776-Y814 WeakPolarHBondContact O-CA 3.29Å; L776-Y814 WeakPolarHBondContact O-CB 3.49Å; L776-V815 HydrophobicContact CB-CB 4.42Å; L776-V815 WeakPolarHBondContact CB-O 3.25Å; L776-V815 PolarHBondContact N-O 2.73Å; L776-V815 PolarHBondContact O-N 3.3Å; L776-L817 HydrophobicContact CD1-CB 3.9Å; L776-L817 HydrophobicContact CD1-CD1 3.84Å; L776-L817 HydrophobicContact CG-CB 4.31Å
777	N	97.2	Very high	94.9	Very high	62 Å²	62	40.3 Å²	40.3	33%	0.332	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	113	164.3	177.7	59	0	0	0	109	A760 D761 V763 Y814	A760-N777 CarbonylContact C-O 3.5Å; A760-N777 VanDerWaalsContact CA-O 3.26Å; A760-N777 WeakPolarHBondContact CA-O 3.32Å; D761-N777 PolarHBondContact N-O 3.05Å; D761-N777 PolarHBondContact O-N 3.11Å; V763-N777 HydrophobicContact CG1-CB 3.5Å; V763-N777 VanDerWaalsContact CG1-CB 3.5Å; N777-Y814 HydrophobicContact CB-CD1 4.13Å; N777-Y814 HydrophobicContact CB-CE1 4.21Å
778	L	96.4	Very high	94.8	Very high	32 Å²	32	38.8 Å²	38.8	17%	0.168	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	142.4	-177.6	-52.9	-167.2	0	0	0	111.3	A760 L776 V782 I787 V815	A760-L778 HydrophobicContact CB-CD2 3.55Å; L776-L778 HydrophobicContact CB-CD2 3.96Å; L778-V782 HydrophobicContact CB-CB 4.19Å; L778-V782 HydrophobicContact CB-CG1 4.35Å; L778-V782 HydrophobicContact CD1-CG1 4.04Å; L778-I787 HydrophobicContact CD1-CD1 3.94Å; L778-I787 HydrophobicContact CD2-CD1 3.55Å; L778-I787 HydrophobicContact CG-CD1 4.43Å; L778-V815 HydrophobicContact CD1-CG2 3.71Å; L778-V815 HydrophobicContact CG-CG2 4.07Å
779	A	96.2	Very high	94.6	Very high	25 Å²	25	44.1 Å²	44.1	21%	0.207	26%	0.26	C	S	.	.	P	Polyproline II helix	trans	-61.8	145.3	173.5	0	0	0	0	0	111.6	K759 G781 V782	K759-A779 HydrophobicContact CB-CB 3.91Å; K759-A779 HydrophobicContact CD-CB 4.49Å; K759-A779 HydrophobicContact CG-CB 4.2Å; K759-A779 VanDerWaalsContact O-CB 3.3Å; K759-A779 WeakPolarHBondContact O-CB 3.12Å; K759-A779 PolarHBondContact O-N 3.06Å; A779-G781 PolarHBondContact O-N 3.23Å; A779-V782 HydrophobicContact CB-CG2 4.16Å; A779-V782 VanDerWaalsContact O-CB 3.32Å; A779-V782 WeakPolarHBondContact O-CB 3.49Å; A779-V782 WeakPolarHBondContact O-CG2 3.3Å; A779-V782 PolarHBondContact O-N 3Å
780	P	94.9	Very high	94.6	Very high	138 Å²	138	45.4 Å²	45.4	90%	0.896	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.5	128.3	-177.9	-29.7	36	0	0	0	113.5
781	G	92.4	Very high	94.4	Very high	82 Å²	82	45.6 Å²	45.6	85%	0.845	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	92.1	-13.3	-177.7	0	0	0	0	0	115.3	A779 K783	A779-G781 PolarHBondContact O-N 3.23Å; G781-K783 PolarHBondContact O-N 2.94Å
782	V	94.1	Very high	94.1	Very high	34 Å²	34	54.7 Å²	54.7	21%	0.206	30%	0.302	C	S	.	.			trans	-74.1	122	173.2	179.4	0	0	0	0	109.9	I758 L778 A779	I758-V782 HydrophobicContact CG2-CG1 3.93Å; L778-V782 HydrophobicContact CB-CB 4.19Å; L778-V782 HydrophobicContact CB-CG1 4.35Å; L778-V782 HydrophobicContact CD1-CG1 4.04Å; A779-V782 HydrophobicContact CB-CG2 4.16Å; A779-V782 VanDerWaalsContact O-CB 3.32Å; A779-V782 WeakPolarHBondContact O-CB 3.49Å; A779-V782 WeakPolarHBondContact O-CG2 3.3Å; A779-V782 PolarHBondContact O-N 3Å
783	K	93.8	Very high	94	Very high	166 Å²	166	57.2 Å²	57.2	72%	0.722	32%	0.316	S	S	*	.			trans	-87	136.2	176.5	-62.2	-179.8	-179.7	178.2	0	111.3	G781 A785 R786	G781-K783 PolarHBondContact O-N 2.94Å; K783-A785 VanDerWaalsContact C-N 3.31Å; K783-A785 PolarHBondContact O-N 3.31Å; K783-R786 WeakPolarHBondContact O-CB 3.15Å; K783-R786 PolarHBondContact O-N 3.32Å; K783-R786 VanDerWaalsContact O-N 3.07Å
784	A	92.3	Very high	93.8	Very high	20 Å²	20	55.4 Å²	55.4	17%	0.165	31%	0.309	C	S	.	.	H	α-helix	trans	-53.5	-44.1	177.5	0	0	0	0	0	113.2	R786 I787 S788 E807 V815	A784-R786 PolarHBondContact O-N 2.77Å; A784-I787 WeakPolarHBondContact O-CA 3.27Å; A784-I787 WeakPolarHBondContact O-CB 3.46Å; A784-I787 PolarHBondContact O-N 3.18Å; A784-S788 PolarHBondContact O-N 2.94Å; A784-S788 PolarHBondContact O-OG 3.01Å; A784-E807 HydrophobicContact CB-CB 3.89Å; A784-E807 HydrophobicContact CB-CG 4Å; A784-V815 HydrophobicContact CB-CG2 3.7Å
785	A	91.6	Very high	93.6	Very high	44 Å²	44	55.6 Å²	55.6	36%	0.364	31%	0.311	S	S	.	.	H	α-helix	trans	-53.8	-25.4	177.8	0	0	0	0	0	114.8	K783 I787 S788 N789 E807	K783-A785 VanDerWaalsContact C-N 3.31Å; K783-A785 PolarHBondContact O-N 3.31Å; A785-I787 VanDerWaalsContact C-N 3.3Å; A785-I787 PolarHBondContact O-N 2.79Å; A785-S788 PolarHBondContact O-N 3.33Å; A785-N789 PolarHBondContact O-N 2.87Å; A785-E807 WeakPolarHBondContact CA-OE1 3.14Å
786	R	92.9	Very high	93.5	Very high	107 Å²	107	63.6 Å²	63.6	40%	0.404	34%	0.341	S	S	.	.	H	α-helix	trans	-66.6	-33.2	174.7	-167.9	-177.4	167	-153.2	-11.3	111.7	F756 R757 I758 K783 A784 L790	F756-R786 PolarHBondContact O-NH2 2.87Å; R757-R786 VanDerWaalsContact O-CZ 3.32Å; R757-R786 PolarHBondContact O-NH1 3.03Å; R757-R786 PolarHBondContact O-NH2 2.86Å; I758-R786 HydrophobicContact CD1-CB 4.43Å; I758-R786 HydrophobicContact CD1-CG 3.93Å; K783-R786 WeakPolarHBondContact O-CB 3.15Å; K783-R786 PolarHBondContact O-N 3.32Å; K783-R786 VanDerWaalsContact O-N 3.07Å; A784-R786 PolarHBondContact O-N 2.77Å; R786-L790 WeakPolarHBondContact O-CD1 3.45Å; R786-L790 WeakPolarHBondContact O-CG 3.49Å
787	I	93.5	Very high	93.3	Very high	0 Å²	0	65 Å²	65	0%	0	35%	0.351	C	S	.	.	H	α-helix	trans	-77	-42	174.1	-51.6	175.9	0	0	0	109.6	L753 I758 L776 L778 A784 A785 N789 L790 S791 L794 V805	L753-I787 HydrophobicContact CD2-CD1 4.47Å; L753-I787 HydrophobicContact CD2-CG1 4.4Å; L753-I787 HydrophobicContact CD2-CG2 4.08Å; I758-I787 HydrophobicContact CD1-CG1 3.92Å; I758-I787 HydrophobicContact CG2-CD1 4.2Å; I758-I787 HydrophobicContact CG2-CG1 4.17Å; L776-I787 HydrophobicContact CD1-CD1 4.41Å; L778-I787 HydrophobicContact CD1-CD1 3.94Å; L778-I787 HydrophobicContact CD2-CD1 3.55Å; L778-I787 HydrophobicContact CG-CD1 4.43Å; A784-I787 WeakPolarHBondContact O-CA 3.27Å; A784-I787 WeakPolarHBondContact O-CB 3.46Å; A784-I787 PolarHBondContact O-N 3.18Å; A785-I787 VanDerWaalsContact C-N 3.3Å; A785-I787 PolarHBondContact O-N 2.79Å; I787-N789 VanDerWaalsContact C-N 3.26Å; I787-N789 PolarHBondContact O-N 3.1Å; I787-L790 CarbonylContact O-C 3.6Å; I787-L790 PolarHBondContact O-N 3Å; I787-S791 PolarHBondContact O-N 2.91Å; I787-S791 VanDerWaalsContact O-N 3.11Å; I787-L794 HydrophobicContact CG2-CD1 3.97Å; I787-V805 HydrophobicContact CB-CG1 4.32Å; I787-V805 HydrophobicContact CG2-CG1 4.19Å; I787-V805 HydrophobicContact CG2-CG2 3.94Å
788	S	91.2	Very high	93.2	Very high	18 Å²	18	62.6 Å²	62.6	13%	0.126	34%	0.338	C	S	.	.	H	α-helix	trans	-56.8	-37.7	176.9	-50	0	0	0	0	113	A784 A785 S791 E807	A784-S788 PolarHBondContact O-N 2.94Å; A784-S788 PolarHBondContact O-OG 3.01Å; A785-S788 PolarHBondContact O-N 3.33Å; S788-S791 WeakPolarHBondContact O-CB 3.43Å; S788-S791 PolarHBondContact O-OG 3.29Å; S788-E807 VanDerWaalsContact CB-OE1 3.3Å; S788-E807 WeakPolarHBondContact CB-OE1 3.47Å; S788-E807 WeakPolarHBondContact OG-CG 3.46Å; S788-E807 PolarHBondContact OG-OE1 2.89Å
789	N	90.6	Very high	93	Very high	126 Å²	126	66.7 Å²	66.7	67%	0.674	37%	0.369	S	S	*	.	H	α-helix	trans	-72.7	-30.7	175.2	-73.5	-7.1	0	0	0	113.2	A785 I787 S791	A785-N789 PolarHBondContact O-N 2.87Å; I787-N789 VanDerWaalsContact C-N 3.26Å; I787-N789 PolarHBondContact O-N 3.1Å; N789-S791 VanDerWaalsContact C-N 3.35Å
790	L	92	Very high	92.8	Very high	35 Å²	35	66.7 Å²	66.7	18%	0.183	37%	0.366	C	S	.	.	H	α-helix	trans	-83.4	-4	176.9	-72.9	167.8	0	0	0	114.2	F756 I758 R786 I787 R792 D793 L794	F756-L790 HydrophobicContact CB-CD1 3.78Å; F756-L790 HydrophobicContact CD1-CD1 4.42Å; F756-L790 HydrophobicContact CD1-CD2 3.92Å; F756-L790 HydrophobicContact CD2-CD1 4.44Å; F756-L790 HydrophobicContact CE1-CD2 4.2Å; F756-L790 HydrophobicContact CG-CD1 3.98Å; F756-L790 HydrophobicContact CG-CD2 4.25Å; I758-L790 HydrophobicContact CD1-CD1 3.53Å; R786-L790 WeakPolarHBondContact O-CD1 3.45Å; R786-L790 WeakPolarHBondContact O-CG 3.49Å; I787-L790 CarbonylContact O-C 3.6Å; I787-L790 PolarHBondContact O-N 3Å; L790-R792 PolarHBondContact O-N 3.2Å; L790-D793 PolarHBondContact O-N 3.06Å; L790-L794 WeakPolarHBondContact O-CB 3.37Å; L790-L794 PolarHBondContact O-N 2.94Å
791	S	91.1	Very high	92.6	Very high	19 Å²	19	66 Å²	66	13%	0.133	36%	0.36	C	S	.	.	H	α-helix	trans	-43.8	-41	-176	46.1	0	0	0	0	115.3	I787 S788 N789 A795	I787-S791 PolarHBondContact O-N 2.91Å; I787-S791 VanDerWaalsContact O-N 3.11Å; S788-S791 WeakPolarHBondContact O-CB 3.43Å; S788-S791 PolarHBondContact O-OG 3.29Å; N789-S791 VanDerWaalsContact C-N 3.35Å; S791-A795 WeakPolarHBondContact O-CB 3.3Å; S791-A795 PolarHBondContact O-N 3.33Å
792	R	90.8	Very high	92.5	Very high	190 Å²	190	63 Å²	63	72%	0.717	33%	0.327	S	S	*	.	H	α-helix	trans	-69.2	-43.8	177.1	-70.6	179.8	171.7	175.9	-5.9	113.3	L790 A795 R796	L790-R792 PolarHBondContact O-N 3.2Å; R792-A795 PolarHBondContact O-N 3.24Å; R792-R796 WeakPolarHBondContact O-CB 3.28Å; R792-R796 PolarHBondContact O-N 2.72Å; R792-R796 VanDerWaalsContact O-N 3.11Å
793	D	93.6	Very high	92.5	Very high	58 Å²	58	61.6 Å²	61.6	31%	0.31	32%	0.318	S	S	.	.	H	α-helix	trans	-73.5	-30.8	178.5	-69.7	-58.8	0	0	0	112.6	F756 L790 R796 S797	F756-D793 HydrophobicContact CE1-CB 4.27Å; F756-D793 HydrophobicContact CZ-CB 3.78Å; L790-D793 PolarHBondContact O-N 3.06Å; D793-R796 PolarHBondContact O-N 3.2Å; D793-R796 IonicContact OD1-CZ 3.72Å; D793-R796 IonicContact OD1-NE 3.32Å; D793-R796 PolarHBondContact OD1-NE 2.7Å; D793-R796 IonicContact OD1-NH2 2.79Å; D793-R796 PolarHBondContact OD1-NH2 2.65Å; D793-S797 WeakPolarHBondContact O-CB 3.38Å; D793-S797 PolarHBondContact O-N 2.61Å; D793-S797 PolarHBondContact O-OG 2.94Å
794	L	93.8	Very high	92.5	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-67.9	-42.6	172.6	-148.5	170.5	0	0	0	110.6	L753 I787 L790 R796 S797 L798 V803 L817	L753-L794 HydrophobicContact CD2-CD1 3.74Å; I787-L794 HydrophobicContact CG2-CD1 3.97Å; L790-L794 WeakPolarHBondContact O-CB 3.37Å; L790-L794 PolarHBondContact O-N 2.94Å; L794-R796 VanDerWaalsContact C-N 3.35Å; L794-R796 PolarHBondContact O-N 3.09Å; L794-S797 PolarHBondContact O-N 3.32Å; L794-S797 PolarHBondContact O-OG 2.93Å; L794-L798 HydrophobicContact CD2-CD1 3.35Å; L794-L798 HydrophobicContact CD2-CG 3.91Å; L794-L798 WeakPolarHBondContact O-CG 3.22Å; L794-L798 PolarHBondContact O-N 3.41Å; L794-L798 VanDerWaalsContact O-N 3.11Å; L794-V803 HydrophobicContact CD2-CG1 4.45Å; L794-V803 HydrophobicContact CD2-CG2 4.45Å; L794-L817 HydrophobicContact CD1-CD1 3.73Å; L794-L817 HydrophobicContact CD2-CD1 4.14Å
795	A	93.3	Very high	92.6	Very high	6 Å²	6	54.9 Å²	54.9	5%	0.05	29%	0.286	C	S	.	.	H	α-helix	trans	-58.1	-47.7	172.7	0	0	0	0	0	112	S791 R792 L798 S799 T800 V803	S791-A795 WeakPolarHBondContact O-CB 3.3Å; S791-A795 PolarHBondContact O-N 3.33Å; R792-A795 PolarHBondContact O-N 3.24Å; A795-L798 PolarHBondContact O-N 3.11Å; A795-S799 PolarHBondContact O-N 3.2Å; A795-S799 VanDerWaalsContact O-N 3.17Å; A795-T800 CarbonylContact C-O 3.54Å; A795-T800 WeakPolarHBondContact CA-OG1 3.31Å; A795-T800 PolarHBondContact O-N 2.68Å; A795-T800 PolarHBondContact O-OG1 2.79Å; A795-V803 VanDerWaalsContact CA-CG2 3.47Å; A795-V803 HydrophobicContact CB-CB 4.22Å; A795-V803 HydrophobicContact CB-CG2 3.69Å
796	R	94.5	Very high	92.7	Very high	173 Å²	173	53.6 Å²	53.6	65%	0.653	27%	0.274	S	S	*	.	H	α-helix	trans	-61.1	-41.5	176.3	-175.7	171.8	61.7	83.6	-3.7	113	R792 D793 L794 L798 S799	R792-R796 WeakPolarHBondContact O-CB 3.28Å; R792-R796 PolarHBondContact O-N 2.72Å; R792-R796 VanDerWaalsContact O-N 3.11Å; D793-R796 PolarHBondContact O-N 3.2Å; D793-R796 IonicContact OD1-CZ 3.72Å; D793-R796 IonicContact OD1-NE 3.32Å; D793-R796 PolarHBondContact OD1-NE 2.7Å; D793-R796 IonicContact OD1-NH2 2.79Å; D793-R796 PolarHBondContact OD1-NH2 2.65Å; L794-R796 VanDerWaalsContact C-N 3.35Å; L794-R796 PolarHBondContact O-N 3.09Å; R796-L798 VanDerWaalsContact C-N 3.34Å; R796-S799 PolarHBondContact O-N 3.23Å
797	S	93.9	Very high	92.7	Very high	31 Å²	31	53 Å²	53	22%	0.217	28%	0.276	C	S	.	.	H	α-helix	trans	-78.4	-14.9	-177.9	73.3	0	0	0	0	114.9	R752 D793 L794	R752-S797 PolarHBondContact NE-O 3.45Å; R752-S797 VanDerWaalsContact NE-O 3.16Å; D793-S797 WeakPolarHBondContact O-CB 3.38Å; D793-S797 PolarHBondContact O-N 2.61Å; D793-S797 PolarHBondContact O-OG 2.94Å; L794-S797 PolarHBondContact O-N 3.32Å; L794-S797 PolarHBondContact O-OG 2.93Å
798	L	93.7	Very high	92.6	Very high	11 Å²	11	57.4 Å²	57.4	6%	0.058	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.6	-0.9	169.9	-64.5	178.2	0	0	0	113.7	M745 L748 V749 R752 L794 A795 R796 T800 L819	M745-L798 HydrophobicContact SD-CD2 4.36Å; L748-L798 HydrophobicContact CB-CD2 4.43Å; L748-L798 HydrophobicContact CD2-CD2 3.81Å; L748-L798 HydrophobicContact CG-CD2 3.68Å; V749-L798 HydrophobicContact CG2-CD1 3.95Å; V749-L798 HydrophobicContact CG2-CD2 4.31Å; R752-L798 HydrophobicContact CB-CD2 4.32Å; R752-L798 HydrophobicContact CG-CD2 3.77Å; R752-L798 HydrophobicContact CG-CG 4.45Å; L794-L798 HydrophobicContact CD2-CD1 3.35Å; L794-L798 HydrophobicContact CD2-CG 3.91Å; L794-L798 WeakPolarHBondContact O-CG 3.22Å; L794-L798 PolarHBondContact O-N 3.41Å; L794-L798 VanDerWaalsContact O-N 3.11Å; A795-L798 PolarHBondContact O-N 3.11Å; R796-L798 VanDerWaalsContact C-N 3.34Å; L798-T800 VanDerWaalsContact C-N 3.31Å; L798-T800 HydrophobicContact CB-CG2 4.1Å; L798-T800 PolarHBondContact O-N 3.17Å; L798-L819 HydrophobicContact CD1-CD1 3.94Å; L798-L819 HydrophobicContact CD1-CD2 3.66Å; L798-L819 HydrophobicContact CD1-CG 4.47Å
799	S	93.6	Very high	92.7	Very high	118 Å²	118	57 Å²	57	83%	0.825	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.6	44.1	-172.3	-55.4	0	0	0	0	113.2	A795 R796	A795-S799 PolarHBondContact O-N 3.2Å; A795-S799 VanDerWaalsContact O-N 3.17Å; R796-S799 PolarHBondContact O-N 3.23Å
800	T	92	Very high	92.6	Very high	24 Å²	24	55.7 Å²	55.7	15%	0.147	30%	0.297	C	S	.	.			trans	-116	149.4	178.1	56	0	0	0	0	111.3	A795 L798 A802 V803 P820	A795-T800 CarbonylContact C-O 3.54Å; A795-T800 WeakPolarHBondContact CA-OG1 3.31Å; A795-T800 PolarHBondContact O-N 2.68Å; A795-T800 PolarHBondContact O-OG1 2.79Å; L798-T800 VanDerWaalsContact C-N 3.31Å; L798-T800 HydrophobicContact CB-CG2 4.1Å; L798-T800 PolarHBondContact O-N 3.17Å; T800-A802 PolarHBondContact O-N 3.26Å; T800-V803 WeakPolarHBondContact OG1-CG2 3.46Å; T800-P820 HydrophobicContact CG2-CG 4.21Å
801	V	89.5	Confident	92.7	Very high	124 Å²	124	58.3 Å²	58.3	75%	0.752	33%	0.333	S	S	*	.	S	Bend	trans	-62.2	-41.7	-176	179.9	0	0	0	0	112.3
802	A	90.9	Very high	92.8	Very high	19 Å²	19	61.3 Å²	61.3	16%	0.157	34%	0.344	C	S	.	.			trans	-155.5	155.8	176.7	0	0	0	0	0	109.7	T800 P820 L1080	T800-A802 PolarHBondContact O-N 3.26Å; A802-P820 VanDerWaalsContact O-CD 3.27Å; A802-P820 WeakPolarHBondContact O-CD 3.41Å; A802-L1080 HydrophobicContact CB-CD2 4.13Å
803	V	93.7	Very high	93	Very high	4 Å²	4	57.7 Å²	57.7	2%	0.024	35%	0.345	C	S	.	.			trans	-128	125	172.7	175.3	0	0	0	0	108.3	L794 A795 T800 L817 L819	L794-V803 HydrophobicContact CD2-CG1 4.45Å; L794-V803 HydrophobicContact CD2-CG2 4.45Å; A795-V803 VanDerWaalsContact CA-CG2 3.47Å; A795-V803 HydrophobicContact CB-CB 4.22Å; A795-V803 HydrophobicContact CB-CG2 3.69Å; T800-V803 WeakPolarHBondContact OG1-CG2 3.46Å; V803-L817 HydrophobicContact CG1-CD1 4.35Å; V803-L817 HydrophobicContact CG1-CD2 3.65Å; V803-L817 HydrophobicContact CG1-CG 3.75Å; V803-L819 HydrophobicContact CB-CD2 4.37Å; V803-L819 HydrophobicContact CG1-CD2 4.1Å; V803-L819 HydrophobicContact CG2-CD2 3.52Å
804	R	94.3	Very high	93.1	Very high	22 Å²	22	58.2 Å²	58.2	8%	0.083	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	124	175.9	178.6	168.8	177.1	-89.8	-3	110.1	E818 S1078	R804-E818 HydrophobicContact CB-CB 4.22Å; R804-E818 WeakPolarHBondContact CD-OE2 3.41Å; R804-E818 IonicContact CZ-OE2 3.6Å; R804-E818 PolarHBondContact N-O 3.42Å; R804-E818 IonicContact NH1-OE1 2.82Å; R804-E818 PolarHBondContact NH1-OE1 3.39Å; R804-E818 IonicContact NH1-OE2 2.82Å; R804-E818 PolarHBondContact NH1-OE2 3.46Å; R804-E818 PolarHBondContact O-N 3Å; R804-S1078 WeakPolarHBondContact CB-OG 3.34Å; R804-S1078 WeakPolarHBondContact CD-OG 3.5Å; R804-S1078 VanDerWaalsContact CG-OG 3.31Å; R804-S1078 WeakPolarHBondContact CG-OG 3.37Å
805	V	93.9	Very high	93.2	Very high	23 Å²	23	58.6 Å²	58.6	14%	0.139	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	129.9	177.1	-175.7	0	0	0	0	108.8	I787 V815	I787-V805 HydrophobicContact CB-CG1 4.32Å; I787-V805 HydrophobicContact CG2-CG1 4.19Å; I787-V805 HydrophobicContact CG2-CG2 3.94Å; V805-V815 HydrophobicContact CG1-CG1 3.8Å
806	V	94	Very high	93.4	Very high	18 Å²	18	58.3 Å²	58.3	11%	0.109	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	95	179.9	-177.5	0	0	0	0	107.5	V808 G816 E818	V806-V808 WeakPolarHBondContact CG1-O 3.39Å; V806-V808 PolarHBondContact O-N 2.84Å; V806-V808 VanDerWaalsContact O-N 3.13Å; V806-G816 PolarHBondContact N-O 2.98Å; V806-G816 PolarHBondContact O-N 3.31Å; V806-E818 HydrophobicContact CG2-CG 4.12Å; V806-E818 WeakPolarHBondContact CG2-OE1 3.49Å
807	E	92.3	Very high	93.4	Very high	95 Å²	95	50.1 Å²	50.1	44%	0.444	31%	0.312	S	S	.	.	S	Bend	trans	-62.1	-23.8	-170.1	-59	-164.3	168.2	0	0	114.3	A784 A785 S788	A784-E807 HydrophobicContact CB-CB 3.89Å; A784-E807 HydrophobicContact CB-CG 4Å; A785-E807 WeakPolarHBondContact CA-OE1 3.14Å; S788-E807 VanDerWaalsContact CB-OE1 3.3Å; S788-E807 WeakPolarHBondContact CB-OE1 3.47Å; S788-E807 WeakPolarHBondContact OG-CG 3.46Å; S788-E807 PolarHBondContact OG-OE1 2.89Å
808	V	91.9	Very high	93.6	Very high	92 Å²	92	48.7 Å²	48.7	56%	0.558	30%	0.302	S	S	*	.			trans	-137.4	116.6	175.2	-178.7	0	0	0	0	109.4	V806	V806-V808 WeakPolarHBondContact CG1-O 3.39Å; V806-V808 PolarHBondContact O-N 2.84Å; V806-V808 VanDerWaalsContact O-N 3.13Å
809	I	92.9	Very high	93.6	Very high	8 Å²	8	48.4 Å²	48.4	4%	0.041	30%	0.3	C	S	.	.			trans	-84.1	122.5	165.7	-60	176.8	0	0	0	108.5	E775 G811 K812 Y814	E775-I809 HydrophobicContact CB-CD1 4.24Å; E775-I809 HydrophobicContact CG-CD1 3.85Å; E775-I809 WeakPolarHBondContact OE1-CD1 3.4Å; I809-G811 PolarHBondContact O-N 3.44Å; I809-K812 HydrophobicContact CB-CB 4.2Å; I809-K812 HydrophobicContact CG2-CB 4.12Å; I809-K812 HydrophobicContact CG2-CD 4.08Å; I809-K812 HydrophobicContact CG2-CG 4.24Å; I809-K812 PolarHBondContact O-N 3.31Å; I809-Y814 WeakPolarHBondContact CG1-O 3.48Å; I809-Y814 PolarHBondContact N-O 3.04Å
810	P	89.9	Confident	93.7	Very high	99 Å²	99	43.8 Å²	43.8	64%	0.643	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54	123.8	179	-28.4	36.3	0	0	0	112.6	K812 L1094	P810-K812 VanDerWaalsContact C-N 3.33Å; P810-K812 PolarHBondContact O-N 2.94Å; P810-L1094 HydrophobicContact CG-CD1 4.5Å
811	G	92.4	Very high	93.8	Very high	91 Å²	91	44.3 Å²	44.3	94%	0.938	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.1	1.8	179.7	0	0	0	0	0	116.2	I809	I809-G811 PolarHBondContact O-N 3.44Å
812	K	94.3	Very high	93.9	Very high	82 Å²	82	48.2 Å²	48.2	36%	0.357	28%	0.276	S	S	.	.	S	Bend	trans	-128.1	148.2	177.7	-60.8	-174.3	-174.9	176.1	0	111.7	E775 I809 P810 Y814	E775-K812 WeakPolarHBondContact OE1-CD 3.35Å; E775-K812 IonicContact OE1-NZ 2.68Å; E775-K812 PolarHBondContact OE1-NZ 3.29Å; E775-K812 IonicContact OE2-NZ 3.58Å; E775-K812 PolarHBondContact OE2-NZ 3.07Å; I809-K812 HydrophobicContact CB-CB 4.2Å; I809-K812 HydrophobicContact CG2-CB 4.12Å; I809-K812 HydrophobicContact CG2-CD 4.08Å; I809-K812 HydrophobicContact CG2-CG 4.24Å; I809-K812 PolarHBondContact O-N 3.31Å; P810-K812 VanDerWaalsContact C-N 3.33Å; P810-K812 PolarHBondContact O-N 2.94Å; K812-Y814 HydrophobicContact CB-CD2 3.95Å; K812-Y814 HydrophobicContact CB-CE2 4.5Å; K812-Y814 HydrophobicContact CD-CD2 4.13Å; K812-Y814 PolarHBondContact O-N 3.17Å
813	P	94.7	Very high	93.8	Very high	114 Å²	114	53.8 Å²	53.8	74%	0.74	30%	0.297	S	S	*	.	S	Bend	trans	-83.1	14.9	178.4	36	-36.4	0	0	0	113.5
814	Y	96.1	Very high	93.7	Very high	69 Å²	69	57.7 Å²	57.7	27%	0.271	31%	0.312	S	S	.	.	S	Bend	trans	-105.4	150.3	-170.9	-49.8	-46.9	0	0	0	111.7	V763 E775 L776 N777 I809 K812	V763-Y814 HydrophobicContact CG2-CD1 3.99Å; V763-Y814 HydrophobicContact CG2-CD2 3.78Å; V763-Y814 HydrophobicContact CG2-CE1 3.86Å; V763-Y814 HydrophobicContact CG2-CE2 3.66Å; V763-Y814 HydrophobicContact CG2-CG 3.96Å; E775-Y814 HydrophobicContact CB-CD2 4.26Å; L776-Y814 WeakPolarHBondContact O-CA 3.29Å; L776-Y814 WeakPolarHBondContact O-CB 3.49Å; N777-Y814 HydrophobicContact CB-CD1 4.13Å; N777-Y814 HydrophobicContact CB-CE1 4.21Å; I809-Y814 WeakPolarHBondContact CG1-O 3.48Å; I809-Y814 PolarHBondContact N-O 3.04Å; K812-Y814 HydrophobicContact CB-CD2 3.95Å; K812-Y814 HydrophobicContact CB-CE2 4.5Å; K812-Y814 HydrophobicContact CD-CD2 4.13Å; K812-Y814 PolarHBondContact O-N 3.17Å
815	V	96.2	Very high	93.7	Very high	8 Å²	8	60.3 Å²	60.3	5%	0.048	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	132.6	169.4	173.8	0	0	0	0	108.7	L776 L778 A784 V805	L776-V815 HydrophobicContact CB-CB 4.42Å; L776-V815 WeakPolarHBondContact CB-O 3.25Å; L776-V815 PolarHBondContact N-O 2.73Å; L776-V815 PolarHBondContact O-N 3.3Å; L778-V815 HydrophobicContact CD1-CG2 3.71Å; L778-V815 HydrophobicContact CG-CG2 4.07Å; A784-V815 HydrophobicContact CB-CG2 3.7Å; V805-V815 HydrophobicContact CG1-CG1 3.8Å
816	G	95.8	Very high	93.7	Very high	0 Å²	0	62.7 Å²	62.7	0%	0	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	138.9	174	0	0	0	0	0	111.5	F774 V806	F774-G816 WeakPolarHBondContact O-CA 3.34Å; V806-G816 PolarHBondContact N-O 2.98Å; V806-G816 PolarHBondContact O-N 3.31Å
817	L	96	Very high	93.8	Very high	0 Å²	0	62.1 Å²	62.1	0%	0	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	108.8	171.6	-168.7	156.7	0	0	0	108.1	V749 F774 L776 L794 V803 L819	V749-L817 HydrophobicContact CG1-CD1 3.93Å; V749-L817 HydrophobicContact CG2-CD2 4.49Å; F774-L817 PolarHBondContact N-O 3.12Å; F774-L817 PolarHBondContact O-N 2.79Å; L776-L817 HydrophobicContact CD1-CB 3.9Å; L776-L817 HydrophobicContact CD1-CD1 3.84Å; L776-L817 HydrophobicContact CG-CB 4.31Å; L794-L817 HydrophobicContact CD1-CD1 3.73Å; L794-L817 HydrophobicContact CD2-CD1 4.14Å; V803-L817 HydrophobicContact CG1-CD1 4.35Å; V803-L817 HydrophobicContact CG1-CD2 3.65Å; V803-L817 HydrophobicContact CG1-CG 3.75Å; L817-L819 HydrophobicContact CD2-CD1 4.42Å; L817-L819 HydrophobicContact CD2-CD2 3.37Å; L817-L819 HydrophobicContact CD2-CG 3.7Å
818	E	96.5	Very high	94	Very high	1 Å²	1	60 Å²	60	1%	0.005	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	114.3	-173.7	-62.9	176.2	166.7	0	0	110	I771 R773 R804 V806 R1097	I771-E818 HydrophobicContact CD1-CB 4.01Å; I771-E818 HydrophobicContact CD1-CG 3.98Å; R773-E818 HydrophobicContact CB-CG 4.1Å; R773-E818 HydrophobicContact CG-CG 4Å; R773-E818 IonicContact CZ-OE1 2.76Å; R773-E818 VanDerWaalsContact CZ-OE1 3.3Å; R773-E818 IonicContact NE-OE1 2.68Å; R773-E818 PolarHBondContact NE-OE1 3.41Å; R773-E818 IonicContact NH2-OE1 3.27Å; R773-E818 PolarHBondContact NH2-OE1 2.82Å; R804-E818 HydrophobicContact CB-CB 4.22Å; R804-E818 WeakPolarHBondContact CD-OE2 3.41Å; R804-E818 IonicContact CZ-OE2 3.6Å; R804-E818 PolarHBondContact N-O 3.42Å; R804-E818 IonicContact NH1-OE1 2.82Å; R804-E818 PolarHBondContact NH1-OE1 3.39Å; R804-E818 IonicContact NH1-OE2 2.82Å; R804-E818 PolarHBondContact NH1-OE2 3.46Å; R804-E818 PolarHBondContact O-N 3Å; V806-E818 HydrophobicContact CG2-CG 4.12Å; V806-E818 WeakPolarHBondContact CG2-OE1 3.49Å; E818-R1097 VanDerWaalsContact OE2-CD 3.27Å; E818-R1097 WeakPolarHBondContact OE2-CD 3.45Å; E818-R1097 IonicContact OE2-CZ 3.84Å; E818-R1097 IonicContact OE2-NE 2.8Å; E818-R1097 IonicContact OE2-NH1 2.74Å; E818-R1097 PolarHBondContact OE2-NH1 2.95Å
819	L	95.5	Very high	94.3	Very high	5 Å²	5	55.9 Å²	55.9	3%	0.026	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	142.3	177.2	-61.2	-171.6	0	0	0	111.3	M745 V749 I771 T772 F774 L798 V803 L817	M745-L819 HydrophobicContact CG-CD1 3.54Å; M745-L819 HydrophobicContact SD-CD1 3.57Å; M745-L819 VanDerWaalsContact SD-CD1 3.57Å; V749-L819 HydrophobicContact CG2-CD1 3.97Å; I771-L819 CarbonylContact C-O 3.51Å; I771-L819 WeakPolarHBondContact CA-O 3.4Å; I771-L819 VanDerWaalsContact CB-O 3.26Å; I771-L819 WeakPolarHBondContact CB-O 3.22Å; T772-L819 PolarHBondContact N-O 2.95Å; T772-L819 PolarHBondContact O-N 2.87Å; F774-L819 HydrophobicContact CD2-CD1 4Å; F774-L819 HydrophobicContact CD2-CG 4.02Å; F774-L819 HydrophobicContact CE2-CB 4.18Å; F774-L819 HydrophobicContact CE2-CD1 3.62Å; F774-L819 HydrophobicContact CE2-CG 3.92Å; F774-L819 HydrophobicContact CZ-CD1 4.42Å; L798-L819 HydrophobicContact CD1-CD1 3.94Å; L798-L819 HydrophobicContact CD1-CD2 3.66Å; L798-L819 HydrophobicContact CD1-CG 4.47Å; V803-L819 HydrophobicContact CB-CD2 4.37Å; V803-L819 HydrophobicContact CG1-CD2 4.1Å; V803-L819 HydrophobicContact CG2-CD2 3.52Å; L817-L819 HydrophobicContact CD2-CD1 4.42Å; L817-L819 HydrophobicContact CD2-CD2 3.37Å; L817-L819 HydrophobicContact CD2-CG 3.7Å
820	P	95.4	Very high	94.5	Very high	22 Å²	22	58.9 Å²	58.9	14%	0.143	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	137.6	170.4	27.8	-34	0	0	0	111.2	T800 A802 L1080	T800-P820 HydrophobicContact CG2-CG 4.21Å; A802-P820 VanDerWaalsContact O-CD 3.27Å; A802-P820 WeakPolarHBondContact O-CD 3.41Å; P820-L1080 HydrophobicContact CB-CD1 3.88Å; P820-L1080 HydrophobicContact CB-CD2 4.05Å; P820-L1080 HydrophobicContact CG-CD2 4.38Å
821	N	93.4	Very high	94.8	Very high	35 Å²	35	57.2 Å²	57.2	19%	0.187	29%	0.293	C	S	.	.	P	Polyproline II helix	trans	-68.7	146.8	171.7	-65.3	-17.1	0	0	0	110.6	G768 P769 V770 I771 T772 K823	G768-N821 PolarHBondContact O-ND2 3.46Å; P769-N821 PolarHBondContact O-ND2 3.24Å; V770-N821 PolarHBondContact O-N 3.3Å; I771-N821 PolarHBondContact O-OD1 2.98Å; T772-N821 PolarHBondContact N-OD1 3.36Å; T772-N821 VanDerWaalsContact N-OD1 3.17Å; T772-N821 PolarHBondContact OG1-OD1 2.85Å; N821-K823 VanDerWaalsContact C-N 3.29Å; N821-K823 VanDerWaalsContact CB-O 3.32Å; N821-K823 WeakPolarHBondContact CB-O 3.18Å; N821-K823 PolarHBondContact O-N 3.33Å
822	K	91.2	Very high	95	Very high	205 Å²	205	52.9 Å²	52.9	89%	0.891	25%	0.249	S	C	*	.	S	Bend	trans	-58.9	-40.8	174.2	-67.6	-177.8	179.6	177.8	0	112
823	K	89.7	Confident	95.2	Very high	136 Å²	136	49.1 Å²	49.1	59%	0.591	23%	0.232	S	C	*	.	S	Bend	trans	-111.5	115.3	169.8	-166.3	-175.4	-166.9	-175.8	0	108.1	E735 N821	E735-K823 WeakPolarHBondContact OE2-CD 3.38Å; E735-K823 WeakPolarHBondContact OE2-CE 3.37Å; E735-K823 IonicContact OE2-NZ 2.65Å; E735-K823 PolarHBondContact OE2-NZ 3.41Å; N821-K823 VanDerWaalsContact C-N 3.29Å; N821-K823 VanDerWaalsContact CB-O 3.32Å; N821-K823 WeakPolarHBondContact CB-O 3.18Å; N821-K823 PolarHBondContact O-N 3.33Å
824	R	91.7	Very high	95.2	Very high	87 Å²	87	47.6 Å²	47.6	33%	0.328	22%	0.218	S	C	.	.	P	Polyproline II helix	trans	-83.9	138.4	172.4	-60	179.2	-175.1	-170.7	4	108.9	V770 L1080	V770-R824 HydrophobicContact CG1-CG 4.13Å; R824-L1080 PolarHBondContact NH1-O 3.37Å
825	Q	93	Very high	95.2	Very high	76 Å²	76	46.7 Å²	46.7	36%	0.355	22%	0.218	S	C	.	.	P	Polyproline II helix	trans	-97	132.1	172.6	-59.1	-179.5	4.1	0	0	110	P769	P769-Q825 HydrophobicContact CB-CB 4.1Å; P769-Q825 PolarHBondContact O-N 3.46Å
826	T	94.7	Very high	95.2	Very high	73 Å²	73	48.5 Å²	48.5	45%	0.448	23%	0.234	S	C	.	.	P	Polyproline II helix	trans	-72.7	129.1	174.3	-55.4	0	0	0	0	110.4	Y828 F1102	T826-Y828 HydrophobicContact CG2-CD2 4.3Å; T826-Y828 HydrophobicContact CG2-CE1 4.43Å; T826-Y828 HydrophobicContact CG2-CE2 4.02Å; T826-Y828 WeakPolarHBondContact O-CD2 3.21Å; T826-Y828 WeakPolarHBondContact O-CE2 3.36Å; T826-F1102 HydrophobicContact CG2-CB 3.76Å; T826-F1102 HydrophobicContact CG2-CD1 3.93Å; T826-F1102 HydrophobicContact CG2-CG 4.07Å
827	V	96.4	Very high	95.3	Very high	6 Å²	6	52.9 Å²	52.9	4%	0.036	25%	0.253	C	S	.	.			trans	-86.6	115.2	170.6	-177	0	0	0	0	108	V832 K851 H1099 F1102	V827-V832 HydrophobicContact CG1-CG2 3.97Å; V827-K851 HydrophobicContact CG1-CB 4.19Å; V827-K851 HydrophobicContact CG1-CD 3.92Å; V827-K851 HydrophobicContact CG1-CG 3.83Å; V827-K851 HydrophobicContact CG2-CB 4.12Å; V827-K851 HydrophobicContact CG2-CD 4.02Å; V827-K851 HydrophobicContact CG2-CG 4.38Å; V827-H1099 HydrophobicContact CG2-CB 4.26Å; V827-F1102 WeakPolarHBondContact O-CB 3.24Å; V827-F1102 PolarHBondContact O-N 3.13Å
828	Y	97.3	Very high	95.3	Very high	52 Å²	52	53.3 Å²	53.3	20%	0.204	26%	0.255	C	S	.	.	B	Isolated β-bridge	trans	-88.8	138.3	-177.4	-69.8	-96.5	0	0	0	111.1	T728 P730 T826 R830 E831	T728-Y828 HydrophobicContact CG2-CD1 4.33Å; T728-Y828 HydrophobicContact CG2-CE1 4.05Å; P730-Y828 HydrophobicContact CB-CD2 4.01Å; T826-Y828 HydrophobicContact CG2-CD2 4.3Å; T826-Y828 HydrophobicContact CG2-CE1 4.43Å; T826-Y828 HydrophobicContact CG2-CE2 4.02Å; T826-Y828 WeakPolarHBondContact O-CD2 3.21Å; T826-Y828 WeakPolarHBondContact O-CE2 3.36Å; Y828-R830 VanDerWaalsContact C-N 3.27Å; Y828-R830 PolarHBondContact O-N 3.41Å; Y828-E831 VanDerWaalsContact O-CB 3.3Å; Y828-E831 WeakPolarHBondContact O-CB 3.4Å; Y828-E831 PolarHBondContact O-N 3.18Å
829	L	97.7	Very high	95.3	Very high	4 Å²	4	60.2 Å²	60.2	2%	0.021	28%	0.281	C	S	.	.	H	α-helix	trans	-53.5	-43.3	177.5	178.6	59.8	0	0	0	112.6	L727 E831 V832 L833 V848 A884 L887 A1101 F1102 V1103	L727-L829 HydrophobicContact CD1-CD2 4.29Å; L727-L829 HydrophobicContact CD1-CG 4.23Å; L829-E831 VanDerWaalsContact C-N 3.28Å; L829-E831 PolarHBondContact O-N 2.85Å; L829-V832 PolarHBondContact O-N 2.72Å; L829-L833 HydrophobicContact CD1-CD1 4.09Å; L829-L833 HydrophobicContact CD1-CG 4.06Å; L829-L833 HydrophobicContact CD2-CD1 4.33Å; L829-L833 HydrophobicContact CG-CD1 3.75Å; L829-L833 HydrophobicContact CG-CG 4.2Å; L829-L833 WeakPolarHBondContact O-CG 3.45Å; L829-L833 PolarHBondContact O-N 2.82Å; L829-V848 HydrophobicContact CD1-CB 4.01Å; L829-V848 HydrophobicContact CD1-CG1 3.93Å; L829-V848 HydrophobicContact CD1-CG2 4.26Å; L829-A884 HydrophobicContact CD1-CB 4.14Å; L829-L887 HydrophobicContact CD2-CB 3.89Å; L829-L887 HydrophobicContact CD2-CD2 3.82Å; L829-A1101 HydrophobicContact CB-CB 4.36Å; L829-A1101 HydrophobicContact CD1-CB 4.07Å; L829-F1102 WeakPolarHBondContact CB-O 3.3Å; L829-F1102 PolarHBondContact N-O 3.29Å; L829-V1103 HydrophobicContact CB-CB 4.38Å; L829-V1103 HydrophobicContact CD2-CB 3.99Å; L829-V1103 HydrophobicContact CD2-CG2 4.1Å
830	R	97.6	Very high	95.3	Very high	72 Å²	72	65.9 Å²	65.9	27%	0.272	31%	0.311	S	S	.	.	H	α-helix	trans	-56.3	-38.7	176.1	-176.5	169.6	169.8	167.4	-0.6	113.6	L724 L727 T728 Y828 V832 L833 D834	L724-R830 HydrophobicContact CB-CG 4.49Å; L724-R830 VanDerWaalsContact O-CD 3.28Å; L724-R830 WeakPolarHBondContact O-CD 3.47Å; L724-R830 PolarHBondContact O-NE 2.87Å; L724-R830 PolarHBondContact O-NH1 3Å; L724-R830 VanDerWaalsContact O-NH1 3.12Å; L727-R830 HydrophobicContact CB-CB 3.8Å; L727-R830 HydrophobicContact CB-CG 4.32Å; L727-R830 HydrophobicContact CD1-CB 4.19Å; L727-R830 VanDerWaalsContact O-CD 3.23Å; L727-R830 WeakPolarHBondContact O-CD 3.44Å; L727-R830 PolarHBondContact O-NH1 3.21Å; T728-R830 WeakPolarHBondContact O-CB 3.43Å; Y828-R830 VanDerWaalsContact C-N 3.27Å; Y828-R830 PolarHBondContact O-N 3.41Å; R830-V832 VanDerWaalsContact C-N 3.28Å; R830-V832 PolarHBondContact O-N 3.25Å; R830-L833 PolarHBondContact O-N 2.89Å; R830-D834 WeakPolarHBondContact O-CB 3.5Å; R830-D834 PolarHBondContact O-N 2.84Å
831	E	95.8	Very high	95.4	Very high	64 Å²	64	66.4 Å²	66.4	30%	0.299	31%	0.313	S	S	.	.	H	α-helix	trans	-64	-35	-178	-171.7	-174.8	-159.5	0	0	111.7	P730 Y828 L829 K851	P730-E831 HydrophobicContact CB-CB 4.39Å; P730-E831 HydrophobicContact CB-CG 4.43Å; P730-E831 HydrophobicContact CG-CB 4.11Å; P730-E831 HydrophobicContact CG-CG 4.11Å; Y828-E831 VanDerWaalsContact O-CB 3.3Å; Y828-E831 WeakPolarHBondContact O-CB 3.4Å; Y828-E831 PolarHBondContact O-N 3.18Å; L829-E831 VanDerWaalsContact C-N 3.28Å; L829-E831 PolarHBondContact O-N 2.85Å; E831-K851 IonicContact OE1-NZ 2.74Å; E831-K851 PolarHBondContact OE1-NZ 3.17Å; E831-K851 VanDerWaalsContact OE2-CE 3.3Å; E831-K851 WeakPolarHBondContact OE2-CE 3.17Å; E831-K851 IonicContact OE2-NZ 3.39Å; E831-K851 PolarHBondContact OE2-NZ 2.82Å
832	V	97	Very high	95.5	Very high	0 Å²	0	70.6 Å²	70.6	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-87.4	-32.5	179.4	-167.5	0	0	0	0	111.7	V827 L829 R830 N835 V848 P857 V859	V827-V832 HydrophobicContact CG1-CG2 3.97Å; L829-V832 PolarHBondContact O-N 2.72Å; R830-V832 VanDerWaalsContact C-N 3.28Å; R830-V832 PolarHBondContact O-N 3.25Å; V832-N835 WeakPolarHBondContact O-CB 3.46Å; V832-N835 PolarHBondContact O-N 2.97Å; V832-V848 HydrophobicContact CB-CG1 3.68Å; V832-V848 HydrophobicContact CB-CG2 4.19Å; V832-V848 HydrophobicContact CG1-CB 4.37Å; V832-V848 HydrophobicContact CG1-CG1 3.64Å; V832-V848 HydrophobicContact CG1-CG2 3.97Å; V832-V848 HydrophobicContact CG2-CG1 4.25Å; V832-P857 HydrophobicContact CG1-CB 3.81Å; V832-V859 HydrophobicContact CG1-CG2 3.94Å
833	L	97.3	Very high	95.7	Very high	2 Å²	2	61.4 Å²	61.4	1%	0.01	30%	0.304	C	S	.	.	H	α-helix	trans	-65.7	-36.3	173	-70.4	174	0	0	0	112.8	L724 L727 L829 R830 N835 F838 V848 Y891	L724-L833 HydrophobicContact CD2-CB 3.86Å; L724-L833 HydrophobicContact CD2-CD1 3.88Å; L727-L833 HydrophobicContact CD1-CD1 3.56Å; L829-L833 HydrophobicContact CD1-CD1 4.09Å; L829-L833 HydrophobicContact CD1-CG 4.06Å; L829-L833 HydrophobicContact CD2-CD1 4.33Å; L829-L833 HydrophobicContact CG-CD1 3.75Å; L829-L833 HydrophobicContact CG-CG 4.2Å; L829-L833 WeakPolarHBondContact O-CG 3.45Å; L829-L833 PolarHBondContact O-N 2.82Å; R830-L833 PolarHBondContact O-N 2.89Å; L833-N835 PolarHBondContact O-N 2.75Å; L833-F838 HydrophobicContact CB-CD1 4.37Å; L833-F838 HydrophobicContact CD2-CD1 3.82Å; L833-F838 HydrophobicContact CD2-CD2 3.93Å; L833-F838 HydrophobicContact CD2-CE1 3.52Å; L833-F838 HydrophobicContact CD2-CE2 3.66Å; L833-F838 HydrophobicContact CD2-CG 4.01Å; L833-F838 HydrophobicContact CD2-CZ 3.44Å; L833-F838 VanDerWaalsContact CD2-CZ 3.44Å; L833-F838 VanDerWaalsContact O-CD1 3.27Å; L833-F838 WeakPolarHBondContact O-CD1 3.44Å; L833-V848 HydrophobicContact CD2-CG2 3.62Å; L833-V848 HydrophobicContact CG-CG2 4.1Å; L833-Y891 HydrophobicContact CD1-CD2 3.68Å; L833-Y891 HydrophobicContact CD1-CE2 4.15Å; L833-Y891 HydrophobicContact CD1-CG 4.03Å
834	D	95.7	Very high	96.1	Very high	82 Å²	82	56 Å²	56	44%	0.439	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.5	-7.9	174.6	-165.3	19.3	0	0	0	112.5	L724 R830 R839	L724-D834 HydrophobicContact CD1-CB 4.38Å; R830-D834 WeakPolarHBondContact O-CB 3.5Å; R830-D834 PolarHBondContact O-N 2.84Å; D834-R839 PolarHBondContact O-NE 2.78Å; D834-R839 PolarHBondContact O-NH2 2.8Å; D834-R839 IonicContact OD1-CZ 3.57Å; D834-R839 VanDerWaalsContact OD1-CZ 3.22Å; D834-R839 IonicContact OD1-NE 3.33Å; D834-R839 PolarHBondContact OD1-NE 3.04Å; D834-R839 IonicContact OD1-NH2 2.63Å; D834-R839 PolarHBondContact OD1-NH2 2.92Å
835	N	96	Very high	96.4	Very high	50 Å²	50	51.9 Å²	51.9	27%	0.267	27%	0.267	S	S	.	.	S	Bend	trans	-74.3	143	177.6	-165.8	-95.5	0	0	0	112.7	V832 L833 K837 F838 R839 P857	V832-N835 WeakPolarHBondContact O-CB 3.46Å; V832-N835 PolarHBondContact O-N 2.97Å; L833-N835 PolarHBondContact O-N 2.75Å; N835-K837 PolarHBondContact O-N 2.87Å; N835-K837 WeakPolarHBondContact OD1-CB 3.43Å; N835-K837 VanDerWaalsContact OD1-CG 3.29Å; N835-K837 WeakPolarHBondContact OD1-CG 3.39Å; N835-K837 PolarHBondContact OD1-N 2.71Å; N835-F838 PolarHBondContact O-N 2.87Å; N835-R839 PolarHBondContact O-N 2.84Å; N835-P857 HydrophobicContact CB-CB 4.25Å; N835-P857 HydrophobicContact CB-CG 4.07Å; N835-P857 WeakPolarHBondContact ND2-CG 3.43Å
836	A	96.6	Very high	96.6	Very high	47 Å²	47	48.2 Å²	48.2	39%	0.388	25%	0.25	S	C	.	.	H	α-helix	trans	-52.1	-37.8	175.8	0	0	0	0	0	113.2	F838 R839 D840	A836-F838 PolarHBondContact O-N 3.28Å; A836-F838 VanDerWaalsContact O-N 3.14Å; A836-R839 PolarHBondContact O-N 3.42Å; A836-D840 WeakPolarHBondContact O-CB 3.4Å; A836-D840 PolarHBondContact O-N 2.96Å
837	K	96.3	Very high	96.8	Very high	92 Å²	92	44.9 Å²	44.9	40%	0.4	23%	0.229	S	C	.	.	H	α-helix	trans	-58.1	-28.1	176.3	-64.4	177.6	-164.9	175.3	0	113.5	N835 E856 P857 V859	N835-K837 PolarHBondContact O-N 2.87Å; N835-K837 WeakPolarHBondContact OD1-CB 3.43Å; N835-K837 VanDerWaalsContact OD1-CG 3.29Å; N835-K837 WeakPolarHBondContact OD1-CG 3.39Å; N835-K837 PolarHBondContact OD1-N 2.71Å; K837-E856 IonicContact NZ-OE2 2.71Å; K837-E856 PolarHBondContact NZ-OE2 3.06Å; K837-P857 HydrophobicContact CD-CG 4.2Å; K837-P857 VanDerWaalsContact CD-O 3.23Å; K837-P857 WeakPolarHBondContact CD-O 3.47Å; K837-P857 PolarHBondContact NZ-O 3.46Å; K837-V859 HydrophobicContact CB-CB 4.4Å; K837-V859 HydrophobicContact CB-CG2 4.09Å
838	F	97.6	Very high	96.9	Very high	9 Å²	9	44.7 Å²	44.7	4%	0.039	23%	0.228	C	C	.	.	H	α-helix	trans	-88.2	-52.6	172	178.9	-94.5	0	0	0	111.3	L833 N835 A836 D840 N841 T846 V848 V859 S888 K892	L833-F838 HydrophobicContact CB-CD1 4.37Å; L833-F838 HydrophobicContact CD2-CD1 3.82Å; L833-F838 HydrophobicContact CD2-CD2 3.93Å; L833-F838 HydrophobicContact CD2-CE1 3.52Å; L833-F838 HydrophobicContact CD2-CE2 3.66Å; L833-F838 HydrophobicContact CD2-CG 4.01Å; L833-F838 HydrophobicContact CD2-CZ 3.44Å; L833-F838 VanDerWaalsContact CD2-CZ 3.44Å; L833-F838 VanDerWaalsContact O-CD1 3.27Å; L833-F838 WeakPolarHBondContact O-CD1 3.44Å; N835-F838 PolarHBondContact O-N 2.87Å; A836-F838 PolarHBondContact O-N 3.28Å; A836-F838 VanDerWaalsContact O-N 3.14Å; F838-D840 PolarHBondContact O-N 2.9Å; F838-N841 PolarHBondContact O-N 3.41Å; F838-T846 HydrophobicContact CD2-CG2 3.64Å; F838-T846 HydrophobicContact CE2-CG2 3.87Å; F838-V848 HydrophobicContact CD2-CG2 3.88Å; F838-V848 HydrophobicContact CE2-CG2 4.37Å; F838-V848 HydrophobicContact CG-CG2 4.45Å; F838-V859 HydrophobicContact CB-CG1 4.43Å; F838-V859 HydrophobicContact CB-CG2 4.09Å; F838-V859 HydrophobicContact CD2-CG1 4.24Å; F838-S888 WeakPolarHBondContact CZ-O 3.32Å; F838-K892 HydrophobicContact CZ-CB 4.02Å; F838-K892 HydrophobicContact CZ-CD 4.43Å; F838-K892 VanDerWaalsContact O-CE 3.28Å; F838-K892 WeakPolarHBondContact O-CE 3.4Å; F838-K892 PolarHBondContact O-NZ 2.98Å
839	R	95.7	Very high	96.9	Very high	145 Å²	145	42.4 Å²	42.4	55%	0.547	22%	0.219	S	C	.	.	H	α-helix	trans	-58.2	-49.9	-174.1	-72.7	-166.8	-85.7	161.7	-22.5	112.5	D834 N835 A836 N841 K892	D834-R839 PolarHBondContact O-NE 2.78Å; D834-R839 PolarHBondContact O-NH2 2.8Å; D834-R839 IonicContact OD1-CZ 3.57Å; D834-R839 VanDerWaalsContact OD1-CZ 3.22Å; D834-R839 IonicContact OD1-NE 3.33Å; D834-R839 PolarHBondContact OD1-NE 3.04Å; D834-R839 IonicContact OD1-NH2 2.63Å; D834-R839 PolarHBondContact OD1-NH2 2.92Å; N835-R839 PolarHBondContact O-N 2.84Å; A836-R839 PolarHBondContact O-N 3.42Å; R839-N841 VanDerWaalsContact C-N 3.29Å; R839-N841 PolarHBondContact O-N 3.09Å; R839-K892 PolarHBondContact O-NZ 2.86Å; R839-K892 VanDerWaalsContact O-NZ 3.13Å
840	D	96.3	Very high	96.9	Very high	125 Å²	125	42.2 Å²	42.2	67%	0.668	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.4	-9.1	-171.1	-54.2	-16.2	0	0	0	113.3	A836 F838 P842	A836-D840 WeakPolarHBondContact O-CB 3.4Å; A836-D840 PolarHBondContact O-N 2.96Å; F838-D840 PolarHBondContact O-N 2.9Å; D840-P842 WeakPolarHBondContact O-CD 3.29Å
841	N	95.8	Very high	96.9	Very high	32 Å²	32	40 Å²	40	17%	0.171	21%	0.211	C	C	.	.			trans	-75.8	119.9	179.5	-172.9	-11.3	0	0	0	110.7	F838 R839 S843 T846 K892	F838-N841 PolarHBondContact O-N 3.41Å; R839-N841 VanDerWaalsContact C-N 3.29Å; R839-N841 PolarHBondContact O-N 3.09Å; N841-S843 VanDerWaalsContact C-N 3.33Å; N841-S843 PolarHBondContact O-N 3.28Å; N841-S843 PolarHBondContact OD1-N 2.77Å; N841-T846 HydrophobicContact CB-CG2 4.08Å; N841-T846 WeakPolarHBondContact ND2-CG2 3.39Å; N841-T846 PolarHBondContact ND2-OG1 2.84Å; N841-T846 VanDerWaalsContact ND2-OG1 3.08Å; N841-T846 PolarHBondContact OD1-OG1 2.79Å; N841-K892 PolarHBondContact O-NZ 2.74Å
842	P	95.5	Very high	96.9	Very high	123 Å²	123	39 Å²	39	80%	0.799	21%	0.207	S	C	*	.			trans	-78.9	-8.5	-174.5	32.2	-37.5	0	0	0	114.5	D840 P844	D840-P842 WeakPolarHBondContact O-CD 3.29Å; P842-P844 WeakPolarHBondContact O-CD 3.47Å
843	S	96.7	Very high	96.8	Very high	13 Å²	13	39.8 Å²	39.8	9%	0.091	21%	0.211	C	C	.	.			trans	-71.9	123.2	177.6	-178.8	0	0	0	0	110.2	N841 L845 T846 D861 K892	N841-S843 VanDerWaalsContact C-N 3.33Å; N841-S843 PolarHBondContact O-N 3.28Å; N841-S843 PolarHBondContact OD1-N 2.77Å; S843-L845 PolarHBondContact O-N 2.94Å; S843-L845 PolarHBondContact OG-N 3.21Å; S843-T846 WeakPolarHBondContact O-CB 3.4Å; S843-T846 PolarHBondContact O-N 2.98Å; S843-T846 VanDerWaalsContact O-N 3.1Å; S843-T846 PolarHBondContact O-OG1 3.38Å; S843-D861 VanDerWaalsContact CB-CG 3.47Å; S843-D861 WeakPolarHBondContact CB-OD1 3.25Å; S843-D861 WeakPolarHBondContact CB-OD2 3.42Å; S843-D861 VanDerWaalsContact OG-CG 3.29Å; S843-D861 PolarHBondContact OG-OD1 3.28Å; S843-K892 WeakPolarHBondContact O-CD 3.3Å
844	P	97.1	Very high	96.7	Very high	22 Å²	22	42.5 Å²	42.5	14%	0.143	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-17.4	173.7	30.6	-35.9	0	0	0	111.8	P842 T846 A893 D897 V898 Y996	P842-P844 WeakPolarHBondContact O-CD 3.47Å; P844-T846 VanDerWaalsContact C-N 3.27Å; P844-T846 PolarHBondContact O-N 3.07Å; P844-A893 HydrophobicContact CB-CB 3.91Å; P844-D897 HydrophobicContact CB-CB 4Å; P844-D897 HydrophobicContact CG-CB 4.4Å; P844-V898 HydrophobicContact CB-CG2 3.86Å; P844-V898 HydrophobicContact CG-CG2 4.25Å; P844-Y996 HydrophobicContact CG-CD2 3.97Å; P844-Y996 HydrophobicContact CG-CE2 4.12Å
845	L	98.1	Very high	96.6	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.4	25.1	173.3	-62.1	-173.5	0	0	0	113.2	S843 L862 A863 M889 V898 Y996 V998 H1032	S843-L845 PolarHBondContact O-N 2.94Å; S843-L845 PolarHBondContact OG-N 3.21Å; L845-L862 HydrophobicContact CB-CB 4.19Å; L845-L862 PolarHBondContact O-N 3.27Å; L845-A863 HydrophobicContact CB-CB 4.43Å; L845-A863 HydrophobicContact CD1-CB 4.14Å; L845-M889 HydrophobicContact CD2-SD 3.77Å; L845-V898 HydrophobicContact CD2-CG1 3.99Å; L845-V898 HydrophobicContact CD2-CG2 3.63Å; L845-V898 HydrophobicContact CG-CG2 4.43Å; L845-Y996 HydrophobicContact CD1-CD1 3.59Å; L845-Y996 HydrophobicContact CD1-CE1 4.27Å; L845-Y996 HydrophobicContact CD1-CG 3.85Å; L845-Y996 HydrophobicContact CG-CD1 4.37Å; L845-Y996 HydrophobicContact CG-CG 4.18Å; L845-V998 HydrophobicContact CD2-CG2 3.45Å; L845-V998 VanDerWaalsContact CD2-CG2 3.45Å; L845-H1032 WeakPolarHBondContact CD1-CD2 3.45Å
846	T	98.1	Very high	96.6	Very high	0 Å²	0	42 Å²	42	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	126.2	172	-60.9	0	0	0	0	110	F838 N841 S843 P844 V859 A860 S888	F838-T846 HydrophobicContact CD2-CG2 3.64Å; F838-T846 HydrophobicContact CE2-CG2 3.87Å; N841-T846 HydrophobicContact CB-CG2 4.08Å; N841-T846 WeakPolarHBondContact ND2-CG2 3.39Å; N841-T846 PolarHBondContact ND2-OG1 2.84Å; N841-T846 VanDerWaalsContact ND2-OG1 3.08Å; N841-T846 PolarHBondContact OD1-OG1 2.79Å; S843-T846 WeakPolarHBondContact O-CB 3.4Å; S843-T846 PolarHBondContact O-N 2.98Å; S843-T846 VanDerWaalsContact O-N 3.1Å; S843-T846 PolarHBondContact O-OG1 3.38Å; P844-T846 VanDerWaalsContact C-N 3.27Å; P844-T846 PolarHBondContact O-N 3.07Å; T846-V859 HydrophobicContact CG2-CG1 3.26Å; T846-A860 CarbonylContact C-O 3.58Å; T846-A860 WeakPolarHBondContact CA-O 3.45Å; T846-S888 WeakPolarHBondContact O-CB 3.26Å
847	V	97.9	Very high	96.6	Very high	3 Å²	3	40.4 Å²	40.4	2%	0.018	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	133.1	179.2	-65	0	0	0	0	111.6	L849 A860 M865 M885 M889	V847-L849 HydrophobicContact CG2-CD2 4.37Å; V847-A860 HydrophobicContact CG2-CB 4.19Å; V847-A860 PolarHBondContact N-O 2.71Å; V847-A860 PolarHBondContact O-N 3.3Å; V847-M865 HydrophobicContact CG2-CE 4.12Å; V847-M885 HydrophobicContact CB-CB 4.26Å; V847-M885 HydrophobicContact CB-CG 4.11Å; V847-M885 HydrophobicContact CG1-CB 3.98Å; V847-M885 HydrophobicContact CG1-CG 4.31Å; V847-M889 HydrophobicContact CG1-CG 4.3Å
848	V	98.1	Very high	96.6	Very high	1 Å²	1	37.5 Å²	37.5	1%	0.006	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	132	164.8	169.8	0	0	0	0	108.5	L829 V832 L833 F838 S888 A1101	L829-V848 HydrophobicContact CD1-CB 4.01Å; L829-V848 HydrophobicContact CD1-CG1 3.93Å; L829-V848 HydrophobicContact CD1-CG2 4.26Å; V832-V848 HydrophobicContact CB-CG1 3.68Å; V832-V848 HydrophobicContact CB-CG2 4.19Å; V832-V848 HydrophobicContact CG1-CB 4.37Å; V832-V848 HydrophobicContact CG1-CG1 3.64Å; V832-V848 HydrophobicContact CG1-CG2 3.97Å; V832-V848 HydrophobicContact CG2-CG1 4.25Å; L833-V848 HydrophobicContact CD2-CG2 3.62Å; L833-V848 HydrophobicContact CG-CG2 4.1Å; F838-V848 HydrophobicContact CD2-CG2 3.88Å; F838-V848 HydrophobicContact CE2-CG2 4.37Å; F838-V848 HydrophobicContact CG-CG2 4.45Å; V848-S888 VanDerWaalsContact CB-OG 3.32Å; V848-S888 WeakPolarHBondContact CB-OG 3.25Å; V848-S888 PolarHBondContact N-OG 3.46Å; V848-A1101 HydrophobicContact CG1-CB 3.59Å
849	L	97.6	Very high	96.6	Very high	4 Å²	4	38.6 Å²	38.6	2%	0.021	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	-43.4	165	-59.9	-174.4	0	0	0	110.6	V847 V858 A860 M885 I1057 M1085 Y1087 V1098 G1100 A1101	V847-L849 HydrophobicContact CG2-CD2 4.37Å; L849-V858 HydrophobicContact CB-CG1 4.17Å; L849-V858 HydrophobicContact CD1-CG1 4.12Å; L849-V858 PolarHBondContact N-O 3.25Å; L849-A860 HydrophobicContact CD1-CB 4.03Å; L849-A860 HydrophobicContact CG-CB 4.24Å; L849-M885 HydrophobicContact CD2-CE 4.09Å; L849-I1057 HydrophobicContact CD1-CD1 4.49Å; L849-I1057 HydrophobicContact CD2-CD1 3.76Å; L849-M1085 HydrophobicContact CB-CE 3.93Å; L849-M1085 WeakPolarHBondContact O-CE 3.3Å; L849-Y1087 HydrophobicContact CD1-CD1 4.28Å; L849-Y1087 HydrophobicContact CD1-CD2 3.84Å; L849-Y1087 HydrophobicContact CD1-CE2 4.12Å; L849-Y1087 HydrophobicContact CD1-CG 3.91Å; L849-V1098 HydrophobicContact CB-CG1 4.07Å; L849-G1100 WeakPolarHBondContact O-CA 3.41Å; L849-A1101 PolarHBondContact O-N 3.29Å
850	G	97.7	Very high	96.6	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	151.5	-132.3	180	0	0	0	0	0	112.2	V858 H1099	G850-V858 PolarHBondContact N-O 3.4Å; G850-V858 PolarHBondContact O-N 2.94Å; G850-H1099 WeakPolarHBondContact CA-O 3.41Å
851	K	97.5	Very high	96.6	Very high	27 Å²	27	27 Å²	27	12%	0.117	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	152.6	171.1	-78.4	174.2	165.6	169.6	0	111	P769 V827 E831 G855 E856 V1098 H1099	P769-K851 HydrophobicContact CG-CD 4.22Å; V827-K851 HydrophobicContact CG1-CB 4.19Å; V827-K851 HydrophobicContact CG1-CD 3.92Å; V827-K851 HydrophobicContact CG1-CG 3.83Å; V827-K851 HydrophobicContact CG2-CB 4.12Å; V827-K851 HydrophobicContact CG2-CD 4.02Å; V827-K851 HydrophobicContact CG2-CG 4.38Å; E831-K851 IonicContact OE1-NZ 2.74Å; E831-K851 PolarHBondContact OE1-NZ 3.17Å; E831-K851 VanDerWaalsContact OE2-CE 3.3Å; E831-K851 WeakPolarHBondContact OE2-CE 3.17Å; E831-K851 IonicContact OE2-NZ 3.39Å; E831-K851 PolarHBondContact OE2-NZ 2.82Å; K851-G855 VanDerWaalsContact CD-O 3.24Å; K851-G855 WeakPolarHBondContact CD-O 3.44Å; K851-G855 VanDerWaalsContact CE-O 3.26Å; K851-G855 WeakPolarHBondContact CE-O 3.31Å; K851-G855 WeakPolarHBondContact CG-O 3.27Å; K851-E856 CarbonylContact C-O 3.53Å; K851-E856 VanDerWaalsContact CA-O 3.29Å; K851-E856 WeakPolarHBondContact CA-O 3.41Å; K851-V1098 CarbonylContact O-C 3.49Å; K851-V1098 WeakPolarHBondContact O-CA 3.4Å; K851-V1098 VanDerWaalsContact O-CG1 3.29Å; K851-V1098 WeakPolarHBondContact O-CG1 3.3Å; K851-H1099 PolarHBondContact N-O 2.89Å; K851-H1099 PolarHBondContact O-N 3.03Å
852	D	96.3	Very high	96.6	Very high	41 Å²	41	25.6 Å²	25.6	22%	0.219	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	-177	171.1	79.5	-2	0	0	0	112.2	A854 G855 E856 V858	D852-A854 PolarHBondContact O-N 2.65Å; D852-A854 WeakPolarHBondContact OD1-CA 3.24Å; D852-A854 WeakPolarHBondContact OD1-CB 3.49Å; D852-A854 PolarHBondContact OD1-N 3.27Å; D852-G855 PolarHBondContact O-N 2.78Å; D852-G855 PolarHBondContact OD1-N 3.25Å; D852-E856 PolarHBondContact N-O 2.82Å; D852-E856 PolarHBondContact OD1-N 3.25Å; D852-V858 HydrophobicContact CB-CG2 3.78Å
853	I	95.8	Very high	96.6	Very high	17 Å²	17	20.7 Å²	20.7	9%	0.087	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-9.7	178.1	62.7	97.5	0	0	0	115.3	G768 I771 R773 R1097	G768-I853 WeakPolarHBondContact CA-O 3.48Å; I771-I853 HydrophobicContact CD1-CB 3.91Å; I771-I853 HydrophobicContact CD1-CG2 4.08Å; I771-I853 HydrophobicContact CG1-CB 4.21Å; I771-I853 HydrophobicContact CG1-CG2 4.03Å; R773-I853 VanDerWaalsContact CZ-CD1 3.49Å; I853-R1097 HydrophobicContact CG2-CB 3.74Å; I853-R1097 HydrophobicContact CG2-CG 3.89Å
854	A	93.7	Very high	96.5	Very high	60 Å²	60	26.1 Å²	26.1	50%	0.496	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.8	-6.4	172	0	0	0	0	0	112.2	D852	D852-A854 PolarHBondContact O-N 2.65Å; D852-A854 WeakPolarHBondContact OD1-CA 3.24Å; D852-A854 WeakPolarHBondContact OD1-CB 3.49Å; D852-A854 PolarHBondContact OD1-N 3.27Å
855	G	93.5	Very high	96.2	Very high	17 Å²	17	25.1 Å²	25.1	18%	0.175	14%	0.144	C	C	.	.	S	Bend	trans	91.4	4.8	-176.2	0	0	0	0	0	114.4	K851 D852	K851-G855 VanDerWaalsContact CD-O 3.24Å; K851-G855 WeakPolarHBondContact CD-O 3.44Å; K851-G855 VanDerWaalsContact CE-O 3.26Å; K851-G855 WeakPolarHBondContact CE-O 3.31Å; K851-G855 WeakPolarHBondContact CG-O 3.27Å; D852-G855 PolarHBondContact O-N 2.78Å; D852-G855 PolarHBondContact OD1-N 3.25Å
856	E	95.9	Very high	95.9	Very high	104 Å²	104	25.8 Å²	25.8	49%	0.486	15%	0.148	S	C	.	.			trans	-73.1	132.7	177.1	-88.8	-69.5	134.9	0	0	110.5	K837 K851 D852 V858	K837-E856 IonicContact NZ-OE2 2.71Å; K837-E856 PolarHBondContact NZ-OE2 3.06Å; K851-E856 CarbonylContact C-O 3.53Å; K851-E856 VanDerWaalsContact CA-O 3.29Å; K851-E856 WeakPolarHBondContact CA-O 3.41Å; D852-E856 PolarHBondContact N-O 2.82Å; D852-E856 PolarHBondContact OD1-N 3.25Å; E856-V858 PolarHBondContact O-N 3.01Å
857	P	97.1	Very high	95.9	Very high	14 Å²	14	25.8 Å²	25.8	9%	0.091	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	131.9	-178.5	17.9	-26.1	0	0	0	111.9	V832 N835 K837	V832-P857 HydrophobicContact CG1-CB 3.81Å; N835-P857 HydrophobicContact CB-CB 4.25Å; N835-P857 HydrophobicContact CB-CG 4.07Å; N835-P857 WeakPolarHBondContact ND2-CG 3.43Å; K837-P857 HydrophobicContact CD-CG 4.2Å; K837-P857 VanDerWaalsContact CD-O 3.23Å; K837-P857 WeakPolarHBondContact CD-O 3.47Å; K837-P857 PolarHBondContact NZ-O 3.46Å
858	V	97	Very high	95.8	Very high	30 Å²	30	25.7 Å²	25.7	18%	0.182	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	115.1	-179.5	-177.4	0	0	0	0	109.3	L849 G850 D852 E856 V1098	L849-V858 HydrophobicContact CB-CG1 4.17Å; L849-V858 HydrophobicContact CD1-CG1 4.12Å; L849-V858 PolarHBondContact N-O 3.25Å; G850-V858 PolarHBondContact N-O 3.4Å; G850-V858 PolarHBondContact O-N 2.94Å; D852-V858 HydrophobicContact CB-CG2 3.78Å; E856-V858 PolarHBondContact O-N 3.01Å; V858-V1098 HydrophobicContact CB-CG1 4.04Å; V858-V1098 HydrophobicContact CB-CG2 4.48Å; V858-V1098 HydrophobicContact CG1-CG1 4.38Å; V858-V1098 HydrophobicContact CG1-CG2 4.14Å; V858-V1098 HydrophobicContact CG2-CG1 4.21Å; V858-V1098 HydrophobicContact CG2-CG2 4.29Å
859	V	97.3	Very high	95.8	Very high	32 Å²	32	25.6 Å²	25.6	19%	0.194	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	138.5	179.5	-179.8	0	0	0	0	107.7	V832 K837 F838 T846	V832-V859 HydrophobicContact CG1-CG2 3.94Å; K837-V859 HydrophobicContact CB-CB 4.4Å; K837-V859 HydrophobicContact CB-CG2 4.09Å; F838-V859 HydrophobicContact CB-CG1 4.43Å; F838-V859 HydrophobicContact CB-CG2 4.09Å; F838-V859 HydrophobicContact CD2-CG1 4.24Å; T846-V859 HydrophobicContact CG2-CG1 3.26Å
860	A	95.8	Very high	95.9	Very high	12 Å²	12	25.4 Å²	25.4	10%	0.099	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	176.3	-179.8	0	0	0	0	0	111.1	T846 V847 L849 M865	T846-A860 CarbonylContact C-O 3.58Å; T846-A860 WeakPolarHBondContact CA-O 3.45Å; V847-A860 HydrophobicContact CG2-CB 4.19Å; V847-A860 PolarHBondContact N-O 2.71Å; V847-A860 PolarHBondContact O-N 3.3Å; L849-A860 HydrophobicContact CD1-CB 4.03Å; L849-A860 HydrophobicContact CG-CB 4.24Å; A860-M865 HydrophobicContact CB-CE 3.39Å
861	D	96.5	Very high	95.9	Very high	14 Å²	14	25.4 Å²	25.4	8%	0.075	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	109.6	-175.2	175.1	7.6	0	0	0	109.7	S843 A863 K864 M865	S843-D861 VanDerWaalsContact CB-CG 3.47Å; S843-D861 WeakPolarHBondContact CB-OD1 3.25Å; S843-D861 WeakPolarHBondContact CB-OD2 3.42Å; S843-D861 VanDerWaalsContact OG-CG 3.29Å; S843-D861 PolarHBondContact OG-OD1 3.28Å; D861-A863 PolarHBondContact O-N 3.22Å; D861-A863 VanDerWaalsContact OD1-CB 3.29Å; D861-A863 WeakPolarHBondContact OD1-CB 3.26Å; D861-A863 PolarHBondContact OD1-N 3.41Å; D861-K864 HydrophobicContact CB-CB 4.39Å; D861-K864 HydrophobicContact CB-CD 4.23Å; D861-K864 HydrophobicContact CB-CG 4.28Å; D861-K864 WeakPolarHBondContact O-CA 3.38Å; D861-K864 WeakPolarHBondContact O-CB 3.31Å; D861-K864 PolarHBondContact O-N 2.84Å; D861-K864 WeakPolarHBondContact OD2-CG 3.31Å; D861-K864 IonicContact OD2-NZ 3.33Å; D861-K864 PolarHBondContact OD2-NZ 3Å; D861-M865 PolarHBondContact O-N 3.47Å
862	L	96.3	Very high	95.9	Very high	3 Å²	3	24.1 Å²	24.1	2%	0.016	14%	0.14	C	C	.	.	G	3₁₀ helix	trans	-63.1	-26.8	-175.8	-176.4	69.9	0	0	0	111.6	L845 K864 M865 P866 L868 V998 H1032 V1034	L845-L862 HydrophobicContact CB-CB 4.19Å; L845-L862 PolarHBondContact O-N 3.27Å; L862-K864 PolarHBondContact O-N 2.91Å; L862-M865 HydrophobicContact CD1-CB 4.23Å; L862-M865 HydrophobicContact CD1-CG 4.46Å; L862-M865 HydrophobicContact CD1-SD 3.74Å; L862-M865 PolarHBondContact O-N 3.34Å; L862-M865 VanDerWaalsContact O-N 3.11Å; L862-P866 CarbonylContact O-C 3.5Å; L862-P866 VanDerWaalsContact O-CA 3.26Å; L862-P866 WeakPolarHBondContact O-CA 3.16Å; L862-L868 HydrophobicContact CD1-CB 3.9Å; L862-V998 HydrophobicContact CD2-CG1 3.81Å; L862-V998 HydrophobicContact CD2-CG2 4.14Å; L862-H1032 HydrophobicContact CD2-CB 3.96Å; L862-H1032 HydrophobicContact CG-CB 4.14Å; L862-V1034 HydrophobicContact CD1-CG2 3.96Å; L862-V1034 HydrophobicContact CD2-CG2 3.69Å
863	A	95.5	Very high	95.9	Very high	21 Å²	21	24 Å²	24	17%	0.174	14%	0.141	C	C	.	.	G	3₁₀ helix	trans	-63.5	-27	173.1	0	0	0	0	0	113	L845 D861	L845-A863 HydrophobicContact CB-CB 4.43Å; L845-A863 HydrophobicContact CD1-CB 4.14Å; D861-A863 PolarHBondContact O-N 3.22Å; D861-A863 VanDerWaalsContact OD1-CB 3.29Å; D861-A863 WeakPolarHBondContact OD1-CB 3.26Å; D861-A863 PolarHBondContact OD1-N 3.41Å
864	K	93.9	Very high	95.8	Very high	126 Å²	126	28.9 Å²	28.9	55%	0.548	17%	0.172	S	C	.	.	G	3₁₀ helix	trans	-87.9	-19.2	176.2	-65.9	-179.5	-179.1	88.4	0	112.9	D861 L862 R1027	D861-K864 HydrophobicContact CB-CB 4.39Å; D861-K864 HydrophobicContact CB-CD 4.23Å; D861-K864 HydrophobicContact CB-CG 4.28Å; D861-K864 WeakPolarHBondContact O-CA 3.38Å; D861-K864 WeakPolarHBondContact O-CB 3.31Å; D861-K864 PolarHBondContact O-N 2.84Å; D861-K864 WeakPolarHBondContact OD2-CG 3.31Å; D861-K864 IonicContact OD2-NZ 3.33Å; D861-K864 PolarHBondContact OD2-NZ 3Å; L862-K864 PolarHBondContact O-N 2.91Å; K864-R1027 PolarHBondContact O-NH2 2.98Å
865	M	91.7	Very high	95.8	Very high	2 Å²	2	29.3 Å²	29.3	1%	0.01	18%	0.181	C	C	.	.	S	Bend	trans	-67.5	-27.4	-172.7	-71.8	-173.7	-177.3	0	0	116.1	V847 A860 D861 L862 L868 P1054 T1055 Y1087	V847-M865 HydrophobicContact CG2-CE 4.12Å; A860-M865 HydrophobicContact CB-CE 3.39Å; D861-M865 PolarHBondContact O-N 3.47Å; L862-M865 HydrophobicContact CD1-CB 4.23Å; L862-M865 HydrophobicContact CD1-CG 4.46Å; L862-M865 HydrophobicContact CD1-SD 3.74Å; L862-M865 PolarHBondContact O-N 3.34Å; L862-M865 VanDerWaalsContact O-N 3.11Å; M865-L868 HydrophobicContact SD-CB 4.1Å; M865-L868 HydrophobicContact SD-CD1 4.27Å; M865-L868 HydrophobicContact SD-CD2 4.24Å; M865-L868 HydrophobicContact SD-CG 4.44Å; M865-P1054 WeakPolarHBondContact O-CG 3.42Å; M865-T1055 WeakPolarHBondContact CA-OG1 3.29Å; M865-T1055 HydrophobicContact CB-CG2 4.28Å; M865-T1055 WeakPolarHBondContact CB-OG1 3.41Å; M865-T1055 HydrophobicContact CE-CG2 4.46Å; M865-T1055 HydrophobicContact CG-CG2 3.91Å; M865-T1055 PolarHBondContact O-OG1 3.38Å; M865-T1055 HydrophobicContact SD-CG2 3.84Å; M865-Y1087 HydrophobicContact CE-CE2 4.14Å
866	P	90.4	Very high	96	Very high	13 Å²	13	28.6 Å²	28.6	8%	0.084	17%	0.174	C	C	.	.			cis	-64.6	-8.8	-42.7	36.2	-39.8	0	0	0	113.9	L862 R1027 H1032	L862-P866 CarbonylContact O-C 3.5Å; L862-P866 VanDerWaalsContact O-CA 3.26Å; L862-P866 WeakPolarHBondContact O-CA 3.16Å; P866-R1027 HydrophobicContact CB-CB 3.71Å; P866-R1027 HydrophobicContact CB-CG 3.57Å; P866-R1027 HydrophobicContact CG-CB 3.95Å; P866-R1027 HydrophobicContact CG-CG 4.09Å; P866-H1032 PolarHBondContact O-ND1 3.45Å
867	H	97.6	Very high	96	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	16%	0.157	C	C	.	.	S	Bend	trans	-134.6	150.4	-176.7	-55.7	-40.7	0	0	0	108.3	A1023 I1031 L1033 I1053 T1055	H867-A1023 VanDerWaalsContact CD2-CA 3.42Å; H867-A1023 WeakPolarHBondContact CD2-CA 3.28Å; H867-A1023 PolarHBondContact CD2-O 3.09Å; H867-A1023 PolarHBondContact NE2-O 3.01Å; H867-I1031 PolarHBondContact CE1-O 3.17Å; H867-L1033 WeakPolarHBondContact CA-O 3.25Å; H867-L1033 HydrophobicContact CB-CB 4.28Å; H867-L1033 PolarHBondContact ND1-N 2.87Å; H867-I1053 HydrophobicContact CB-CG1 4.12Å; H867-I1053 HydrophobicContact CB-CG2 4.07Å; H867-T1055 WeakPolarHBondContact O-CB 3.31Å
868	L	97.7	Very high	96	Very high	1 Å²	1	23.7 Å²	23.7	1%	0.005	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	130	-171.9	175.8	62	0	0	0	111.1	L862 M865 V870 M885 L1033 V1034 L1035 T1055 I1057	L862-L868 HydrophobicContact CD1-CB 3.9Å; M865-L868 HydrophobicContact SD-CB 4.1Å; M865-L868 HydrophobicContact SD-CD1 4.27Å; M865-L868 HydrophobicContact SD-CD2 4.24Å; M865-L868 HydrophobicContact SD-CG 4.44Å; L868-V870 HydrophobicContact CD1-CG2 4.34Å; L868-V870 HydrophobicContact CD2-CG2 3.88Å; L868-V870 HydrophobicContact CG-CG2 3.76Å; L868-M885 HydrophobicContact CD2-CE 4.12Å; L868-M885 HydrophobicContact CD2-SD 3.63Å; L868-L1033 PolarHBondContact N-O 3.44Å; L868-V1034 HydrophobicContact CD2-CG1 4.3Å; L868-V1034 WeakPolarHBondContact O-CA 3.29Å; L868-L1035 PolarHBondContact O-N 3.45Å; L868-T1055 HydrophobicContact CD1-CG2 3.88Å; L868-I1057 HydrophobicContact CD1-CB 4.36Å; L868-I1057 HydrophobicContact CD1-CD1 3.96Å; L868-I1057 HydrophobicContact CD1-CG1 3.94Å; L868-I1057 HydrophobicContact CD2-CD1 4.17Å
869	L	97.9	Very high	95.9	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	127.1	168.7	-174	66.5	0	0	0	109.2	F1004 L1035 I1045 I1049 I1053 T1055 R1056 I1057 I1070	L869-F1004 HydrophobicContact CD1-CD1 4.48Å; L869-F1004 HydrophobicContact CD1-CE1 3.54Å; L869-F1004 HydrophobicContact CD1-CZ 3.87Å; L869-L1035 CarbonylContact C-O 3.48Å; L869-L1035 WeakPolarHBondContact CA-O 3.41Å; L869-L1035 HydrophobicContact CD1-CB 4.06Å; L869-I1045 HydrophobicContact CD2-CD1 4.37Å; L869-I1045 HydrophobicContact CD2-CG1 4.42Å; L869-I1045 HydrophobicContact CD2-CG2 3.65Å; L869-I1049 HydrophobicContact CD1-CG2 4.39Å; L869-I1049 HydrophobicContact CD2-CG2 4.49Å; L869-I1053 HydrophobicContact CB-CG2 3.9Å; L869-T1055 PolarHBondContact N-O 3.06Å; L869-T1055 VanDerWaalsContact N-O 3.07Å; L869-R1056 CarbonylContact O-C 3.53Å; L869-R1056 WeakPolarHBondContact O-CA 3.44Å; L869-I1057 PolarHBondContact O-N 3.19Å; L869-I1070 HydrophobicContact CB-CD1 4.18Å; L869-I1070 HydrophobicContact CD2-CD1 3.52Å; L869-I1070 HydrophobicContact CG-CD1 3.6Å
870	V	98.3	Very high	95.9	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	128.8	-178.7	-171.9	0	0	0	0	109.5	L868 K878 V1034 L1035 A1036 T1037 I1057 F1059	L868-V870 HydrophobicContact CD1-CG2 4.34Å; L868-V870 HydrophobicContact CD2-CG2 3.88Å; L868-V870 HydrophobicContact CG-CG2 3.76Å; V870-K878 HydrophobicContact CG1-CG 4.36Å; V870-V1034 HydrophobicContact CG2-CG1 4.49Å; V870-L1035 PolarHBondContact N-O 2.97Å; V870-A1036 HydrophobicContact CB-CB 4.07Å; V870-A1036 CarbonylContact O-C 3.51Å; V870-A1036 VanDerWaalsContact O-CA 3.3Å; V870-A1036 WeakPolarHBondContact O-CA 3.4Å; V870-T1037 PolarHBondContact O-N 3Å; V870-I1057 CarbonylContact C-O 3.59Å; V870-I1057 WeakPolarHBondContact CA-O 3.48Å; V870-I1057 HydrophobicContact CG1-CB 4.45Å; V870-I1057 HydrophobicContact CG1-CG2 4.22Å; V870-I1057 HydrophobicContact CG2-CB 4.48Å; V870-F1059 HydrophobicContact CG1-CD2 3.97Å; V870-F1059 HydrophobicContact CG1-CE2 3.73Å
871	A	98.2	Very high	95.9	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	147.9	173.9	0	0	0	0	0	112.2	T1037 P1040 I1045 I1057 A1058 F1059 I1070	A871-T1037 WeakPolarHBondContact CA-O 3.29Å; A871-T1037 HydrophobicContact CB-CG2 4.12Å; A871-P1040 HydrophobicContact CB-CB 4.2Å; A871-I1045 HydrophobicContact CB-CD1 4.34Å; A871-I1057 PolarHBondContact N-O 2.68Å; A871-A1058 CarbonylContact O-C 3.56Å; A871-A1058 WeakPolarHBondContact O-CA 3.36Å; A871-F1059 PolarHBondContact O-N 3.14Å; A871-I1070 HydrophobicContact CB-CB 3.94Å; A871-I1070 HydrophobicContact CB-CD1 4.12Å; A871-I1070 HydrophobicContact CB-CG1 3.86Å; A871-I1070 HydrophobicContact CB-CG2 4.18Å
872	G	97.2	Very high	96	Very high	0 Å²	0	23 Å²	23	0%	0	15%	0.15	C	C	.	.			trans	174.2	145.7	173.9	0	0	0	0	0	112.2	S876 T1037 Q1038	G872-S876 WeakPolarHBondContact CA-OG 3.44Å; G872-T1037 PolarHBondContact N-O 2.71Å; G872-Q1038 WeakPolarHBondContact O-CA 3.5Å
873	T	95.8	Very high	96	Very high	39 Å²	39	23.2 Å²	23.2	24%	0.239	15%	0.151	C	C	.	.			trans	-67.5	165.5	179.3	50.5	0	0	0	0	112.3	G875 S876 T1060 S1062	T873-G875 PolarHBondContact O-N 3.13Å; T873-S876 PolarHBondContact N-OG 2.98Å; T873-S876 WeakPolarHBondContact O-CB 3.46Å; T873-S876 PolarHBondContact O-N 3.41Å; T873-S876 PolarHBondContact O-OG 2.92Å; T873-T1060 PolarHBondContact N-O 3.39Å; T873-T1060 PolarHBondContact OG1-O 3.2Å; T873-S1062 WeakPolarHBondContact CG2-OG 3.5Å
874	T	95.2	Very high	96.1	Very high	119 Å²	119	22.3 Å²	22.3	73%	0.73	14%	0.144	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.7	132.7	171.8	-41.7	0	0	0	0	110.5	S876 Q1038	T874-S876 PolarHBondContact O-N 3.28Å; T874-Q1038 PolarHBondContact OG1-OE1 2.54Å
875	G	93.8	Very high	96.3	Very high	68 Å²	68	16.6 Å²	16.6	70%	0.701	12%	0.119	S	C	*	.	T	Hydrogen-bonded Turn	trans	77	-4.3	-175.4	0	0	0	0	0	116	T873 G877	T873-G875 PolarHBondContact O-N 3.13Å; G875-G877 PolarHBondContact O-N 3.23Å
876	S	96.2	Very high	96.6	Very high	3 Å²	3	16.5 Å²	16.5	2%	0.021	12%	0.119	C	C	.	.	S	Bend	trans	-66.4	-24.3	176.7	66.4	0	0	0	0	114	G872 T873 T874 T1060 G1081 M1082 G1083	G872-S876 WeakPolarHBondContact CA-OG 3.44Å; T873-S876 PolarHBondContact N-OG 2.98Å; T873-S876 WeakPolarHBondContact O-CB 3.46Å; T873-S876 PolarHBondContact O-N 3.41Å; T873-S876 PolarHBondContact O-OG 2.92Å; T874-S876 PolarHBondContact O-N 3.28Å; S876-T1060 VanDerWaalsContact CB-O 3.32Å; S876-T1060 WeakPolarHBondContact CB-O 3.39Å; S876-G1081 CarbonylContact O-C 3.45Å; S876-M1082 PolarHBondContact O-N 2.8Å; S876-G1083 PolarHBondContact O-N 3.19Å
877	G	96	Very high	97	Very high	12 Å²	12	15.9 Å²	15.9	12%	0.124	12%	0.115	C	C	.	.	S	Bend	trans	114.4	-2.5	-174.9	0	0	0	0	0	115.1	G875 S879 V880 G881	G875-G877 PolarHBondContact O-N 3.23Å; G877-S879 PolarHBondContact O-N 2.87Å; G877-V880 PolarHBondContact O-N 3.37Å; G877-G881 PolarHBondContact O-N 2.84Å
878	K	96.9	Very high	97	Very high	3 Å²	3	15.9 Å²	15.9	1%	0.013	12%	0.115	C	C	.	.	H	α-helix	trans	-38.4	-63.3	179.6	-176.3	-166.8	75.7	97.2	0	113.4	V870 G881 V882 D1002 A1036 Q1038 F1059	V870-K878 HydrophobicContact CG1-CG 4.36Å; K878-G881 CarbonylContact O-C 3.6Å; K878-G881 WeakPolarHBondContact O-CA 3.35Å; K878-G881 PolarHBondContact O-N 2.99Å; K878-G881 VanDerWaalsContact O-N 3.12Å; K878-V882 PolarHBondContact O-N 2.78Å; K878-D1002 PolarHBondContact NZ-O 3.32Å; K878-D1002 IonicContact NZ-OD1 2.96Å; K878-D1002 PolarHBondContact NZ-OD1 3.47Å; K878-D1002 IonicContact NZ-OD2 2.83Å; K878-D1002 PolarHBondContact NZ-OD2 2.85Å; K878-A1036 HydrophobicContact CD-CB 4.31Å; K878-A1036 HydrophobicContact CG-CB 4.48Å; K878-Q1038 HydrophobicContact CD-CG 3.81Å; K878-Q1038 VanDerWaalsContact CE-CG 3.5Å; K878-F1059 HydrophobicContact CB-CD2 4.41Å
879	S	95.2	Very high	97.1	Very high	20 Å²	20	16 Å²	16	14%	0.14	12%	0.115	C	C	.	.	H	α-helix	trans	-70.7	-38.3	-169.6	-28.9	0	0	0	0	112.6	G877 G881 V882 N883 E909	G877-S879 PolarHBondContact O-N 2.87Å; S879-G881 VanDerWaalsContact C-N 3.27Å; S879-G881 PolarHBondContact O-N 3.29Å; S879-V882 PolarHBondContact O-N 2.81Å; S879-N883 WeakPolarHBondContact O-CB 3.35Å; S879-N883 PolarHBondContact O-N 2.93Å; S879-N883 PolarHBondContact O-ND2 3.04Å; S879-E909 WeakPolarHBondContact CB-OE1 3.45Å; S879-E909 WeakPolarHBondContact CB-OE2 3.49Å; S879-E909 VanDerWaalsContact OG-CD 3.22Å; S879-E909 PolarHBondContact OG-OE1 3.08Å; S879-E909 PolarHBondContact OG-OE2 3.38Å
880	V	97.2	Very high	97.1	Very high	41 Å²	41	16 Å²	16	25%	0.248	12%	0.115	C	C	.	.	H	α-helix	trans	-59	-40.4	170	-179.6	0	0	0	0	110.8	G877 N883 A884 F1102 V1103	G877-V880 PolarHBondContact O-N 3.37Å; V880-N883 PolarHBondContact O-N 3.48Å; V880-A884 WeakPolarHBondContact O-CB 3.45Å; V880-A884 PolarHBondContact O-N 2.74Å; V880-F1102 HydrophobicContact CG1-CD2 4.04Å; V880-V1103 HydrophobicContact CG1-CG1 3.94Å
881	G	97.3	Very high	97	Very high	7 Å²	7	16.9 Å²	16.9	7%	0.072	12%	0.119	C	C	.	.	H	α-helix	trans	-65.4	-41.9	174.5	0	0	0	0	0	113.6	G877 K878 S879 A884 M885	G877-G881 PolarHBondContact O-N 2.84Å; K878-G881 CarbonylContact O-C 3.6Å; K878-G881 WeakPolarHBondContact O-CA 3.35Å; K878-G881 PolarHBondContact O-N 2.99Å; K878-G881 VanDerWaalsContact O-N 3.12Å; S879-G881 VanDerWaalsContact C-N 3.27Å; S879-G881 PolarHBondContact O-N 3.29Å; G881-A884 PolarHBondContact O-N 3.44Å; G881-M885 WeakPolarHBondContact O-CG 3.31Å; G881-M885 PolarHBondContact O-N 3.02Å; G881-M885 VanDerWaalsContact O-N 3.09Å
882	V	97	Very high	97	Very high	4 Å²	4	18.7 Å²	18.7	2%	0.024	13%	0.126	C	C	.	.	H	α-helix	trans	-62.9	-45.3	173.4	172.5	0	0	0	0	110.4	K878 S879 A884 M885 I886 L910 L1000 A1036	K878-V882 PolarHBondContact O-N 2.78Å; S879-V882 PolarHBondContact O-N 2.81Å; V882-A884 VanDerWaalsContact C-N 3.34Å; V882-A884 PolarHBondContact O-N 3.34Å; V882-M885 WeakPolarHBondContact O-CB 3.43Å; V882-M885 PolarHBondContact O-N 3.49Å; V882-M885 VanDerWaalsContact O-N 3.08Å; V882-I886 HydrophobicContact CG1-CD1 3.88Å; V882-I886 HydrophobicContact CG1-CG1 4.43Å; V882-I886 WeakPolarHBondContact O-CG1 3.2Å; V882-I886 PolarHBondContact O-N 3.46Å; V882-L910 HydrophobicContact CG1-CD2 4.24Å; V882-L1000 HydrophobicContact CG1-CD2 4.29Å; V882-A1036 HydrophobicContact CG2-CB 4.24Å
883	N	97.6	Very high	97	Very high	8 Å²	8	18.7 Å²	18.7	4%	0.043	13%	0.126	C	C	.	.	H	α-helix	trans	-61.8	-39.1	176.2	-73.6	-23.5	0	0	0	112.4	S879 V880 M885 I886 L887 Y913 V1103 V1108	S879-N883 WeakPolarHBondContact O-CB 3.35Å; S879-N883 PolarHBondContact O-N 2.93Å; S879-N883 PolarHBondContact O-ND2 3.04Å; V880-N883 PolarHBondContact O-N 3.48Å; N883-M885 VanDerWaalsContact C-N 3.34Å; N883-M885 PolarHBondContact O-N 3.39Å; N883-I886 PolarHBondContact O-N 3.35Å; N883-L887 WeakPolarHBondContact O-CB 3.34Å; N883-L887 WeakPolarHBondContact O-CD1 3.32Å; N883-L887 PolarHBondContact O-N 3.48Å; N883-Y913 WeakPolarHBondContact CA-OH 3.33Å; N883-Y913 VanDerWaalsContact CG-OH 3.31Å; N883-Y913 VanDerWaalsContact OD1-CE2 3.31Å; N883-Y913 WeakPolarHBondContact OD1-CE2 3.32Å; N883-Y913 PolarHBondContact OD1-OH 3.41Å; N883-V1103 HydrophobicContact CB-CG1 4.09Å; N883-V1108 HydrophobicContact CB-CG2 4.15Å
884	A	98	Very high	97	Very high	2 Å²	2	19.3 Å²	19.3	2%	0.017	13%	0.127	C	C	.	.	H	α-helix	trans	-61.8	-38.1	172.1	0	0	0	0	0	112.7	L829 V880 G881 V882 S888 A1101	L829-A884 HydrophobicContact CD1-CB 4.14Å; V880-A884 WeakPolarHBondContact O-CB 3.45Å; V880-A884 PolarHBondContact O-N 2.74Å; G881-A884 PolarHBondContact O-N 3.44Å; V882-A884 VanDerWaalsContact C-N 3.34Å; V882-A884 PolarHBondContact O-N 3.34Å; A884-S888 WeakPolarHBondContact O-CB 3.47Å; A884-S888 PolarHBondContact O-N 3.02Å; A884-S888 PolarHBondContact O-OG 3.37Å; A884-A1101 HydrophobicContact CB-CB 4.36Å
885	M	97.9	Very high	97.1	Very high	7 Å²	7	15 Å²	15	3%	0.034	10%	0.101	C	C	.	.	H	α-helix	trans	-68.5	-43.7	174.6	-64.5	177.3	-148.8	0	0	112.2	V847 L849 L868 G881 V882 N883 S888 M889 I1057	V847-M885 HydrophobicContact CB-CB 4.26Å; V847-M885 HydrophobicContact CB-CG 4.11Å; V847-M885 HydrophobicContact CG1-CB 3.98Å; V847-M885 HydrophobicContact CG1-CG 4.31Å; L849-M885 HydrophobicContact CD2-CE 4.09Å; L868-M885 HydrophobicContact CD2-CE 4.12Å; L868-M885 HydrophobicContact CD2-SD 3.63Å; G881-M885 WeakPolarHBondContact O-CG 3.31Å; G881-M885 PolarHBondContact O-N 3.02Å; G881-M885 VanDerWaalsContact O-N 3.09Å; V882-M885 WeakPolarHBondContact O-CB 3.43Å; V882-M885 PolarHBondContact O-N 3.49Å; V882-M885 VanDerWaalsContact O-N 3.08Å; N883-M885 VanDerWaalsContact C-N 3.34Å; N883-M885 PolarHBondContact O-N 3.39Å; M885-S888 WeakPolarHBondContact O-CB 3.46Å; M885-S888 PolarHBondContact O-N 2.93Å; M885-M889 PolarHBondContact O-N 3.32Å; M885-I1057 HydrophobicContact CE-CD1 3.69Å
886	I	98.1	Very high	97.2	Very high	0 Å²	0	17.4 Å²	17.4	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-62.9	-49.6	177.6	-62.9	166.9	0	0	0	110.2	V882 N883 S888 M889 L890 M902 L910 Y913 L1000	V882-I886 HydrophobicContact CG1-CD1 3.88Å; V882-I886 HydrophobicContact CG1-CG1 4.43Å; V882-I886 WeakPolarHBondContact O-CG1 3.2Å; V882-I886 PolarHBondContact O-N 3.46Å; N883-I886 PolarHBondContact O-N 3.35Å; I886-S888 VanDerWaalsContact C-N 3.27Å; I886-S888 PolarHBondContact O-N 3.43Å; I886-M889 PolarHBondContact O-N 3.39Å; I886-M889 VanDerWaalsContact O-N 3.11Å; I886-L890 HydrophobicContact CG2-CD1 4Å; I886-L890 HydrophobicContact CG2-CG 4.35Å; I886-L890 WeakPolarHBondContact O-CG 3.5Å; I886-L890 PolarHBondContact O-N 3.34Å; I886-M902 HydrophobicContact CD1-CE 4.4Å; I886-M902 HydrophobicContact CG2-CE 4.15Å; I886-L910 HydrophobicContact CD1-CD2 3.76Å; I886-Y913 HydrophobicContact CB-CE1 4.28Å; I886-Y913 HydrophobicContact CD1-CD2 4.18Å; I886-Y913 HydrophobicContact CD1-CE2 3.55Å; I886-Y913 HydrophobicContact CG2-CD1 4Å; I886-Y913 HydrophobicContact CG2-CE1 3.49Å; I886-Y913 VanDerWaalsContact CG2-CE1 3.49Å; I886-Y913 HydrophobicContact CG2-CE2 4.27Å; I886-L1000 HydrophobicContact CD1-CD1 4.34Å; I886-L1000 HydrophobicContact CD1-CD2 4.16Å; I886-L1000 HydrophobicContact CG1-CD1 4.12Å; I886-L1000 HydrophobicContact CG1-CD2 3.95Å
887	L	98.2	Very high	97.2	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-61.3	-35.1	177.3	-94.5	68.9	0	0	0	112.3	L727 L829 N883 M889 L890 Y891 Y913 V1103 V1108 V1111	L727-L887 HydrophobicContact CD2-CD2 4.26Å; L829-L887 HydrophobicContact CD2-CB 3.89Å; L829-L887 HydrophobicContact CD2-CD2 3.82Å; N883-L887 WeakPolarHBondContact O-CB 3.34Å; N883-L887 WeakPolarHBondContact O-CD1 3.32Å; N883-L887 PolarHBondContact O-N 3.48Å; L887-M889 VanDerWaalsContact C-N 3.28Å; L887-M889 PolarHBondContact O-N 2.96Å; L887-L890 CarbonylContact O-C 3.32Å; L887-L890 PolarHBondContact O-N 3.42Å; L887-L890 VanDerWaalsContact O-N 3.17Å; L887-Y891 HydrophobicContact CB-CD2 4.47Å; L887-Y891 WeakPolarHBondContact O-CB 3.5Å; L887-Y891 WeakPolarHBondContact O-CD2 3.42Å; L887-Y891 PolarHBondContact O-N 3.34Å; L887-Y913 HydrophobicContact CD1-CE1 3.9Å; L887-Y913 WeakPolarHBondContact CD1-OH 3.38Å; L887-V1103 HydrophobicContact CD2-CG2 4.01Å; L887-V1108 HydrophobicContact CD1-CB 4.41Å; L887-V1108 HydrophobicContact CD1-CG1 4.14Å; L887-V1108 HydrophobicContact CD1-CG2 4.07Å; L887-V1108 HydrophobicContact CD2-CG2 4.49Å; L887-V1111 HydrophobicContact CD2-CB 4.38Å; L887-V1111 HydrophobicContact CD2-CG2 4.04Å; L887-V1111 HydrophobicContact CG-CB 4.44Å; L887-V1111 HydrophobicContact CG-CG1 4.25Å
888	S	98.2	Very high	97.3	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-57.6	-41.2	174.9	-62.3	0	0	0	0	112.4	F838 T846 V848 A884 M885 I886	F838-S888 WeakPolarHBondContact CZ-O 3.32Å; T846-S888 WeakPolarHBondContact O-CB 3.26Å; V848-S888 VanDerWaalsContact CB-OG 3.32Å; V848-S888 WeakPolarHBondContact CB-OG 3.25Å; V848-S888 PolarHBondContact N-OG 3.46Å; A884-S888 WeakPolarHBondContact O-CB 3.47Å; A884-S888 PolarHBondContact O-N 3.02Å; A884-S888 PolarHBondContact O-OG 3.37Å; M885-S888 WeakPolarHBondContact O-CB 3.46Å; M885-S888 PolarHBondContact O-N 2.93Å; I886-S888 VanDerWaalsContact C-N 3.27Å; I886-S888 PolarHBondContact O-N 3.43Å
889	M	98.2	Very high	97.4	Very high	2 Å²	2	19.9 Å²	19.9	1%	0.01	10%	0.102	C	C	.	.	H	α-helix	trans	-71.2	-43.1	174.9	-65	179.1	-71.9	0	0	110.8	L845 V847 M885 I886 L887 Y891 K892 A893 V898 F900 V998	L845-M889 HydrophobicContact CD2-SD 3.77Å; V847-M889 HydrophobicContact CG1-CG 4.3Å; M885-M889 PolarHBondContact O-N 3.32Å; I886-M889 PolarHBondContact O-N 3.39Å; I886-M889 VanDerWaalsContact O-N 3.11Å; L887-M889 VanDerWaalsContact C-N 3.28Å; L887-M889 PolarHBondContact O-N 2.96Å; M889-Y891 PolarHBondContact O-N 3.29Å; M889-K892 PolarHBondContact O-N 2.76Å; M889-A893 WeakPolarHBondContact O-CB 3.43Å; M889-A893 PolarHBondContact O-N 3.12Å; M889-V898 HydrophobicContact SD-CG1 4.49Å; M889-F900 HydrophobicContact CB-CZ 4Å; M889-F900 HydrophobicContact CE-CE1 3.6Å; M889-F900 HydrophobicContact CE-CZ 4.02Å; M889-F900 HydrophobicContact SD-CE1 3.99Å; M889-F900 HydrophobicContact SD-CZ 4.35Å; M889-V998 HydrophobicContact CE-CG1 4.46Å; M889-V998 HydrophobicContact SD-CG2 4.08Å
890	L	97.9	Very high	97.6	Very high	0 Å²	0	19 Å²	19	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-62.5	-20	175.7	-67	177.4	0	0	0	114.4	P722 I886 L887 F900 Y913 I916 V1111 W1115	P722-L890 WeakPolarHBondContact CD-O 3.35Å; P722-L890 VanDerWaalsContact CG-O 3.25Å; P722-L890 WeakPolarHBondContact CG-O 3.46Å; I886-L890 HydrophobicContact CG2-CD1 4Å; I886-L890 HydrophobicContact CG2-CG 4.35Å; I886-L890 WeakPolarHBondContact O-CG 3.5Å; I886-L890 PolarHBondContact O-N 3.34Å; L887-L890 CarbonylContact O-C 3.32Å; L887-L890 PolarHBondContact O-N 3.42Å; L887-L890 VanDerWaalsContact O-N 3.17Å; L890-F900 HydrophobicContact CD2-CE2 3.98Å; L890-Y913 HydrophobicContact CD1-CD1 4.3Å; L890-Y913 HydrophobicContact CD1-CE1 4.13Å; L890-I916 HydrophobicContact CD2-CD1 4.2Å; L890-V1111 HydrophobicContact CB-CG1 4.32Å; L890-V1111 HydrophobicContact CD1-CG1 4.28Å; L890-W1115 WeakPolarHBondContact O-CZ2 3.22Å; L890-W1115 PolarHBondContact O-NE1 2.89Å
891	Y	97.8	Very high	97.6	Very high	19 Å²	19	17 Å²	17	8%	0.075	8%	0.084	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.8	-1.9	173.5	-91.6	-71.6	0	0	0	114.4	P722 S723 L724 L727 L833 L887 M889 V1111	P722-Y891 HydrophobicContact CB-CD1 4.31Å; P722-Y891 HydrophobicContact CB-CE1 3.76Å; P722-Y891 HydrophobicContact CG-CD1 3.73Å; P722-Y891 HydrophobicContact CG-CE1 3.7Å; P722-Y891 HydrophobicContact CG-CG 4.21Å; P722-Y891 WeakPolarHBondContact O-CE1 3.39Å; S723-Y891 VanDerWaalsContact O-CE1 3.32Å; S723-Y891 WeakPolarHBondContact O-CE1 3.31Å; S723-Y891 PolarHBondContact O-OH 2.82Å; L724-Y891 HydrophobicContact CD2-CD1 3.81Å; L724-Y891 HydrophobicContact CD2-CE1 3.69Å; L724-Y891 HydrophobicContact CD2-CG 4.39Å; L724-Y891 HydrophobicContact CG-CE1 4.3Å; L727-Y891 HydrophobicContact CD1-CD2 4.48Å; L727-Y891 HydrophobicContact CD1-CE2 3.71Å; L727-Y891 HydrophobicContact CD2-CE2 4.3Å; L727-Y891 HydrophobicContact CG-CE2 4.1Å; L833-Y891 HydrophobicContact CD1-CD2 3.68Å; L833-Y891 HydrophobicContact CD1-CE2 4.15Å; L833-Y891 HydrophobicContact CD1-CG 4.03Å; L887-Y891 HydrophobicContact CB-CD2 4.47Å; L887-Y891 WeakPolarHBondContact O-CB 3.5Å; L887-Y891 WeakPolarHBondContact O-CD2 3.42Å; L887-Y891 PolarHBondContact O-N 3.34Å; M889-Y891 PolarHBondContact O-N 3.29Å; Y891-V1111 HydrophobicContact CE2-CG1 4.36Å; Y891-V1111 HydrophobicContact CE2-CG2 3.77Å; Y891-V1111 WeakPolarHBondContact OH-CG2 3.35Å
892	K	96.5	Very high	97.7	Very high	38 Å²	38	16.7 Å²	16.7	17%	0.165	8%	0.08	C	C	.	.	T	Hydrogen-bonded Turn	trans	-132.5	-29.3	-176	-172.9	175.2	-76.8	-79.4	0	114.7	F838 R839 N841 S843 M889	F838-K892 HydrophobicContact CZ-CB 4.02Å; F838-K892 HydrophobicContact CZ-CD 4.43Å; F838-K892 VanDerWaalsContact O-CE 3.28Å; F838-K892 WeakPolarHBondContact O-CE 3.4Å; F838-K892 PolarHBondContact O-NZ 2.98Å; R839-K892 PolarHBondContact O-NZ 2.86Å; R839-K892 VanDerWaalsContact O-NZ 3.13Å; N841-K892 PolarHBondContact O-NZ 2.74Å; S843-K892 WeakPolarHBondContact O-CD 3.3Å; M889-K892 PolarHBondContact O-N 2.76Å
893	A	97.1	Very high	97.7	Very high	0 Å²	0	16.5 Å²	16.5	0%	0	8%	0.079	C	C	.	.			trans	-115	136.8	-168.1	0	0	0	0	0	113.4	P844 M889 D897 V898 H918	P844-A893 HydrophobicContact CB-CB 3.91Å; M889-A893 WeakPolarHBondContact O-CB 3.43Å; M889-A893 PolarHBondContact O-N 3.12Å; A893-D897 HydrophobicContact CB-CB 4Å; A893-V898 HydrophobicContact CB-CB 3.82Å; A893-V898 HydrophobicContact CB-CG2 3.49Å; A893-V898 VanDerWaalsContact CB-CG2 3.49Å; A893-H918 PolarHBondContact O-NE2 2.95Å
894	Q	96.7	Very high	97.6	Very high	52 Å²	52	16.2 Å²	16.2	24%	0.243	8%	0.077	C	C	.	.			trans	-78.7	163.8	165	-66.1	-61.1	-37.4	0	0	111.3	P720 E896 D897 V898	P720-Q894 PolarHBondContact O-NE2 3.44Å; Q894-E896 HydrophobicContact CB-CG 3.68Å; Q894-E896 PolarHBondContact O-N 3.48Å; Q894-E896 VanDerWaalsContact O-N 3.1Å; Q894-D897 WeakPolarHBondContact CB-OD2 3.32Å; Q894-D897 PolarHBondContact N-OD2 3.27Å; Q894-D897 WeakPolarHBondContact O-CB 3.27Å; Q894-D897 PolarHBondContact O-N 3.1Å; Q894-V898 PolarHBondContact O-N 2.94Å
895	P	96.9	Very high	97.3	Very high	30 Å²	30	17.6 Å²	17.6	20%	0.195	9%	0.086	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58	-18.9	170.7	-25.7	35	0	0	0	114.8	V898 P917 W1115	P895-V898 WeakPolarHBondContact CA-O 3.27Å; P895-P917 HydrophobicContact CG-CB 3.84Å; P895-P917 HydrophobicContact CG-CG 4.01Å; P895-W1115 HydrophobicContact CG-CZ3 4.5Å
896	E	96	Very high	96.9	Very high	118 Å²	118	20.6 Å²	20.6	55%	0.551	10%	0.099	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.2	-13.9	171.8	58.3	156.8	-110.7	0	0	114.1	Q894 K993	Q894-E896 HydrophobicContact CB-CG 3.68Å; Q894-E896 PolarHBondContact O-N 3.48Å; Q894-E896 VanDerWaalsContact O-N 3.1Å; E896-K993 WeakPolarHBondContact O-CE 3.24Å; E896-K993 IonicContact OE1-NZ 3.73Å; E896-K993 PolarHBondContact OE1-NZ 3.41Å
897	D	97	Very high	96.4	Very high	40 Å²	40	26.2 Å²	26.2	21%	0.214	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.1	-43.5	173.4	-60.3	-53.6	0	0	0	111.2	P844 A893 Q894 K993 Y996	P844-D897 HydrophobicContact CB-CB 4Å; P844-D897 HydrophobicContact CG-CB 4.4Å; A893-D897 HydrophobicContact CB-CB 4Å; Q894-D897 WeakPolarHBondContact CB-OD2 3.32Å; Q894-D897 PolarHBondContact N-OD2 3.27Å; Q894-D897 WeakPolarHBondContact O-CB 3.27Å; Q894-D897 PolarHBondContact O-N 3.1Å; D897-K993 IonicContact OD1-NZ 2.67Å; D897-K993 PolarHBondContact OD1-NZ 3.03Å; D897-Y996 PolarHBondContact O-N 3.46Å
898	V	98.2	Very high	95.9	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	135.3	-173.8	179.8	0	0	0	0	110.3	P844 L845 M889 A893 Q894 P895 F900 H918 Y996 V998	P844-V898 HydrophobicContact CB-CG2 3.86Å; P844-V898 HydrophobicContact CG-CG2 4.25Å; L845-V898 HydrophobicContact CD2-CG1 3.99Å; L845-V898 HydrophobicContact CD2-CG2 3.63Å; L845-V898 HydrophobicContact CG-CG2 4.43Å; M889-V898 HydrophobicContact SD-CG1 4.49Å; A893-V898 HydrophobicContact CB-CB 3.82Å; A893-V898 HydrophobicContact CB-CG2 3.49Å; A893-V898 VanDerWaalsContact CB-CG2 3.49Å; Q894-V898 PolarHBondContact O-N 2.94Å; P895-V898 WeakPolarHBondContact CA-O 3.27Å; V898-F900 HydrophobicContact CG1-CD1 4.33Å; V898-F900 HydrophobicContact CG1-CE1 3.61Å; V898-F900 HydrophobicContact CG1-CZ 3.73Å; V898-H918 PolarHBondContact O-CD2 3.12Å; V898-Y996 CarbonylContact C-O 3.49Å; V898-Y996 WeakPolarHBondContact CA-O 3.27Å; V898-V998 HydrophobicContact CG1-CG2 4.14Å
899	R	98.5	Very high	95.4	Very high	30 Å²	30	35.1 Å²	35.1	11%	0.113	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	148.7	174.9	-79.2	-65.4	-145.3	138.1	17	110.1	H918 L919 L920 P995 Y996 I997 V998 Q1122	R899-H918 CarbonylContact C-O 3.56Å; R899-H918 VanDerWaalsContact CA-O 3.29Å; R899-H918 WeakPolarHBondContact CA-O 3.26Å; R899-H918 WeakPolarHBondContact CD-O 3.32Å; R899-L919 PolarHBondContact NH1-O 3.32Å; R899-L920 HydrophobicContact CB-CD1 3.72Å; R899-L920 HydrophobicContact CB-CD2 4.32Å; R899-L920 HydrophobicContact CB-CG 3.81Å; R899-L920 HydrophobicContact CG-CD1 4.4Å; R899-L920 HydrophobicContact CG-CD2 4.12Å; R899-L920 HydrophobicContact CG-CG 4.11Å; R899-P995 HydrophobicContact CB-CB 4.41Å; R899-P995 HydrophobicContact CB-CG 4.28Å; R899-P995 HydrophobicContact CG-CB 3.84Å; R899-P995 HydrophobicContact CG-CG 3.55Å; R899-Y996 PolarHBondContact N-O 3.11Å; R899-I997 WeakPolarHBondContact O-CA 3.26Å; R899-V998 PolarHBondContact O-N 3.13Å; R899-Q1122 PolarHBondContact NH1-O 3.39Å; R899-Q1122 PolarHBondContact NH2-O 2.88Å
900	F	98.6	Very high	95.2	Very high	0 Å²	0	35 Å²	35	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	143.2	-179	-60.2	-56.5	0	0	0	112.4	M889 L890 V898 M902 I916 H918 L919 L920 V998 L1000	M889-F900 HydrophobicContact CB-CZ 4Å; M889-F900 HydrophobicContact CE-CE1 3.6Å; M889-F900 HydrophobicContact CE-CZ 4.02Å; M889-F900 HydrophobicContact SD-CE1 3.99Å; M889-F900 HydrophobicContact SD-CZ 4.35Å; L890-F900 HydrophobicContact CD2-CE2 3.98Å; V898-F900 HydrophobicContact CG1-CD1 4.33Å; V898-F900 HydrophobicContact CG1-CE1 3.61Å; V898-F900 HydrophobicContact CG1-CZ 3.73Å; F900-M902 HydrophobicContact CB-CE 3.91Å; F900-M902 HydrophobicContact CB-CG 4.27Å; F900-M902 HydrophobicContact CD2-CE 3.87Å; F900-M902 HydrophobicContact CG-CE 3.84Å; F900-I916 HydrophobicContact CD2-CD1 3.99Å; F900-I916 HydrophobicContact CE2-CD1 4.35Å; F900-H918 HydrophobicContact CD2-CB 3.42Å; F900-H918 VanDerWaalsContact CD2-CB 3.42Å; F900-H918 HydrophobicContact CE2-CB 3.64Å; F900-H918 HydrophobicContact CG-CB 4.47Å; F900-H918 PolarHBondContact N-O 3.25Å; F900-L919 HydrophobicContact CB-CD2 4.13Å; F900-L920 PolarHBondContact O-N 2.97Å; F900-V998 WeakPolarHBondContact CA-O 3.48Å; F900-V998 HydrophobicContact CD1-CB 3.9Å; F900-V998 HydrophobicContact CE1-CB 4.04Å; F900-V998 HydrophobicContact CE1-CG2 4.39Å; F900-L1000 HydrophobicContact CD1-CD1 3.7Å; F900-L1000 HydrophobicContact CE1-CD1 4.25Å; F900-L1000 HydrophobicContact CG-CD1 4.34Å
901	I	98.4	Very high	95	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	124.8	153.9	-68.5	168.4	0	0	0	105.4	I903 L920 A933 W936 I997 V998 V999 L1000 I1127	I901-I903 HydrophobicContact CG2-CG1 4.3Å; I901-L920 HydrophobicContact CD1-CD1 4.22Å; I901-L920 HydrophobicContact CG1-CB 4.02Å; I901-L920 HydrophobicContact CG1-CD1 4.09Å; I901-A933 HydrophobicContact CG2-CB 4.14Å; I901-W936 HydrophobicContact CD1-CE3 3.87Å; I901-W936 HydrophobicContact CD1-CZ3 3.82Å; I901-I997 HydrophobicContact CD1-CG2 4.45Å; I901-V998 PolarHBondContact N-O 3.36Å; I901-V999 HydrophobicContact CG2-CG1 4.49Å; I901-V999 WeakPolarHBondContact O-CA 3.33Å; I901-L1000 PolarHBondContact O-N 2.88Å; I901-I1127 HydrophobicContact CD1-CD1 4.4Å; I901-I1127 HydrophobicContact CD1-CG2 4.22Å
902	M	98.4	Very high	94.9	Very high	0 Å²	0	37 Å²	37	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	131.2	-177.5	-66.8	-170.5	-172.2	0	0	109	I886 F900 L910 Y913 I916 L919 V923 V924 L1000	I886-M902 HydrophobicContact CD1-CE 4.4Å; I886-M902 HydrophobicContact CG2-CE 4.15Å; F900-M902 HydrophobicContact CB-CE 3.91Å; F900-M902 HydrophobicContact CB-CG 4.27Å; F900-M902 HydrophobicContact CD2-CE 3.87Å; F900-M902 HydrophobicContact CG-CE 3.84Å; M902-L910 HydrophobicContact CB-CB 4.28Å; M902-L910 HydrophobicContact CB-CD1 3.97Å; M902-L910 HydrophobicContact CG-CD1 4.4Å; M902-L910 HydrophobicContact SD-CB 4.16Å; M902-Y913 HydrophobicContact CE-CD2 4.19Å; M902-Y913 HydrophobicContact CE-CG 3.96Å; M902-Y913 HydrophobicContact SD-CD2 3.87Å; M902-Y913 HydrophobicContact SD-CG 3.97Å; M902-I916 HydrophobicContact CE-CD1 4.12Å; M902-L919 HydrophobicContact CB-CD2 4.2Å; M902-L919 HydrophobicContact CE-CD2 4.4Å; M902-L919 HydrophobicContact CG-CD2 3.86Å; M902-L919 HydrophobicContact SD-CD2 4.1Å; M902-V923 HydrophobicContact CB-CG1 4.38Å; M902-V923 HydrophobicContact CB-CG2 4.21Å; M902-V924 PolarHBondContact O-N 3.28Å; M902-L1000 CarbonylContact C-O 3.52Å; M902-L1000 HydrophobicContact CE-CD1 4.14Å; M902-L1000 HydrophobicContact CG-CB 4.37Å; M902-L1000 HydrophobicContact CG-CD1 4.18Å
903	I	97.3	Very high	95	Very high	1 Å²	1	35.2 Å²	35.2	1%	0.005	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	113.1	-178.3	-49	-174.4	0	0	0	108.2	I901 V924 A930 V999 L1000 V1001 D1002 L1007	I901-I903 HydrophobicContact CG2-CG1 4.3Å; I903-V924 WeakPolarHBondContact CA-O 3.27Å; I903-V924 HydrophobicContact CG1-CB 4.27Å; I903-V924 HydrophobicContact CG2-CB 4.48Å; I903-A930 HydrophobicContact CD1-CB 3.98Å; I903-A930 HydrophobicContact CG2-CB 3.59Å; I903-V999 HydrophobicContact CD1-CG1 4.5Å; I903-L1000 PolarHBondContact N-O 3.28Å; I903-V1001 HydrophobicContact CB-CB 4.46Å; I903-V1001 HydrophobicContact CB-CG1 4.2Å; I903-V1001 HydrophobicContact CB-CG2 4.17Å; I903-V1001 HydrophobicContact CD1-CG2 4.03Å; I903-V1001 HydrophobicContact CG1-CG2 4.3Å; I903-V1001 HydrophobicContact CG2-CG1 4.36Å; I903-D1002 PolarHBondContact O-N 3.4Å; I903-D1002 VanDerWaalsContact O-N 3.15Å; I903-L1007 HydrophobicContact CG2-CD1 4.37Å
904	D	96.6	Very high	94.9	Very high	1 Å²	1	37.4 Å²	37.4	1%	0.005	19%	0.189	C	C	.	.			trans	-133.9	86.2	-176.4	-178.8	-2.5	0	0	0	109.8	K906 M907 L908 E909 L910 S911 V923 V924	D904-K906 PolarHBondContact O-N 2.85Å; D904-K906 PolarHBondContact OD1-N 3.43Å; D904-K906 VanDerWaalsContact OD1-N 3.15Å; D904-M907 PolarHBondContact O-N 2.9Å; D904-M907 VanDerWaalsContact O-N 3.12Å; D904-M907 PolarHBondContact OD1-N 2.9Å; D904-L908 PolarHBondContact OD1-N 3.07Å; D904-L908 PolarHBondContact OD2-N 3.24Å; D904-E909 PolarHBondContact OD2-N 3.39Å; D904-L910 HydrophobicContact CB-CB 3.95Å; D904-L910 HydrophobicContact CB-CD1 4.39Å; D904-L910 HydrophobicContact CB-CG 4.26Å; D904-L910 PolarHBondContact OD2-N 2.85Å; D904-S911 PolarHBondContact OD2-N 3.45Å; D904-V923 HydrophobicContact CB-CG1 3.84Å; D904-V924 PolarHBondContact N-O 3.45Å
905	P	90.9	Very high	94.8	Very high	31 Å²	31	35.7 Å²	35.7	20%	0.201	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72	3.5	-176.9	32.9	-37.9	0	0	0	113.6	M927 D1006	P905-M927 HydrophobicContact CB-CE 4Å; P905-M927 HydrophobicContact CB-SD 3.45Å; P905-M927 WeakPolarHBondContact CB-SD 3.18Å; P905-M927 HydrophobicContact CG-SD 4.44Å; P905-D1006 HydrophobicContact CG-CB 4.24Å
906	K	89.5	Confident	94.8	Very high	71 Å²	71	34.3 Å²	34.3	31%	0.309	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-113	-12.1	174.5	-60.9	-170	178.4	82.4	0	112.7	D904 L908 E1003 D1006	D904-K906 PolarHBondContact O-N 2.85Å; D904-K906 PolarHBondContact OD1-N 3.43Å; D904-K906 VanDerWaalsContact OD1-N 3.15Å; K906-L908 HydrophobicContact CB-CB 4.47Å; K906-L908 HydrophobicContact CB-CD1 4.23Å; K906-L908 HydrophobicContact CB-CG 4.05Å; K906-L908 WeakPolarHBondContact O-CG 3.44Å; K906-L908 PolarHBondContact O-N 2.88Å; K906-E1003 VanDerWaalsContact NZ-CB 3.3Å; K906-E1003 IonicContact NZ-OE2 3.43Å; K906-E1003 PolarHBondContact NZ-OE2 2.85Å; K906-E1003 VanDerWaalsContact NZ-OE2 3.11Å; K906-D1006 WeakPolarHBondContact CE-OD2 3.46Å; K906-D1006 IonicContact NZ-OD2 2.85Å; K906-D1006 PolarHBondContact NZ-OD2 3.33Å
907	M	86.9	Confident	94.9	Very high	118 Å²	118	29.2 Å²	29.2	58%	0.581	15%	0.154	S	C	*	.	S	Bend	trans	60.4	19.9	-175.7	-49.6	179.8	66.5	0	0	114.6	D904 S911 T925	D904-M907 PolarHBondContact O-N 2.9Å; D904-M907 VanDerWaalsContact O-N 3.12Å; D904-M907 PolarHBondContact OD1-N 2.9Å; M907-S911 VanDerWaalsContact O-CB 3.31Å; M907-S911 WeakPolarHBondContact O-CB 3.49Å; M907-S911 PolarHBondContact O-OG 2.92Å; M907-T925 HydrophobicContact CE-CG2 4.08Å; M907-T925 HydrophobicContact CG-CG2 3.6Å; M907-T925 HydrophobicContact SD-CG2 4.02Å
908	L	87.6	Confident	94.9	Very high	134 Å²	134	27.3 Å²	27.3	70%	0.702	14%	0.144	S	C	*	.	S	Bend	trans	-101.3	-30.4	-170.1	-65.9	-176.8	0	0	0	115	D904 K906	D904-L908 PolarHBondContact OD1-N 3.07Å; D904-L908 PolarHBondContact OD2-N 3.24Å; K906-L908 HydrophobicContact CB-CB 4.47Å; K906-L908 HydrophobicContact CB-CD1 4.23Å; K906-L908 HydrophobicContact CB-CG 4.05Å; K906-L908 WeakPolarHBondContact O-CG 3.44Å; K906-L908 PolarHBondContact O-N 2.88Å
909	E	87.6	Confident	94.9	Very high	52 Å²	52	27.3 Å²	27.3	24%	0.243	14%	0.144	C	C	.	.	S	Bend	trans	-121	-41	-157.3	-63.9	-86.8	-147.9	0	0	112.1	S879 D904 D1002	S879-E909 WeakPolarHBondContact CB-OE1 3.45Å; S879-E909 WeakPolarHBondContact CB-OE2 3.49Å; S879-E909 VanDerWaalsContact OG-CD 3.22Å; S879-E909 PolarHBondContact OG-OE1 3.08Å; S879-E909 PolarHBondContact OG-OE2 3.38Å; D904-E909 PolarHBondContact OD2-N 3.39Å; E909-D1002 HydrophobicContact CB-CB 4.5Å
910	L	95.1	Very high	94.9	Very high	1 Å²	1	26.4 Å²	26.4	1%	0.005	14%	0.141	C	C	.	.	S	Bend	trans	-102	-16.3	177.5	-50.9	179.6	0	0	0	112.7	V882 I886 M902 D904 V912 Y913 V923 L1000 D1002	V882-L910 HydrophobicContact CG1-CD2 4.24Å; I886-L910 HydrophobicContact CD1-CD2 3.76Å; M902-L910 HydrophobicContact CB-CB 4.28Å; M902-L910 HydrophobicContact CB-CD1 3.97Å; M902-L910 HydrophobicContact CG-CD1 4.4Å; M902-L910 HydrophobicContact SD-CB 4.16Å; D904-L910 HydrophobicContact CB-CB 3.95Å; D904-L910 HydrophobicContact CB-CD1 4.39Å; D904-L910 HydrophobicContact CB-CG 4.26Å; D904-L910 PolarHBondContact OD2-N 2.85Å; L910-V912 PolarHBondContact O-N 3.18Å; L910-Y913 HydrophobicContact CB-CD2 4.47Å; L910-Y913 HydrophobicContact CD2-CD2 4.42Å; L910-Y913 HydrophobicContact CD2-CE2 4.3Å; L910-Y913 WeakPolarHBondContact O-CD2 3.36Å; L910-Y913 PolarHBondContact O-N 3.07Å; L910-V923 HydrophobicContact CB-CG1 4.25Å; L910-L1000 HydrophobicContact CD1-CB 4.24Å; L910-D1002 HydrophobicContact CD1-CB 4.16Å; L910-D1002 HydrophobicContact CG-CB 4.21Å
911	S	94.5	Very high	94.8	Very high	31 Å²	31	27.1 Å²	27.1	22%	0.217	15%	0.146	C	C	.	.	G	3₁₀ helix	trans	-58.8	-15.3	176.7	68.9	0	0	0	0	114.4	D904 M907 Y913 E914	D904-S911 PolarHBondContact OD2-N 3.45Å; M907-S911 VanDerWaalsContact O-CB 3.31Å; M907-S911 WeakPolarHBondContact O-CB 3.49Å; M907-S911 PolarHBondContact O-OG 2.92Å; S911-Y913 VanDerWaalsContact C-N 3.33Å; S911-E914 WeakPolarHBondContact O-CB 3.47Å
912	V	95.5	Very high	94.7	Very high	30 Å²	30	32.6 Å²	32.6	18%	0.182	17%	0.171	C	C	.	.	G	3₁₀ helix	trans	-65.6	-31.8	169.9	65.7	0	0	0	0	113	L910 E914 V1108 H1109	L910-V912 PolarHBondContact O-N 3.18Å; V912-E914 VanDerWaalsContact C-N 3.34Å; V912-V1108 HydrophobicContact CG1-CG1 3.87Å; V912-V1108 HydrophobicContact CG2-CG1 3.97Å; V912-H1109 VanDerWaalsContact CG2-CE1 3.48Å; V912-H1109 WeakPolarHBondContact CG2-CE1 3.39Å
913	Y	97.5	Very high	94.7	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	18%	0.175	C	C	.	.	G	3₁₀ helix	trans	-82.5	-8.5	-178.5	-62.2	-76.9	0	0	0	113.8	N883 I886 L887 L890 M902 L910 S911 G915 I916 L919 V1108 V1112	N883-Y913 WeakPolarHBondContact CA-OH 3.33Å; N883-Y913 VanDerWaalsContact CG-OH 3.31Å; N883-Y913 VanDerWaalsContact OD1-CE2 3.31Å; N883-Y913 WeakPolarHBondContact OD1-CE2 3.32Å; N883-Y913 PolarHBondContact OD1-OH 3.41Å; I886-Y913 HydrophobicContact CB-CE1 4.28Å; I886-Y913 HydrophobicContact CD1-CD2 4.18Å; I886-Y913 HydrophobicContact CD1-CE2 3.55Å; I886-Y913 HydrophobicContact CG2-CD1 4Å; I886-Y913 HydrophobicContact CG2-CE1 3.49Å; I886-Y913 VanDerWaalsContact CG2-CE1 3.49Å; I886-Y913 HydrophobicContact CG2-CE2 4.27Å; L887-Y913 HydrophobicContact CD1-CE1 3.9Å; L887-Y913 WeakPolarHBondContact CD1-OH 3.38Å; L890-Y913 HydrophobicContact CD1-CD1 4.3Å; L890-Y913 HydrophobicContact CD1-CE1 4.13Å; M902-Y913 HydrophobicContact CE-CD2 4.19Å; M902-Y913 HydrophobicContact CE-CG 3.96Å; M902-Y913 HydrophobicContact SD-CD2 3.87Å; M902-Y913 HydrophobicContact SD-CG 3.97Å; L910-Y913 HydrophobicContact CB-CD2 4.47Å; L910-Y913 HydrophobicContact CD2-CD2 4.42Å; L910-Y913 HydrophobicContact CD2-CE2 4.3Å; L910-Y913 WeakPolarHBondContact O-CD2 3.36Å; L910-Y913 PolarHBondContact O-N 3.07Å; S911-Y913 VanDerWaalsContact C-N 3.33Å; Y913-G915 PolarHBondContact O-N 3.36Å; Y913-I916 HydrophobicContact CD1-CD1 4.3Å; Y913-I916 WeakPolarHBondContact O-CG1 3.37Å; Y913-I916 WeakPolarHBondContact O-CG2 3.31Å; Y913-I916 PolarHBondContact O-N 3.04Å; Y913-I916 VanDerWaalsContact O-N 3.08Å; Y913-L919 WeakPolarHBondContact O-CD1 3.24Å; Y913-V1108 HydrophobicContact CE1-CG1 3.71Å; Y913-V1108 HydrophobicContact CE2-CG1 4.37Å; Y913-V1108 WeakPolarHBondContact OH-CG1 3.41Å; Y913-V1112 HydrophobicContact CD1-CG2 3.55Å; Y913-V1112 HydrophobicContact CE1-CG2 4.01Å; Y913-V1112 HydrophobicContact CG-CG2 4.39Å
914	E	95.9	Very high	94.7	Very high	45 Å²	45	33.5 Å²	33.5	21%	0.21	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-46.3	126.6	-177.7	-177.6	45.8	-109.5	0	0	111.9	S911 V912 V923 K1116 Y1123	S911-E914 WeakPolarHBondContact O-CB 3.47Å; V912-E914 VanDerWaalsContact C-N 3.34Å; E914-V923 HydrophobicContact CB-CG2 4.31Å; E914-V923 WeakPolarHBondContact OE2-CG2 3.25Å; E914-V923 PolarHBondContact OE2-N 3.34Å; E914-K1116 WeakPolarHBondContact O-CE 3.48Å; E914-K1116 PolarHBondContact O-NZ 2.93Å; E914-Y1123 PolarHBondContact OE1-OH 3.47Å
915	G	94	Very high	94.6	Very high	17 Å²	17	36.5 Å²	36.5	18%	0.175	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	79.7	14	-177.8	0	0	0	0	0	117.6	Y913 K1116 P1121	Y913-G915 PolarHBondContact O-N 3.36Å; G915-K1116 WeakPolarHBondContact O-CG 3.42Å; G915-P1121 WeakPolarHBondContact O-CD 3.22Å
916	I	97	Very high	94.7	Very high	0 Å²	0	38 Å²	38	0%	0	20%	0.201	C	C	.	.			trans	-70.6	147	164.7	60.4	175.9	0	0	0	111.4	L890 F900 M902 Y913 H918 L919 V1112 W1115	L890-I916 HydrophobicContact CD2-CD1 4.2Å; F900-I916 HydrophobicContact CD2-CD1 3.99Å; F900-I916 HydrophobicContact CE2-CD1 4.35Å; M902-I916 HydrophobicContact CE-CD1 4.12Å; Y913-I916 HydrophobicContact CD1-CD1 4.3Å; Y913-I916 WeakPolarHBondContact O-CG1 3.37Å; Y913-I916 WeakPolarHBondContact O-CG2 3.31Å; Y913-I916 PolarHBondContact O-N 3.04Å; Y913-I916 VanDerWaalsContact O-N 3.08Å; I916-H918 HydrophobicContact CD1-CB 4.29Å; I916-H918 HydrophobicContact CG1-CB 4.48Å; I916-H918 PolarHBondContact O-N 3.19Å; I916-L919 HydrophobicContact CD1-CG 4.42Å; I916-L919 HydrophobicContact CG1-CB 4.49Å; I916-L919 HydrophobicContact CG1-CD1 3.89Å; I916-L919 HydrophobicContact CG1-CG 3.76Å; I916-L919 PolarHBondContact O-N 2.98Å; I916-L919 VanDerWaalsContact O-N 3.12Å; I916-V1112 HydrophobicContact CG2-CB 4.32Å; I916-V1112 HydrophobicContact CG2-CG1 3.94Å; I916-V1112 HydrophobicContact CG2-CG2 4.1Å; I916-W1115 HydrophobicContact CG2-CB 4.38Å
917	P	97.4	Very high	94.8	Very high	12 Å²	12	35.8 Å²	35.8	8%	0.078	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-17.4	-175.5	24.8	-34.2	0	0	0	114.8	P895 W1115	P895-P917 HydrophobicContact CG-CB 3.84Å; P895-P917 HydrophobicContact CG-CG 4.01Å; P917-W1115 HydrophobicContact CG-CE3 3.8Å; P917-W1115 HydrophobicContact CG-CZ3 4.41Å
918	H	98.3	Very high	95.1	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-16.4	176.9	-56.4	72	0	0	0	114.3	A893 V898 R899 F900 I916 W1115	A893-H918 PolarHBondContact O-NE2 2.95Å; V898-H918 PolarHBondContact O-CD2 3.12Å; R899-H918 CarbonylContact C-O 3.56Å; R899-H918 VanDerWaalsContact CA-O 3.29Å; R899-H918 WeakPolarHBondContact CA-O 3.26Å; R899-H918 WeakPolarHBondContact CD-O 3.32Å; F900-H918 HydrophobicContact CD2-CB 3.42Å; F900-H918 VanDerWaalsContact CD2-CB 3.42Å; F900-H918 HydrophobicContact CE2-CB 3.64Å; F900-H918 HydrophobicContact CG-CB 4.47Å; F900-H918 PolarHBondContact N-O 3.25Å; I916-H918 HydrophobicContact CD1-CB 4.29Å; I916-H918 HydrophobicContact CG1-CB 4.48Å; I916-H918 PolarHBondContact O-N 3.19Å; H918-W1115 AromaticContact CE1-CD2 3.66Å; H918-W1115 AromaticContact CE1-CE2 3.62Å; H918-W1115 AromaticContact CE1-CE3 3.67Å; H918-W1115 AromaticContact CE1-CH2 3.6Å; H918-W1115 AromaticContact CE1-CZ2 3.59Å; H918-W1115 AromaticContact CE1-CZ3 3.64Å
919	L	98.4	Very high	95.4	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	18%	0.178	C	C	.	.	B	Isolated β-bridge	trans	-72.4	130.9	-178.6	-81.1	167.9	0	0	0	112.2	R899 F900 M902 Y913 I916 T921 V923 Y1123	R899-L919 PolarHBondContact NH1-O 3.32Å; F900-L919 HydrophobicContact CB-CD2 4.13Å; M902-L919 HydrophobicContact CB-CD2 4.2Å; M902-L919 HydrophobicContact CE-CD2 4.4Å; M902-L919 HydrophobicContact CG-CD2 3.86Å; M902-L919 HydrophobicContact SD-CD2 4.1Å; Y913-L919 WeakPolarHBondContact O-CD1 3.24Å; I916-L919 HydrophobicContact CD1-CG 4.42Å; I916-L919 HydrophobicContact CG1-CB 4.49Å; I916-L919 HydrophobicContact CG1-CD1 3.89Å; I916-L919 HydrophobicContact CG1-CG 3.76Å; I916-L919 PolarHBondContact O-N 2.98Å; I916-L919 VanDerWaalsContact O-N 3.12Å; L919-T921 WeakPolarHBondContact CB-O 3.33Å; L919-V923 HydrophobicContact CD1-CG2 4.4Å; L919-Y1123 HydrophobicContact CB-CE1 3.82Å; L919-Y1123 WeakPolarHBondContact O-CD1 3.47Å
920	L	97.8	Very high	95.8	Very high	10 Å²	10	31.4 Å²	31.4	5%	0.052	17%	0.167	C	C	.	.	S	Bend	trans	-83.4	-24.7	176.4	-79.8	164.9	0	0	0	113.6	R899 F900 I901 W936 I997 Y1123 V1124 I1127	R899-L920 HydrophobicContact CB-CD1 3.72Å; R899-L920 HydrophobicContact CB-CD2 4.32Å; R899-L920 HydrophobicContact CB-CG 3.81Å; R899-L920 HydrophobicContact CG-CD1 4.4Å; R899-L920 HydrophobicContact CG-CD2 4.12Å; R899-L920 HydrophobicContact CG-CG 4.11Å; F900-L920 PolarHBondContact O-N 2.97Å; I901-L920 HydrophobicContact CD1-CD1 4.22Å; I901-L920 HydrophobicContact CG1-CB 4.02Å; I901-L920 HydrophobicContact CG1-CD1 4.09Å; L920-W936 HydrophobicContact CD1-CH2 4.23Å; L920-W936 HydrophobicContact CD1-CZ3 4.3Å; L920-I997 HydrophobicContact CD1-CD1 4.18Å; L920-I997 HydrophobicContact CD1-CG1 4.22Å; L920-I997 HydrophobicContact CD1-CG2 3.96Å; L920-Y1123 CarbonylContact O-C 3.48Å; L920-Y1123 VanDerWaalsContact O-CA 3.25Å; L920-Y1123 WeakPolarHBondContact O-CA 3.44Å; L920-V1124 HydrophobicContact CD2-CG2 3.79Å; L920-V1124 PolarHBondContact O-N 2.87Å; L920-I1127 HydrophobicContact CB-CD1 3.71Å
921	T	97.3	Very high	95.7	Very high	15 Å²	15	31.5 Å²	31.5	9%	0.092	17%	0.167	C	C	.	.	S	Bend	trans	-149	170.3	173.2	-175.3	0	0	0	0	106.9	L919 V924 Y1123 I1127	L919-T921 WeakPolarHBondContact CB-O 3.33Å; T921-V924 HydrophobicContact CG2-CG2 3.92Å; T921-Y1123 VanDerWaalsContact C-CE1 3.48Å; T921-I1127 HydrophobicContact CG2-CB 4.34Å; T921-I1127 HydrophobicContact CG2-CD1 4.49Å; T921-I1127 HydrophobicContact CG2-CG2 3.74Å
922	E	96.5	Very high	95.8	Very high	116 Å²	116	30.5 Å²	30.5	54%	0.542	16%	0.159	S	C	.	.	S	Bend	trans	-60.9	163.4	174.4	-62.3	-171	166.3	0	0	110.7	V924 Y1123	E922-V924 PolarHBondContact O-N 3.28Å; E922-Y1123 HydrophobicContact CG-CD2 4.06Å; E922-Y1123 HydrophobicContact CG-CE1 4.49Å; E922-Y1123 HydrophobicContact CG-CE2 3.29Å
923	V	97.3	Very high	95.8	Very high	13 Å²	13	29.1 Å²	29.1	8%	0.079	15%	0.151	C	C	.	.			trans	-62.7	110.8	177.5	176	0	0	0	0	108.7	M902 D904 L910 E914 L919 T925	M902-V923 HydrophobicContact CB-CG1 4.38Å; M902-V923 HydrophobicContact CB-CG2 4.21Å; D904-V923 HydrophobicContact CB-CG1 3.84Å; L910-V923 HydrophobicContact CB-CG1 4.25Å; E914-V923 HydrophobicContact CB-CG2 4.31Å; E914-V923 WeakPolarHBondContact OE2-CG2 3.25Å; E914-V923 PolarHBondContact OE2-N 3.34Å; L919-V923 HydrophobicContact CD1-CG2 4.4Å; V923-T925 WeakPolarHBondContact O-CG2 3.08Å; V923-T925 PolarHBondContact O-N 3.19Å
924	V	96.6	Very high	95.8	Very high	7 Å²	7	29.1 Å²	29.1	4%	0.042	15%	0.151	C	C	.	.	B	Isolated β-bridge	trans	-72.9	119	-170.3	-174.5	0	0	0	0	109.9	M902 I903 D904 T921 E922 D929 A930 T1128	M902-V924 PolarHBondContact O-N 3.28Å; I903-V924 WeakPolarHBondContact CA-O 3.27Å; I903-V924 HydrophobicContact CG1-CB 4.27Å; I903-V924 HydrophobicContact CG2-CB 4.48Å; D904-V924 PolarHBondContact N-O 3.45Å; T921-V924 HydrophobicContact CG2-CG2 3.92Å; E922-V924 PolarHBondContact O-N 3.28Å; V924-D929 HydrophobicContact CG1-CB 3.65Å; V924-A930 HydrophobicContact CG1-CB 4.18Å; V924-T1128 HydrophobicContact CG2-CG2 4.13Å
925	T	94.6	Very high	95.8	Very high	63 Å²	63	28.9 Å²	28.9	39%	0.387	15%	0.148	S	C	.	.			trans	-103.3	-34.9	-176.8	58.5	0	0	0	0	112.8	M907 V923	M907-T925 HydrophobicContact CE-CG2 4.08Å; M907-T925 HydrophobicContact CG-CG2 3.6Å; M907-T925 HydrophobicContact SD-CG2 4.02Å; V923-T925 WeakPolarHBondContact O-CG2 3.08Å; V923-T925 PolarHBondContact O-N 3.19Å
926	D	93.7	Very high	96	Very high	62 Å²	62	30.5 Å²	30.5	33%	0.332	15%	0.149	S	C	.	.	S	Bend	trans	-79.1	150.2	178.4	177.8	-103.1	0	0	0	113.2	K928 D929 A930	D926-K928 VanDerWaalsContact OD1-CA 3.32Å; D926-K928 WeakPolarHBondContact OD1-CA 3.42Å; D926-K928 WeakPolarHBondContact OD1-CB 3.27Å; D926-K928 PolarHBondContact OD1-N 3.35Å; D926-D929 HydrophobicContact CB-CB 4.11Å; D926-D929 PolarHBondContact OD1-N 2.92Å; D926-A930 VanDerWaalsContact O-CB 3.24Å; D926-A930 WeakPolarHBondContact O-CB 3.25Å; D926-A930 PolarHBondContact O-N 2.71Å
927	M	92.3	Very high	96.1	Very high	25 Å²	25	30.5 Å²	30.5	12%	0.123	15%	0.149	C	C	.	.	H	α-helix	trans	-81.1	-29.7	-173.5	-49.1	-56.1	-94	0	0	112.8	P905 A931 D1006 L1007 T1010 V1011	P905-M927 HydrophobicContact CB-CE 4Å; P905-M927 HydrophobicContact CB-SD 3.45Å; P905-M927 WeakPolarHBondContact CB-SD 3.18Å; P905-M927 HydrophobicContact CG-SD 4.44Å; M927-A931 PolarHBondContact O-N 3.33Å; M927-D1006 HydrophobicContact CE-CB 3.55Å; M927-D1006 VanDerWaalsContact CE-O 3.27Å; M927-D1006 WeakPolarHBondContact CE-O 3.28Å; M927-L1007 HydrophobicContact CB-CD2 4.34Å; M927-L1007 HydrophobicContact CE-CD2 3.79Å; M927-L1007 HydrophobicContact CE-CG 4.29Å; M927-L1007 HydrophobicContact SD-CD2 3.81Å; M927-T1010 HydrophobicContact CB-CG2 3.93Å; M927-T1010 HydrophobicContact CG-CG2 4.04Å; M927-V1011 HydrophobicContact CB-CG2 4.01Å; M927-V1011 WeakPolarHBondContact O-CG2 3.44Å
928	K	92	Very high	96.1	Very high	155 Å²	155	30.3 Å²	30.3	67%	0.674	15%	0.148	S	C	*	.	H	α-helix	trans	-75.7	-46.3	173.3	-51.3	172.9	-175.5	169.4	0	109.2	D926 A930 A931 N932	D926-K928 VanDerWaalsContact OD1-CA 3.32Å; D926-K928 WeakPolarHBondContact OD1-CA 3.42Å; D926-K928 WeakPolarHBondContact OD1-CB 3.27Å; D926-K928 PolarHBondContact OD1-N 3.35Å; K928-A930 VanDerWaalsContact C-N 3.27Å; K928-A930 PolarHBondContact O-N 2.66Å; K928-A931 CarbonylContact O-C 3.54Å; K928-A931 WeakPolarHBondContact O-CA 3.4Å; K928-A931 WeakPolarHBondContact O-CB 3.46Å; K928-A931 PolarHBondContact O-N 2.9Å; K928-N932 PolarHBondContact O-N 3.18Å
929	D	94.6	Very high	96	Very high	58 Å²	58	34.4 Å²	34.4	31%	0.31	17%	0.17	S	C	.	.	H	α-helix	trans	-58.5	-39.3	174.9	-75.5	4.1	0	0	0	111.7	V924 D926 A931 N932 A933 T1128	V924-D929 HydrophobicContact CG1-CB 3.65Å; D926-D929 HydrophobicContact CB-CB 4.11Å; D926-D929 PolarHBondContact OD1-N 2.92Å; D929-A931 VanDerWaalsContact C-N 3.34Å; D929-A931 PolarHBondContact O-N 3.36Å; D929-N932 CarbonylContact O-C 3.57Å; D929-N932 PolarHBondContact O-N 3.5Å; D929-N932 VanDerWaalsContact O-N 3.17Å; D929-A933 WeakPolarHBondContact O-CB 3.46Å; D929-A933 PolarHBondContact O-N 3.33Å; D929-T1128 HydrophobicContact CB-CG2 4.06Å
930	A	95.1	Very high	96	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-61.4	-39.4	172.7	0	0	0	0	0	113	I903 V924 D926 K928 N932 L934 L1007	I903-A930 HydrophobicContact CD1-CB 3.98Å; I903-A930 HydrophobicContact CG2-CB 3.59Å; V924-A930 HydrophobicContact CG1-CB 4.18Å; D926-A930 VanDerWaalsContact O-CB 3.24Å; D926-A930 WeakPolarHBondContact O-CB 3.25Å; D926-A930 PolarHBondContact O-N 2.71Å; K928-A930 VanDerWaalsContact C-N 3.27Å; K928-A930 PolarHBondContact O-N 2.66Å; A930-N932 VanDerWaalsContact C-N 3.35Å; A930-L934 WeakPolarHBondContact O-CG 3.35Å; A930-L934 PolarHBondContact O-N 3.44Å; A930-L934 VanDerWaalsContact O-N 3.14Å; A930-L1007 HydrophobicContact CB-CD1 4.28Å; A930-L1007 HydrophobicContact CB-CD2 3.47Å; A930-L1007 VanDerWaalsContact CB-CD2 3.47Å
931	A	94.3	Very high	96	Very high	2 Å²	2	34.8 Å²	34.8	2%	0.017	17%	0.171	C	C	.	.	H	α-helix	trans	-70.3	-32.3	174.2	0	0	0	0	0	112.1	M927 K928 D929 R935 V1011 V1015 L1018	M927-A931 PolarHBondContact O-N 3.33Å; K928-A931 CarbonylContact O-C 3.54Å; K928-A931 WeakPolarHBondContact O-CA 3.4Å; K928-A931 WeakPolarHBondContact O-CB 3.46Å; K928-A931 PolarHBondContact O-N 2.9Å; D929-A931 VanDerWaalsContact C-N 3.34Å; D929-A931 PolarHBondContact O-N 3.36Å; A931-R935 WeakPolarHBondContact O-CB 3.33Å; A931-R935 PolarHBondContact O-N 2.92Å; A931-V1011 HydrophobicContact CB-CG1 4.21Å; A931-V1015 HydrophobicContact CB-CG2 4.09Å; A931-L1018 WeakPolarHBondContact O-CD1 3.32Å
932	N	95.4	Very high	96	Very high	10 Å²	10	37.5 Å²	37.5	5%	0.053	18%	0.183	C	C	.	.	H	α-helix	trans	-70.3	-42.3	174.1	-68.6	-17.6	0	0	0	111.7	K928 D929 A930 L934 R935 W936 I1127 T1128 D1130	K928-N932 PolarHBondContact O-N 3.18Å; D929-N932 CarbonylContact O-C 3.57Å; D929-N932 PolarHBondContact O-N 3.5Å; D929-N932 VanDerWaalsContact O-N 3.17Å; A930-N932 VanDerWaalsContact C-N 3.35Å; N932-L934 VanDerWaalsContact C-N 3.29Å; N932-L934 PolarHBondContact O-N 2.94Å; N932-R935 CarbonylContact O-C 3.11Å; N932-R935 WeakPolarHBondContact O-CA 3.41Å; N932-R935 WeakPolarHBondContact O-CB 3.48Å; N932-R935 PolarHBondContact O-N 3.45Å; N932-R935 PolarHBondContact OD1-NH1 3.48Å; N932-W936 PolarHBondContact O-N 2.91Å; N932-I1127 CarbonylContact C-O 3.59Å; N932-I1127 VanDerWaalsContact C-O 3.23Å; N932-T1128 WeakPolarHBondContact CB-O 3.24Å; N932-T1128 PolarHBondContact ND2-O 2.96Å; N932-D1130 PolarHBondContact ND2-N 3Å; N932-D1130 PolarHBondContact OD1-OD2 3.38Å
933	A	97	Very high	96	Very high	1 Å²	1	36.5 Å²	36.5	1%	0.008	17%	0.174	C	C	.	.	H	α-helix	trans	-60.9	-38.1	173.9	0	0	0	0	0	112.1	I901 D929 W936 C937 I1127	I901-A933 HydrophobicContact CG2-CB 4.14Å; D929-A933 WeakPolarHBondContact O-CB 3.46Å; D929-A933 PolarHBondContact O-N 3.33Å; A933-W936 PolarHBondContact O-N 2.85Å; A933-C937 PolarHBondContact O-N 2.75Å; A933-C937 PolarHBondContact O-SG 2.88Å; A933-C937 VanDerWaalsContact O-SG 3.37Å; A933-I1127 VanDerWaalsContact CA-O 3.3Å; A933-I1127 WeakPolarHBondContact CA-O 3.42Å; A933-I1127 HydrophobicContact CB-CG2 3.79Å; A933-I1127 PolarHBondContact N-O 3.42Å; A933-I1127 VanDerWaalsContact N-O 3.15Å
934	L	97	Very high	96	Very high	1 Å²	1	36.1 Å²	36.1	1%	0.005	17%	0.172	C	C	.	.	H	α-helix	trans	-65.9	-41.3	171.3	-71.3	171.4	0	0	0	112.3	A930 N932 W936 C937 V938 V999 V1015 L1018 I1019 L1022 L1033	A930-L934 WeakPolarHBondContact O-CG 3.35Å; A930-L934 PolarHBondContact O-N 3.44Å; A930-L934 VanDerWaalsContact O-N 3.14Å; N932-L934 VanDerWaalsContact C-N 3.29Å; N932-L934 PolarHBondContact O-N 2.94Å; L934-W936 VanDerWaalsContact C-N 3.35Å; L934-C937 PolarHBondContact O-N 3.02Å; L934-V938 WeakPolarHBondContact O-CG2 3.4Å; L934-V938 PolarHBondContact O-N 3.14Å; L934-V999 HydrophobicContact CD2-CG1 4.21Å; L934-V1015 HydrophobicContact CD1-CG1 4.06Å; L934-V1015 HydrophobicContact CD1-CG2 4.46Å; L934-L1018 HydrophobicContact CB-CB 4.16Å; L934-L1018 HydrophobicContact CB-CD1 4.02Å; L934-I1019 HydrophobicContact CD1-CG1 4.21Å; L934-L1022 HydrophobicContact CD2-CD1 3.89Å; L934-L1033 HydrophobicContact CD2-CD2 4.2Å
935	R	96.5	Very high	96	Very high	39 Å²	39	40.1 Å²	40.1	15%	0.147	19%	0.187	C	C	.	.	H	α-helix	trans	-62.9	-38.2	173.3	-173.9	-155.2	-109.2	134.2	-38	111.7	A931 N932 V938 N939 L1018 D1130 E1132	A931-R935 WeakPolarHBondContact O-CB 3.33Å; A931-R935 PolarHBondContact O-N 2.92Å; N932-R935 CarbonylContact O-C 3.11Å; N932-R935 WeakPolarHBondContact O-CA 3.41Å; N932-R935 WeakPolarHBondContact O-CB 3.48Å; N932-R935 PolarHBondContact O-N 3.45Å; N932-R935 PolarHBondContact OD1-NH1 3.48Å; R935-V938 WeakPolarHBondContact O-CB 3.43Å; R935-V938 PolarHBondContact O-N 2.83Å; R935-N939 PolarHBondContact O-N 3.22Å; R935-N939 VanDerWaalsContact O-N 3.11Å; R935-N939 PolarHBondContact O-ND2 2.88Å; R935-L1018 HydrophobicContact CB-CD1 4.37Å; R935-L1018 HydrophobicContact CB-CD2 4.3Å; R935-D1130 IonicContact CZ-OD1 3.93Å; R935-D1130 IonicContact CZ-OD2 3.39Å; R935-D1130 IonicContact NH1-OD1 2.64Å; R935-D1130 PolarHBondContact NH1-OD1 3.15Å; R935-D1130 IonicContact NH1-OD2 2.74Å; R935-D1130 PolarHBondContact NH1-OD2 3.47Å; R935-D1130 IonicContact NH2-OD1 3.09Å; R935-D1130 PolarHBondContact NH2-OD1 3.07Å; R935-D1130 IonicContact NH2-OD2 3.36Å; R935-E1132 IonicContact CZ-OE2 2.77Å; R935-E1132 IonicContact NE-OE2 3.33Å; R935-E1132 PolarHBondContact NE-OE2 3.46Å; R935-E1132 IonicContact NH2-OE2 3.84Å; R935-E1132 PolarHBondContact NH2-OE2 3.38Å
936	W	97.9	Very high	96.1	Very high	51 Å²	51	42.5 Å²	42.5	19%	0.193	19%	0.192	C	C	.	.	H	α-helix	trans	-65	-47.7	174.4	180	95.6	0	0	0	111.3	I901 L920 N932 A933 L934 V938 N939 E940 I997 V1124 I1127	I901-W936 HydrophobicContact CD1-CE3 3.87Å; I901-W936 HydrophobicContact CD1-CZ3 3.82Å; L920-W936 HydrophobicContact CD1-CH2 4.23Å; L920-W936 HydrophobicContact CD1-CZ3 4.3Å; N932-W936 PolarHBondContact O-N 2.91Å; A933-W936 PolarHBondContact O-N 2.85Å; L934-W936 VanDerWaalsContact C-N 3.35Å; W936-V938 PolarHBondContact O-N 3.47Å; W936-N939 PolarHBondContact O-N 3.34Å; W936-E940 HydrophobicContact CE3-CB 4.47Å; W936-E940 HydrophobicContact CH2-CB 4.07Å; W936-E940 HydrophobicContact CH2-CG 3.98Å; W936-E940 HydrophobicContact CZ2-CB 4.24Å; W936-E940 HydrophobicContact CZ2-CG 4.4Å; W936-E940 HydrophobicContact CZ3-CB 4.2Å; W936-E940 HydrophobicContact CZ3-CG 4.37Å; W936-E940 PolarHBondContact O-N 2.72Å; W936-I997 HydrophobicContact CH2-CD1 3.97Å; W936-I997 HydrophobicContact CZ3-CD1 3.99Å; W936-V1124 HydrophobicContact CZ2-CG1 4.35Å; W936-I1127 HydrophobicContact CD2-CD1 4.19Å; W936-I1127 HydrophobicContact CD2-CG1 3.68Å; W936-I1127 HydrophobicContact CE3-CD1 4.26Å; W936-I1127 HydrophobicContact CE3-CG1 4.19Å; W936-I1127 HydrophobicContact CG-CB 4.33Å; W936-I1127 HydrophobicContact CG-CG1 3.87Å; W936-I1127 HydrophobicContact CG-CG2 4.48Å; W936-I1127 HydrophobicContact CH2-CD1 4.26Å; W936-I1127 HydrophobicContact CZ2-CD1 4.13Å; W936-I1127 HydrophobicContact CZ2-CG1 4.19Å; W936-I1127 HydrophobicContact CZ3-CD1 4.31Å
937	C	98.2	Very high	96.2	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-57	-34.8	174.1	-74.1	0	0	0	0	112.6	A933 L934 M941 V999 L1022 I1031	A933-C937 PolarHBondContact O-N 2.75Å; A933-C937 PolarHBondContact O-SG 2.88Å; A933-C937 VanDerWaalsContact O-SG 3.37Å; L934-C937 PolarHBondContact O-N 3.02Å; C937-M941 VanDerWaalsContact O-CB 3.3Å; C937-M941 WeakPolarHBondContact O-CB 3.38Å; C937-M941 PolarHBondContact O-N 2.96Å; C937-V999 VanDerWaalsContact SG-CG2 3.51Å; C937-L1022 HydrophobicContact CB-CD1 4.09Å; C937-L1022 HydrophobicContact CB-CD2 3.96Å; C937-I1031 HydrophobicContact CB-CG2 4.48Å
938	V	97.6	Very high	96.5	Very high	9 Å²	9	38.8 Å²	38.8	6%	0.055	17%	0.172	C	C	.	.	H	α-helix	trans	-67.3	-37.5	175.6	167.2	0	0	0	0	112	L934 R935 W936 E942 L1018 L1022	L934-V938 WeakPolarHBondContact O-CG2 3.4Å; L934-V938 PolarHBondContact O-N 3.14Å; R935-V938 WeakPolarHBondContact O-CB 3.43Å; R935-V938 PolarHBondContact O-N 2.83Å; W936-V938 PolarHBondContact O-N 3.47Å; V938-E942 PolarHBondContact O-N 2.81Å; V938-L1018 HydrophobicContact CB-CD2 4.44Å; V938-L1018 HydrophobicContact CG2-CD2 3.88Å; V938-L1022 HydrophobicContact CB-CD2 4.45Å; V938-L1022 HydrophobicContact CG2-CD1 4.21Å; V938-L1022 HydrophobicContact CG2-CD2 3.67Å; V938-L1022 HydrophobicContact CG2-CG 3.56Å
939	N	96.9	Very high	96.7	Very high	85 Å²	85	35.7 Å²	35.7	46%	0.455	17%	0.17	S	C	.	.	H	α-helix	trans	-72.8	-44.6	176	-82.5	-80.8	0	0	0	112.1	R935 W936 M941 E942 R943	R935-N939 PolarHBondContact O-N 3.22Å; R935-N939 VanDerWaalsContact O-N 3.11Å; R935-N939 PolarHBondContact O-ND2 2.88Å; W936-N939 PolarHBondContact O-N 3.34Å; N939-M941 VanDerWaalsContact C-N 3.3Å; N939-M941 PolarHBondContact O-N 3.4Å; N939-E942 WeakPolarHBondContact O-CA 3.27Å; N939-E942 PolarHBondContact O-N 3.17Å; N939-R943 PolarHBondContact O-N 3.45Å
940	E	97.1	Very high	96.7	Very high	17 Å²	17	35.1 Å²	35.1	8%	0.079	17%	0.173	C	C	.	.	H	α-helix	trans	-64.5	-34.4	177.2	173.9	54.9	-172.1	0	0	112	W936 E942 R943 R944 I997 I1031	W936-E940 HydrophobicContact CE3-CB 4.47Å; W936-E940 HydrophobicContact CH2-CB 4.07Å; W936-E940 HydrophobicContact CH2-CG 3.98Å; W936-E940 HydrophobicContact CZ2-CB 4.24Å; W936-E940 HydrophobicContact CZ2-CG 4.4Å; W936-E940 HydrophobicContact CZ3-CB 4.2Å; W936-E940 HydrophobicContact CZ3-CG 4.37Å; W936-E940 PolarHBondContact O-N 2.72Å; E940-E942 VanDerWaalsContact C-N 3.3Å; E940-E942 PolarHBondContact O-N 2.98Å; E940-R943 PolarHBondContact O-N 3.32Å; E940-R943 IonicContact OE1-NH1 3.87Å; E940-R943 PolarHBondContact OE1-NH1 2.86Å; E940-R943 VanDerWaalsContact OE2-CD 3.3Å; E940-R943 WeakPolarHBondContact OE2-CD 3.49Å; E940-R943 IonicContact OE2-CZ 2.86Å; E940-R943 IonicContact OE2-NE 2.7Å; E940-R943 IonicContact OE2-NH1 2.74Å; E940-R943 PolarHBondContact OE2-NH1 3.27Å; E940-R944 WeakPolarHBondContact O-CB 3.1Å; E940-R944 WeakPolarHBondContact O-CG 3.47Å; E940-R944 PolarHBondContact O-N 3.14Å; E940-R944 WeakPolarHBondContact OE1-CD 3.4Å; E940-R944 WeakPolarHBondContact OE1-CG 3.38Å; E940-R944 IonicContact OE1-CZ 2.75Å; E940-R944 IonicContact OE1-NE 3.19Å; E940-R944 PolarHBondContact OE1-NE 3.34Å; E940-R944 IonicContact OE1-NH2 2.78Å; E940-I997 HydrophobicContact CG-CD1 3.95Å; E940-I1031 HydrophobicContact CB-CD1 4.4Å; E940-I1031 HydrophobicContact CG-CD1 4.14Å
941	M	97.6	Very high	96.7	Very high	1 Å²	1	36.3 Å²	36.3	1%	0.005	18%	0.179	C	C	.	.	H	α-helix	trans	-55.7	-44.3	168.1	177.9	-178	64.4	0	0	111.8	C937 N939 Y945 L1022 K1025 A1026 A1029 I1031	C937-M941 VanDerWaalsContact O-CB 3.3Å; C937-M941 WeakPolarHBondContact O-CB 3.38Å; C937-M941 PolarHBondContact O-N 2.96Å; N939-M941 VanDerWaalsContact C-N 3.3Å; N939-M941 PolarHBondContact O-N 3.4Å; M941-Y945 HydrophobicContact CG-CD2 3.94Å; M941-Y945 HydrophobicContact CG-CE2 3.92Å; M941-Y945 WeakPolarHBondContact O-CD2 3.18Å; M941-Y945 PolarHBondContact O-N 2.75Å; M941-Y945 HydrophobicContact SD-CE2 4.49Å; M941-L1022 HydrophobicContact SD-CD2 4.37Å; M941-K1025 HydrophobicContact CE-CB 4.16Å; M941-K1025 HydrophobicContact CE-CD 4.46Å; M941-K1025 HydrophobicContact SD-CB 3.48Å; M941-K1025 WeakPolarHBondContact SD-CB 3.32Å; M941-A1026 HydrophobicContact SD-CB 4.05Å; M941-A1026 PolarHBondContact SD-N 2.84Å; M941-A1026 VanDerWaalsContact SD-N 3.43Å; M941-A1029 HydrophobicContact CG-CB 4.12Å; M941-I1031 HydrophobicContact CB-CD1 4.08Å
942	E	97.1	Very high	96.8	Very high	72 Å²	72	39.2 Å²	39.2	34%	0.336	21%	0.209	S	C	.	.	H	α-helix	trans	-71.9	-39.2	178.1	-71.2	-165	-166.1	0	0	113	V938 N939 E940 R944 Y945 K946 R1021	V938-E942 PolarHBondContact O-N 2.81Å; N939-E942 WeakPolarHBondContact O-CA 3.27Å; N939-E942 PolarHBondContact O-N 3.17Å; E940-E942 VanDerWaalsContact C-N 3.3Å; E940-E942 PolarHBondContact O-N 2.98Å; E942-R944 PolarHBondContact O-N 3.15Å; E942-Y945 PolarHBondContact O-N 3.04Å; E942-K946 WeakPolarHBondContact O-CG 3.24Å; E942-K946 PolarHBondContact O-N 3.46Å; E942-R1021 IonicContact OE1-CZ 3.75Å; E942-R1021 IonicContact OE1-NH1 2.69Å; E942-R1021 PolarHBondContact OE1-NH1 3.38Å; E942-R1021 IonicContact OE1-NH2 2.91Å; E942-R1021 PolarHBondContact OE1-NH2 2.79Å
943	R	96.6	Very high	96.9	Very high	96 Å²	96	39.9 Å²	39.9	36%	0.362	21%	0.214	S	C	.	.	H	α-helix	trans	-56.1	-49.6	171.4	174.4	173.3	161	-78.4	-8.3	110.7	N939 E940 Y945 K946 L947 E994	N939-R943 PolarHBondContact O-N 3.45Å; E940-R943 PolarHBondContact O-N 3.32Å; E940-R943 IonicContact OE1-NH1 3.87Å; E940-R943 PolarHBondContact OE1-NH1 2.86Å; E940-R943 VanDerWaalsContact OE2-CD 3.3Å; E940-R943 WeakPolarHBondContact OE2-CD 3.49Å; E940-R943 IonicContact OE2-CZ 2.86Å; E940-R943 IonicContact OE2-NE 2.7Å; E940-R943 IonicContact OE2-NH1 2.74Å; E940-R943 PolarHBondContact OE2-NH1 3.27Å; R943-Y945 VanDerWaalsContact C-N 3.33Å; R943-Y945 PolarHBondContact O-N 2.97Å; R943-K946 WeakPolarHBondContact O-CB 3.46Å; R943-K946 PolarHBondContact O-N 3.1Å; R943-K946 VanDerWaalsContact O-N 3.16Å; R943-L947 HydrophobicContact CG-CD1 4.32Å; R943-L947 PolarHBondContact O-N 3.39Å; R943-E994 IonicContact CZ-OE1 3.17Å; R943-E994 VanDerWaalsContact CZ-OE1 3.27Å; R943-E994 IonicContact NH1-OE1 2.87Å; R943-E994 PolarHBondContact NH1-OE1 3.43Å; R943-E994 IonicContact NH2-OE1 2.69Å; R943-E994 PolarHBondContact NH2-OE1 2.87Å
944	R	98	Very high	96.8	Very high	5 Å²	5	51 Å²	51	2%	0.019	26%	0.255	C	S	.	.	H	α-helix	trans	-61.2	-38.3	175.5	-71.6	179	175.1	-154.8	-5.4	112.7	E940 E942 L947 M948 E994 P995 A1029	E940-R944 WeakPolarHBondContact O-CB 3.1Å; E940-R944 WeakPolarHBondContact O-CG 3.47Å; E940-R944 PolarHBondContact O-N 3.14Å; E940-R944 WeakPolarHBondContact OE1-CD 3.4Å; E940-R944 WeakPolarHBondContact OE1-CG 3.38Å; E940-R944 IonicContact OE1-CZ 2.75Å; E940-R944 IonicContact OE1-NE 3.19Å; E940-R944 PolarHBondContact OE1-NE 3.34Å; E940-R944 IonicContact OE1-NH2 2.78Å; E942-R944 PolarHBondContact O-N 3.15Å; R944-L947 PolarHBondContact O-N 3.32Å; R944-M948 HydrophobicContact CB-CE 4.4Å; R944-M948 WeakPolarHBondContact O-CB 3.25Å; R944-M948 WeakPolarHBondContact O-CE 3.35Å; R944-M948 VanDerWaalsContact O-CG 3.24Å; R944-M948 WeakPolarHBondContact O-CG 3.43Å; R944-M948 PolarHBondContact O-N 3.39Å; R944-E994 IonicContact CZ-OE2 3.72Å; R944-E994 IonicContact NE-OE2 3.83Å; R944-E994 IonicContact NH2-OE2 3.93Å; R944-E994 PolarHBondContact NH2-OE2 3.14Å; R944-P995 VanDerWaalsContact CZ-O 3.23Å; R944-P995 PolarHBondContact NH1-O 3.06Å; R944-P995 PolarHBondContact NH2-O 3.33Å; R944-A1029 HydrophobicContact CB-CB 3.87Å; R944-A1029 VanDerWaalsContact CD-O 3.27Å; R944-A1029 WeakPolarHBondContact CD-O 3.4Å; R944-A1029 PolarHBondContact NH1-O 3.28Å
945	Y	97.6	Very high	96.8	Very high	91 Å²	91	54.4 Å²	54.4	36%	0.357	27%	0.274	S	S	.	.	H	α-helix	trans	-64.6	-37.6	174.1	-91.4	-63.8	0	0	0	113.4	M941 E942 R943 M948 S949 K1025 A1028	M941-Y945 HydrophobicContact CG-CD2 3.94Å; M941-Y945 HydrophobicContact CG-CE2 3.92Å; M941-Y945 WeakPolarHBondContact O-CD2 3.18Å; M941-Y945 PolarHBondContact O-N 2.75Å; M941-Y945 HydrophobicContact SD-CE2 4.49Å; E942-Y945 PolarHBondContact O-N 3.04Å; R943-Y945 VanDerWaalsContact C-N 3.33Å; R943-Y945 PolarHBondContact O-N 2.97Å; Y945-M948 HydrophobicContact CD1-CE 3.7Å; Y945-M948 HydrophobicContact CE1-CE 4.04Å; Y945-M948 HydrophobicContact CG-CE 4.04Å; Y945-S949 VanDerWaalsContact O-CB 3.31Å; Y945-S949 WeakPolarHBondContact O-CB 3.44Å; Y945-S949 PolarHBondContact O-N 3.19Å; Y945-K1025 HydrophobicContact CE2-CB 4.17Å; Y945-K1025 PolarHBondContact OH-O 3.43Å; Y945-A1028 HydrophobicContact CE1-CB 4.05Å; Y945-A1028 WeakPolarHBondContact OH-CB 3.37Å
946	K	96.5	Very high	96.8	Very high	113 Å²	113	52.7 Å²	52.7	49%	0.491	27%	0.267	S	S	.	.	H	α-helix	trans	-60.9	-54.4	171.9	-66.5	166.2	-172.5	171.7	0	110	E942 R943 M948 S949 A950 Y977	E942-K946 WeakPolarHBondContact O-CG 3.24Å; E942-K946 PolarHBondContact O-N 3.46Å; R943-K946 WeakPolarHBondContact O-CB 3.46Å; R943-K946 PolarHBondContact O-N 3.1Å; R943-K946 VanDerWaalsContact O-N 3.16Å; K946-M948 PolarHBondContact O-N 3.14Å; K946-S949 WeakPolarHBondContact O-CB 3.4Å; K946-S949 PolarHBondContact O-N 2.9Å; K946-S949 VanDerWaalsContact O-N 3.09Å; K946-A950 PolarHBondContact O-N 3.36Å; K946-Y977 VanDerWaalsContact C-CE2 3.47Å; K946-Y977 HydrophobicContact CB-CD2 4.32Å; K946-Y977 HydrophobicContact CB-CE2 3.72Å; K946-Y977 WeakPolarHBondContact O-CE2 3.47Å; K946-Y977 PolarHBondContact O-OH 3.44Å; K946-Y977 VanDerWaalsContact O-OH 3.07Å
947	L	96.2	Very high	96.8	Very high	4 Å²	4	51.8 Å²	51.8	2%	0.021	27%	0.27	C	S	.	.	H	α-helix	trans	-56.6	-46.2	178.4	-68.2	176.4	0	0	0	113	R943 R944 S949 A950 L951 Y959 Y977 L991	R943-L947 HydrophobicContact CG-CD1 4.32Å; R943-L947 PolarHBondContact O-N 3.39Å; R944-L947 PolarHBondContact O-N 3.32Å; L947-S949 VanDerWaalsContact C-N 3.32Å; L947-S949 PolarHBondContact O-N 3.16Å; L947-A950 PolarHBondContact O-N 2.89Å; L947-L951 PolarHBondContact O-N 3.4Å; L947-Y959 HydrophobicContact CB-CD2 4.46Å; L947-Y959 HydrophobicContact CB-CE2 4.04Å; L947-Y959 HydrophobicContact CD1-CE2 4.45Å; L947-Y977 HydrophobicContact CD2-CD2 4.22Å; L947-L991 HydrophobicContact CD1-CD2 4.42Å; L947-L991 HydrophobicContact CD2-CD1 4.33Å; L947-L991 HydrophobicContact CD2-CD2 3.63Å
948	M	97.1	Very high	96.7	Very high	5 Å²	5	52.3 Å²	52.3	3%	0.025	28%	0.276	C	S	.	.	H	α-helix	trans	-62	-38.2	176.3	-73.7	-172.7	-68.4	0	0	112.5	R944 Y945 K946 G952 V953 N955 A1029	R944-M948 HydrophobicContact CB-CE 4.4Å; R944-M948 WeakPolarHBondContact O-CB 3.25Å; R944-M948 WeakPolarHBondContact O-CE 3.35Å; R944-M948 VanDerWaalsContact O-CG 3.24Å; R944-M948 WeakPolarHBondContact O-CG 3.43Å; R944-M948 PolarHBondContact O-N 3.39Å; Y945-M948 HydrophobicContact CD1-CE 3.7Å; Y945-M948 HydrophobicContact CE1-CE 4.04Å; Y945-M948 HydrophobicContact CG-CE 4.04Å; K946-M948 PolarHBondContact O-N 3.14Å; M948-G952 PolarHBondContact O-N 3.47Å; M948-G952 VanDerWaalsContact O-N 3.07Å; M948-V953 HydrophobicContact CB-CG2 3.83Å; M948-V953 HydrophobicContact CG-CG2 3.88Å; M948-V953 WeakPolarHBondContact O-CG2 3.43Å; M948-V953 PolarHBondContact O-N 2.98Å; M948-N955 WeakPolarHBondContact SD-CA 3.3Å; M948-A1029 HydrophobicContact CE-CB 4.2Å
949	S	96.2	Very high	96.7	Very high	90 Å²	90	52 Å²	52	63%	0.629	27%	0.274	S	S	*	.	H	α-helix	trans	-64.6	-48.9	176.5	-169.7	0	0	0	0	111.5	Y945 K946 L947 L951 G952	Y945-S949 VanDerWaalsContact O-CB 3.31Å; Y945-S949 WeakPolarHBondContact O-CB 3.44Å; Y945-S949 PolarHBondContact O-N 3.19Å; K946-S949 WeakPolarHBondContact O-CB 3.4Å; K946-S949 PolarHBondContact O-N 2.9Å; K946-S949 VanDerWaalsContact O-N 3.09Å; L947-S949 VanDerWaalsContact C-N 3.32Å; L947-S949 PolarHBondContact O-N 3.16Å; S949-L951 PolarHBondContact O-N 2.88Å; S949-G952 PolarHBondContact O-N 2.97Å
950	A	95.7	Very high	96.7	Very high	46 Å²	46	49.2 Å²	49.2	38%	0.38	26%	0.259	S	S	.	.	H	α-helix	trans	-64.1	-38.5	179.6	0	0	0	0	0	113.2	K946 L947 G952 P976 Y977	K946-A950 PolarHBondContact O-N 3.36Å; L947-A950 PolarHBondContact O-N 2.89Å; A950-G952 VanDerWaalsContact C-N 3.25Å; A950-G952 PolarHBondContact O-N 2.96Å; A950-P976 HydrophobicContact CB-CB 3.83Å; A950-P976 HydrophobicContact CB-CG 3.37Å; A950-Y977 HydrophobicContact CB-CE2 3.69Å
951	L	95.3	Very high	96.7	Very high	25 Å²	25	54.6 Å²	54.6	13%	0.131	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.8	-4.2	173.2	-59.3	-166	0	0	0	113.6	L947 S949 V953 Y959 K962 I963 I973 L991	L947-L951 PolarHBondContact O-N 3.4Å; S949-L951 PolarHBondContact O-N 2.88Å; L951-V953 HydrophobicContact CB-CG1 4.46Å; L951-V953 HydrophobicContact CB-CG2 4.24Å; L951-Y959 HydrophobicContact CD1-CD2 3.66Å; L951-Y959 HydrophobicContact CD1-CE2 3.73Å; L951-K962 HydrophobicContact CB-CD 4.48Å; L951-K962 PolarHBondContact O-NZ 3.43Å; L951-I963 HydrophobicContact CD1-CD1 4.26Å; L951-I973 HydrophobicContact CD1-CD1 4.38Å; L951-I973 HydrophobicContact CD2-CD1 4.36Å; L951-I973 HydrophobicContact CD2-CG2 3.98Å; L951-L991 HydrophobicContact CD1-CD1 4.05Å; L951-L991 HydrophobicContact CD2-CD1 4.13Å; L951-L991 HydrophobicContact CG-CD1 4.33Å
952	G	96	Very high	96.6	Very high	62 Å²	62	58.4 Å²	58.4	64%	0.639	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.7	42.1	-179.3	0	0	0	0	0	113.6	M948 S949 A950	M948-G952 PolarHBondContact O-N 3.47Å; M948-G952 VanDerWaalsContact O-N 3.07Å; S949-G952 PolarHBondContact O-N 2.97Å; A950-G952 VanDerWaalsContact C-N 3.25Å; A950-G952 PolarHBondContact O-N 2.96Å
953	V	97.1	Very high	96.6	Very high	24 Å²	24	55.1 Å²	55.1	15%	0.145	29%	0.285	C	S	.	.			trans	-118.8	162.1	179.7	-63.6	0	0	0	0	111.3	M948 L951 G958 K962	M948-V953 HydrophobicContact CB-CG2 3.83Å; M948-V953 HydrophobicContact CG-CG2 3.88Å; M948-V953 WeakPolarHBondContact O-CG2 3.43Å; M948-V953 PolarHBondContact O-N 2.98Å; L951-V953 HydrophobicContact CB-CG1 4.46Å; L951-V953 HydrophobicContact CB-CG2 4.24Å; V953-G958 WeakPolarHBondContact CG1-O 3.45Å; V953-K962 HydrophobicContact CG1-CD 3.58Å; V953-K962 VanDerWaalsContact CG1-CE 3.47Å; V953-K962 HydrophobicContact CG1-CG 4.2Å
954	R	95.7	Very high	96.5	Very high	234 Å²	234	52.7 Å²	52.7	88%	0.883	29%	0.286	S	S	*	.	S	Bend	trans	-104.1	-16.8	-170.8	-66.6	-177.6	178	175.3	-0.1	115
955	N	96.5	Very high	96.4	Very high	74 Å²	74	56.7 Å²	56.7	40%	0.396	31%	0.305	S	S	.	.	S	Bend	trans	-160.7	167.3	-174.6	60.4	3.1	0	0	0	111.2	M948 A957 G958 Y959 A1028	M948-N955 WeakPolarHBondContact SD-CA 3.3Å; N955-A957 PolarHBondContact O-N 3.31Å; N955-G958 PolarHBondContact O-N 2.88Å; N955-G958 PolarHBondContact OD1-N 3.49Å; N955-Y959 PolarHBondContact O-N 2.9Å; N955-A1028 CarbonylContact C-O 3.56Å; N955-A1028 VanDerWaalsContact CA-O 3.25Å; N955-A1028 WeakPolarHBondContact CA-O 3.33Å
956	L	97	Very high	96.4	Very high	3 Å²	3	52.9 Å²	52.9	2%	0.016	29%	0.292	C	S	.	.	H	α-helix	trans	-55.2	-36.4	178.3	-170.5	67.9	0	0	0	113.4	Y959 N960 E994 Y996 A1028	L956-Y959 HydrophobicContact CD1-CD1 4.35Å; L956-Y959 WeakPolarHBondContact O-CB 3.43Å; L956-Y959 PolarHBondContact O-N 3.41Å; L956-N960 WeakPolarHBondContact O-CB 3.44Å; L956-N960 PolarHBondContact O-N 3.07Å; L956-E994 HydrophobicContact CD1-CB 3.57Å; L956-Y996 HydrophobicContact CD2-CD1 3.82Å; L956-Y996 HydrophobicContact CD2-CD2 4.1Å; L956-Y996 HydrophobicContact CD2-CE1 3.97Å; L956-Y996 HydrophobicContact CD2-CE2 4.24Å; L956-Y996 HydrophobicContact CD2-CG 3.88Å; L956-A1028 PolarHBondContact N-O 3.2Å
957	A	96	Very high	96.3	Very high	31 Å²	31	51.8 Å²	51.8	26%	0.256	29%	0.291	S	S	.	.	H	α-helix	trans	-60.8	-51.9	176.5	0	0	0	0	0	111.7	N955 Y959 N960 E961	N955-A957 PolarHBondContact O-N 3.31Å; A957-Y959 VanDerWaalsContact C-N 3.28Å; A957-Y959 PolarHBondContact O-N 3.32Å; A957-N960 PolarHBondContact O-N 3.33Å; A957-E961 WeakPolarHBondContact O-CG 3.2Å; A957-E961 PolarHBondContact O-N 3Å
958	G	96.5	Very high	96.2	Very high	11 Å²	11	60.3 Å²	60.3	11%	0.113	32%	0.323	C	S	.	.	H	α-helix	trans	-66.6	-27.1	177.1	0	0	0	0	0	113.8	V953 N955 K962	V953-G958 WeakPolarHBondContact CG1-O 3.45Å; N955-G958 PolarHBondContact O-N 2.88Å; N955-G958 PolarHBondContact OD1-N 3.49Å; G958-K962 PolarHBondContact O-N 3.42Å
959	Y	98	Very high	96.2	Very high	4 Å²	4	65.8 Å²	65.8	2%	0.016	35%	0.35	C	S	.	.	H	α-helix	trans	-64.2	-53.9	168.4	171.6	-86.4	0	0	0	110.5	L947 L951 N955 L956 A957 E961 K962 I963 L991 K992 E994	L947-Y959 HydrophobicContact CB-CD2 4.46Å; L947-Y959 HydrophobicContact CB-CE2 4.04Å; L947-Y959 HydrophobicContact CD1-CE2 4.45Å; L951-Y959 HydrophobicContact CD1-CD2 3.66Å; L951-Y959 HydrophobicContact CD1-CE2 3.73Å; N955-Y959 PolarHBondContact O-N 2.9Å; L956-Y959 HydrophobicContact CD1-CD1 4.35Å; L956-Y959 WeakPolarHBondContact O-CB 3.43Å; L956-Y959 PolarHBondContact O-N 3.41Å; A957-Y959 VanDerWaalsContact C-N 3.28Å; A957-Y959 PolarHBondContact O-N 3.32Å; Y959-E961 VanDerWaalsContact C-N 3.33Å; Y959-E961 PolarHBondContact O-N 3.39Å; Y959-K962 PolarHBondContact O-N 2.96Å; Y959-I963 HydrophobicContact CD1-CG1 4.28Å; Y959-I963 HydrophobicContact CE1-CD1 4.4Å; Y959-I963 HydrophobicContact CE1-CG1 3.79Å; Y959-I963 HydrophobicContact CE2-CD1 4.35Å; Y959-I963 PolarHBondContact O-N 3.03Å; Y959-I963 VanDerWaalsContact O-N 3.08Å; Y959-L991 HydrophobicContact CE2-CD1 4.35Å; Y959-K992 VanDerWaalsContact CE1-O 3.29Å; Y959-K992 WeakPolarHBondContact CE1-O 3.3Å; Y959-K992 PolarHBondContact OH-O 2.96Å; Y959-E994 HydrophobicContact CD1-CB 4.1Å; Y959-E994 HydrophobicContact CD1-CG 4.29Å; Y959-E994 HydrophobicContact CE1-CB 3.68Å; Y959-E994 HydrophobicContact CE1-CG 3.46Å; Y959-E994 VanDerWaalsContact CE1-CG 3.46Å
960	N	97	Very high	96.1	Very high	26 Å²	26	69.7 Å²	69.7	14%	0.139	36%	0.361	C	S	.	.	H	α-helix	trans	-63.7	-35.1	-179.5	-75.3	-20	0	0	0	112.9	L956 A957 K962 I963 A964 K993 E994	L956-N960 WeakPolarHBondContact O-CB 3.44Å; L956-N960 PolarHBondContact O-N 3.07Å; A957-N960 PolarHBondContact O-N 3.33Å; N960-K962 VanDerWaalsContact C-N 3.32Å; N960-K962 PolarHBondContact O-N 2.82Å; N960-I963 PolarHBondContact O-N 3.09Å; N960-A964 WeakPolarHBondContact O-CB 3.28Å; N960-A964 PolarHBondContact O-N 3.08Å; N960-K993 HydrophobicContact CB-CG 4.44Å; N960-K993 WeakPolarHBondContact OD1-CA 3.3Å; N960-E994 PolarHBondContact ND2-O 3.5Å; N960-E994 PolarHBondContact OD1-N 3.36Å; N960-E994 PolarHBondContact OD1-O 3.05Å
961	E	96.4	Very high	96	Very high	130 Å²	130	76.8 Å²	76.8	61%	0.607	38%	0.378	S	S	*	.	H	α-helix	trans	-58.1	-41.8	171.5	-77.1	169.1	-170.2	0	0	112	A957 Y959 E965	A957-E961 WeakPolarHBondContact O-CG 3.2Å; A957-E961 PolarHBondContact O-N 3Å; Y959-E961 VanDerWaalsContact C-N 3.33Å; Y959-E961 PolarHBondContact O-N 3.39Å; E961-E965 WeakPolarHBondContact O-CB 3.39Å; E961-E965 PolarHBondContact O-N 2.82Å
962	K	95.8	Very high	95.9	Very high	80 Å²	80	78.9 Å²	78.9	35%	0.348	39%	0.392	S	S	.	.	H	α-helix	trans	-72.2	-37.2	177.6	-75.1	-165.8	-179.7	-173.5	0	113.5	L951 V953 G958 Y959 N960 E965 A966	L951-K962 HydrophobicContact CB-CD 4.48Å; L951-K962 PolarHBondContact O-NZ 3.43Å; V953-K962 HydrophobicContact CG1-CD 3.58Å; V953-K962 VanDerWaalsContact CG1-CE 3.47Å; V953-K962 HydrophobicContact CG1-CG 4.2Å; G958-K962 PolarHBondContact O-N 3.42Å; Y959-K962 PolarHBondContact O-N 2.96Å; N960-K962 VanDerWaalsContact C-N 3.32Å; N960-K962 PolarHBondContact O-N 2.82Å; K962-E965 PolarHBondContact O-N 2.76Å; K962-A966 WeakPolarHBondContact O-CB 3.42Å; K962-A966 PolarHBondContact O-N 2.68Å
963	I	96.8	Very high	95.8	Very high	3 Å²	3	78 Å²	78	2%	0.015	37%	0.372	C	S	.	.	H	α-helix	trans	-63.8	-47.9	172.6	-53.8	-54.6	0	0	0	109.6	L951 Y959 N960 E965 A966 D967 I973 L991	L951-I963 HydrophobicContact CD1-CD1 4.26Å; Y959-I963 HydrophobicContact CD1-CG1 4.28Å; Y959-I963 HydrophobicContact CE1-CD1 4.4Å; Y959-I963 HydrophobicContact CE1-CG1 3.79Å; Y959-I963 HydrophobicContact CE2-CD1 4.35Å; Y959-I963 PolarHBondContact O-N 3.03Å; Y959-I963 VanDerWaalsContact O-N 3.08Å; N960-I963 PolarHBondContact O-N 3.09Å; I963-E965 VanDerWaalsContact C-N 3.25Å; I963-E965 PolarHBondContact O-N 2.93Å; I963-A966 WeakPolarHBondContact O-CB 3.46Å; I963-A966 PolarHBondContact O-N 2.8Å; I963-A966 VanDerWaalsContact O-N 3.07Å; I963-D967 PolarHBondContact O-N 3.47Å; I963-I973 HydrophobicContact CD1-CD1 4.19Å; I963-L991 HydrophobicContact CD1-CB 3.68Å; I963-L991 HydrophobicContact CD1-CD1 4.47Å
964	A	95.5	Very high	95.6	Very high	45 Å²	45	80 Å²	80	37%	0.372	39%	0.386	S	S	.	.	H	α-helix	trans	-63.7	-27.3	177	0	0	0	0	0	113.3	N960 R968	N960-A964 WeakPolarHBondContact O-CB 3.28Å; N960-A964 PolarHBondContact O-N 3.08Å; A964-R968 WeakPolarHBondContact O-CB 3.39Å; A964-R968 VanDerWaalsContact O-CG 3.25Å; A964-R968 WeakPolarHBondContact O-CG 3.43Å; A964-R968 PolarHBondContact O-N 2.89Å; A964-R968 PolarHBondContact O-NE 3.4Å
965	E	96.4	Very high	95.5	Very high	90 Å²	90	70.3 Å²	70.3	42%	0.421	35%	0.352	S	S	.	.	H	α-helix	trans	-70.1	-46.9	168.8	-172	174.4	179	0	0	112.2	E961 K962 I963 D967 R968 M969	E961-E965 WeakPolarHBondContact O-CB 3.39Å; E961-E965 PolarHBondContact O-N 2.82Å; K962-E965 PolarHBondContact O-N 2.76Å; I963-E965 VanDerWaalsContact C-N 3.25Å; I963-E965 PolarHBondContact O-N 2.93Å; E965-D967 PolarHBondContact O-N 2.89Å; E965-R968 VanDerWaalsContact CA-NH2 3.3Å; E965-R968 PolarHBondContact O-N 3.35Å; E965-M969 HydrophobicContact CG-CE 3.72Å; E965-M969 HydrophobicContact CG-SD 4.46Å; E965-M969 WeakPolarHBondContact O-CG 3.4Å; E965-M969 PolarHBondContact O-N 3Å; E965-M969 VanDerWaalsContact OE1-CE 3.27Å; E965-M969 WeakPolarHBondContact OE1-CE 3.47Å
966	A	95.9	Very high	95.2	Very high	10 Å²	10	69.9 Å²	69.9	8%	0.083	35%	0.353	C	S	.	.	H	α-helix	trans	-59	-43.7	176.7	0	0	0	0	0	112.7	K962 I963 M969 M970 R971 I973	K962-A966 WeakPolarHBondContact O-CB 3.42Å; K962-A966 PolarHBondContact O-N 2.68Å; I963-A966 WeakPolarHBondContact O-CB 3.46Å; I963-A966 PolarHBondContact O-N 2.8Å; I963-A966 VanDerWaalsContact O-N 3.07Å; A966-M969 CarbonylContact O-C 3.6Å; A966-M969 PolarHBondContact O-N 3.35Å; A966-M970 PolarHBondContact O-N 2.9Å; A966-M970 VanDerWaalsContact O-N 3.12Å; A966-R971 WeakPolarHBondContact CB-O 3.42Å; A966-R971 CarbonylContact O-C 3.54Å; A966-R971 PolarHBondContact O-N 3.2Å; A966-I973 HydrophobicContact CB-CD1 3.97Å; A966-I973 HydrophobicContact CB-CG1 3.56Å
967	D	94.3	Very high	94.9	Very high	90 Å²	90	74.9 Å²	74.9	48%	0.481	37%	0.373	S	S	.	.	H	α-helix	trans	-64.6	-43.4	176.6	-67.3	-27.2	0	0	0	111.7	I963 E965 M969 M970	I963-D967 PolarHBondContact O-N 3.47Å; E965-D967 PolarHBondContact O-N 2.89Å; D967-M969 PolarHBondContact O-N 2.86Å; D967-M970 PolarHBondContact O-N 2.9Å
968	R	95.9	Very high	94.5	Very high	183 Å²	183	75.8 Å²	75.8	69%	0.691	37%	0.37	S	S	*	.	H	α-helix	trans	-63.1	-28	173.6	-78	177.4	-67.4	155.4	1.5	113	A964 E965 M970	A964-R968 WeakPolarHBondContact O-CB 3.39Å; A964-R968 VanDerWaalsContact O-CG 3.25Å; A964-R968 WeakPolarHBondContact O-CG 3.43Å; A964-R968 PolarHBondContact O-N 2.89Å; A964-R968 PolarHBondContact O-NE 3.4Å; E965-R968 VanDerWaalsContact CA-NH2 3.3Å; E965-R968 PolarHBondContact O-N 3.35Å; R968-M970 VanDerWaalsContact C-N 3.32Å
969	M	96	Very high	94	Very high	121 Å²	121	81.7 Å²	81.7	60%	0.596	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.1	-1.2	172.7	-67.7	-174.5	-174.2	0	0	113.4	E965 A966 D967 R971	E965-M969 HydrophobicContact CG-CE 3.72Å; E965-M969 HydrophobicContact CG-SD 4.46Å; E965-M969 WeakPolarHBondContact O-CG 3.4Å; E965-M969 PolarHBondContact O-N 3Å; E965-M969 VanDerWaalsContact OE1-CE 3.27Å; E965-M969 WeakPolarHBondContact OE1-CE 3.47Å; A966-M969 CarbonylContact O-C 3.6Å; A966-M969 PolarHBondContact O-N 3.35Å; D967-M969 PolarHBondContact O-N 2.86Å; M969-R971 HydrophobicContact CB-CB 4.3Å; M969-R971 PolarHBondContact O-N 2.71Å
970	M	93.6	Very high	93.1	Very high	171 Å²	171	87.2 Å²	87.2	84%	0.842	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.5	34.4	-170.2	-66.8	179.5	-79.9	0	0	112.9	A966 D967 R968	A966-M970 PolarHBondContact O-N 2.9Å; A966-M970 VanDerWaalsContact O-N 3.12Å; D967-M970 PolarHBondContact O-N 2.9Å; R968-M970 VanDerWaalsContact C-N 3.32Å
971	R	94.4	Very high	92.1	Very high	196 Å²	196	89.2 Å²	89.2	74%	0.74	46%	0.455	S	S	*	.			trans	-127.4	73.1	-178.6	-169.7	-175.6	178.2	170	1.1	109.8	A966 M969	A966-R971 WeakPolarHBondContact CB-O 3.42Å; A966-R971 CarbonylContact O-C 3.54Å; A966-R971 PolarHBondContact O-N 3.2Å; M969-R971 HydrophobicContact CB-CB 4.3Å; M969-R971 PolarHBondContact O-N 2.71Å
972	P	92.3	Very high	91.1	Very high	68 Å²	68	87.4 Å²	87.4	44%	0.442	45%	0.45	S	S	.	.	P	Polyproline II helix	trans	-53.1	144.8	-179.9	20.2	-32.7	0	0	0	112.4	P974 V990	P972-P974 WeakPolarHBondContact O-CD 3.34Å; P972-V990 HydrophobicContact CB-CB 4.4Å; P972-V990 HydrophobicContact CB-CG1 3.48Å; P972-V990 VanDerWaalsContact CB-CG1 3.48Å; P972-V990 HydrophobicContact CB-CG2 3.96Å; P972-V990 HydrophobicContact CG-CG2 4.47Å
973	I	94.4	Very high	89.8	Confident	43 Å²	43	85.7 Å²	85.7	22%	0.221	45%	0.448	C	S	.	.	P	Polyproline II helix	trans	-88.9	119	179.8	-48.8	-173.3	0	0	0	109	L951 I963 A966 V990 L991	L951-I973 HydrophobicContact CD1-CD1 4.38Å; L951-I973 HydrophobicContact CD2-CD1 4.36Å; L951-I973 HydrophobicContact CD2-CG2 3.98Å; I963-I973 HydrophobicContact CD1-CD1 4.19Å; A966-I973 HydrophobicContact CB-CD1 3.97Å; A966-I973 HydrophobicContact CB-CG1 3.56Å; I973-V990 WeakPolarHBondContact O-CA 3.29Å; I973-L991 HydrophobicContact CB-CB 4.5Å; I973-L991 HydrophobicContact CB-CD1 4.41Å; I973-L991 HydrophobicContact CG2-CD1 4.07Å; I973-L991 PolarHBondContact O-N 3.06Å
974	P	92.9	Very high	88.5	Confident	67 Å²	67	95.1 Å²	95.1	44%	0.435	49%	0.494	S	S	.	.	B	Isolated β-bridge	trans	-68.8	149.8	171.6	29.3	-34.1	0	0	0	111.1	P972 P976 P989	P972-P974 WeakPolarHBondContact O-CD 3.34Å; P974-P976 WeakPolarHBondContact O-CD 3.44Å; P974-P989 WeakPolarHBondContact CA-O 3.29Å
975	D	93.4	Very high	87.2	Confident	30 Å²	30	98.6 Å²	98.6	16%	0.16	51%	0.507	C	S	.	.	P	Polyproline II helix	trans	-63.5	116.3	179.4	-167.2	-41.3	0	0	0	112.1	Y977 W978 H988 P989 L991	D975-Y977 PolarHBondContact O-N 3.24Å; D975-Y977 PolarHBondContact OD1-N 3.36Å; D975-W978 HydrophobicContact CB-CB 4.17Å; D975-W978 PolarHBondContact O-N 2.8Å; D975-H988 PolarHBondContact N-CE1 2.87Å; D975-H988 PolarHBondContact O-CE1 2.84Å; D975-P989 HydrophobicContact CB-CG 4.31Å; D975-P989 PolarHBondContact N-O 3.34Å; D975-L991 HydrophobicContact CB-CD2 3.84Å; D975-L991 HydrophobicContact CB-CG 4.44Å
976	P	91.5	Very high	86.1	Confident	65 Å²	65	99.4 Å²	99.4	42%	0.422	53%	0.529	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68	-2.8	-176	28.1	-34.6	0	0	0	114.9	A950 P974	A950-P976 HydrophobicContact CB-CB 3.83Å; A950-P976 HydrophobicContact CB-CG 3.37Å; P974-P976 WeakPolarHBondContact O-CD 3.44Å
977	Y	90.3	Very high	85.3	Confident	108 Å²	108	106.8 Å²	106.8	42%	0.424	56%	0.561	S	S	.	*	T	Hydrogen-bonded Turn	trans	-112.2	-13.4	179.2	-65.6	-75.4	0	0	0	115.1	K946 L947 A950 D975	K946-Y977 VanDerWaalsContact C-CE2 3.47Å; K946-Y977 HydrophobicContact CB-CD2 4.32Å; K946-Y977 HydrophobicContact CB-CE2 3.72Å; K946-Y977 WeakPolarHBondContact O-CE2 3.47Å; K946-Y977 PolarHBondContact O-OH 3.44Å; K946-Y977 VanDerWaalsContact O-OH 3.07Å; L947-Y977 HydrophobicContact CD2-CD2 4.22Å; A950-Y977 HydrophobicContact CB-CE2 3.69Å; D975-Y977 PolarHBondContact O-N 3.24Å; D975-Y977 PolarHBondContact OD1-N 3.36Å
978	W	88.2	Confident	84.7	Confident	51 Å²	51	106.3 Å²	106.3	19%	0.193	56%	0.556	C	S	.	*			trans	-72.2	139.8	-180	179.8	90.5	0	0	0	112	D975 P980 S983 H988 P989	D975-W978 HydrophobicContact CB-CB 4.17Å; D975-W978 PolarHBondContact O-N 2.8Å; W978-P980 HydrophobicContact CH2-CB 4.34Å; W978-P980 HydrophobicContact CH2-CG 4.26Å; W978-P980 HydrophobicContact CZ3-CG 3.97Å; W978-S983 PolarHBondContact NE1-OG 2.94Å; W978-H988 HydrophobicContact CE3-CB 4.32Å; W978-H988 AromaticContact CE3-CD2 3.51Å; W978-H988 AromaticContact CE3-CE1 3.83Å; W978-H988 AromaticContact CE3-CG 3.74Å; W978-H988 AromaticContact CE3-ND1 3.97Å; W978-H988 AromaticContact CE3-NE2 3.62Å; W978-H988 HydrophobicContact CZ3-CB 4.1Å; W978-H988 AromaticContact CZ3-CD2 3.73Å; W978-H988 AromaticContact CZ3-CG 3.94Å; W978-P989 HydrophobicContact CB-CG 3.86Å; W978-P989 VanDerWaalsContact CD1-CG 3.46Å; W978-P989 VanDerWaalsContact CD2-CD 3.46Å; W978-P989 HydrophobicContact CD2-CG 4.1Å; W978-P989 VanDerWaalsContact CG-CD 3.48Å; W978-P989 HydrophobicContact CG-CG 3.53Å
979	K	85.3	Confident	84.5	Confident	135 Å²	135	100 Å²	100	59%	0.587	54%	0.538	S	S	*	.			trans	-118.8	149.9	173.7	-50.1	170.4	-160.2	147.2	0	110.6	G981 D982	K979-G981 PolarHBondContact O-N 2.94Å; K979-D982 PolarHBondContact N-OD2 3.42Å; K979-D982 PolarHBondContact O-N 3.49Å
980	P	78.6	Confident	84.3	Confident	119 Å²	119	97.3 Å²	97.3	77%	0.773	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	109.3	165.5	-20.8	32.9	0	0	0	110.4	W978	W978-P980 HydrophobicContact CH2-CB 4.34Å; W978-P980 HydrophobicContact CH2-CG 4.26Å; W978-P980 HydrophobicContact CZ3-CG 3.97Å
981	G	75.5	Confident	84.4	Confident	69 Å²	69	89.5 Å²	89.5	71%	0.711	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	127.9	-27.8	-173.7	0	0	0	0	0	113.8	K979 S983	K979-G981 PolarHBondContact O-N 2.94Å; G981-S983 PolarHBondContact O-N 2.9Å; G981-S983 VanDerWaalsContact O-N 3.12Å
982	D	75.4	Confident	84.4	Confident	92 Å²	92	87.7 Å²	87.7	49%	0.492	49%	0.488	S	S	.	.	S	Bend	trans	-68.1	-12.2	-178.1	-63.5	-11.5	0	0	0	113.2	K979	K979-D982 PolarHBondContact N-OD2 3.42Å; K979-D982 PolarHBondContact O-N 3.49Å
983	S	70.1	Confident	84.6	Confident	43 Å²	43	88.2 Å²	88.2	30%	0.301	48%	0.483	S	S	.	.	S	Bend	trans	-154.8	153	-180	59.6	0	0	0	0	111.4	W978 G981 D985	W978-S983 PolarHBondContact NE1-OG 2.94Å; G981-S983 PolarHBondContact O-N 2.9Å; G981-S983 VanDerWaalsContact O-N 3.12Å; S983-D985 PolarHBondContact O-N 2.9Å
984	M	68.9	Low	84.7	Confident	201 Å²	201	87.4 Å²	87.4	99%	0.99	48%	0.479	S	S	*	.	S	Bend	trans	-67.3	-14.3	171.2	-67.6	-177.4	70.3	0	0	113.7	A986	M984-A986 PolarHBondContact O-N 3.13Å
985	D	69	Low	84.9	Confident	119 Å²	119	85.2 Å²	85.2	64%	0.636	47%	0.465	S	S	*	.			trans	-63.9	121	178	-76	-49	0	0	0	112.3	S983 Q987	S983-D985 PolarHBondContact O-N 2.9Å; D985-Q987 PolarHBondContact O-N 3.47Å
986	A	72.6	Confident	85.2	Confident	107 Å²	107	85.8 Å²	85.8	88%	0.884	47%	0.465	S	S	*	.	S	Bend	trans	-73.3	-0.8	175.8	0	0	0	0	0	113.9	M984	M984-A986 PolarHBondContact O-N 3.13Å
987	Q	78.2	Confident	85.5	Confident	164 Å²	164	82.8 Å²	82.8	77%	0.766	45%	0.445	S	S	*	.	S	Bend	trans	-116.5	133.9	178.2	-64.2	-172.4	22.8	0	0	110.1	D985	D985-Q987 PolarHBondContact O-N 3.47Å
988	H	83.4	Confident	85.9	Confident	81 Å²	81	77.7 Å²	77.7	38%	0.375	43%	0.425	S	S	.	.			trans	-58.8	123.7	175.3	-167.4	-43	0	0	0	110.2	D975 W978	D975-H988 PolarHBondContact N-CE1 2.87Å; D975-H988 PolarHBondContact O-CE1 2.84Å; W978-H988 HydrophobicContact CE3-CB 4.32Å; W978-H988 AromaticContact CE3-CD2 3.51Å; W978-H988 AromaticContact CE3-CE1 3.83Å; W978-H988 AromaticContact CE3-CG 3.74Å; W978-H988 AromaticContact CE3-ND1 3.97Å; W978-H988 AromaticContact CE3-NE2 3.62Å; W978-H988 HydrophobicContact CZ3-CB 4.1Å; W978-H988 AromaticContact CZ3-CD2 3.73Å; W978-H988 AromaticContact CZ3-CG 3.94Å
989	P	89.6	Confident	86.4	Confident	49 Å²	49	75.2 Å²	75.2	32%	0.318	42%	0.416	S	S	.	.			trans	-64.7	147.3	-179.6	25.8	-34.2	0	0	0	111.6	P974 D975 W978	P974-P989 WeakPolarHBondContact CA-O 3.29Å; D975-P989 HydrophobicContact CB-CG 4.31Å; D975-P989 PolarHBondContact N-O 3.34Å; W978-P989 HydrophobicContact CB-CG 3.86Å; W978-P989 VanDerWaalsContact CD1-CG 3.46Å; W978-P989 VanDerWaalsContact CD2-CD 3.46Å; W978-P989 HydrophobicContact CD2-CG 4.1Å; W978-P989 VanDerWaalsContact CG-CD 3.48Å; W978-P989 HydrophobicContact CG-CG 3.53Å
990	V	93	Very high	87.1	Confident	65 Å²	65	69 Å²	69	39%	0.394	39%	0.389	S	S	.	.	B	Isolated β-bridge	trans	-107	133.3	-178.7	163.8	0	0	0	0	110	P972 I973	P972-V990 HydrophobicContact CB-CB 4.4Å; P972-V990 HydrophobicContact CB-CG1 3.48Å; P972-V990 VanDerWaalsContact CB-CG1 3.48Å; P972-V990 HydrophobicContact CB-CG2 3.96Å; P972-V990 HydrophobicContact CG-CG2 4.47Å; I973-V990 WeakPolarHBondContact O-CA 3.29Å
991	L	95	Very high	87.9	Confident	7 Å²	7	63.5 Å²	63.5	4%	0.037	35%	0.353	C	S	.	.			trans	-65.2	132.7	173.1	-62.9	-175	0	0	0	111.1	L947 L951 Y959 I963 I973 D975	L947-L991 HydrophobicContact CD1-CD2 4.42Å; L947-L991 HydrophobicContact CD2-CD1 4.33Å; L947-L991 HydrophobicContact CD2-CD2 3.63Å; L951-L991 HydrophobicContact CD1-CD1 4.05Å; L951-L991 HydrophobicContact CD2-CD1 4.13Å; L951-L991 HydrophobicContact CG-CD1 4.33Å; Y959-L991 HydrophobicContact CE2-CD1 4.35Å; I963-L991 HydrophobicContact CD1-CB 3.68Å; I963-L991 HydrophobicContact CD1-CD1 4.47Å; I973-L991 HydrophobicContact CB-CB 4.5Å; I973-L991 HydrophobicContact CB-CD1 4.41Å; I973-L991 HydrophobicContact CG2-CD1 4.07Å; I973-L991 PolarHBondContact O-N 3.06Å; D975-L991 HydrophobicContact CB-CD2 3.84Å; D975-L991 HydrophobicContact CB-CG 4.44Å
992	K	94.6	Very high	88.9	Confident	158 Å²	158	60.5 Å²	60.5	69%	0.687	32%	0.321	S	S	*	.			trans	-113.7	167.1	177.7	-64.9	175.5	-175.6	170.6	0	110.5	Y959 E994	Y959-K992 VanDerWaalsContact CE1-O 3.29Å; Y959-K992 WeakPolarHBondContact CE1-O 3.3Å; Y959-K992 PolarHBondContact OH-O 2.96Å; K992-E994 PolarHBondContact O-N 2.93Å
993	K	96.2	Very high	89.9	Confident	79 Å²	79	56.3 Å²	56.3	34%	0.343	30%	0.298	S	S	.	.	P	Polyproline II helix	trans	-53.4	127.1	167.1	178.7	-174.7	172.4	-176.9	0	108.9	E896 D897 N960	E896-K993 WeakPolarHBondContact O-CE 3.24Å; E896-K993 IonicContact OE1-NZ 3.73Å; E896-K993 PolarHBondContact OE1-NZ 3.41Å; D897-K993 IonicContact OD1-NZ 2.67Å; D897-K993 PolarHBondContact OD1-NZ 3.03Å; N960-K993 HydrophobicContact CB-CG 4.44Å; N960-K993 WeakPolarHBondContact OD1-CA 3.3Å
994	E	97.3	Very high	91.1	Very high	26 Å²	26	54.2 Å²	54.2	12%	0.121	28%	0.284	C	S	.	.	P	Polyproline II helix	trans	-100.9	122.2	-179.7	-80	-76.5	-177.3	0	0	109	R943 R944 L956 Y959 N960 K992	R943-E994 IonicContact CZ-OE1 3.17Å; R943-E994 VanDerWaalsContact CZ-OE1 3.27Å; R943-E994 IonicContact NH1-OE1 2.87Å; R943-E994 PolarHBondContact NH1-OE1 3.43Å; R943-E994 IonicContact NH2-OE1 2.69Å; R943-E994 PolarHBondContact NH2-OE1 2.87Å; R944-E994 IonicContact CZ-OE2 3.72Å; R944-E994 IonicContact NE-OE2 3.83Å; R944-E994 IonicContact NH2-OE2 3.93Å; R944-E994 PolarHBondContact NH2-OE2 3.14Å; L956-E994 HydrophobicContact CD1-CB 3.57Å; Y959-E994 HydrophobicContact CD1-CB 4.1Å; Y959-E994 HydrophobicContact CD1-CG 4.29Å; Y959-E994 HydrophobicContact CE1-CB 3.68Å; Y959-E994 HydrophobicContact CE1-CG 3.46Å; Y959-E994 VanDerWaalsContact CE1-CG 3.46Å; N960-E994 PolarHBondContact ND2-O 3.5Å; N960-E994 PolarHBondContact OD1-N 3.36Å; N960-E994 PolarHBondContact OD1-O 3.05Å; K992-E994 PolarHBondContact O-N 2.93Å
995	P	97.9	Very high	92.4	Very high	22 Å²	22	44.7 Å²	44.7	14%	0.143	24%	0.237	C	C	.	.	P	Polyproline II helix	trans	-73.6	154.9	-176.9	29.4	-35	0	0	0	111.4	R899 R944	R899-P995 HydrophobicContact CB-CB 4.41Å; R899-P995 HydrophobicContact CB-CG 4.28Å; R899-P995 HydrophobicContact CG-CB 3.84Å; R899-P995 HydrophobicContact CG-CG 3.55Å; R944-P995 VanDerWaalsContact CZ-O 3.23Å; R944-P995 PolarHBondContact NH1-O 3.06Å; R944-P995 PolarHBondContact NH2-O 3.33Å
996	Y	98.6	Very high	93.6	Very high	41 Å²	41	40.2 Å²	40.2	16%	0.161	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	138.3	164.3	-74	-88	0	0	0	109.7	P844 L845 D897 V898 R899 L956 G1030 H1032	P844-Y996 HydrophobicContact CG-CD2 3.97Å; P844-Y996 HydrophobicContact CG-CE2 4.12Å; L845-Y996 HydrophobicContact CD1-CD1 3.59Å; L845-Y996 HydrophobicContact CD1-CE1 4.27Å; L845-Y996 HydrophobicContact CD1-CG 3.85Å; L845-Y996 HydrophobicContact CG-CD1 4.37Å; L845-Y996 HydrophobicContact CG-CG 4.18Å; D897-Y996 PolarHBondContact O-N 3.46Å; V898-Y996 CarbonylContact C-O 3.49Å; V898-Y996 WeakPolarHBondContact CA-O 3.27Å; R899-Y996 PolarHBondContact N-O 3.11Å; L956-Y996 HydrophobicContact CD2-CD1 3.82Å; L956-Y996 HydrophobicContact CD2-CD2 4.1Å; L956-Y996 HydrophobicContact CD2-CE1 3.97Å; L956-Y996 HydrophobicContact CD2-CE2 4.24Å; L956-Y996 HydrophobicContact CD2-CG 3.88Å; Y996-G1030 CarbonylContact C-O 3.59Å; Y996-G1030 WeakPolarHBondContact CA-O 3.48Å; Y996-G1030 WeakPolarHBondContact CD1-O 3.02Å; Y996-H1032 AromaticContact CD1-CD2 3.93Å; Y996-H1032 AromaticContact CD1-NE2 3.62Å; Y996-H1032 AromaticContact CE1-NE2 3.94Å
997	I	98.7	Very high	94.6	Very high	3 Å²	3	35.2 Å²	35.2	2%	0.015	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	124.5	177.1	-55.8	177.9	0	0	0	108.3	R899 I901 L920 W936 E940 V999 G1030 I1031 H1032	R899-I997 WeakPolarHBondContact O-CA 3.26Å; I901-I997 HydrophobicContact CD1-CG2 4.45Å; L920-I997 HydrophobicContact CD1-CD1 4.18Å; L920-I997 HydrophobicContact CD1-CG1 4.22Å; L920-I997 HydrophobicContact CD1-CG2 3.96Å; W936-I997 HydrophobicContact CH2-CD1 3.97Å; W936-I997 HydrophobicContact CZ3-CD1 3.99Å; E940-I997 HydrophobicContact CG-CD1 3.95Å; I997-V999 HydrophobicContact CG2-CG2 4.42Å; I997-G1030 PolarHBondContact N-O 3.29Å; I997-I1031 HydrophobicContact CB-CB 4.5Å; I997-I1031 HydrophobicContact CB-CG1 4.14Å; I997-I1031 HydrophobicContact CB-CG2 4.27Å; I997-I1031 HydrophobicContact CD1-CD1 4.23Å; I997-I1031 HydrophobicContact CD1-CG1 4.3Å; I997-I1031 HydrophobicContact CG1-CG1 4.48Å; I997-I1031 HydrophobicContact CG2-CG2 4.44Å; I997-I1031 CarbonylContact O-C 3.56Å; I997-I1031 VanDerWaalsContact O-CA 3.31Å; I997-I1031 WeakPolarHBondContact O-CA 3.44Å; I997-H1032 PolarHBondContact O-N 2.93Å
998	V	98.7	Very high	95.3	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	119.5	174.8	-175.3	0	0	0	0	109.2	L845 L862 M889 V898 R899 F900 I901 L1000 H1032 V1034	L845-V998 HydrophobicContact CD2-CG2 3.45Å; L845-V998 VanDerWaalsContact CD2-CG2 3.45Å; L862-V998 HydrophobicContact CD2-CG1 3.81Å; L862-V998 HydrophobicContact CD2-CG2 4.14Å; M889-V998 HydrophobicContact CE-CG1 4.46Å; M889-V998 HydrophobicContact SD-CG2 4.08Å; V898-V998 HydrophobicContact CG1-CG2 4.14Å; R899-V998 PolarHBondContact O-N 3.13Å; F900-V998 WeakPolarHBondContact CA-O 3.48Å; F900-V998 HydrophobicContact CD1-CB 3.9Å; F900-V998 HydrophobicContact CE1-CB 4.04Å; F900-V998 HydrophobicContact CE1-CG2 4.39Å; I901-V998 PolarHBondContact N-O 3.36Å; V998-L1000 HydrophobicContact CG1-CD1 4.21Å; V998-L1000 HydrophobicContact CG1-CG 4.13Å; V998-H1032 CarbonylContact C-O 3.23Å; V998-H1032 WeakPolarHBondContact CA-O 3.39Å; V998-H1032 HydrophobicContact CG2-CB 4.39Å; V998-V1034 HydrophobicContact CG1-CG2 4Å
999	V	98.6	Very high	95.6	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	112.3	178	-174.9	0	0	0	0	107.8	I901 I903 L934 C937 I997 V1001 I1031 H1032 L1033 V1034	I901-V999 HydrophobicContact CG2-CG1 4.49Å; I901-V999 WeakPolarHBondContact O-CA 3.33Å; I903-V999 HydrophobicContact CD1-CG1 4.5Å; L934-V999 HydrophobicContact CD2-CG1 4.21Å; C937-V999 VanDerWaalsContact SG-CG2 3.51Å; I997-V999 HydrophobicContact CG2-CG2 4.42Å; V999-V1001 HydrophobicContact CG1-CG2 4.39Å; V999-I1031 HydrophobicContact CG2-CG2 4.45Å; V999-H1032 PolarHBondContact N-O 3.45Å; V999-L1033 HydrophobicContact CB-CD2 4.18Å; V999-L1033 HydrophobicContact CG1-CD2 4.31Å; V999-V1034 PolarHBondContact O-N 3.39Å
1000	L	98.4	Very high	95.6	Very high	3 Å²	3	33 Å²	33	2%	0.016	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	127.3	-178.5	-71.8	135.7	0	0	0	109.4	V882 I886 F900 I901 M902 I903 L910 V998 V1034	V882-L1000 HydrophobicContact CG1-CD2 4.29Å; I886-L1000 HydrophobicContact CD1-CD1 4.34Å; I886-L1000 HydrophobicContact CD1-CD2 4.16Å; I886-L1000 HydrophobicContact CG1-CD1 4.12Å; I886-L1000 HydrophobicContact CG1-CD2 3.95Å; F900-L1000 HydrophobicContact CD1-CD1 3.7Å; F900-L1000 HydrophobicContact CE1-CD1 4.25Å; F900-L1000 HydrophobicContact CG-CD1 4.34Å; I901-L1000 PolarHBondContact O-N 2.88Å; M902-L1000 CarbonylContact C-O 3.52Å; M902-L1000 HydrophobicContact CE-CD1 4.14Å; M902-L1000 HydrophobicContact CG-CB 4.37Å; M902-L1000 HydrophobicContact CG-CD1 4.18Å; I903-L1000 PolarHBondContact N-O 3.28Å; L910-L1000 HydrophobicContact CD1-CB 4.24Å; V998-L1000 HydrophobicContact CG1-CD1 4.21Å; V998-L1000 HydrophobicContact CG1-CG 4.13Å; L1000-V1034 HydrophobicContact CD2-CB 3.91Å; L1000-V1034 HydrophobicContact CD2-CG1 3.98Å; L1000-V1034 HydrophobicContact CD2-CG2 4.34Å; L1000-V1034 HydrophobicContact CG-CB 4.37Å
1001	V	97.4	Very high	95.4	Very high	5 Å²	5	31.9 Å²	31.9	3%	0.03	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	114.2	177.1	-170	0	0	0	0	108.4	I903 V999 F1004 L1007 V1034 L1035 A1036	I903-V1001 HydrophobicContact CB-CB 4.46Å; I903-V1001 HydrophobicContact CB-CG1 4.2Å; I903-V1001 HydrophobicContact CB-CG2 4.17Å; I903-V1001 HydrophobicContact CD1-CG2 4.03Å; I903-V1001 HydrophobicContact CG1-CG2 4.3Å; I903-V1001 HydrophobicContact CG2-CG1 4.36Å; V999-V1001 HydrophobicContact CG1-CG2 4.39Å; V1001-F1004 HydrophobicContact CB-CB 4.23Å; V1001-F1004 HydrophobicContact CG1-CB 3.66Å; V1001-L1007 HydrophobicContact CG1-CD1 3.77Å; V1001-V1034 PolarHBondContact N-O 3.43Å; V1001-L1035 HydrophobicContact CB-CD2 3.93Å; V1001-L1035 HydrophobicContact CG2-CD2 3.64Å; V1001-A1036 PolarHBondContact O-N 2.9Å
1002	D	95.1	Very high	95.1	Very high	5 Å²	5	32.5 Å²	32.5	3%	0.027	17%	0.167	C	C	.	.	S	Bend	trans	-76.3	-34.1	-171.7	-172.4	66.6	0	0	0	113.9	K878 I903 E909 L910 A1036	K878-D1002 PolarHBondContact NZ-O 3.32Å; K878-D1002 IonicContact NZ-OD1 2.96Å; K878-D1002 PolarHBondContact NZ-OD1 3.47Å; K878-D1002 IonicContact NZ-OD2 2.83Å; K878-D1002 PolarHBondContact NZ-OD2 2.85Å; I903-D1002 PolarHBondContact O-N 3.4Å; I903-D1002 VanDerWaalsContact O-N 3.15Å; E909-D1002 HydrophobicContact CB-CB 4.5Å; L910-D1002 HydrophobicContact CD1-CB 4.16Å; L910-D1002 HydrophobicContact CG-CB 4.21Å; D1002-A1036 CarbonylContact C-O 3.36Å; D1002-A1036 CarbonylContact O-C 3.5Å; D1002-A1036 WeakPolarHBondContact O-CB 3.41Å
1003	E	95.8	Very high	94.9	Very high	4 Å²	4	32.3 Å²	32.3	2%	0.019	17%	0.166	C	C	.	.			trans	-136.6	83	171.3	-171.7	90.3	-117.6	0	0	110.6	K906 A1005 D1006 A1036 T1037 Q1038	K906-E1003 VanDerWaalsContact NZ-CB 3.3Å; K906-E1003 IonicContact NZ-OE2 3.43Å; K906-E1003 PolarHBondContact NZ-OE2 2.85Å; K906-E1003 VanDerWaalsContact NZ-OE2 3.11Å; E1003-A1005 HydrophobicContact CG-CB 3.95Å; E1003-A1005 PolarHBondContact O-N 2.88Å; E1003-A1005 VanDerWaalsContact O-N 3.17Å; E1003-A1005 WeakPolarHBondContact OE1-CB 3.48Å; E1003-D1006 HydrophobicContact CG-CB 4.49Å; E1003-D1006 WeakPolarHBondContact CG-OD2 3.24Å; E1003-D1006 PolarHBondContact O-N 3.41Å; E1003-A1036 VanDerWaalsContact CA-O 3.3Å; E1003-A1036 WeakPolarHBondContact CA-O 3.29Å; E1003-T1037 VanDerWaalsContact OE1-CA 3.25Å; E1003-T1037 WeakPolarHBondContact OE1-CA 3.28Å; E1003-T1037 PolarHBondContact OE1-OG1 3.21Å; E1003-Q1038 PolarHBondContact OE1-N 3.43Å
1004	F	95.7	Very high	94.8	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-68.9	-12	176.4	89.9	-87	0	0	0	113	L869 V1001 D1006 L1007 M1008 L1035 A1036 T1037 V1044 I1045	L869-F1004 HydrophobicContact CD1-CD1 4.48Å; L869-F1004 HydrophobicContact CD1-CE1 3.54Å; L869-F1004 HydrophobicContact CD1-CZ 3.87Å; V1001-F1004 HydrophobicContact CB-CB 4.23Å; V1001-F1004 HydrophobicContact CG1-CB 3.66Å; F1004-D1006 VanDerWaalsContact C-N 3.3Å; F1004-D1006 PolarHBondContact O-N 3.04Å; F1004-L1007 PolarHBondContact O-N 2.92Å; F1004-M1008 HydrophobicContact CD2-CG 3.73Å; F1004-M1008 HydrophobicContact CE2-CG 3.9Å; F1004-M1008 WeakPolarHBondContact O-CG 3.44Å; F1004-M1008 PolarHBondContact O-N 3.37Å; F1004-L1035 HydrophobicContact CB-CD2 4.38Å; F1004-L1035 HydrophobicContact CD1-CB 3.79Å; F1004-L1035 HydrophobicContact CE1-CB 4.21Å; F1004-L1035 HydrophobicContact CG-CB 4.23Å; F1004-A1036 WeakPolarHBondContact CD1-O 3.38Å; F1004-A1036 PolarHBondContact N-O 3.08Å; F1004-T1037 HydrophobicContact CD1-CG2 4.3Å; F1004-T1037 HydrophobicContact CE1-CG2 3.68Å; F1004-V1044 HydrophobicContact CD2-CG1 4.38Å; F1004-V1044 HydrophobicContact CE1-CG1 3.98Å; F1004-V1044 HydrophobicContact CE2-CG1 3.74Å; F1004-V1044 VanDerWaalsContact CE2-O 3.27Å; F1004-V1044 WeakPolarHBondContact CE2-O 3.42Å; F1004-V1044 HydrophobicContact CZ-CG1 3.5Å; F1004-I1045 HydrophobicContact CZ-CG1 4.14Å
1005	A	95.9	Very high	94.7	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-59.3	-39.6	172.7	0	0	0	0	0	112.5	E1003 L1007 M1008 M1009 R1039 V1044	E1003-A1005 HydrophobicContact CG-CB 3.95Å; E1003-A1005 PolarHBondContact O-N 2.88Å; E1003-A1005 VanDerWaalsContact O-N 3.17Å; E1003-A1005 WeakPolarHBondContact OE1-CB 3.48Å; A1005-L1007 VanDerWaalsContact C-N 3.34Å; A1005-M1008 PolarHBondContact O-N 3.22Å; A1005-M1009 VanDerWaalsContact O-CG 3.27Å; A1005-M1009 WeakPolarHBondContact O-CG 3.45Å; A1005-M1009 PolarHBondContact O-N 3.47Å; A1005-R1039 HydrophobicContact CB-CB 4.06Å; A1005-R1039 HydrophobicContact CB-CG 4.49Å; A1005-V1044 HydrophobicContact CB-CB 4.38Å; A1005-V1044 HydrophobicContact CB-CG1 3.74Å; A1005-V1044 HydrophobicContact CB-CG2 3.67Å
1006	D	94.3	Very high	94.5	Very high	26 Å²	26	31.8 Å²	31.8	14%	0.139	16%	0.162	C	C	.	.	H	α-helix	trans	-68.9	-36.6	-179.5	-64.3	-33.5	0	0	0	110.3	P905 K906 M927 E1003 F1004 M1009 T1010 R1039	P905-D1006 HydrophobicContact CG-CB 4.24Å; K906-D1006 WeakPolarHBondContact CE-OD2 3.46Å; K906-D1006 IonicContact NZ-OD2 2.85Å; K906-D1006 PolarHBondContact NZ-OD2 3.33Å; M927-D1006 HydrophobicContact CE-CB 3.55Å; M927-D1006 VanDerWaalsContact CE-O 3.27Å; M927-D1006 WeakPolarHBondContact CE-O 3.28Å; E1003-D1006 HydrophobicContact CG-CB 4.49Å; E1003-D1006 WeakPolarHBondContact CG-OD2 3.24Å; E1003-D1006 PolarHBondContact O-N 3.41Å; F1004-D1006 VanDerWaalsContact C-N 3.3Å; F1004-D1006 PolarHBondContact O-N 3.04Å; D1006-M1009 PolarHBondContact O-N 3.17Å; D1006-T1010 PolarHBondContact O-N 2.78Å; D1006-T1010 PolarHBondContact O-OG1 3.03Å; D1006-R1039 IonicContact OD1-CZ 2.68Å; D1006-R1039 IonicContact OD1-NH1 3.8Å; D1006-R1039 PolarHBondContact OD1-NH1 2.87Å; D1006-R1039 IonicContact OD1-NH2 3.35Å
1007	L	93.3	Very high	94.4	Very high	1 Å²	1	36.3 Å²	36.3	1%	0.005	18%	0.184	C	C	.	.	H	α-helix	trans	-63	-42.1	172	-62.2	175.6	0	0	0	112.4	I903 M927 A930 V1001 F1004 A1005 M1009 V1011 G1012 V1015	I903-L1007 HydrophobicContact CG2-CD1 4.37Å; M927-L1007 HydrophobicContact CB-CD2 4.34Å; M927-L1007 HydrophobicContact CE-CD2 3.79Å; M927-L1007 HydrophobicContact CE-CG 4.29Å; M927-L1007 HydrophobicContact SD-CD2 3.81Å; A930-L1007 HydrophobicContact CB-CD1 4.28Å; A930-L1007 HydrophobicContact CB-CD2 3.47Å; A930-L1007 VanDerWaalsContact CB-CD2 3.47Å; V1001-L1007 HydrophobicContact CG1-CD1 3.77Å; F1004-L1007 PolarHBondContact O-N 2.92Å; A1005-L1007 VanDerWaalsContact C-N 3.34Å; L1007-M1009 VanDerWaalsContact C-N 3.26Å; L1007-M1009 PolarHBondContact O-N 2.87Å; L1007-V1011 PolarHBondContact O-N 3.48Å; L1007-G1012 PolarHBondContact O-N 3.4Å; L1007-V1015 HydrophobicContact CB-CG1 4.09Å; L1007-V1015 HydrophobicContact CB-CG2 4.42Å
1008	M	93.4	Very high	94.3	Very high	21 Å²	21	37.1 Å²	37.1	10%	0.103	19%	0.189	C	C	.	.	H	α-helix	trans	-65.6	-28.2	176	-70.9	-67.3	-68.3	0	0	112.5	F1004 A1005 G1012 V1015 E1016 T1046	F1004-M1008 HydrophobicContact CD2-CG 3.73Å; F1004-M1008 HydrophobicContact CE2-CG 3.9Å; F1004-M1008 WeakPolarHBondContact O-CG 3.44Å; F1004-M1008 PolarHBondContact O-N 3.37Å; A1005-M1008 PolarHBondContact O-N 3.22Å; M1008-G1012 VanDerWaalsContact O-CA 3.26Å; M1008-G1012 WeakPolarHBondContact O-CA 3.33Å; M1008-G1012 PolarHBondContact O-N 3.14Å; M1008-V1015 HydrophobicContact SD-CG1 4.39Å; M1008-E1016 HydrophobicContact CE-CB 4.09Å; M1008-E1016 HydrophobicContact CE-CG 4.31Å; M1008-E1016 HydrophobicContact SD-CB 4.11Å; M1008-T1046 HydrophobicContact CE-CG2 3.71Å
1009	M	90.8	Very high	94.2	Very high	129 Å²	129	37.2 Å²	37.2	64%	0.635	19%	0.189	S	C	*	.	H	α-helix	trans	-85.6	-33.9	178.2	-69.6	176.2	70.6	0	0	113.1	A1005 D1006 L1007 R1039	A1005-M1009 VanDerWaalsContact O-CG 3.27Å; A1005-M1009 WeakPolarHBondContact O-CG 3.45Å; A1005-M1009 PolarHBondContact O-N 3.47Å; D1006-M1009 PolarHBondContact O-N 3.17Å; L1007-M1009 VanDerWaalsContact C-N 3.26Å; L1007-M1009 PolarHBondContact O-N 2.87Å; M1009-R1039 PolarHBondContact SD-NH1 3.02Å
1010	T	90.1	Very high	94.1	Very high	98 Å²	98	37.8 Å²	37.8	60%	0.601	19%	0.194	S	C	*	.	H	α-helix	trans	-89.9	-42.1	-179.1	-58.8	0	0	0	0	113.6	M927 D1006	M927-T1010 HydrophobicContact CB-CG2 3.93Å; M927-T1010 HydrophobicContact CG-CG2 4.04Å; D1006-T1010 PolarHBondContact O-N 2.78Å; D1006-T1010 PolarHBondContact O-OG1 3.03Å
1011	V	88.6	Confident	94	Very high	42 Å²	42	42 Å²	42	26%	0.255	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-109.6	-25	-174.2	-169.2	0	0	0	0	112.1	M927 A931 L1007 K1013 K1014 V1015	M927-V1011 HydrophobicContact CB-CG2 4.01Å; M927-V1011 WeakPolarHBondContact O-CG2 3.44Å; A931-V1011 HydrophobicContact CB-CG1 4.21Å; L1007-V1011 PolarHBondContact O-N 3.48Å; V1011-K1013 PolarHBondContact O-N 3.23Å; V1011-K1014 HydrophobicContact CG1-CB 4.21Å; V1011-V1015 HydrophobicContact CB-CG2 3.79Å; V1011-V1015 HydrophobicContact CG1-CG2 3.8Å; V1011-V1015 HydrophobicContact CG2-CG2 4.49Å
1012	G	88.1	Confident	94	Very high	20 Å²	20	41.8 Å²	41.8	21%	0.206	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.3	-129.3	171.9	0	0	0	0	0	113.9	L1007 M1008 K1014 V1015 E1016	L1007-G1012 PolarHBondContact O-N 3.4Å; M1008-G1012 VanDerWaalsContact O-CA 3.26Å; M1008-G1012 WeakPolarHBondContact O-CA 3.33Å; M1008-G1012 PolarHBondContact O-N 3.14Å; G1012-K1014 VanDerWaalsContact C-N 3.29Å; G1012-K1014 PolarHBondContact O-N 2.9Å; G1012-K1014 VanDerWaalsContact O-N 3.14Å; G1012-V1015 PolarHBondContact O-N 2.76Å; G1012-E1016 PolarHBondContact O-N 2.91Å
1013	K	91.1	Very high	94.1	Very high	154 Å²	154	42 Å²	42	67%	0.67	21%	0.21	S	C	*	.	H	α-helix	trans	-57.7	-33.2	-165.3	-64.3	-174.3	178.2	-180	0	114.8	V1011 V1015 E1016 E1017	V1011-K1013 PolarHBondContact O-N 3.23Å; K1013-V1015 PolarHBondContact O-N 2.9Å; K1013-E1016 PolarHBondContact O-N 3.4Å; K1013-E1017 WeakPolarHBondContact O-CB 3.38Å; K1013-E1017 WeakPolarHBondContact O-CG 3.39Å; K1013-E1017 PolarHBondContact O-N 3.19Å
1014	K	92.9	Very high	94	Very high	86 Å²	86	47.5 Å²	47.5	37%	0.374	24%	0.236	S	C	.	.	H	α-helix	trans	-58.9	-38.5	176.5	-174	-176.6	178.7	-173.1	0	111	V1011 G1012 L1018 D1130	V1011-K1014 HydrophobicContact CG1-CB 4.21Å; G1012-K1014 VanDerWaalsContact C-N 3.29Å; G1012-K1014 PolarHBondContact O-N 2.9Å; G1012-K1014 VanDerWaalsContact O-N 3.14Å; K1014-L1018 HydrophobicContact CG-CD1 4.31Å; K1014-L1018 WeakPolarHBondContact O-CB 3.41Å; K1014-L1018 WeakPolarHBondContact O-CD1 3.3Å; K1014-L1018 WeakPolarHBondContact O-CG 3.31Å; K1014-L1018 PolarHBondContact O-N 3.11Å; K1014-L1018 VanDerWaalsContact O-N 3.16Å; K1014-D1130 IonicContact NZ-OD2 3.17Å
1015	V	94.9	Very high	94	Very high	0 Å²	0	52 Å²	52	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-73.9	-41.4	176.2	167.9	0	0	0	0	111.5	A931 L934 L1007 M1008 V1011 G1012 K1013 E1017 L1018 I1019	A931-V1015 HydrophobicContact CB-CG2 4.09Å; L934-V1015 HydrophobicContact CD1-CG1 4.06Å; L934-V1015 HydrophobicContact CD1-CG2 4.46Å; L1007-V1015 HydrophobicContact CB-CG1 4.09Å; L1007-V1015 HydrophobicContact CB-CG2 4.42Å; M1008-V1015 HydrophobicContact SD-CG1 4.39Å; V1011-V1015 HydrophobicContact CB-CG2 3.79Å; V1011-V1015 HydrophobicContact CG1-CG2 3.8Å; V1011-V1015 HydrophobicContact CG2-CG2 4.49Å; G1012-V1015 PolarHBondContact O-N 2.76Å; K1013-V1015 PolarHBondContact O-N 2.9Å; V1015-E1017 VanDerWaalsContact C-N 3.35Å; V1015-E1017 PolarHBondContact O-N 2.99Å; V1015-L1018 PolarHBondContact O-N 2.69Å; V1015-I1019 HydrophobicContact CG1-CD1 3.53Å; V1015-I1019 HydrophobicContact CG1-CG1 4.23Å; V1015-I1019 WeakPolarHBondContact O-CB 3.31Å; V1015-I1019 VanDerWaalsContact O-CG1 3.28Å; V1015-I1019 WeakPolarHBondContact O-CG1 3.45Å; V1015-I1019 PolarHBondContact O-N 3.42Å
1016	E	95.3	Very high	94.1	Very high	30 Å²	30	52.1 Å²	52.1	14%	0.14	26%	0.256	C	S	.	.	H	α-helix	trans	-58.3	-45.4	175.5	-170.9	179.3	-163.1	0	0	112	M1008 G1012 K1013 A1020 T1046 L1048 I1049	M1008-E1016 HydrophobicContact CE-CB 4.09Å; M1008-E1016 HydrophobicContact CE-CG 4.31Å; M1008-E1016 HydrophobicContact SD-CB 4.11Å; G1012-E1016 PolarHBondContact O-N 2.91Å; K1013-E1016 PolarHBondContact O-N 3.4Å; E1016-A1020 VanDerWaalsContact O-CB 3.29Å; E1016-A1020 WeakPolarHBondContact O-CB 3.49Å; E1016-A1020 PolarHBondContact O-N 3.16Å; E1016-T1046 VanDerWaalsContact OE1-CB 3.24Å; E1016-T1046 WeakPolarHBondContact OE1-CB 3.21Å; E1016-T1046 VanDerWaalsContact OE1-CG2 3.31Å; E1016-T1046 WeakPolarHBondContact OE1-CG2 3.5Å; E1016-T1046 PolarHBondContact OE1-OG1 2.93Å; E1016-L1048 HydrophobicContact CG-CB 4.48Å; E1016-L1048 HydrophobicContact CG-CD1 4.47Å; E1016-I1049 HydrophobicContact CG-CD1 4.22Å
1017	E	95.2	Very high	94.2	Very high	135 Å²	135	57.4 Å²	57.4	63%	0.631	27%	0.274	S	S	*	.	H	α-helix	trans	-65.6	-43.2	178.3	-73	177.3	-166.6	0	0	112.4	K1013 V1015 A1020 R1021	K1013-E1017 WeakPolarHBondContact O-CB 3.38Å; K1013-E1017 WeakPolarHBondContact O-CG 3.39Å; K1013-E1017 PolarHBondContact O-N 3.19Å; V1015-E1017 VanDerWaalsContact C-N 3.35Å; V1015-E1017 PolarHBondContact O-N 2.99Å; E1017-A1020 PolarHBondContact O-N 2.95Å; E1017-R1021 VanDerWaalsContact O-CB 3.29Å; E1017-R1021 WeakPolarHBondContact O-CB 3.5Å; E1017-R1021 PolarHBondContact O-N 2.98Å
1018	L	96.8	Very high	94.4	Very high	21 Å²	21	58.4 Å²	58.4	11%	0.11	28%	0.283	C	S	.	.	H	α-helix	trans	-63.5	-46.1	175.8	-73.7	170	0	0	0	111.8	A931 L934 R935 V938 K1014 V1015 A1020 R1021 L1022	A931-L1018 WeakPolarHBondContact O-CD1 3.32Å; L934-L1018 HydrophobicContact CB-CB 4.16Å; L934-L1018 HydrophobicContact CB-CD1 4.02Å; R935-L1018 HydrophobicContact CB-CD1 4.37Å; R935-L1018 HydrophobicContact CB-CD2 4.3Å; V938-L1018 HydrophobicContact CB-CD2 4.44Å; V938-L1018 HydrophobicContact CG2-CD2 3.88Å; K1014-L1018 HydrophobicContact CG-CD1 4.31Å; K1014-L1018 WeakPolarHBondContact O-CB 3.41Å; K1014-L1018 WeakPolarHBondContact O-CD1 3.3Å; K1014-L1018 WeakPolarHBondContact O-CG 3.31Å; K1014-L1018 PolarHBondContact O-N 3.11Å; K1014-L1018 VanDerWaalsContact O-N 3.16Å; V1015-L1018 PolarHBondContact O-N 2.69Å; L1018-A1020 PolarHBondContact O-N 2.84Å; L1018-R1021 PolarHBondContact O-N 3.42Å; L1018-L1022 WeakPolarHBondContact O-CG 3.47Å; L1018-L1022 PolarHBondContact O-N 3Å
1019	I	96.7	Very high	94.6	Very high	1 Å²	1	57.4 Å²	57.4	1%	0.005	28%	0.278	C	S	.	.	H	α-helix	trans	-61.7	-43.8	176.4	-70.4	170.2	0	0	0	110.6	L934 V1015 L1022 A1023 L1033 L1035 I1049 I1053	L934-I1019 HydrophobicContact CD1-CG1 4.21Å; V1015-I1019 HydrophobicContact CG1-CD1 3.53Å; V1015-I1019 HydrophobicContact CG1-CG1 4.23Å; V1015-I1019 WeakPolarHBondContact O-CB 3.31Å; V1015-I1019 VanDerWaalsContact O-CG1 3.28Å; V1015-I1019 WeakPolarHBondContact O-CG1 3.45Å; V1015-I1019 PolarHBondContact O-N 3.42Å; I1019-L1022 PolarHBondContact O-N 3.49Å; I1019-A1023 WeakPolarHBondContact O-CB 3.47Å; I1019-A1023 PolarHBondContact O-N 3.01Å; I1019-L1033 HydrophobicContact CG2-CD1 4.21Å; I1019-L1035 HydrophobicContact CD1-CD1 4Å; I1019-L1035 HydrophobicContact CD1-CD2 4.45Å; I1019-L1035 HydrophobicContact CG1-CD1 4.47Å; I1019-L1035 HydrophobicContact CG2-CD1 3.7Å; I1019-I1049 HydrophobicContact CB-CD1 4.09Å; I1019-I1049 HydrophobicContact CD1-CD1 4.49Å; I1019-I1049 HydrophobicContact CG2-CD1 3.58Å; I1019-I1053 HydrophobicContact CG2-CD1 4.38Å
1020	A	95.9	Very high	94.9	Very high	12 Å²	12	51.2 Å²	51.2	10%	0.099	25%	0.247	C	C	.	.	H	α-helix	trans	-64.1	-43.2	176.9	0	0	0	0	0	112.1	E1016 E1017 L1018 L1022 A1023 Q1024	E1016-A1020 VanDerWaalsContact O-CB 3.29Å; E1016-A1020 WeakPolarHBondContact O-CB 3.49Å; E1016-A1020 PolarHBondContact O-N 3.16Å; E1017-A1020 PolarHBondContact O-N 2.95Å; L1018-A1020 PolarHBondContact O-N 2.84Å; A1020-L1022 PolarHBondContact O-N 2.84Å; A1020-A1023 PolarHBondContact O-N 2.98Å; A1020-Q1024 VanDerWaalsContact O-CG 3.27Å; A1020-Q1024 WeakPolarHBondContact O-CG 3.5Å; A1020-Q1024 PolarHBondContact O-N 3.02Å; A1020-Q1024 VanDerWaalsContact O-N 3.09Å
1021	R	96.7	Very high	95.3	Very high	92 Å²	92	46.6 Å²	46.6	35%	0.347	22%	0.219	S	C	.	.	H	α-helix	trans	-63.5	-39.4	178.8	-165.5	177.1	-161.5	-85.4	0.7	112	E942 E1017 L1018	E942-R1021 IonicContact OE1-CZ 3.75Å; E942-R1021 IonicContact OE1-NH1 2.69Å; E942-R1021 PolarHBondContact OE1-NH1 3.38Å; E942-R1021 IonicContact OE1-NH2 2.91Å; E942-R1021 PolarHBondContact OE1-NH2 2.79Å; E1017-R1021 VanDerWaalsContact O-CB 3.29Å; E1017-R1021 WeakPolarHBondContact O-CB 3.5Å; E1017-R1021 PolarHBondContact O-N 2.98Å; L1018-R1021 PolarHBondContact O-N 3.42Å
1022	L	97.7	Very high	95.8	Very high	1 Å²	1	44.6 Å²	44.6	1%	0.005	21%	0.207	C	C	.	.	H	α-helix	trans	-64.7	-57.1	170.2	-74.5	172	0	0	0	110.8	L934 C937 V938 M941 L1018 I1019 A1020 Q1024 K1025 A1026 L1033	L934-L1022 HydrophobicContact CD2-CD1 3.89Å; C937-L1022 HydrophobicContact CB-CD1 4.09Å; C937-L1022 HydrophobicContact CB-CD2 3.96Å; V938-L1022 HydrophobicContact CB-CD2 4.45Å; V938-L1022 HydrophobicContact CG2-CD1 4.21Å; V938-L1022 HydrophobicContact CG2-CD2 3.67Å; V938-L1022 HydrophobicContact CG2-CG 3.56Å; M941-L1022 HydrophobicContact SD-CD2 4.37Å; L1018-L1022 WeakPolarHBondContact O-CG 3.47Å; L1018-L1022 PolarHBondContact O-N 3Å; I1019-L1022 PolarHBondContact O-N 3.49Å; A1020-L1022 PolarHBondContact O-N 2.84Å; L1022-Q1024 PolarHBondContact O-N 3.46Å; L1022-K1025 PolarHBondContact O-N 3.42Å; L1022-A1026 HydrophobicContact CB-CB 4.37Å; L1022-A1026 HydrophobicContact CD2-CB 4.33Å; L1022-A1026 WeakPolarHBondContact O-CB 3.38Å; L1022-A1026 PolarHBondContact O-N 3.07Å; L1022-L1033 HydrophobicContact CB-CD1 3.78Å; L1022-L1033 HydrophobicContact CD1-CD1 4.46Å; L1022-L1033 HydrophobicContact CD1-CD2 4.13Å
1023	A	96.3	Very high	96.3	Very high	9 Å²	9	43.7 Å²	43.7	7%	0.074	20%	0.197	C	C	.	.	H	α-helix	trans	-60.1	-24.3	-171.3	0	0	0	0	0	114.2	H867 I1019 A1020 L1033 N1052 I1053	H867-A1023 VanDerWaalsContact CD2-CA 3.42Å; H867-A1023 WeakPolarHBondContact CD2-CA 3.28Å; H867-A1023 PolarHBondContact CD2-O 3.09Å; H867-A1023 PolarHBondContact NE2-O 3.01Å; I1019-A1023 WeakPolarHBondContact O-CB 3.47Å; I1019-A1023 PolarHBondContact O-N 3.01Å; A1020-A1023 PolarHBondContact O-N 2.98Å; A1023-L1033 HydrophobicContact CB-CD1 4.11Å; A1023-N1052 HydrophobicContact CB-CB 3.59Å; A1023-I1053 HydrophobicContact CB-CG1 3.97Å
1024	Q	95.3	Very high	96.6	Very high	120 Å²	120	36.7 Å²	36.7	56%	0.561	17%	0.167	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.3	-25.6	174.4	-75	173.2	6.9	0	0	115.1	A1020 L1022 N1052	A1020-Q1024 VanDerWaalsContact O-CG 3.27Å; A1020-Q1024 WeakPolarHBondContact O-CG 3.5Å; A1020-Q1024 PolarHBondContact O-N 3.02Å; A1020-Q1024 VanDerWaalsContact O-N 3.09Å; L1022-Q1024 PolarHBondContact O-N 3.46Å; Q1024-N1052 HydrophobicContact CG-CB 4.39Å; Q1024-N1052 WeakPolarHBondContact CG-OD1 3.35Å; Q1024-N1052 PolarHBondContact NE2-OD1 2.87Å; Q1024-N1052 VanDerWaalsContact NE2-OD1 3.08Å
1025	K	95.4	Very high	96.9	Very high	95 Å²	95	32.7 Å²	32.7	41%	0.413	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-136.9	-30.7	-162.5	-69	179.9	-175.9	178.6	0	114.7	M941 Y945 L1022 R1027 A1028	M941-K1025 HydrophobicContact CE-CB 4.16Å; M941-K1025 HydrophobicContact CE-CD 4.46Å; M941-K1025 HydrophobicContact SD-CB 3.48Å; M941-K1025 WeakPolarHBondContact SD-CB 3.32Å; Y945-K1025 HydrophobicContact CE2-CB 4.17Å; Y945-K1025 PolarHBondContact OH-O 3.43Å; L1022-K1025 PolarHBondContact O-N 3.42Å; K1025-R1027 PolarHBondContact O-N 3.07Å; K1025-A1028 PolarHBondContact O-N 3.38Å
1026	A	97.5	Very high	97	Very high	1 Å²	1	32.8 Å²	32.8	1%	0.008	15%	0.151	C	C	.	.	H	α-helix	trans	-55.8	-29.6	-170.2	0	0	0	0	0	114.4	M941 L1022 A1028 A1029 G1030 I1031	M941-A1026 HydrophobicContact SD-CB 4.05Å; M941-A1026 PolarHBondContact SD-N 2.84Å; M941-A1026 VanDerWaalsContact SD-N 3.43Å; L1022-A1026 HydrophobicContact CB-CB 4.37Å; L1022-A1026 HydrophobicContact CD2-CB 4.33Å; L1022-A1026 WeakPolarHBondContact O-CB 3.38Å; L1022-A1026 PolarHBondContact O-N 3.07Å; A1026-A1028 VanDerWaalsContact C-N 3.28Å; A1026-A1028 PolarHBondContact O-N 3.42Å; A1026-A1028 VanDerWaalsContact O-N 3.13Å; A1026-A1029 CarbonylContact O-C 3.5Å; A1026-A1029 PolarHBondContact O-N 3.02Å; A1026-A1029 VanDerWaalsContact O-N 3.11Å; A1026-G1030 PolarHBondContact O-N 3.3Å; A1026-G1030 VanDerWaalsContact O-N 3.1Å; A1026-I1031 CarbonylContact C-O 3.53Å; A1026-I1031 HydrophobicContact CB-CB 4.01Å; A1026-I1031 HydrophobicContact CB-CG2 4.45Å; A1026-I1031 VanDerWaalsContact CB-O 3.27Å; A1026-I1031 WeakPolarHBondContact CB-O 3.28Å; A1026-I1031 PolarHBondContact O-N 2.81Å; A1026-I1031 VanDerWaalsContact O-N 3.12Å
1027	R	97	Very high	97.1	Very high	138 Å²	138	31.3 Å²	31.3	52%	0.521	14%	0.144	S	C	.	.	H	α-helix	trans	-45.1	-44.1	177.2	-178.7	176.7	-160.5	172.7	7	114.8	K864 P866 K1025 G1030	K864-R1027 PolarHBondContact O-NH2 2.98Å; P866-R1027 HydrophobicContact CB-CB 3.71Å; P866-R1027 HydrophobicContact CB-CG 3.57Å; P866-R1027 HydrophobicContact CG-CB 3.95Å; P866-R1027 HydrophobicContact CG-CG 4.09Å; K1025-R1027 PolarHBondContact O-N 3.07Å; R1027-G1030 PolarHBondContact O-N 2.67Å
1028	A	96.6	Very high	97.2	Very high	21 Å²	21	26.9 Å²	26.9	17%	0.174	12%	0.123	C	C	.	.	H	α-helix	trans	-77.4	-36.8	-175.5	0	0	0	0	0	111.8	Y945 N955 L956 K1025 A1026 G1030	Y945-A1028 HydrophobicContact CE1-CB 4.05Å; Y945-A1028 WeakPolarHBondContact OH-CB 3.37Å; N955-A1028 CarbonylContact C-O 3.56Å; N955-A1028 VanDerWaalsContact CA-O 3.25Å; N955-A1028 WeakPolarHBondContact CA-O 3.33Å; L956-A1028 PolarHBondContact N-O 3.2Å; K1025-A1028 PolarHBondContact O-N 3.38Å; A1026-A1028 VanDerWaalsContact C-N 3.28Å; A1026-A1028 PolarHBondContact O-N 3.42Å; A1026-A1028 VanDerWaalsContact O-N 3.13Å; A1028-G1030 PolarHBondContact O-N 3.46Å
1029	A	97.8	Very high	97.1	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-71.6	-4.7	173.6	0	0	0	0	0	113.4	M941 R944 M948 A1026 I1031	M941-A1029 HydrophobicContact CG-CB 4.12Å; R944-A1029 HydrophobicContact CB-CB 3.87Å; R944-A1029 VanDerWaalsContact CD-O 3.27Å; R944-A1029 WeakPolarHBondContact CD-O 3.4Å; R944-A1029 PolarHBondContact NH1-O 3.28Å; M948-A1029 HydrophobicContact CE-CB 4.2Å; A1026-A1029 CarbonylContact O-C 3.5Å; A1026-A1029 PolarHBondContact O-N 3.02Å; A1026-A1029 VanDerWaalsContact O-N 3.11Å; A1029-I1031 VanDerWaalsContact C-N 3.33Å; A1029-I1031 HydrophobicContact CB-CG1 4.38Å
1030	G	97.7	Very high	97	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	67.6	32.5	-178.3	0	0	0	0	0	113.3	Y996 I997 A1026 R1027 A1028 H1032	Y996-G1030 CarbonylContact C-O 3.59Å; Y996-G1030 WeakPolarHBondContact CA-O 3.48Å; Y996-G1030 WeakPolarHBondContact CD1-O 3.02Å; I997-G1030 PolarHBondContact N-O 3.29Å; A1026-G1030 PolarHBondContact O-N 3.3Å; A1026-G1030 VanDerWaalsContact O-N 3.1Å; R1027-G1030 PolarHBondContact O-N 2.67Å; A1028-G1030 PolarHBondContact O-N 3.46Å; G1030-H1032 VanDerWaalsContact C-CD2 3.42Å; G1030-H1032 PolarHBondContact O-CD2 3.01Å
1031	I	98.5	Very high	97	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	133.5	171.3	-53.5	-175.1	0	0	0	107.8	H867 C937 E940 M941 I997 V999 A1026 A1029	H867-I1031 PolarHBondContact CE1-O 3.17Å; C937-I1031 HydrophobicContact CB-CG2 4.48Å; E940-I1031 HydrophobicContact CB-CD1 4.4Å; E940-I1031 HydrophobicContact CG-CD1 4.14Å; M941-I1031 HydrophobicContact CB-CD1 4.08Å; I997-I1031 HydrophobicContact CB-CB 4.5Å; I997-I1031 HydrophobicContact CB-CG1 4.14Å; I997-I1031 HydrophobicContact CB-CG2 4.27Å; I997-I1031 HydrophobicContact CD1-CD1 4.23Å; I997-I1031 HydrophobicContact CD1-CG1 4.3Å; I997-I1031 HydrophobicContact CG1-CG1 4.48Å; I997-I1031 HydrophobicContact CG2-CG2 4.44Å; I997-I1031 CarbonylContact O-C 3.56Å; I997-I1031 VanDerWaalsContact O-CA 3.31Å; I997-I1031 WeakPolarHBondContact O-CA 3.44Å; V999-I1031 HydrophobicContact CG2-CG2 4.45Å; A1026-I1031 CarbonylContact C-O 3.53Å; A1026-I1031 HydrophobicContact CB-CB 4.01Å; A1026-I1031 HydrophobicContact CB-CG2 4.45Å; A1026-I1031 VanDerWaalsContact CB-O 3.27Å; A1026-I1031 WeakPolarHBondContact CB-O 3.28Å; A1026-I1031 PolarHBondContact O-N 2.81Å; A1026-I1031 VanDerWaalsContact O-N 3.12Å; A1029-I1031 VanDerWaalsContact C-N 3.33Å; A1029-I1031 HydrophobicContact CB-CG1 4.38Å
1032	H	98.5	Very high	97	Very high	1 Å²	1	33.1 Å²	33.1	1%	0.005	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	119.8	-166.7	-64.3	-81.7	0	0	0	112.4	L845 L862 P866 Y996 I997 V998 V999 G1030	L845-H1032 WeakPolarHBondContact CD1-CD2 3.45Å; L862-H1032 HydrophobicContact CD2-CB 3.96Å; L862-H1032 HydrophobicContact CG-CB 4.14Å; P866-H1032 PolarHBondContact O-ND1 3.45Å; Y996-H1032 AromaticContact CD1-CD2 3.93Å; Y996-H1032 AromaticContact CD1-NE2 3.62Å; Y996-H1032 AromaticContact CE1-NE2 3.94Å; I997-H1032 PolarHBondContact O-N 2.93Å; V998-H1032 CarbonylContact C-O 3.23Å; V998-H1032 WeakPolarHBondContact CA-O 3.39Å; V998-H1032 HydrophobicContact CG2-CB 4.39Å; V999-H1032 PolarHBondContact N-O 3.45Å; G1030-H1032 VanDerWaalsContact C-CD2 3.42Å; G1030-H1032 PolarHBondContact O-CD2 3.01Å
1033	L	98.5	Very high	96.8	Very high	1 Å²	1	39 Å²	39	1%	0.005	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	133.9	174.9	-69.1	157.7	0	0	0	112	H867 L868 L934 V999 I1019 L1022 A1023 L1035	H867-L1033 WeakPolarHBondContact CA-O 3.25Å; H867-L1033 HydrophobicContact CB-CB 4.28Å; H867-L1033 PolarHBondContact ND1-N 2.87Å; L868-L1033 PolarHBondContact N-O 3.44Å; L934-L1033 HydrophobicContact CD2-CD2 4.2Å; V999-L1033 HydrophobicContact CB-CD2 4.18Å; V999-L1033 HydrophobicContact CG1-CD2 4.31Å; I1019-L1033 HydrophobicContact CG2-CD1 4.21Å; L1022-L1033 HydrophobicContact CB-CD1 3.78Å; L1022-L1033 HydrophobicContact CD1-CD1 4.46Å; L1022-L1033 HydrophobicContact CD1-CD2 4.13Å; A1023-L1033 HydrophobicContact CB-CD1 4.11Å; L1033-L1035 HydrophobicContact CB-CG 4.43Å; L1033-L1035 HydrophobicContact CD2-CD2 4.19Å
1034	V	98.3	Very high	96.8	Very high	7 Å²	7	38.7 Å²	38.7	4%	0.042	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	104.2	163.4	-179.3	0	0	0	0	107.6	L862 L868 V870 V998 V999 L1000 V1001	L862-V1034 HydrophobicContact CD1-CG2 3.96Å; L862-V1034 HydrophobicContact CD2-CG2 3.69Å; L868-V1034 HydrophobicContact CD2-CG1 4.3Å; L868-V1034 WeakPolarHBondContact O-CA 3.29Å; V870-V1034 HydrophobicContact CG2-CG1 4.49Å; V998-V1034 HydrophobicContact CG1-CG2 4Å; V999-V1034 PolarHBondContact O-N 3.39Å; L1000-V1034 HydrophobicContact CD2-CB 3.91Å; L1000-V1034 HydrophobicContact CD2-CG1 3.98Å; L1000-V1034 HydrophobicContact CD2-CG2 4.34Å; L1000-V1034 HydrophobicContact CG-CB 4.37Å; V1001-V1034 PolarHBondContact N-O 3.43Å
1035	L	98	Very high	96.8	Very high	1 Å²	1	33 Å²	33	1%	0.005	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	115.5	-176.6	-58.6	-178.2	0	0	0	109.8	L868 L869 V870 V1001 F1004 I1019 L1033 I1053	L868-L1035 PolarHBondContact O-N 3.45Å; L869-L1035 CarbonylContact C-O 3.48Å; L869-L1035 WeakPolarHBondContact CA-O 3.41Å; L869-L1035 HydrophobicContact CD1-CB 4.06Å; V870-L1035 PolarHBondContact N-O 2.97Å; V1001-L1035 HydrophobicContact CB-CD2 3.93Å; V1001-L1035 HydrophobicContact CG2-CD2 3.64Å; F1004-L1035 HydrophobicContact CB-CD2 4.38Å; F1004-L1035 HydrophobicContact CD1-CB 3.79Å; F1004-L1035 HydrophobicContact CE1-CB 4.21Å; F1004-L1035 HydrophobicContact CG-CB 4.23Å; I1019-L1035 HydrophobicContact CD1-CD1 4Å; I1019-L1035 HydrophobicContact CD1-CD2 4.45Å; I1019-L1035 HydrophobicContact CG1-CD1 4.47Å; I1019-L1035 HydrophobicContact CG2-CD1 3.7Å; L1033-L1035 HydrophobicContact CB-CG 4.43Å; L1033-L1035 HydrophobicContact CD2-CD2 4.19Å; L1035-I1053 HydrophobicContact CD1-CD1 3.61Å; L1035-I1053 HydrophobicContact CG-CD1 4.38Å
1036	A	97.9	Very high	96.8	Very high	2 Å²	2	29.3 Å²	29.3	2%	0.017	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	149.8	176.8	0	0	0	0	0	112	V870 K878 V882 V1001 D1002 E1003 F1004	V870-A1036 HydrophobicContact CB-CB 4.07Å; V870-A1036 CarbonylContact O-C 3.51Å; V870-A1036 VanDerWaalsContact O-CA 3.3Å; V870-A1036 WeakPolarHBondContact O-CA 3.4Å; K878-A1036 HydrophobicContact CD-CB 4.31Å; K878-A1036 HydrophobicContact CG-CB 4.48Å; V882-A1036 HydrophobicContact CG2-CB 4.24Å; V1001-A1036 PolarHBondContact O-N 2.9Å; D1002-A1036 CarbonylContact C-O 3.36Å; D1002-A1036 CarbonylContact O-C 3.5Å; D1002-A1036 WeakPolarHBondContact O-CB 3.41Å; E1003-A1036 VanDerWaalsContact CA-O 3.3Å; E1003-A1036 WeakPolarHBondContact CA-O 3.29Å; F1004-A1036 WeakPolarHBondContact CD1-O 3.38Å; F1004-A1036 PolarHBondContact N-O 3.08Å
1037	T	97.3	Very high	96.7	Very high	0 Å²	0	32 Å²	32	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	145.8	177.7	176	0	0	0	0	112.3	V870 A871 G872 E1003 F1004 R1039 V1044 I1045	V870-T1037 PolarHBondContact O-N 3Å; A871-T1037 WeakPolarHBondContact CA-O 3.29Å; A871-T1037 HydrophobicContact CB-CG2 4.12Å; G872-T1037 PolarHBondContact N-O 2.71Å; E1003-T1037 VanDerWaalsContact OE1-CA 3.25Å; E1003-T1037 WeakPolarHBondContact OE1-CA 3.28Å; E1003-T1037 PolarHBondContact OE1-OG1 3.21Å; F1004-T1037 HydrophobicContact CD1-CG2 4.3Å; F1004-T1037 HydrophobicContact CE1-CG2 3.68Å; T1037-R1039 PolarHBondContact OG1-N 3.08Å; T1037-R1039 PolarHBondContact OG1-O 3.24Å; T1037-V1044 HydrophobicContact CG2-CG1 4.47Å; T1037-I1045 HydrophobicContact CG2-CD1 3.99Å; T1037-I1045 HydrophobicContact CG2-CG1 4.3Å
1038	Q	96.4	Very high	96.5	Very high	42 Å²	42	30.1 Å²	30.1	20%	0.196	18%	0.175	C	C	.	.	S	Bend	trans	-96.4	-8.1	167.2	-58.2	-175.8	69.4	0	0	112.3	G872 T874 K878 E1003 P1040	G872-Q1038 WeakPolarHBondContact O-CA 3.5Å; T874-Q1038 PolarHBondContact OG1-OE1 2.54Å; K878-Q1038 HydrophobicContact CD-CG 3.81Å; K878-Q1038 VanDerWaalsContact CE-CG 3.5Å; E1003-Q1038 PolarHBondContact OE1-N 3.43Å; Q1038-P1040 VanDerWaalsContact C-CD 3.48Å; Q1038-P1040 VanDerWaalsContact O-CD 3.22Å; Q1038-P1040 WeakPolarHBondContact O-CD 3.43Å
1039	R	95.2	Very high	96.5	Very high	109 Å²	109	29.1 Å²	29.1	41%	0.411	17%	0.167	S	C	.	.			trans	-114.1	80.1	179.6	-60.3	-174.9	-173	134.4	11.1	111.6	A1005 D1006 M1009 T1037 S1041	A1005-R1039 HydrophobicContact CB-CB 4.06Å; A1005-R1039 HydrophobicContact CB-CG 4.49Å; D1006-R1039 IonicContact OD1-CZ 2.68Å; D1006-R1039 IonicContact OD1-NH1 3.8Å; D1006-R1039 PolarHBondContact OD1-NH1 2.87Å; D1006-R1039 IonicContact OD1-NH2 3.35Å; M1009-R1039 PolarHBondContact SD-NH1 3.02Å; T1037-R1039 PolarHBondContact OG1-N 3.08Å; T1037-R1039 PolarHBondContact OG1-O 3.24Å; R1039-S1041 PolarHBondContact O-N 3.25Å
1040	P	95.7	Very high	96.3	Very high	9 Å²	9	31 Å²	31	6%	0.058	18%	0.175	C	C	.	.			trans	-75.7	52.8	176.8	33.4	-37.9	0	0	0	113.5	A871 Q1038 I1045 V1061 D1066 T1069	A871-P1040 HydrophobicContact CB-CB 4.2Å; Q1038-P1040 VanDerWaalsContact C-CD 3.48Å; Q1038-P1040 VanDerWaalsContact O-CD 3.22Å; Q1038-P1040 WeakPolarHBondContact O-CD 3.43Å; P1040-I1045 HydrophobicContact CB-CD1 3.9Å; P1040-V1061 HydrophobicContact CG-CG1 4.39Å; P1040-D1066 HydrophobicContact CB-CB 4.38Å; P1040-D1066 HydrophobicContact CG-CB 3.75Å; P1040-T1069 WeakPolarHBondContact O-CB 3.32Å; P1040-T1069 WeakPolarHBondContact O-CG2 3.22Å; P1040-T1069 PolarHBondContact O-OG1 3.3Å
1041	S	95.8	Very high	96.1	Very high	40 Å²	40	34.7 Å²	34.7	28%	0.28	21%	0.206	S	C	.	.			trans	-83.7	164.8	170.6	86	0	0	0	0	111.6	R1039 D1043 V1044 I1045 T1069	R1039-S1041 PolarHBondContact O-N 3.25Å; S1041-D1043 VanDerWaalsContact C-N 3.26Å; S1041-D1043 WeakPolarHBondContact CB-OD2 3.48Å; S1041-D1043 PolarHBondContact O-N 2.88Å; S1041-D1043 PolarHBondContact OG-N 2.84Å; S1041-D1043 PolarHBondContact OG-OD2 3.42Å; S1041-V1044 PolarHBondContact O-N 3.43Å; S1041-V1044 PolarHBondContact OG-N 3.28Å; S1041-I1045 PolarHBondContact O-N 2.89Å; S1041-T1069 VanDerWaalsContact O-CG2 3.31Å; S1041-T1069 WeakPolarHBondContact O-CG2 3.45Å
1042	V	95.3	Very high	95.9	Very high	99 Å²	99	36.2 Å²	36.2	60%	0.6	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.9	-26.8	178.9	-179.7	0	0	0	0	111.7	V1044 I1045 T1046 T1069	V1042-V1044 VanDerWaalsContact C-N 3.34Å; V1042-I1045 CarbonylContact O-C 3.5Å; V1042-T1046 WeakPolarHBondContact O-CA 3.39Å; V1042-T1046 PolarHBondContact O-N 2.83Å; V1042-T1069 HydrophobicContact CG2-CG2 4.31Å
1043	D	94	Very high	95.8	Very high	123 Å²	123	36.1 Å²	36.1	66%	0.658	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.9	-27.8	179.5	-28.7	-81.6	0	0	0	111.8	S1041 T1046	S1041-D1043 VanDerWaalsContact C-N 3.26Å; S1041-D1043 WeakPolarHBondContact CB-OD2 3.48Å; S1041-D1043 PolarHBondContact O-N 2.88Å; S1041-D1043 PolarHBondContact OG-N 2.84Å; S1041-D1043 PolarHBondContact OG-OD2 3.42Å; D1043-T1046 WeakPolarHBondContact O-CG2 3.41Å
1044	V	95.8	Very high	95.6	Very high	4 Å²	4	38.4 Å²	38.4	2%	0.024	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.7	-55.4	173.5	173.7	0	0	0	0	110.3	F1004 A1005 T1037 S1041 V1042 T1046	F1004-V1044 HydrophobicContact CD2-CG1 4.38Å; F1004-V1044 HydrophobicContact CE1-CG1 3.98Å; F1004-V1044 HydrophobicContact CE2-CG1 3.74Å; F1004-V1044 VanDerWaalsContact CE2-O 3.27Å; F1004-V1044 WeakPolarHBondContact CE2-O 3.42Å; F1004-V1044 HydrophobicContact CZ-CG1 3.5Å; A1005-V1044 HydrophobicContact CB-CB 4.38Å; A1005-V1044 HydrophobicContact CB-CG1 3.74Å; A1005-V1044 HydrophobicContact CB-CG2 3.67Å; T1037-V1044 HydrophobicContact CG2-CG1 4.47Å; S1041-V1044 PolarHBondContact O-N 3.43Å; S1041-V1044 PolarHBondContact OG-N 3.28Å; V1042-V1044 VanDerWaalsContact C-N 3.34Å; V1044-T1046 VanDerWaalsContact C-N 3.35Å; V1044-T1046 PolarHBondContact O-N 2.69Å
1045	I	96.3	Very high	95.5	Very high	1 Å²	1	38.1 Å²	38.1	1%	0.005	23%	0.227	C	C	.	.	S	Bend	trans	-93.8	71.1	-179.3	-55.5	178.2	0	0	0	108.7	L869 A871 F1004 T1037 P1040 S1041 V1042 K1050 T1069 I1070	L869-I1045 HydrophobicContact CD2-CD1 4.37Å; L869-I1045 HydrophobicContact CD2-CG1 4.42Å; L869-I1045 HydrophobicContact CD2-CG2 3.65Å; A871-I1045 HydrophobicContact CB-CD1 4.34Å; F1004-I1045 HydrophobicContact CZ-CG1 4.14Å; T1037-I1045 HydrophobicContact CG2-CD1 3.99Å; T1037-I1045 HydrophobicContact CG2-CG1 4.3Å; P1040-I1045 HydrophobicContact CB-CD1 3.9Å; S1041-I1045 PolarHBondContact O-N 2.89Å; V1042-I1045 CarbonylContact O-C 3.5Å; I1045-K1050 HydrophobicContact CG2-CD 3.68Å; I1045-K1050 HydrophobicContact CG2-CG 3.55Å; I1045-T1069 HydrophobicContact CB-CG2 3.79Å; I1045-T1069 HydrophobicContact CD1-CG2 4.34Å; I1045-T1069 HydrophobicContact CG1-CG2 4.48Å; I1045-T1069 HydrophobicContact CG2-CG2 4.27Å; I1045-I1070 HydrophobicContact CD1-CB 4.22Å; I1045-I1070 HydrophobicContact CD1-CD1 4.4Å
1046	T	95.7	Very high	95.5	Very high	17 Å²	17	39.1 Å²	39.1	10%	0.104	23%	0.23	C	C	.	.			trans	-68.8	166.5	-175.3	86.4	0	0	0	0	112.7	M1008 E1016 V1042 D1043 V1044 L1048 I1049 K1050	M1008-T1046 HydrophobicContact CE-CG2 3.71Å; E1016-T1046 VanDerWaalsContact OE1-CB 3.24Å; E1016-T1046 WeakPolarHBondContact OE1-CB 3.21Å; E1016-T1046 VanDerWaalsContact OE1-CG2 3.31Å; E1016-T1046 WeakPolarHBondContact OE1-CG2 3.5Å; E1016-T1046 PolarHBondContact OE1-OG1 2.93Å; V1042-T1046 WeakPolarHBondContact O-CA 3.39Å; V1042-T1046 PolarHBondContact O-N 2.83Å; D1043-T1046 WeakPolarHBondContact O-CG2 3.41Å; V1044-T1046 VanDerWaalsContact C-N 3.35Å; V1044-T1046 PolarHBondContact O-N 2.69Å; T1046-L1048 PolarHBondContact O-N 2.93Å; T1046-L1048 PolarHBondContact OG1-N 2.86Å; T1046-L1048 VanDerWaalsContact OG1-N 3.13Å; T1046-I1049 HydrophobicContact CG2-CG1 4.45Å; T1046-I1049 PolarHBondContact O-N 2.96Å; T1046-I1049 PolarHBondContact OG1-N 3.46Å; T1046-K1050 PolarHBondContact O-N 3.19Å
1047	G	93.9	Very high	95.5	Very high	56 Å²	56	39 Å²	39	58%	0.577	23%	0.23	S	C	*	.	H	α-helix	trans	-59.5	-32	171.5	0	0	0	0	0	113.7	A1051	G1047-A1051 VanDerWaalsContact O-CB 3.26Å; G1047-A1051 WeakPolarHBondContact O-CB 3.44Å; G1047-A1051 PolarHBondContact O-N 3.3Å
1048	L	94.2	Very high	95.6	Very high	99 Å²	99	39 Å²	39	52%	0.518	23%	0.23	S	C	.	.	H	α-helix	trans	-73.4	-42.7	177.6	-64.1	179	0	0	0	111.4	E1016 T1046 K1050 A1051 N1052	E1016-L1048 HydrophobicContact CG-CB 4.48Å; E1016-L1048 HydrophobicContact CG-CD1 4.47Å; T1046-L1048 PolarHBondContact O-N 2.93Å; T1046-L1048 PolarHBondContact OG1-N 2.86Å; T1046-L1048 VanDerWaalsContact OG1-N 3.13Å; L1048-K1050 PolarHBondContact O-N 2.84Å; L1048-A1051 PolarHBondContact O-N 3.45Å; L1048-N1052 PolarHBondContact O-N 2.89Å; L1048-N1052 PolarHBondContact O-ND2 3.46Å
1049	I	95.5	Very high	95.7	Very high	1 Å²	1	37 Å²	37	1%	0.005	22%	0.22	C	C	.	.	H	α-helix	trans	-58.4	-49.7	174	-57.7	-63.3	0	0	0	109.8	L869 E1016 I1019 T1046 A1051 N1052 I1053	L869-I1049 HydrophobicContact CD1-CG2 4.39Å; L869-I1049 HydrophobicContact CD2-CG2 4.49Å; E1016-I1049 HydrophobicContact CG-CD1 4.22Å; I1019-I1049 HydrophobicContact CB-CD1 4.09Å; I1019-I1049 HydrophobicContact CD1-CD1 4.49Å; I1019-I1049 HydrophobicContact CG2-CD1 3.58Å; T1046-I1049 HydrophobicContact CG2-CG1 4.45Å; T1046-I1049 PolarHBondContact O-N 2.96Å; T1046-I1049 PolarHBondContact OG1-N 3.46Å; I1049-A1051 PolarHBondContact O-N 3.35Å; I1049-N1052 PolarHBondContact O-N 3.22Å; I1049-I1053 HydrophobicContact CG2-CD1 4.09Å; I1049-I1053 PolarHBondContact O-N 3.45Å
1050	K	94.5	Very high	95.8	Very high	39 Å²	39	33 Å²	33	17%	0.17	21%	0.207	C	C	.	.	H	α-helix	trans	-68.5	-25.5	-178.3	-77.2	-158.6	-72.7	-179.6	0	115.9	I1045 T1046 L1048 R1056 T1069 D1072	I1045-K1050 HydrophobicContact CG2-CD 3.68Å; I1045-K1050 HydrophobicContact CG2-CG 3.55Å; T1046-K1050 PolarHBondContact O-N 3.19Å; L1048-K1050 PolarHBondContact O-N 2.84Å; K1050-R1056 PolarHBondContact O-NH2 3.07Å; K1050-T1069 WeakPolarHBondContact CD-O 3.24Å; K1050-T1069 VanDerWaalsContact CE-O 3.28Å; K1050-T1069 WeakPolarHBondContact CE-O 3.31Å; K1050-T1069 PolarHBondContact NZ-O 3.12Å; K1050-D1072 IonicContact NZ-OD1 2.73Å; K1050-D1072 PolarHBondContact NZ-OD1 2.91Å
1051	A	92.8	Very high	95.8	Very high	78 Å²	78	32.8 Å²	32.8	65%	0.645	21%	0.206	S	C	*	.	H	α-helix	trans	-72.6	-30	176	0	0	0	0	0	112.7	G1047 L1048 I1049	G1047-A1051 VanDerWaalsContact O-CB 3.26Å; G1047-A1051 WeakPolarHBondContact O-CB 3.44Å; G1047-A1051 PolarHBondContact O-N 3.3Å; L1048-A1051 PolarHBondContact O-N 3.45Å; I1049-A1051 PolarHBondContact O-N 3.35Å
1052	N	94.6	Very high	95.8	Very high	31 Å²	31	35.4 Å²	35.4	17%	0.166	22%	0.224	C	C	.	.	H	α-helix	trans	-105	-20.3	-174.2	-57.3	-70.5	0	0	0	113.4	A1023 Q1024 L1048 I1049 P1054	A1023-N1052 HydrophobicContact CB-CB 3.59Å; Q1024-N1052 HydrophobicContact CG-CB 4.39Å; Q1024-N1052 WeakPolarHBondContact CG-OD1 3.35Å; Q1024-N1052 PolarHBondContact NE2-OD1 2.87Å; Q1024-N1052 VanDerWaalsContact NE2-OD1 3.08Å; L1048-N1052 PolarHBondContact O-N 2.89Å; L1048-N1052 PolarHBondContact O-ND2 3.46Å; I1049-N1052 PolarHBondContact O-N 3.22Å; N1052-P1054 WeakPolarHBondContact O-CD 3.4Å
1053	I	96.2	Very high	95.7	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	21%	0.206	C	C	.	.			trans	-107	99.7	174.1	-56.8	-178.6	0	0	0	109.1	H867 L869 I1019 A1023 L1035 I1049 R1056	H867-I1053 HydrophobicContact CB-CG1 4.12Å; H867-I1053 HydrophobicContact CB-CG2 4.07Å; L869-I1053 HydrophobicContact CB-CG2 3.9Å; I1019-I1053 HydrophobicContact CG2-CD1 4.38Å; A1023-I1053 HydrophobicContact CB-CG1 3.97Å; L1035-I1053 HydrophobicContact CD1-CD1 3.61Å; L1035-I1053 HydrophobicContact CG-CD1 4.38Å; I1049-I1053 HydrophobicContact CG2-CD1 4.09Å; I1049-I1053 PolarHBondContact O-N 3.45Å; I1053-R1056 PolarHBondContact O-NH1 3.11Å
1054	P	93.8	Very high	95.7	Very high	49 Å²	49	29.6 Å²	29.6	32%	0.318	19%	0.189	S	C	.	.			trans	-80.6	-34.6	-175.7	30.9	-34.7	0	0	0	112.9	M865 N1052 R1056 P1090	M865-P1054 WeakPolarHBondContact O-CG 3.42Å; N1052-P1054 WeakPolarHBondContact O-CD 3.4Å; P1054-R1056 PolarHBondContact O-NH1 3.02Å; P1054-P1090 HydrophobicContact CB-CB 3.93Å; P1054-P1090 HydrophobicContact CG-CB 3.94Å
1055	T	97.3	Very high	95.8	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	128.2	-177.6	-52.1	0	0	0	0	111.2	M865 H867 L868 L869 Y1087 S1088 P1090	M865-T1055 WeakPolarHBondContact CA-OG1 3.29Å; M865-T1055 HydrophobicContact CB-CG2 4.28Å; M865-T1055 WeakPolarHBondContact CB-OG1 3.41Å; M865-T1055 HydrophobicContact CE-CG2 4.46Å; M865-T1055 HydrophobicContact CG-CG2 3.91Å; M865-T1055 PolarHBondContact O-OG1 3.38Å; M865-T1055 HydrophobicContact SD-CG2 3.84Å; H867-T1055 WeakPolarHBondContact O-CB 3.31Å; L868-T1055 HydrophobicContact CD1-CG2 3.88Å; L869-T1055 PolarHBondContact N-O 3.06Å; L869-T1055 VanDerWaalsContact N-O 3.07Å; T1055-Y1087 HydrophobicContact CG2-CD2 4.37Å; T1055-Y1087 HydrophobicContact CG2-CE2 3.53Å; T1055-S1088 WeakPolarHBondContact CA-O 3.19Å; T1055-P1090 WeakPolarHBondContact OG1-CD 3.26Å
1056	R	97.2	Very high	95.8	Very high	23 Å²	23	36.7 Å²	36.7	9%	0.087	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	140.4	-177	-60.5	139.4	162.9	68.2	-0.7	110.6	L869 K1050 I1053 P1054 I1070 L1071 D1072 S1088	L869-R1056 CarbonylContact O-C 3.53Å; L869-R1056 WeakPolarHBondContact O-CA 3.44Å; K1050-R1056 PolarHBondContact O-NH2 3.07Å; I1053-R1056 PolarHBondContact O-NH1 3.11Å; P1054-R1056 PolarHBondContact O-NH1 3.02Å; R1056-I1070 HydrophobicContact CB-CD1 4.03Å; R1056-I1070 HydrophobicContact CB-CG1 4.38Å; R1056-I1070 VanDerWaalsContact CD-O 3.22Å; R1056-I1070 WeakPolarHBondContact CD-O 3.37Å; R1056-I1070 HydrophobicContact CG-CD1 4.15Å; R1056-I1070 WeakPolarHBondContact CG-O 3.5Å; R1056-I1070 PolarHBondContact NE-O 3.21Å; R1056-I1070 VanDerWaalsContact NE-O 3.14Å; R1056-L1071 HydrophobicContact CB-CD2 3.97Å; R1056-D1072 IonicContact CZ-OD2 2.76Å; R1056-D1072 VanDerWaalsContact CZ-OD2 3.31Å; R1056-D1072 IonicContact NE-OD2 3.19Å; R1056-D1072 PolarHBondContact NE-OD2 3.44Å; R1056-D1072 VanDerWaalsContact NE-OD2 3.11Å; R1056-D1072 IonicContact NH2-OD2 2.69Å; R1056-D1072 PolarHBondContact NH2-OD2 3.08Å; R1056-S1088 PolarHBondContact N-O 3.2Å; R1056-S1088 PolarHBondContact O-N 2.87Å
1057	I	98.2	Very high	95.8	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	127	163.3	-73.5	172.8	0	0	0	108.1	L849 L868 L869 V870 A871 M885 F1059 M1085 L1086 Y1087	L849-I1057 HydrophobicContact CD1-CD1 4.49Å; L849-I1057 HydrophobicContact CD2-CD1 3.76Å; L868-I1057 HydrophobicContact CD1-CB 4.36Å; L868-I1057 HydrophobicContact CD1-CD1 3.96Å; L868-I1057 HydrophobicContact CD1-CG1 3.94Å; L868-I1057 HydrophobicContact CD2-CD1 4.17Å; L869-I1057 PolarHBondContact O-N 3.19Å; V870-I1057 CarbonylContact C-O 3.59Å; V870-I1057 WeakPolarHBondContact CA-O 3.48Å; V870-I1057 HydrophobicContact CG1-CB 4.45Å; V870-I1057 HydrophobicContact CG1-CG2 4.22Å; V870-I1057 HydrophobicContact CG2-CB 4.48Å; A871-I1057 PolarHBondContact N-O 2.68Å; M885-I1057 HydrophobicContact CE-CD1 3.69Å; I1057-F1059 HydrophobicContact CG2-CD2 3.97Å; I1057-F1059 HydrophobicContact CG2-CE2 3.67Å; I1057-F1059 HydrophobicContact CG2-CZ 4.24Å; I1057-M1085 HydrophobicContact CD1-SD 4.27Å; I1057-M1085 HydrophobicContact CG1-SD 4.45Å; I1057-M1085 HydrophobicContact CG2-CB 4.22Å; I1057-M1085 HydrophobicContact CG2-SD 3.58Å; I1057-M1085 VanDerWaalsContact CG2-SD 3.58Å; I1057-L1086 WeakPolarHBondContact CA-O 3.48Å; I1057-Y1087 HydrophobicContact CD1-CD2 4.19Å; I1057-Y1087 HydrophobicContact CG1-CD2 3.78Å
1058	A	98.3	Very high	96	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	113.9	168.1	0	0	0	0	0	109.2	A871 I1070 L1071 A1076 L1079 M1085 L1086	A871-A1058 CarbonylContact O-C 3.56Å; A871-A1058 WeakPolarHBondContact O-CA 3.36Å; A1058-I1070 HydrophobicContact CB-CG1 4.05Å; A1058-I1070 HydrophobicContact CB-CG2 3.72Å; A1058-L1071 HydrophobicContact CB-CD1 3.86Å; A1058-L1071 HydrophobicContact CB-CD2 3.83Å; A1058-L1071 HydrophobicContact CB-CG 3.73Å; A1058-A1076 HydrophobicContact CB-CB 3.72Å; A1058-L1079 WeakPolarHBondContact O-CD1 3.35Å; A1058-M1085 CarbonylContact O-C 3.49Å; A1058-M1085 VanDerWaalsContact O-CA 3.25Å; A1058-M1085 WeakPolarHBondContact O-CA 3.26Å; A1058-M1085 WeakPolarHBondContact O-CB 3.29Å; A1058-L1086 PolarHBondContact N-O 2.94Å; A1058-L1086 PolarHBondContact O-N 2.8Å
1059	F	98.5	Very high	96.1	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	-172.6	158.6	-66.9	-86.4	0	0	0	109.2	V870 A871 K878 I1057 V1061 M1085	V870-F1059 HydrophobicContact CG1-CD2 3.97Å; V870-F1059 HydrophobicContact CG1-CE2 3.73Å; A871-F1059 PolarHBondContact O-N 3.14Å; K878-F1059 HydrophobicContact CB-CD2 4.41Å; I1057-F1059 HydrophobicContact CG2-CD2 3.97Å; I1057-F1059 HydrophobicContact CG2-CE2 3.67Å; I1057-F1059 HydrophobicContact CG2-CZ 4.24Å; F1059-V1061 PolarHBondContact O-N 3.18Å; F1059-M1085 HydrophobicContact CD1-CB 3.74Å; F1059-M1085 HydrophobicContact CD1-CG 4.42Å; F1059-M1085 HydrophobicContact CE1-CB 3.9Å; F1059-M1085 HydrophobicContact CE1-CE 4.37Å; F1059-M1085 HydrophobicContact CE1-CG 4.1Å; F1059-M1085 HydrophobicContact CE1-SD 4.06Å; F1059-M1085 HydrophobicContact CG-CB 4.14Å; F1059-M1085 HydrophobicContact CZ-CB 4.45Å; F1059-M1085 HydrophobicContact CZ-CE 4.34Å; F1059-M1085 HydrophobicContact CZ-SD 3.94Å
1060	T	97.5	Very high	96.2	Very high	23 Å²	23	35.2 Å²	35.2	14%	0.141	20%	0.195	C	C	.	.			trans	-58.7	135.7	177.8	-49	0	0	0	0	111.6	T873 S876 L1079 G1081	T873-T1060 PolarHBondContact N-O 3.39Å; T873-T1060 PolarHBondContact OG1-O 3.2Å; S876-T1060 VanDerWaalsContact CB-O 3.32Å; S876-T1060 WeakPolarHBondContact CB-O 3.39Å; T1060-L1079 HydrophobicContact CG2-CB 4.21Å; T1060-L1079 WeakPolarHBondContact OG1-CB 3.47Å; T1060-G1081 VanDerWaalsContact OG1-CA 3.3Å; T1060-G1081 WeakPolarHBondContact OG1-CA 3.23Å; T1060-G1081 PolarHBondContact OG1-N 3.37Å
1061	V	97.2	Very high	96.2	Very high	6 Å²	6	33.5 Å²	33.5	4%	0.036	19%	0.188	C	C	.	.			trans	-131	160.9	178.3	-63.4	0	0	0	0	111.4	P1040 F1059 S1063 D1066 A1076 E1077	P1040-V1061 HydrophobicContact CG-CG1 4.39Å; F1059-V1061 PolarHBondContact O-N 3.18Å; V1061-S1063 PolarHBondContact O-N 3.22Å; V1061-D1066 HydrophobicContact CB-CB 3.82Å; V1061-D1066 HydrophobicContact CG1-CB 4.4Å; V1061-D1066 HydrophobicContact CG2-CB 3.86Å; V1061-A1076 HydrophobicContact CG2-CB 3.67Å; V1061-A1076 PolarHBondContact N-O 3.03Å; V1061-E1077 HydrophobicContact CG2-CB 4.42Å; V1061-E1077 WeakPolarHBondContact O-CA 3.18Å
1062	S	94.5	Very high	96.3	Very high	94 Å²	94	34 Å²	34	66%	0.657	18%	0.18	S	C	*	.	S	Bend	trans	-67.2	-33.7	-173.9	-56	0	0	0	0	114.6	T873 D1066	T873-S1062 WeakPolarHBondContact CG2-OG 3.5Å; S1062-D1066 WeakPolarHBondContact CB-OD2 3.29Å
1063	S	94.4	Very high	96.2	Very high	32 Å²	32	35.3 Å²	35.3	22%	0.224	18%	0.184	C	C	.	.			trans	-146.4	164.8	-168.4	80.3	0	0	0	0	116.3	V1061 I1065 D1066 S1067	V1061-S1063 PolarHBondContact O-N 3.22Å; S1063-I1065 PolarHBondContact O-N 2.82Å; S1063-I1065 PolarHBondContact OG-N 2.73Å; S1063-D1066 WeakPolarHBondContact CA-OD2 3.37Å; S1063-D1066 VanDerWaalsContact CB-OD2 3.24Å; S1063-D1066 WeakPolarHBondContact CB-OD2 3.2Å; S1063-D1066 PolarHBondContact N-OD2 3.2Å; S1063-D1066 PolarHBondContact O-N 2.86Å; S1063-D1066 PolarHBondContact OG-N 2.7Å; S1063-D1066 VanDerWaalsContact OG-N 3.15Å; S1063-D1066 PolarHBondContact OG-OD2 3.26Å; S1063-S1067 PolarHBondContact O-N 2.87Å
1064	K	93.8	Very high	96	Very high	69 Å²	69	37.2 Å²	37.2	30%	0.3	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-11.7	169.5	-77.7	-172.9	175.7	-177.1	0	114.1	R1068 A1074 E1077	K1064-R1068 WeakPolarHBondContact O-CG 3.22Å; K1064-R1068 PolarHBondContact O-NH1 2.95Å; K1064-A1074 HydrophobicContact CG-CB 4.34Å; K1064-E1077 WeakPolarHBondContact CE-OE1 3.22Å; K1064-E1077 HydrophobicContact CG-CG 3.73Å; K1064-E1077 WeakPolarHBondContact CG-OE1 3.43Å
1065	I	96.5	Very high	95.9	Very high	122 Å²	122	35.3 Å²	35.3	63%	0.626	19%	0.189	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.4	-55.5	173	-60.3	176.2	0	0	0	107.4	S1063 S1067 R1068 T1069	S1063-I1065 PolarHBondContact O-N 2.82Å; S1063-I1065 PolarHBondContact OG-N 2.73Å; I1065-S1067 VanDerWaalsContact C-N 3.3Å; I1065-S1067 PolarHBondContact O-N 3.14Å; I1065-R1068 CarbonylContact O-C 3.56Å; I1065-R1068 WeakPolarHBondContact O-CA 3.22Å; I1065-R1068 WeakPolarHBondContact O-CB 3.34Å; I1065-R1068 PolarHBondContact O-N 2.91Å; I1065-T1069 PolarHBondContact O-N 2.94Å; I1065-T1069 PolarHBondContact O-OG1 3.37Å
1066	D	97.3	Very high	95.8	Very high	32 Å²	32	35.3 Å²	35.3	17%	0.171	19%	0.189	C	C	.	.	H	α-helix	trans	-49.5	-48.9	176.6	-51.3	-44.6	0	0	0	112.2	P1040 V1061 S1062 S1063 R1068 T1069 I1070	P1040-D1066 HydrophobicContact CB-CB 4.38Å; P1040-D1066 HydrophobicContact CG-CB 3.75Å; V1061-D1066 HydrophobicContact CB-CB 3.82Å; V1061-D1066 HydrophobicContact CG1-CB 4.4Å; V1061-D1066 HydrophobicContact CG2-CB 3.86Å; S1062-D1066 WeakPolarHBondContact CB-OD2 3.29Å; S1063-D1066 WeakPolarHBondContact CA-OD2 3.37Å; S1063-D1066 VanDerWaalsContact CB-OD2 3.24Å; S1063-D1066 WeakPolarHBondContact CB-OD2 3.2Å; S1063-D1066 PolarHBondContact N-OD2 3.2Å; S1063-D1066 PolarHBondContact O-N 2.86Å; S1063-D1066 PolarHBondContact OG-N 2.7Å; S1063-D1066 VanDerWaalsContact OG-N 3.15Å; S1063-D1066 PolarHBondContact OG-OD2 3.26Å; D1066-R1068 VanDerWaalsContact C-N 3.27Å; D1066-R1068 PolarHBondContact O-N 2.99Å; D1066-T1069 WeakPolarHBondContact O-CA 3.08Å; D1066-T1069 VanDerWaalsContact O-CB 3.31Å; D1066-T1069 WeakPolarHBondContact O-CB 3.44Å; D1066-T1069 PolarHBondContact O-N 2.74Å; D1066-I1070 WeakPolarHBondContact O-CG2 3.47Å; D1066-I1070 PolarHBondContact O-N 3.48Å; D1066-I1070 VanDerWaalsContact O-N 3.08Å
1067	S	96.5	Very high	95.7	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-57.3	-40.3	177.5	-176.4	0	0	0	0	112	S1063 I1065 L1071 Q1073 A1074 G1075 A1076 E1077	S1063-S1067 PolarHBondContact O-N 2.87Å; I1065-S1067 VanDerWaalsContact C-N 3.3Å; I1065-S1067 PolarHBondContact O-N 3.14Å; S1067-L1071 WeakPolarHBondContact O-CB 3.25Å; S1067-L1071 PolarHBondContact O-N 3.34Å; S1067-Q1073 CarbonylContact C-O 3.51Å; S1067-Q1073 PolarHBondContact OG-O 3.2Å; S1067-A1074 WeakPolarHBondContact OG-CA 3.48Å; S1067-G1075 PolarHBondContact OG-N 3.31Å; S1067-A1076 WeakPolarHBondContact OG-CB 3.35Å; S1067-A1076 PolarHBondContact OG-N 3.12Å; S1067-E1077 WeakPolarHBondContact CB-OE2 3.26Å
1068	R	96.4	Very high	95.4	Very high	134 Å²	134	37 Å²	37	51%	0.506	20%	0.2	S	C	.	.	H	α-helix	trans	-73.5	-30.6	175.2	-72.5	-178	179.2	108	-16	112.1	K1064 I1065 D1066 D1072 Q1073	K1064-R1068 WeakPolarHBondContact O-CG 3.22Å; K1064-R1068 PolarHBondContact O-NH1 2.95Å; I1065-R1068 CarbonylContact O-C 3.56Å; I1065-R1068 WeakPolarHBondContact O-CA 3.22Å; I1065-R1068 WeakPolarHBondContact O-CB 3.34Å; I1065-R1068 PolarHBondContact O-N 2.91Å; D1066-R1068 VanDerWaalsContact C-N 3.27Å; D1066-R1068 PolarHBondContact O-N 2.99Å; R1068-D1072 WeakPolarHBondContact O-CA 3.32Å; R1068-D1072 PolarHBondContact O-N 3.12Å; R1068-Q1073 PolarHBondContact N-O 3.27Å
1069	T	97.1	Very high	95.3	Very high	8 Å²	8	37.5 Å²	37.5	5%	0.049	20%	0.203	C	C	.	.	H	α-helix	trans	-59.9	-47.5	173.4	-47.8	0	0	0	0	110.4	P1040 S1041 V1042 I1045 K1050 I1065 D1066	P1040-T1069 WeakPolarHBondContact O-CB 3.32Å; P1040-T1069 WeakPolarHBondContact O-CG2 3.22Å; P1040-T1069 PolarHBondContact O-OG1 3.3Å; S1041-T1069 VanDerWaalsContact O-CG2 3.31Å; S1041-T1069 WeakPolarHBondContact O-CG2 3.45Å; V1042-T1069 HydrophobicContact CG2-CG2 4.31Å; I1045-T1069 HydrophobicContact CB-CG2 3.79Å; I1045-T1069 HydrophobicContact CD1-CG2 4.34Å; I1045-T1069 HydrophobicContact CG1-CG2 4.48Å; I1045-T1069 HydrophobicContact CG2-CG2 4.27Å; K1050-T1069 WeakPolarHBondContact CD-O 3.24Å; K1050-T1069 VanDerWaalsContact CE-O 3.28Å; K1050-T1069 WeakPolarHBondContact CE-O 3.31Å; K1050-T1069 PolarHBondContact NZ-O 3.12Å; I1065-T1069 PolarHBondContact O-N 2.94Å; I1065-T1069 PolarHBondContact O-OG1 3.37Å; D1066-T1069 WeakPolarHBondContact O-CA 3.08Å; D1066-T1069 VanDerWaalsContact O-CB 3.31Å; D1066-T1069 WeakPolarHBondContact O-CB 3.44Å; D1066-T1069 PolarHBondContact O-N 2.74Å
1070	I	96.9	Very high	95.2	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-81.6	-53	178.7	174.4	64	0	0	0	114.1	L869 A871 I1045 R1056 A1058 D1066	L869-I1070 HydrophobicContact CB-CD1 4.18Å; L869-I1070 HydrophobicContact CD2-CD1 3.52Å; L869-I1070 HydrophobicContact CG-CD1 3.6Å; A871-I1070 HydrophobicContact CB-CB 3.94Å; A871-I1070 HydrophobicContact CB-CD1 4.12Å; A871-I1070 HydrophobicContact CB-CG1 3.86Å; A871-I1070 HydrophobicContact CB-CG2 4.18Å; I1045-I1070 HydrophobicContact CD1-CB 4.22Å; I1045-I1070 HydrophobicContact CD1-CD1 4.4Å; R1056-I1070 HydrophobicContact CB-CD1 4.03Å; R1056-I1070 HydrophobicContact CB-CG1 4.38Å; R1056-I1070 VanDerWaalsContact CD-O 3.22Å; R1056-I1070 WeakPolarHBondContact CD-O 3.37Å; R1056-I1070 HydrophobicContact CG-CD1 4.15Å; R1056-I1070 WeakPolarHBondContact CG-O 3.5Å; R1056-I1070 PolarHBondContact NE-O 3.21Å; R1056-I1070 VanDerWaalsContact NE-O 3.14Å; A1058-I1070 HydrophobicContact CB-CG1 4.05Å; A1058-I1070 HydrophobicContact CB-CG2 3.72Å; D1066-I1070 WeakPolarHBondContact O-CG2 3.47Å; D1066-I1070 PolarHBondContact O-N 3.48Å; D1066-I1070 VanDerWaalsContact O-N 3.08Å
1071	L	95.5	Very high	95.1	Very high	3 Å²	3	37.9 Å²	37.9	2%	0.016	21%	0.208	C	C	.	.	H	α-helix	trans	-94.8	-3.4	-170	-61	178.1	0	0	0	114.8	R1056 A1058 S1067 Q1073 A1076 L1086	R1056-L1071 HydrophobicContact CB-CD2 3.97Å; A1058-L1071 HydrophobicContact CB-CD1 3.86Å; A1058-L1071 HydrophobicContact CB-CD2 3.83Å; A1058-L1071 HydrophobicContact CB-CG 3.73Å; S1067-L1071 WeakPolarHBondContact O-CB 3.25Å; S1067-L1071 PolarHBondContact O-N 3.34Å; L1071-Q1073 HydrophobicContact CB-CG 3.92Å; L1071-Q1073 PolarHBondContact O-N 2.92Å; L1071-Q1073 PolarHBondContact O-NE2 3.24Å; L1071-A1076 HydrophobicContact CD1-CB 4.21Å; L1071-L1086 HydrophobicContact CD1-CB 3.76Å; L1071-L1086 HydrophobicContact CD1-CD1 3.62Å; L1071-L1086 HydrophobicContact CD1-CG 4.31Å
1072	D	94.4	Very high	95	Very high	89 Å²	89	45.5 Å²	45.5	48%	0.476	25%	0.245	S	C	.	.	S	Bend	trans	58.9	11.2	-167.7	-57.3	-68.1	0	0	0	113.8	K1050 R1056 R1068	K1050-D1072 IonicContact NZ-OD1 2.73Å; K1050-D1072 PolarHBondContact NZ-OD1 2.91Å; R1056-D1072 IonicContact CZ-OD2 2.76Å; R1056-D1072 VanDerWaalsContact CZ-OD2 3.31Å; R1056-D1072 IonicContact NE-OD2 3.19Å; R1056-D1072 PolarHBondContact NE-OD2 3.44Å; R1056-D1072 VanDerWaalsContact NE-OD2 3.11Å; R1056-D1072 IonicContact NH2-OD2 2.69Å; R1056-D1072 PolarHBondContact NH2-OD2 3.08Å; R1068-D1072 WeakPolarHBondContact O-CA 3.32Å; R1068-D1072 PolarHBondContact O-N 3.12Å
1073	Q	92.7	Very high	95.1	Very high	57 Å²	57	41.4 Å²	41.4	27%	0.266	22%	0.218	S	C	.	.	S	Bend	trans	-150.5	162.1	179	67.9	-162	-75	0	0	112.2	S1067 R1068 L1071 T1093	S1067-Q1073 CarbonylContact C-O 3.51Å; S1067-Q1073 PolarHBondContact OG-O 3.2Å; R1068-Q1073 PolarHBondContact N-O 3.27Å; L1071-Q1073 HydrophobicContact CB-CG 3.92Å; L1071-Q1073 PolarHBondContact O-N 2.92Å; L1071-Q1073 PolarHBondContact O-NE2 3.24Å; Q1073-T1093 PolarHBondContact NE2-O 3.15Å
1074	A	91.8	Very high	95.3	Very high	40 Å²	40	40.1 Å²	40.1	33%	0.331	21%	0.208	S	C	.	.	S	Bend	trans	-81.2	161.4	176.9	0	0	0	0	0	112.3	K1064 S1067	K1064-A1074 HydrophobicContact CG-CB 4.34Å; S1067-A1074 WeakPolarHBondContact OG-CA 3.48Å
1075	G	91.8	Very high	95.5	Very high	9 Å²	9	36.9 Å²	36.9	9%	0.093	19%	0.194	C	C	.	.			trans	134.6	-23	172	0	0	0	0	0	114.5	S1067 E1077 S1078	S1067-G1075 PolarHBondContact OG-N 3.31Å; G1075-E1077 WeakPolarHBondContact CA-OE2 3.47Å; G1075-E1077 PolarHBondContact N-OE2 2.77Å; G1075-E1077 PolarHBondContact O-N 2.99Å; G1075-S1078 PolarHBondContact O-N 3.37Å; G1075-S1078 VanDerWaalsContact O-N 3.09Å; G1075-S1078 PolarHBondContact O-OG 3.07Å
1076	A	95.9	Very high	95.6	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	17%	0.165	C	C	.	.	G	3₁₀ helix	trans	-69.9	-20.9	178.1	0	0	0	0	0	112.4	A1058 V1061 S1067 L1071 S1078 L1079 L1086	A1058-A1076 HydrophobicContact CB-CB 3.72Å; V1061-A1076 HydrophobicContact CG2-CB 3.67Å; V1061-A1076 PolarHBondContact N-O 3.03Å; S1067-A1076 WeakPolarHBondContact OG-CB 3.35Å; S1067-A1076 PolarHBondContact OG-N 3.12Å; L1071-A1076 HydrophobicContact CD1-CB 4.21Å; A1076-S1078 PolarHBondContact O-N 2.87Å; A1076-L1079 HydrophobicContact CB-CD1 4.03Å; A1076-L1079 WeakPolarHBondContact O-CB 3.48Å; A1076-L1079 WeakPolarHBondContact O-CD1 3.3Å; A1076-L1079 PolarHBondContact O-N 3.34Å; A1076-L1086 HydrophobicContact CB-CD1 4.44Å
1077	E	93.8	Very high	95.6	Very high	44 Å²	44	31.5 Å²	31.5	21%	0.206	16%	0.164	C	C	.	.	G	3₁₀ helix	trans	-76.4	-0.9	171.3	81.2	-67.1	166.1	0	0	114.2	V1061 K1064 S1067 G1075	V1061-E1077 HydrophobicContact CG2-CB 4.42Å; V1061-E1077 WeakPolarHBondContact O-CA 3.18Å; K1064-E1077 WeakPolarHBondContact CE-OE1 3.22Å; K1064-E1077 HydrophobicContact CG-CG 3.73Å; K1064-E1077 WeakPolarHBondContact CG-OE1 3.43Å; S1067-E1077 WeakPolarHBondContact CB-OE2 3.26Å; G1075-E1077 WeakPolarHBondContact CA-OE2 3.47Å; G1075-E1077 PolarHBondContact N-OE2 2.77Å; G1075-E1077 PolarHBondContact O-N 2.99Å
1078	S	93	Very high	95.5	Very high	16 Å²	16	32 Å²	32	11%	0.112	17%	0.167	C	C	.	.	G	3₁₀ helix	trans	-111.5	11.3	175.8	69.4	0	0	0	0	113.4	R804 G1075 A1076	R804-S1078 WeakPolarHBondContact CB-OG 3.34Å; R804-S1078 WeakPolarHBondContact CD-OG 3.5Å; R804-S1078 VanDerWaalsContact CG-OG 3.31Å; R804-S1078 WeakPolarHBondContact CG-OG 3.37Å; G1075-S1078 PolarHBondContact O-N 3.37Å; G1075-S1078 VanDerWaalsContact O-N 3.09Å; G1075-S1078 PolarHBondContact O-OG 3.07Å; A1076-S1078 PolarHBondContact O-N 2.87Å
1079	L	96.4	Very high	95.2	Very high	9 Å²	9	26.1 Å²	26.1	5%	0.047	15%	0.149	C	C	.	.			trans	-80.2	164.1	173.9	-64.7	169	0	0	0	111.3	A1058 T1060 A1076 D1084 L1086 R1097	A1058-L1079 WeakPolarHBondContact O-CD1 3.35Å; T1060-L1079 HydrophobicContact CG2-CB 4.21Å; T1060-L1079 WeakPolarHBondContact OG1-CB 3.47Å; A1076-L1079 HydrophobicContact CB-CD1 4.03Å; A1076-L1079 WeakPolarHBondContact O-CB 3.48Å; A1076-L1079 WeakPolarHBondContact O-CD1 3.3Å; A1076-L1079 PolarHBondContact O-N 3.34Å; L1079-D1084 WeakPolarHBondContact CA-OD2 3.18Å; L1079-D1084 VanDerWaalsContact CD2-OD2 3.29Å; L1079-D1084 WeakPolarHBondContact CD2-OD2 3.21Å; L1079-L1086 HydrophobicContact CD1-CG 4.2Å; L1079-L1086 HydrophobicContact CD2-CD2 4.23Å; L1079-L1086 HydrophobicContact CD2-CG 4.11Å; L1079-L1086 HydrophobicContact CG-CG 4.46Å; L1079-R1097 HydrophobicContact CD2-CG 4.27Å
1080	L	95.7	Very high	94.7	Very high	15 Å²	15	28.4 Å²	28.4	8%	0.079	16%	0.164	C	C	.	.			trans	-105.1	13.1	-163.1	-65.7	171.8	0	0	0	114.9	V770 I771 A802 P820 R824 D1084	V770-L1080 HydrophobicContact CG1-CD1 4.05Å; I771-L1080 HydrophobicContact CG2-CD1 3.45Å; I771-L1080 VanDerWaalsContact CG2-CD1 3.45Å; A802-L1080 HydrophobicContact CB-CD2 4.13Å; P820-L1080 HydrophobicContact CB-CD1 3.88Å; P820-L1080 HydrophobicContact CB-CD2 4.05Å; P820-L1080 HydrophobicContact CG-CD2 4.38Å; R824-L1080 PolarHBondContact NH1-O 3.37Å; L1080-D1084 HydrophobicContact CB-CB 4.28Å; L1080-D1084 PolarHBondContact N-OD2 2.9Å
1081	G	95.6	Very high	94.2	Very high	17 Å²	17	36.4 Å²	36.4	18%	0.175	21%	0.206	C	C	.	.	S	Bend	trans	68.6	-167.6	-170.3	0	0	0	0	0	113	S876 T1060 G1083 D1084	S876-G1081 CarbonylContact O-C 3.45Å; T1060-G1081 VanDerWaalsContact OG1-CA 3.3Å; T1060-G1081 WeakPolarHBondContact OG1-CA 3.23Å; T1060-G1081 PolarHBondContact OG1-N 3.37Å; G1081-G1083 VanDerWaalsContact C-N 3.28Å; G1081-G1083 PolarHBondContact O-N 2.81Å; G1081-G1083 VanDerWaalsContact O-N 3.12Å; G1081-D1084 WeakPolarHBondContact O-CB 3.32Å; G1081-D1084 PolarHBondContact O-N 2.82Å
1082	M	95.4	Very high	93.6	Very high	165 Å²	165	39 Å²	39	81%	0.813	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	54	37.3	165.4	-57.5	174	172.4	0	0	114.9	S876	S876-M1082 PolarHBondContact O-N 2.8Å
1083	G	96.9	Very high	93.1	Very high	8 Å²	8	40.5 Å²	40.5	8%	0.082	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	93.5	-3	177.7	0	0	0	0	0	115.5	S876 G1081 M1085 G1100	S876-G1083 PolarHBondContact O-N 3.19Å; G1081-G1083 VanDerWaalsContact C-N 3.28Å; G1081-G1083 PolarHBondContact O-N 2.81Å; G1081-G1083 VanDerWaalsContact O-N 3.12Å; G1083-M1085 PolarHBondContact O-N 3.48Å; G1083-G1100 VanDerWaalsContact O-CA 3.3Å; G1083-G1100 WeakPolarHBondContact O-CA 3.25Å; G1083-G1100 PolarHBondContact O-N 3.12Å
1084	D	98.1	Very high	92.9	Very high	5 Å²	5	41.7 Å²	41.7	3%	0.027	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	123.3	172.2	-174.1	44.6	0	0	0	110.6	L1079 L1080 G1081 R1097 H1099	L1079-D1084 WeakPolarHBondContact CA-OD2 3.18Å; L1079-D1084 VanDerWaalsContact CD2-OD2 3.29Å; L1079-D1084 WeakPolarHBondContact CD2-OD2 3.21Å; L1080-D1084 HydrophobicContact CB-CB 4.28Å; L1080-D1084 PolarHBondContact N-OD2 2.9Å; G1081-D1084 WeakPolarHBondContact O-CB 3.32Å; G1081-D1084 PolarHBondContact O-N 2.82Å; D1084-R1097 IonicContact OD1-CZ 2.72Å; D1084-R1097 IonicContact OD1-NE 3.92Å; D1084-R1097 PolarHBondContact OD1-NE 3.31Å; D1084-R1097 IonicContact OD1-NH2 3.74Å; D1084-R1097 IonicContact OD2-CZ 2.66Å; D1084-R1097 IonicContact OD2-NE 3.34Å; D1084-R1097 PolarHBondContact OD2-NE 3.24Å; D1084-R1097 IonicContact OD2-NH2 3.57Å; D1084-R1097 PolarHBondContact OD2-NH2 3.27Å; D1084-H1099 IonicContact OD1-CE1 3.19Å; D1084-H1099 PolarHBondContact OD1-CE1 2.86Å; D1084-H1099 IonicContact OD1-ND1 3.56Å; D1084-H1099 PolarHBondContact OD1-ND1 2.78Å
1085	M	98.1	Very high	93	Very high	2 Å²	2	40.7 Å²	40.7	1%	0.01	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	161	-170.4	57.4	164.1	147.4	0	0	114.3	L849 I1057 A1058 F1059 G1083 R1097 V1098	L849-M1085 HydrophobicContact CB-CE 3.93Å; L849-M1085 WeakPolarHBondContact O-CE 3.3Å; I1057-M1085 HydrophobicContact CD1-SD 4.27Å; I1057-M1085 HydrophobicContact CG1-SD 4.45Å; I1057-M1085 HydrophobicContact CG2-CB 4.22Å; I1057-M1085 HydrophobicContact CG2-SD 3.58Å; I1057-M1085 VanDerWaalsContact CG2-SD 3.58Å; A1058-M1085 CarbonylContact O-C 3.49Å; A1058-M1085 VanDerWaalsContact O-CA 3.25Å; A1058-M1085 WeakPolarHBondContact O-CA 3.26Å; A1058-M1085 WeakPolarHBondContact O-CB 3.29Å; F1059-M1085 HydrophobicContact CD1-CB 3.74Å; F1059-M1085 HydrophobicContact CD1-CG 4.42Å; F1059-M1085 HydrophobicContact CE1-CB 3.9Å; F1059-M1085 HydrophobicContact CE1-CE 4.37Å; F1059-M1085 HydrophobicContact CE1-CG 4.1Å; F1059-M1085 HydrophobicContact CE1-SD 4.06Å; F1059-M1085 HydrophobicContact CG-CB 4.14Å; F1059-M1085 HydrophobicContact CZ-CB 4.45Å; F1059-M1085 HydrophobicContact CZ-CE 4.34Å; F1059-M1085 HydrophobicContact CZ-SD 3.94Å; G1083-M1085 PolarHBondContact O-N 3.48Å; M1085-R1097 WeakPolarHBondContact O-CA 3.36Å; M1085-V1098 HydrophobicContact CE-CB 4.23Å; M1085-V1098 HydrophobicContact CE-CG1 4Å; M1085-V1098 HydrophobicContact CG-CB 4.08Å; M1085-V1098 WeakPolarHBondContact CG-O 3.37Å; M1085-V1098 PolarHBondContact N-O 2.72Å; M1085-V1098 PolarHBondContact O-N 2.99Å
1086	L	97.7	Very high	93.1	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	119.8	165.9	-67.1	-175.1	0	0	0	110	I1057 A1058 L1071 A1076 L1079 P1095 R1097	I1057-L1086 WeakPolarHBondContact CA-O 3.48Å; A1058-L1086 PolarHBondContact N-O 2.94Å; A1058-L1086 PolarHBondContact O-N 2.8Å; L1071-L1086 HydrophobicContact CD1-CB 3.76Å; L1071-L1086 HydrophobicContact CD1-CD1 3.62Å; L1071-L1086 HydrophobicContact CD1-CG 4.31Å; A1076-L1086 HydrophobicContact CB-CD1 4.44Å; L1079-L1086 HydrophobicContact CD1-CG 4.2Å; L1079-L1086 HydrophobicContact CD2-CD2 4.23Å; L1079-L1086 HydrophobicContact CD2-CG 4.11Å; L1079-L1086 HydrophobicContact CG-CG 4.46Å; L1086-P1095 HydrophobicContact CB-CB 4.19Å; L1086-P1095 HydrophobicContact CD1-CG 4.4Å; L1086-R1097 HydrophobicContact CD2-CB 3.79Å; L1086-R1097 HydrophobicContact CD2-CG 4.17Å
1087	Y	97.4	Very high	93.2	Very high	41 Å²	41	44 Å²	44	16%	0.161	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	123.4	174.2	169.2	-112.3	0	0	0	110.6	L849 M865 T1055 I1057 P1095 V1096	L849-Y1087 HydrophobicContact CD1-CD1 4.28Å; L849-Y1087 HydrophobicContact CD1-CD2 3.84Å; L849-Y1087 HydrophobicContact CD1-CE2 4.12Å; L849-Y1087 HydrophobicContact CD1-CG 3.91Å; M865-Y1087 HydrophobicContact CE-CE2 4.14Å; T1055-Y1087 HydrophobicContact CG2-CD2 4.37Å; T1055-Y1087 HydrophobicContact CG2-CE2 3.53Å; I1057-Y1087 HydrophobicContact CD1-CD2 4.19Å; I1057-Y1087 HydrophobicContact CG1-CD2 3.78Å; Y1087-P1095 CarbonylContact O-C 3.57Å; Y1087-P1095 WeakPolarHBondContact O-CA 3.4Å; Y1087-V1096 PolarHBondContact N-O 2.64Å; Y1087-V1096 PolarHBondContact O-N 2.91Å
1088	S	94.9	Very high	93.4	Very high	9 Å²	9	42 Å²	42	6%	0.063	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	102	174.2	-159.9	0	0	0	0	109.7	T1055 R1056	T1055-S1088 WeakPolarHBondContact CA-O 3.19Å; R1056-S1088 PolarHBondContact N-O 3.2Å; R1056-S1088 PolarHBondContact O-N 2.87Å
1089	G	89.9	Confident	93.6	Very high	12 Å²	12	41.4 Å²	41.4	12%	0.124	24%	0.239	C	C	.	.			trans	-76.4	161.5	176.7	0	0	0	0	0	113.1	N1091 S1092	G1089-N1091 PolarHBondContact O-N 3.17Å; G1089-N1091 VanDerWaalsContact O-N 3.09Å; G1089-S1092 PolarHBondContact O-N 2.69Å
1090	P	86.6	Confident	93.7	Very high	56 Å²	56	41.6 Å²	41.6	36%	0.364	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-13.2	-169.5	30.6	-35.5	0	0	0	114	P1054 T1055	P1054-P1090 HydrophobicContact CB-CB 3.93Å; P1054-P1090 HydrophobicContact CG-CB 3.94Å; T1055-P1090 WeakPolarHBondContact OG1-CD 3.26Å
1091	N	86	Confident	93.8	Very high	167 Å²	167	41 Å²	41	89%	0.893	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-109.8	8.8	-178.3	-60.1	-25.7	0	0	0	112.9	G1089	G1089-N1091 PolarHBondContact O-N 3.17Å; G1089-N1091 VanDerWaalsContact O-N 3.09Å
1092	S	83.2	Confident	93.9	Very high	57 Å²	57	44.3 Å²	44.3	40%	0.399	25%	0.25	S	S	.	.			trans	-133.6	132.3	179.9	-174.6	0	0	0	0	111	G1089 L1094	G1089-S1092 PolarHBondContact O-N 2.69Å; S1092-L1094 PolarHBondContact OG-N 3.07Å; S1092-L1094 PolarHBondContact OG-O 3.07Å
1093	T	83.3	Confident	94	Very high	121 Å²	121	36.6 Å²	36.6	74%	0.742	21%	0.212	S	C	*	.	S	Bend	trans	-80.1	-24.3	168.7	50.7	0	0	0	0	112.5	Q1073	Q1073-T1093 PolarHBondContact NE2-O 3.15Å
1094	L	89.4	Confident	93.9	Very high	82 Å²	82	41.1 Å²	41.1	43%	0.429	23%	0.227	S	C	.	.	S	Bend	trans	-91.4	127.6	179.6	-61.3	-179.6	0	0	0	110.2	P810 S1092	P810-L1094 HydrophobicContact CG-CD1 4.5Å; S1092-L1094 PolarHBondContact OG-N 3.07Å; S1092-L1094 PolarHBondContact OG-O 3.07Å
1095	P	93.7	Very high	93.7	Very high	19 Å²	19	46 Å²	46	12%	0.123	25%	0.253	C	S	.	.	P	Polyproline II helix	trans	-82.9	137.7	179.6	32.2	-33.4	0	0	0	111.2	L1086 Y1087	L1086-P1095 HydrophobicContact CB-CB 4.19Å; L1086-P1095 HydrophobicContact CD1-CG 4.4Å; Y1087-P1095 CarbonylContact O-C 3.57Å; Y1087-P1095 WeakPolarHBondContact O-CA 3.4Å
1096	V	94.2	Very high	93.6	Very high	73 Å²	73	52 Å²	52	44%	0.442	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	130.1	174.6	-178.5	0	0	0	0	108.7	Y1087 V1098	Y1087-V1096 PolarHBondContact N-O 2.64Å; Y1087-V1096 PolarHBondContact O-N 2.91Å; V1096-V1098 HydrophobicContact CG1-CG2 4.22Å
1097	R	97.5	Very high	93.6	Very high	7 Å²	7	52.4 Å²	52.4	3%	0.026	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	128.7	172.3	-173.6	179.7	-168.3	163.3	7.3	109.6	E818 I853 L1079 D1084 M1085 L1086	E818-R1097 VanDerWaalsContact OE2-CD 3.27Å; E818-R1097 WeakPolarHBondContact OE2-CD 3.45Å; E818-R1097 IonicContact OE2-CZ 3.84Å; E818-R1097 IonicContact OE2-NE 2.8Å; E818-R1097 IonicContact OE2-NH1 2.74Å; E818-R1097 PolarHBondContact OE2-NH1 2.95Å; I853-R1097 HydrophobicContact CG2-CB 3.74Å; I853-R1097 HydrophobicContact CG2-CG 3.89Å; L1079-R1097 HydrophobicContact CD2-CG 4.27Å; D1084-R1097 IonicContact OD1-CZ 2.72Å; D1084-R1097 IonicContact OD1-NE 3.92Å; D1084-R1097 PolarHBondContact OD1-NE 3.31Å; D1084-R1097 IonicContact OD1-NH2 3.74Å; D1084-R1097 IonicContact OD2-CZ 2.66Å; D1084-R1097 IonicContact OD2-NE 3.34Å; D1084-R1097 PolarHBondContact OD2-NE 3.24Å; D1084-R1097 IonicContact OD2-NH2 3.57Å; D1084-R1097 PolarHBondContact OD2-NH2 3.27Å; M1085-R1097 WeakPolarHBondContact O-CA 3.36Å; L1086-R1097 HydrophobicContact CD2-CB 3.79Å; L1086-R1097 HydrophobicContact CD2-CG 4.17Å
1098	V	97.9	Very high	93.5	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	133.7	-178.4	-173	0	0	0	0	107.8	L849 K851 V858 M1085 V1096	L849-V1098 HydrophobicContact CB-CG1 4.07Å; K851-V1098 CarbonylContact O-C 3.49Å; K851-V1098 WeakPolarHBondContact O-CA 3.4Å; K851-V1098 VanDerWaalsContact O-CG1 3.29Å; K851-V1098 WeakPolarHBondContact O-CG1 3.3Å; V858-V1098 HydrophobicContact CB-CG1 4.04Å; V858-V1098 HydrophobicContact CB-CG2 4.48Å; V858-V1098 HydrophobicContact CG1-CG1 4.38Å; V858-V1098 HydrophobicContact CG1-CG2 4.14Å; V858-V1098 HydrophobicContact CG2-CG1 4.21Å; V858-V1098 HydrophobicContact CG2-CG2 4.29Å; M1085-V1098 HydrophobicContact CE-CB 4.23Å; M1085-V1098 HydrophobicContact CE-CG1 4Å; M1085-V1098 HydrophobicContact CG-CB 4.08Å; M1085-V1098 WeakPolarHBondContact CG-O 3.37Å; M1085-V1098 PolarHBondContact N-O 2.72Å; M1085-V1098 PolarHBondContact O-N 2.99Å; V1096-V1098 HydrophobicContact CG1-CG2 4.22Å
1099	H	97.9	Very high	93.6	Very high	4 Å²	4	53.4 Å²	53.4	2%	0.019	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	112.3	172.4	-51.8	-44.2	0	0	0	107.6	V770 V827 G850 K851 D1084	V770-H1099 HydrophobicContact CG2-CB 3.85Å; V827-H1099 HydrophobicContact CG2-CB 4.26Å; G850-H1099 WeakPolarHBondContact CA-O 3.41Å; K851-H1099 PolarHBondContact N-O 2.89Å; K851-H1099 PolarHBondContact O-N 3.03Å; D1084-H1099 IonicContact OD1-CE1 3.19Å; D1084-H1099 PolarHBondContact OD1-CE1 2.86Å; D1084-H1099 IonicContact OD1-ND1 3.56Å; D1084-H1099 PolarHBondContact OD1-ND1 2.78Å
1100	G	98	Very high	93.9	Very high	13 Å²	13	54.2 Å²	54.2	13%	0.134	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.8	144.3	-168.6	0	0	0	0	0	114.2	L849 G1083 F1102	L849-G1100 WeakPolarHBondContact O-CA 3.41Å; G1083-G1100 VanDerWaalsContact O-CA 3.3Å; G1083-G1100 WeakPolarHBondContact O-CA 3.25Å; G1083-G1100 PolarHBondContact O-N 3.12Å; G1100-F1102 PolarHBondContact O-N 2.86Å
1101	A	97.9	Very high	94.4	Very high	3 Å²	3	51.5 Å²	51.5	3%	0.025	28%	0.276	C	S	.	.	P	Polyproline II helix	trans	-65.2	121.1	169.8	0	0	0	0	0	110.6	L829 V848 L849 A884	L829-A1101 HydrophobicContact CB-CB 4.36Å; L829-A1101 HydrophobicContact CD1-CB 4.07Å; V848-A1101 HydrophobicContact CG1-CB 3.59Å; L849-A1101 PolarHBondContact O-N 3.29Å; A884-A1101 HydrophobicContact CB-CB 4.36Å
1102	F	97.9	Very high	94.9	Very high	86 Å²	86	43.7 Å²	43.7	38%	0.377	23%	0.234	S	C	.	.	B	Isolated β-bridge	trans	-81.2	137.7	174.8	-176.3	-111.3	0	0	0	111.1	T826 V827 L829 V880 G1100 R1104	T826-F1102 HydrophobicContact CG2-CB 3.76Å; T826-F1102 HydrophobicContact CG2-CD1 3.93Å; T826-F1102 HydrophobicContact CG2-CG 4.07Å; V827-F1102 WeakPolarHBondContact O-CB 3.24Å; V827-F1102 PolarHBondContact O-N 3.13Å; L829-F1102 WeakPolarHBondContact CB-O 3.3Å; L829-F1102 PolarHBondContact N-O 3.29Å; V880-F1102 HydrophobicContact CG1-CD2 4.04Å; G1100-F1102 PolarHBondContact O-N 2.86Å; F1102-R1104 HydrophobicContact CE1-CG 3.61Å; F1102-R1104 HydrophobicContact CZ-CG 3.87Å
1103	V	97.1	Very high	95.4	Very high	3 Å²	3	42.5 Å²	42.5	2%	0.018	22%	0.222	C	C	.	.			trans	-139.7	140.4	171.7	57.2	0	0	0	0	107.9	L829 V880 N883 L887 E1107 V1108	L829-V1103 HydrophobicContact CB-CB 4.38Å; L829-V1103 HydrophobicContact CD2-CB 3.99Å; L829-V1103 HydrophobicContact CD2-CG2 4.1Å; V880-V1103 HydrophobicContact CG1-CG1 3.94Å; N883-V1103 HydrophobicContact CB-CG1 4.09Å; L887-V1103 HydrophobicContact CD2-CG2 4.01Å; V1103-E1107 HydrophobicContact CG2-CB 3.91Å; V1103-V1108 HydrophobicContact CG2-CG2 3.93Å
1104	R	96.2	Very high	96	Very high	103 Å²	103	38.2 Å²	38.2	39%	0.389	20%	0.195	S	C	.	.			trans	-90.5	151.1	173	-59.2	-169.3	-58.6	-82.6	-7	111.1	T728 F1102 Q1106 E1107 V1108	T728-R1104 PolarHBondContact OG1-NH1 3.48Å; T728-R1104 PolarHBondContact OG1-NH2 2.95Å; F1102-R1104 HydrophobicContact CE1-CG 3.61Å; F1102-R1104 HydrophobicContact CZ-CG 3.87Å; R1104-Q1106 PolarHBondContact O-N 2.83Å; R1104-Q1106 VanDerWaalsContact O-N 3.14Å; R1104-E1107 HydrophobicContact CB-CG 4.25Å; R1104-E1107 IonicContact CZ-OE1 3.34Å; R1104-E1107 IonicContact CZ-OE2 3.87Å; R1104-E1107 PolarHBondContact N-OE2 2.85Å; R1104-E1107 IonicContact NH1-OE1 2.69Å; R1104-E1107 IonicContact NH2-OE1 3.44Å; R1104-E1107 WeakPolarHBondContact O-CA 3.31Å; R1104-E1107 WeakPolarHBondContact O-CB 3.35Å; R1104-E1107 PolarHBondContact O-N 2.88Å; R1104-V1108 PolarHBondContact O-N 3.45Å; R1104-V1108 VanDerWaalsContact O-N 3.15Å
1105	D	93.7	Very high	96.3	Very high	107 Å²	107	34.4 Å²	34.4	57%	0.572	18%	0.175	S	C	*	.	H	α-helix	trans	-57.5	-34.6	177.7	-41.3	-39.4	0	0	0	112	E1107 V1108 H1109	D1105-E1107 VanDerWaalsContact C-N 3.28Å; D1105-E1107 PolarHBondContact O-N 2.81Å; D1105-V1108 WeakPolarHBondContact O-CB 3.48Å; D1105-V1108 PolarHBondContact O-N 2.86Å; D1105-H1109 PolarHBondContact O-N 3.37Å; D1105-H1109 PolarHBondContact O-ND1 3.21Å
1106	Q	95.1	Very high	96.4	Very high	129 Å²	129	36.5 Å²	36.5	60%	0.603	18%	0.182	S	C	*	.	H	α-helix	trans	-63.9	-29.5	174.6	-175.4	57.3	80.9	0	0	113.5	R1104 A1110	R1104-Q1106 PolarHBondContact O-N 2.83Å; R1104-Q1106 VanDerWaalsContact O-N 3.14Å; Q1106-A1110 WeakPolarHBondContact O-CB 3.44Å; Q1106-A1110 PolarHBondContact O-N 3.46Å
1107	E	96.9	Very high	96.3	Very high	9 Å²	9	33.8 Å²	33.8	4%	0.042	17%	0.167	C	C	.	.	H	α-helix	trans	-77.2	-38.5	174.9	-62.6	172.9	127.3	0	0	110.4	L727 T728 V1103 R1104 D1105 A1110 V1111	L727-E1107 HydrophobicContact CD2-CB 3.86Å; L727-E1107 HydrophobicContact CD2-CG 4.43Å; T728-E1107 VanDerWaalsContact CB-OE1 3.27Å; T728-E1107 WeakPolarHBondContact CB-OE1 3.45Å; T728-E1107 PolarHBondContact N-OE1 3.46Å; T728-E1107 PolarHBondContact OG1-OE1 2.82Å; V1103-E1107 HydrophobicContact CG2-CB 3.91Å; R1104-E1107 HydrophobicContact CB-CG 4.25Å; R1104-E1107 IonicContact CZ-OE1 3.34Å; R1104-E1107 IonicContact CZ-OE2 3.87Å; R1104-E1107 PolarHBondContact N-OE2 2.85Å; R1104-E1107 IonicContact NH1-OE1 2.69Å; R1104-E1107 IonicContact NH2-OE1 3.44Å; R1104-E1107 WeakPolarHBondContact O-CA 3.31Å; R1104-E1107 WeakPolarHBondContact O-CB 3.35Å; R1104-E1107 PolarHBondContact O-N 2.88Å; D1105-E1107 VanDerWaalsContact C-N 3.28Å; D1105-E1107 PolarHBondContact O-N 2.81Å; E1107-A1110 PolarHBondContact O-N 3.47Å; E1107-V1111 WeakPolarHBondContact O-CG2 3.42Å; E1107-V1111 PolarHBondContact O-N 3.17Å
1108	V	97	Very high	96	Very high	2 Å²	2	34.6 Å²	34.6	1%	0.012	17%	0.17	C	C	.	.	H	α-helix	trans	-58.3	-49.8	169.8	-179.3	0	0	0	0	110.4	N883 L887 V912 Y913 V1103 R1104 D1105 A1110 V1111 V1112	N883-V1108 HydrophobicContact CB-CG2 4.15Å; L887-V1108 HydrophobicContact CD1-CB 4.41Å; L887-V1108 HydrophobicContact CD1-CG1 4.14Å; L887-V1108 HydrophobicContact CD1-CG2 4.07Å; L887-V1108 HydrophobicContact CD2-CG2 4.49Å; V912-V1108 HydrophobicContact CG1-CG1 3.87Å; V912-V1108 HydrophobicContact CG2-CG1 3.97Å; Y913-V1108 HydrophobicContact CE1-CG1 3.71Å; Y913-V1108 HydrophobicContact CE2-CG1 4.37Å; Y913-V1108 WeakPolarHBondContact OH-CG1 3.41Å; V1103-V1108 HydrophobicContact CG2-CG2 3.93Å; R1104-V1108 PolarHBondContact O-N 3.45Å; R1104-V1108 VanDerWaalsContact O-N 3.15Å; D1105-V1108 WeakPolarHBondContact O-CB 3.48Å; D1105-V1108 PolarHBondContact O-N 2.86Å; V1108-A1110 VanDerWaalsContact C-N 3.33Å; V1108-A1110 PolarHBondContact O-N 2.74Å; V1108-V1111 PolarHBondContact O-N 2.87Å; V1108-V1112 HydrophobicContact CG1-CG2 4.36Å; V1108-V1112 WeakPolarHBondContact O-CB 3.4Å; V1108-V1112 VanDerWaalsContact O-CG2 3.32Å; V1108-V1112 WeakPolarHBondContact O-CG2 3.43Å; V1108-V1112 PolarHBondContact O-N 2.78Å
1109	H	96	Very high	95.7	Very high	69 Å²	69	36 Å²	36	32%	0.319	19%	0.185	S	C	.	.	H	α-helix	trans	-58.5	-41.9	176.4	-78.1	80.8	0	0	0	112.3	V912 D1105 V1112 Q1113	V912-H1109 VanDerWaalsContact CG2-CE1 3.48Å; V912-H1109 WeakPolarHBondContact CG2-CE1 3.39Å; D1105-H1109 PolarHBondContact O-N 3.37Å; D1105-H1109 PolarHBondContact O-ND1 3.21Å; H1109-V1112 PolarHBondContact O-N 2.88Å; H1109-Q1113 WeakPolarHBondContact O-CG 3.4Å; H1109-Q1113 PolarHBondContact O-N 3.37Å
1110	A	96	Very high	95.4	Very high	28 Å²	28	46.6 Å²	46.6	23%	0.231	22%	0.224	C	C	.	.	H	α-helix	trans	-62.5	-47.3	178.3	0	0	0	0	0	111.9	L726 Q1106 E1107 V1108 Q1113 D1114	L726-A1110 HydrophobicContact CB-CB 4.48Å; Q1106-A1110 WeakPolarHBondContact O-CB 3.44Å; Q1106-A1110 PolarHBondContact O-N 3.46Å; E1107-A1110 PolarHBondContact O-N 3.47Å; V1108-A1110 VanDerWaalsContact C-N 3.33Å; V1108-A1110 PolarHBondContact O-N 2.74Å; A1110-Q1113 PolarHBondContact O-N 3.06Å; A1110-D1114 WeakPolarHBondContact O-CB 3.28Å; A1110-D1114 PolarHBondContact O-N 3.49Å
1111	V	96.8	Very high	95.2	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-65.8	-38.3	177.8	175.4	0	0	0	0	111.6	P722 L726 L727 L887 L890 Y891 E1107 V1108 W1115	P722-V1111 HydrophobicContact CG-CG1 4.49Å; L726-V1111 HydrophobicContact CB-CG2 4.35Å; L726-V1111 HydrophobicContact CD1-CG2 4.16Å; L727-V1111 HydrophobicContact CD2-CG2 4.23Å; L887-V1111 HydrophobicContact CD2-CB 4.38Å; L887-V1111 HydrophobicContact CD2-CG2 4.04Å; L887-V1111 HydrophobicContact CG-CB 4.44Å; L887-V1111 HydrophobicContact CG-CG1 4.25Å; L890-V1111 HydrophobicContact CB-CG1 4.32Å; L890-V1111 HydrophobicContact CD1-CG1 4.28Å; Y891-V1111 HydrophobicContact CE2-CG1 4.36Å; Y891-V1111 HydrophobicContact CE2-CG2 3.77Å; Y891-V1111 WeakPolarHBondContact OH-CG2 3.35Å; E1107-V1111 WeakPolarHBondContact O-CG2 3.42Å; E1107-V1111 PolarHBondContact O-N 3.17Å; V1108-V1111 PolarHBondContact O-N 2.87Å; V1111-W1115 PolarHBondContact O-N 2.95Å
1112	V	96.4	Very high	95.1	Very high	2 Å²	2	54.1 Å²	54.1	1%	0.012	26%	0.258	C	S	.	.	H	α-helix	trans	-63.3	-45.2	175.1	164	0	0	0	0	111.7	Y913 I916 V1108 H1109 W1115 K1116	Y913-V1112 HydrophobicContact CD1-CG2 3.55Å; Y913-V1112 HydrophobicContact CE1-CG2 4.01Å; Y913-V1112 HydrophobicContact CG-CG2 4.39Å; I916-V1112 HydrophobicContact CG2-CB 4.32Å; I916-V1112 HydrophobicContact CG2-CG1 3.94Å; I916-V1112 HydrophobicContact CG2-CG2 4.1Å; V1108-V1112 HydrophobicContact CG1-CG2 4.36Å; V1108-V1112 WeakPolarHBondContact O-CB 3.4Å; V1108-V1112 VanDerWaalsContact O-CG2 3.32Å; V1108-V1112 WeakPolarHBondContact O-CG2 3.43Å; V1108-V1112 PolarHBondContact O-N 2.78Å; H1109-V1112 PolarHBondContact O-N 2.88Å; V1112-W1115 PolarHBondContact O-N 2.95Å; V1112-K1116 HydrophobicContact CG1-CD 3.85Å; V1112-K1116 VanDerWaalsContact CG1-CE 3.47Å; V1112-K1116 WeakPolarHBondContact O-CG 3.41Å; V1112-K1116 PolarHBondContact O-N 3.46Å
1113	Q	94.5	Very high	95	Very high	32 Å²	32	52.4 Å²	52.4	15%	0.15	25%	0.25	C	C	.	.	H	α-helix	trans	-69.2	-38	179.3	-68.5	-58.4	-22.4	0	0	112.5	N708 H1109 A1110 W1115 K1116 A1117	N708-Q1113 PolarHBondContact O-NE2 3.42Å; H1109-Q1113 WeakPolarHBondContact O-CG 3.4Å; H1109-Q1113 PolarHBondContact O-N 3.37Å; A1110-Q1113 PolarHBondContact O-N 3.06Å; Q1113-W1115 VanDerWaalsContact C-N 3.29Å; Q1113-W1115 PolarHBondContact O-N 3.21Å; Q1113-K1116 PolarHBondContact O-N 3.03Å; Q1113-A1117 WeakPolarHBondContact O-CB 3.39Å; Q1113-A1117 PolarHBondContact O-N 3.25Å
1114	D	95.7	Very high	94.8	Very high	31 Å²	31	54.8 Å²	54.8	17%	0.166	26%	0.264	C	S	.	.	H	α-helix	trans	-62.4	-35.5	173.1	-174.2	55.6	0	0	0	111.8	P717 P722 L726 A1110 R1118	P717-D1114 WeakPolarHBondContact CG-OD1 3.49Å; P722-D1114 VanDerWaalsContact CA-OD2 3.23Å; P722-D1114 WeakPolarHBondContact CA-OD2 3.4Å; P722-D1114 VanDerWaalsContact CB-OD2 3.24Å; P722-D1114 WeakPolarHBondContact CB-OD2 3.21Å; L726-D1114 HydrophobicContact CD1-CB 3.77Å; A1110-D1114 WeakPolarHBondContact O-CB 3.28Å; A1110-D1114 PolarHBondContact O-N 3.49Å; D1114-R1118 VanDerWaalsContact CG-NH1 3.28Å; D1114-R1118 PolarHBondContact O-NH1 2.86Å; D1114-R1118 VanDerWaalsContact O-NH1 3.11Å; D1114-R1118 IonicContact OD1-CZ 3.4Å; D1114-R1118 IonicContact OD1-NH1 3.97Å; D1114-R1118 IonicContact OD1-NH2 2.68Å; D1114-R1118 PolarHBondContact OD1-NH2 3.11Å; D1114-R1118 IonicContact OD2-CZ 3.22Å; D1114-R1118 IonicContact OD2-NH1 2.87Å; D1114-R1118 PolarHBondContact OD2-NH1 3.43Å; D1114-R1118 IonicContact OD2-NH2 2.66Å; D1114-R1118 PolarHBondContact OD2-NH2 3.33Å
1115	W	96.2	Very high	94.4	Very high	3 Å²	3	57.2 Å²	57.2	1%	0.011	29%	0.285	C	S	.	.	H	α-helix	trans	-71.6	-42.2	171.2	-90.6	113.8	0	0	0	114.1	L721 L890 P895 I916 P917 H918 V1111 V1112 Q1113 A1117 R1118 G1119	L721-W1115 HydrophobicContact CD2-CH2 4.07Å; L721-W1115 HydrophobicContact CD2-CZ2 3.81Å; L890-W1115 WeakPolarHBondContact O-CZ2 3.22Å; L890-W1115 PolarHBondContact O-NE1 2.89Å; P895-W1115 HydrophobicContact CG-CZ3 4.5Å; I916-W1115 HydrophobicContact CG2-CB 4.38Å; P917-W1115 HydrophobicContact CG-CE3 3.8Å; P917-W1115 HydrophobicContact CG-CZ3 4.41Å; H918-W1115 AromaticContact CE1-CD2 3.66Å; H918-W1115 AromaticContact CE1-CE2 3.62Å; H918-W1115 AromaticContact CE1-CE3 3.67Å; H918-W1115 AromaticContact CE1-CH2 3.6Å; H918-W1115 AromaticContact CE1-CZ2 3.59Å; H918-W1115 AromaticContact CE1-CZ3 3.64Å; V1111-W1115 PolarHBondContact O-N 2.95Å; V1112-W1115 PolarHBondContact O-N 2.95Å; Q1113-W1115 VanDerWaalsContact C-N 3.29Å; Q1113-W1115 PolarHBondContact O-N 3.21Å; W1115-A1117 PolarHBondContact O-N 3.41Å; W1115-R1118 HydrophobicContact CE3-CB 4.29Å; W1115-R1118 WeakPolarHBondContact O-CB 3.39Å; W1115-R1118 PolarHBondContact O-N 3.38Å; W1115-G1119 PolarHBondContact O-N 3.16Å
1116	K	94.9	Very high	94.2	Very high	62 Å²	62	53.3 Å²	53.3	27%	0.27	27%	0.27	S	S	.	.	H	α-helix	trans	-58.9	-34.5	173.2	-75.7	167.7	176.7	175.1	0	112.4	E914 G915 V1112 Q1113 R1118	E914-K1116 WeakPolarHBondContact O-CE 3.48Å; E914-K1116 PolarHBondContact O-NZ 2.93Å; G915-K1116 WeakPolarHBondContact O-CG 3.42Å; V1112-K1116 HydrophobicContact CG1-CD 3.85Å; V1112-K1116 VanDerWaalsContact CG1-CE 3.47Å; V1112-K1116 WeakPolarHBondContact O-CG 3.41Å; V1112-K1116 PolarHBondContact O-N 3.46Å; Q1113-K1116 PolarHBondContact O-N 3.03Å; K1116-R1118 VanDerWaalsContact C-N 3.27Å; K1116-R1118 PolarHBondContact O-N 3.17Å
1117	A	92.4	Very high	94.1	Very high	16 Å²	16	47.2 Å²	47.2	13%	0.132	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-20.2	174.5	0	0	0	0	0	113.8	L714 K716 P717 Q1113 W1115	L714-A1117 HydrophobicContact CB-CB 3.62Å; L714-A1117 HydrophobicContact CD1-CB 4.27Å; L714-A1117 HydrophobicContact CG-CB 4.44Å; K716-A1117 WeakPolarHBondContact CG-O 3.25Å; P717-A1117 HydrophobicContact CG-CB 4.38Å; Q1113-A1117 WeakPolarHBondContact O-CB 3.39Å; Q1113-A1117 PolarHBondContact O-N 3.25Å; W1115-A1117 PolarHBondContact O-N 3.41Å
1118	R	92.4	Very high	93.7	Very high	25 Å²	25	48.7 Å²	48.7	9%	0.094	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.7	-39.7	175.2	-68.8	-174.3	-176.1	81.1	14	112.5	K716 P717 T719 P720 L721 D1114 W1115 K1116	K716-R1118 WeakPolarHBondContact CE-O 3.42Å; K716-R1118 PolarHBondContact NZ-O 3.25Å; P717-R1118 HydrophobicContact CB-CG 4.43Å; P717-R1118 VanDerWaalsContact CB-NH2 3.32Å; P717-R1118 HydrophobicContact CG-CG 4.13Å; T719-R1118 PolarHBondContact O-NE 2.7Å; T719-R1118 PolarHBondContact OG1-NH2 2.64Å; P720-R1118 WeakPolarHBondContact O-CD 3.36Å; L721-R1118 PolarHBondContact O-NH2 2.91Å; L721-R1118 VanDerWaalsContact O-NH2 3.15Å; D1114-R1118 VanDerWaalsContact CG-NH1 3.28Å; D1114-R1118 PolarHBondContact O-NH1 2.86Å; D1114-R1118 VanDerWaalsContact O-NH1 3.11Å; D1114-R1118 IonicContact OD1-CZ 3.4Å; D1114-R1118 IonicContact OD1-NH1 3.97Å; D1114-R1118 IonicContact OD1-NH2 2.68Å; D1114-R1118 PolarHBondContact OD1-NH2 3.11Å; D1114-R1118 IonicContact OD2-CZ 3.22Å; D1114-R1118 IonicContact OD2-NH1 2.87Å; D1114-R1118 PolarHBondContact OD2-NH1 3.43Å; D1114-R1118 IonicContact OD2-NH2 2.66Å; D1114-R1118 PolarHBondContact OD2-NH2 3.33Å; W1115-R1118 HydrophobicContact CE3-CB 4.29Å; W1115-R1118 WeakPolarHBondContact O-CB 3.39Å; W1115-R1118 PolarHBondContact O-N 3.38Å; K1116-R1118 VanDerWaalsContact C-N 3.27Å; K1116-R1118 PolarHBondContact O-N 3.17Å
1119	G	90.6	Very high	93.1	Very high	29 Å²	29	50.9 Å²	50.9	30%	0.299	27%	0.267	S	S	.	.			trans	-173.2	162.2	179.6	0	0	0	0	0	113.8	W1115	W1115-G1119 PolarHBondContact O-N 3.16Å
1120	R	92.3	Very high	91.8	Very high	227 Å²	227	49.8 Å²	49.8	86%	0.857	26%	0.263	S	S	*	.			trans	-83.7	157.9	171.2	-68.6	-176	179.8	-170.2	-2	110.6
1121	P	94.2	Very high	89.9	Confident	34 Å²	34	52 Å²	52	22%	0.221	28%	0.277	C	S	.	.			trans	-60.7	142.1	168.1	27.5	-35.7	0	0	0	111.3	G915 Y1123	G915-P1121 WeakPolarHBondContact O-CD 3.22Å; P1121-Y1123 HydrophobicContact CB-CD1 3.69Å; P1121-Y1123 HydrophobicContact CB-CE1 3.28Å; P1121-Y1123 HydrophobicContact CB-CE2 4.44Å; P1121-Y1123 HydrophobicContact CB-CG 4.41Å; P1121-Y1123 HydrophobicContact CG-CD1 4.29Å; P1121-Y1123 HydrophobicContact CG-CE1 3.65Å; P1121-Y1123 HydrophobicContact CG-CE2 4Å; P1121-Y1123 VanDerWaalsContact CG-CZ 3.47Å
1122	Q	94.5	Very high	87.7	Confident	139 Å²	139	58.1 Å²	58.1	65%	0.65	31%	0.306	S	S	*	.			trans	-98.5	97.7	156.7	179.1	60.9	66.8	0	0	106.5	R899	R899-Q1122 PolarHBondContact NH1-O 3.39Å; R899-Q1122 PolarHBondContact NH2-O 2.88Å
1123	Y	95.8	Very high	85.1	Confident	51 Å²	51	62.4 Å²	62.4	20%	0.2	34%	0.336	C	S	.	.			trans	-69.6	159.9	171.4	-62.6	-33.1	0	0	0	111	E914 L919 L920 T921 E922 P1121	E914-Y1123 PolarHBondContact OE1-OH 3.47Å; L919-Y1123 HydrophobicContact CB-CE1 3.82Å; L919-Y1123 WeakPolarHBondContact O-CD1 3.47Å; L920-Y1123 CarbonylContact O-C 3.48Å; L920-Y1123 VanDerWaalsContact O-CA 3.25Å; L920-Y1123 WeakPolarHBondContact O-CA 3.44Å; T921-Y1123 VanDerWaalsContact C-CE1 3.48Å; E922-Y1123 HydrophobicContact CG-CD2 4.06Å; E922-Y1123 HydrophobicContact CG-CE1 4.49Å; E922-Y1123 HydrophobicContact CG-CE2 3.29Å; P1121-Y1123 HydrophobicContact CB-CD1 3.69Å; P1121-Y1123 HydrophobicContact CB-CE1 3.28Å; P1121-Y1123 HydrophobicContact CB-CE2 4.44Å; P1121-Y1123 HydrophobicContact CB-CG 4.41Å; P1121-Y1123 HydrophobicContact CG-CD1 4.29Å; P1121-Y1123 HydrophobicContact CG-CE1 3.65Å; P1121-Y1123 HydrophobicContact CG-CE2 4Å; P1121-Y1123 VanDerWaalsContact CG-CZ 3.47Å
1124	V	93.5	Very high	82.4	Confident	53 Å²	53	68.2 Å²	68.2	32%	0.321	36%	0.363	S	S	.	.			trans	-122.2	115.2	178.4	175.4	0	0	0	0	107	L920 W936 I1127	L920-V1124 HydrophobicContact CD2-CG2 3.79Å; L920-V1124 PolarHBondContact O-N 2.87Å; W936-V1124 HydrophobicContact CZ2-CG1 4.35Å; V1124-I1127 HydrophobicContact CB-CD1 3.89Å; V1124-I1127 HydrophobicContact CB-CG1 4.35Å; V1124-I1127 HydrophobicContact CG1-CD1 4.3Å; V1124-I1127 HydrophobicContact CG1-CG1 4.35Å; V1124-I1127 WeakPolarHBondContact O-CG1 3.49Å
1125	D	88	Confident	79.4	Confident	153 Å²	153	69.6 Å²	69.6	82%	0.818	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.2	151.4	-180	-47.5	-57.5	0	0	0	110.4
1126	G	88.7	Confident	76.3	Confident	26 Å²	26	73.2 Å²	73.2	27%	0.268	42%	0.423	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.8	10.6	-178.4	0	0	0	0	0	116.2
1127	I	92.6	Very high	73.2	Confident	1 Å²	1	73.5 Å²	73.5	1%	0.005	44%	0.437	C	S	.	.	S	Bend	trans	-76.4	-42.3	170.5	-67	-176.8	0	0	0	111.6	I901 L920 T921 N932 A933 W936 V1124	I901-I1127 HydrophobicContact CD1-CD1 4.4Å; I901-I1127 HydrophobicContact CD1-CG2 4.22Å; L920-I1127 HydrophobicContact CB-CD1 3.71Å; T921-I1127 HydrophobicContact CG2-CB 4.34Å; T921-I1127 HydrophobicContact CG2-CD1 4.49Å; T921-I1127 HydrophobicContact CG2-CG2 3.74Å; N932-I1127 CarbonylContact C-O 3.59Å; N932-I1127 VanDerWaalsContact C-O 3.23Å; A933-I1127 VanDerWaalsContact CA-O 3.3Å; A933-I1127 WeakPolarHBondContact CA-O 3.42Å; A933-I1127 HydrophobicContact CB-CG2 3.79Å; A933-I1127 PolarHBondContact N-O 3.42Å; A933-I1127 VanDerWaalsContact N-O 3.15Å; W936-I1127 HydrophobicContact CD2-CD1 4.19Å; W936-I1127 HydrophobicContact CD2-CG1 3.68Å; W936-I1127 HydrophobicContact CE3-CD1 4.26Å; W936-I1127 HydrophobicContact CE3-CG1 4.19Å; W936-I1127 HydrophobicContact CG-CB 4.33Å; W936-I1127 HydrophobicContact CG-CG1 3.87Å; W936-I1127 HydrophobicContact CG-CG2 4.48Å; W936-I1127 HydrophobicContact CH2-CD1 4.26Å; W936-I1127 HydrophobicContact CZ2-CD1 4.13Å; W936-I1127 HydrophobicContact CZ2-CG1 4.19Å; W936-I1127 HydrophobicContact CZ3-CD1 4.31Å; V1124-I1127 HydrophobicContact CB-CD1 3.89Å; V1124-I1127 HydrophobicContact CB-CG1 4.35Å; V1124-I1127 HydrophobicContact CG1-CD1 4.3Å; V1124-I1127 HydrophobicContact CG1-CG1 4.35Å; V1124-I1127 WeakPolarHBondContact O-CG1 3.49Å
1128	T	89.8	Confident	70.3	Confident	39 Å²	39	76 Å²	76	24%	0.239	46%	0.464	C	S	.	.	S	Bend	trans	-96.4	-31.5	-175.8	47.4	0	0	0	0	113.6	V924 D929 N932	V924-T1128 HydrophobicContact CG2-CG2 4.13Å; D929-T1128 HydrophobicContact CB-CG2 4.06Å; N932-T1128 WeakPolarHBondContact CB-O 3.24Å; N932-T1128 PolarHBondContact ND2-O 2.96Å
1129	S	84.3	Confident	67.4	Low	49 Å²	49	78.4 Å²	78.4	34%	0.343	50%	0.496	S	S	.	.	S	Bend	trans	-70.8	143.2	-180	59.6	0	0	0	0	112.8	S1131	S1129-S1131 PolarHBondContact O-N 3.46Å
1130	D	69.1	Low	64.5	Low	46 Å²	46	85.3 Å²	85.3	25%	0.246	52%	0.519	C	S	.	.			trans	-80	71.3	176.3	-147.1	-33.9	0	0	0	109.5	N932 R935 K1014 E1132 S1133	N932-D1130 PolarHBondContact ND2-N 3Å; N932-D1130 PolarHBondContact OD1-OD2 3.38Å; R935-D1130 IonicContact CZ-OD1 3.93Å; R935-D1130 IonicContact CZ-OD2 3.39Å; R935-D1130 IonicContact NH1-OD1 2.64Å; R935-D1130 PolarHBondContact NH1-OD1 3.15Å; R935-D1130 IonicContact NH1-OD2 2.74Å; R935-D1130 PolarHBondContact NH1-OD2 3.47Å; R935-D1130 IonicContact NH2-OD1 3.09Å; R935-D1130 PolarHBondContact NH2-OD1 3.07Å; R935-D1130 IonicContact NH2-OD2 3.36Å; K1014-D1130 IonicContact NZ-OD2 3.17Å; D1130-E1132 PolarHBondContact O-N 2.86Å; D1130-S1133 PolarHBondContact O-N 3.4Å
1131	S	55.1	Low	61.9	Low	74 Å²	74	81.9 Å²	81.9	52%	0.517	52%	0.517	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-5	-176.1	40	0	0	0	0	115	S1129	S1129-S1131 PolarHBondContact O-N 3.46Å
1132	E	51	Low	59.2	Low	128 Å²	128	84.1 Å²	84.1	60%	0.598	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.2	-8	168.4	-65.8	179.4	153.5	0	0	113.1	R935 D1130	R935-E1132 IonicContact CZ-OE2 2.77Å; R935-E1132 IonicContact NE-OE2 3.33Å; R935-E1132 PolarHBondContact NE-OE2 3.46Å; R935-E1132 IonicContact NH2-OE2 3.84Å; R935-E1132 PolarHBondContact NH2-OE2 3.38Å; D1130-E1132 PolarHBondContact O-N 2.86Å
1133	S	42.7	Very low	56.8	Low	93 Å²	93	81.9 Å²	81.9	65%	0.65	55%	0.551	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.5	-33.7	176.7	-67.2	0	0	0	0	113.8	D1130 G1135	D1130-S1133 PolarHBondContact O-N 3.4Å; S1133-G1135 VanDerWaalsContact C-N 3.35Å
1134	E	36.8	Very low	55	Low	153 Å²	153	86.2 Å²	86.2	72%	0.715	57%	0.574	S	S	*	*	G	3₁₀ helix	trans	-84.5	-10.1	171.3	-67.6	-178.8	128.6	0	0	112.9	G1136	E1134-G1136 PolarHBondContact O-N 3.37Å
1135	G	33.6	Very low	53.9	Low	61 Å²	61	92.2 Å²	92.2	63%	0.629	60%	0.598	S	S	*	*	G	3₁₀ helix	trans	-74.3	3.4	171.9	0	0	0	0	0	115.1	S1133	S1133-G1135 VanDerWaalsContact C-N 3.35Å
1136	G	30.8	Very low	53.6	Low	78 Å²	78	88.6 Å²	88.6	80%	0.804	58%	0.579	S	S	*	*	G	3₁₀ helix	trans	-82.1	-7.7	179.2	0	0	0	0	0	115.2	E1134	E1134-G1136 PolarHBondContact O-N 3.37Å
1137	A	30.2	Very low	53.7	Low	69 Å²	69	87.6 Å²	87.6	57%	0.57	57%	0.567	S	S	*	*	S	Bend	trans	-130	145.7	-177.7	0	0	0	0	0	112	G1139	A1137-G1139 VanDerWaalsContact C-N 3.32Å; A1137-G1139 PolarHBondContact O-N 3.28Å; A1137-G1139 VanDerWaalsContact O-N 3.15Å
1138	G	29.7	Very low	53.6	Low	68 Å²	68	92.9 Å²	92.9	70%	0.701	60%	0.601	S	S	*	*	S	Bend	trans	77	-9.8	165.4	0	0	0	0	0	118.6	F1140	G1138-F1140 PolarHBondContact O-N 2.98Å; G1138-F1140 VanDerWaalsContact O-N 3.07Å
1139	G	32.2	Very low	53.7	Low	75 Å²	75	92.6 Å²	92.6	77%	0.773	60%	0.598	S	S	*	*			trans	-74.3	91.1	-179.9	0	0	0	0	0	114.4	A1137 D1141	A1137-G1139 VanDerWaalsContact C-N 3.32Å; A1137-G1139 PolarHBondContact O-N 3.28Å; A1137-G1139 VanDerWaalsContact O-N 3.15Å; G1139-D1141 PolarHBondContact O-N 3.41Å
1140	F	30.7	Very low	54.2	Low	174 Å²	174	90.8 Å²	90.8	76%	0.763	58%	0.584	S	S	*	*			trans	-66	99.5	177.1	-98.6	-110.2	0	0	0	113.1	G1138	G1138-F1140 PolarHBondContact O-N 2.98Å; G1138-F1140 VanDerWaalsContact O-N 3.07Å
1141	D	36.3	Very low	55.3	Low	156 Å²	156	94.5 Å²	94.5	83%	0.834	60%	0.604	S	S	*	*			trans	-126.1	105.8	154.5	-160.1	3.2	0	0	0	109.2	G1139 A1143	G1139-D1141 PolarHBondContact O-N 3.41Å; D1141-A1143 PolarHBondContact O-N 2.92Å
1142	G	38.8	Very low	57	Low	80 Å²	80	96 Å²	96	83%	0.825	60%	0.603	S	S	*	*			trans	-83.5	80.3	-157.4	0	0	0	0	0	114.7
1143	A	43.1	Very low	59.1	Low	92 Å²	92	89.9 Å²	89.9	76%	0.76	57%	0.574	S	S	*	*			trans	-147.7	1.1	176.3	0	0	0	0	0	117.5	D1141 E1145	D1141-A1143 PolarHBondContact O-N 2.92Å; A1143-E1145 PolarHBondContact O-N 2.78Å
1144	E	57.5	Low	61.5	Low	142 Å²	142	86.8 Å²	86.8	66%	0.664	55%	0.551	S	S	*	*			trans	-69.1	120.7	166.2	-86.5	-130.6	140.8	0	0	109.9	L1146 Q1185	E1144-L1146 PolarHBondContact O-N 2.92Å; E1144-Q1185 PolarHBondContact OE2-NE2 2.74Å; E1144-Q1185 VanDerWaalsContact OE2-NE2 3.08Å
1145	E	70.3	Confident	64.1	Low	180 Å²	180	84.7 Å²	84.7	84%	0.841	54%	0.541	S	S	*	.			trans	-65.1	112.7	169.9	-171.3	172.7	-154.3	0	0	108.5	A1143 D1147	A1143-E1145 PolarHBondContact O-N 2.78Å; E1145-D1147 PolarHBondContact O-N 2.84Å
1146	L	83.7	Confident	66.9	Low	77 Å²	77	83 Å²	83	40%	0.403	52%	0.517	S	S	.	.			trans	-51.7	140.5	178.4	-70.5	172.5	0	0	0	110	E1144 F1150	E1144-L1146 PolarHBondContact O-N 2.92Å; L1146-F1150 HydrophobicContact CB-CB 4.3Å; L1146-F1150 HydrophobicContact CB-CG 4.41Å; L1146-F1150 HydrophobicContact CD1-CD1 3.97Å; L1146-F1150 HydrophobicContact CD1-CE1 4.19Å; L1146-F1150 HydrophobicContact CD2-CD1 4.2Å; L1146-F1150 HydrophobicContact CD2-CD2 4.35Å; L1146-F1150 HydrophobicContact CD2-CE1 4.22Å; L1146-F1150 HydrophobicContact CD2-CE2 4.39Å; L1146-F1150 HydrophobicContact CD2-CG 4.25Å; L1146-F1150 HydrophobicContact CD2-CZ 4.32Å; L1146-F1150 HydrophobicContact CG-CD1 4.48Å
1147	D	90.4	Very high	69.9	Low	5 Å²	5	79.2 Å²	79.2	3%	0.027	48%	0.478	C	S	.	.			trans	-55.9	135.5	-179	-168	-68.1	0	0	0	110.4	E1145 L1149 F1150 R1178 R1181 I1182	E1145-D1147 PolarHBondContact O-N 2.84Å; D1147-L1149 PolarHBondContact O-N 2.86Å; D1147-L1149 PolarHBondContact OD1-N 2.87Å; D1147-L1149 VanDerWaalsContact OD1-N 3.12Å; D1147-F1150 WeakPolarHBondContact O-CB 3.18Å; D1147-F1150 PolarHBondContact O-N 3.14Å; D1147-R1178 IonicContact OD1-CZ 3.33Å; D1147-R1178 IonicContact OD1-NE 3.17Å; D1147-R1178 PolarHBondContact OD1-NE 3.3Å; D1147-R1178 VanDerWaalsContact OD1-NE 3.17Å; D1147-R1178 IonicContact OD1-NH2 2.68Å; D1147-R1178 PolarHBondContact OD1-NH2 3.17Å; D1147-R1178 WeakPolarHBondContact OD2-CG 3.48Å; D1147-R1178 IonicContact OD2-CZ 3.62Å; D1147-R1178 IonicContact OD2-NE 2.79Å; D1147-R1178 PolarHBondContact OD2-NE 3.11Å; D1147-R1178 IonicContact OD2-NH2 3.61Å; D1147-R1181 IonicContact OD2-CZ 2.71Å; D1147-R1181 IonicContact OD2-NH2 2.74Å; D1147-R1181 PolarHBondContact OD2-NH2 3.25Å; D1147-I1182 HydrophobicContact CB-CD1 4.03Å; D1147-I1182 HydrophobicContact CB-CG1 3.72Å
1148	P	90.4	Very high	72.8	Confident	111 Å²	111	76.5 Å²	76.5	72%	0.721	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-4.3	-178.7	-28.9	36.2	0	0	0	116.4
1149	L	91.8	Very high	75.6	Confident	33 Å²	33	78.1 Å²	78.1	17%	0.173	44%	0.444	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.6	1.5	172	-65.1	172.3	0	0	0	113.6	D1147 Q1152 A1153 F1172 I1174 I1182	D1147-L1149 PolarHBondContact O-N 2.86Å; D1147-L1149 PolarHBondContact OD1-N 2.87Å; D1147-L1149 VanDerWaalsContact OD1-N 3.12Å; L1149-Q1152 PolarHBondContact O-N 2.91Å; L1149-A1153 WeakPolarHBondContact O-CB 3.36Å; L1149-A1153 PolarHBondContact O-N 3.18Å; L1149-F1172 HydrophobicContact CD1-CB 4.26Å; L1149-F1172 HydrophobicContact CD2-CD1 4.38Å; L1149-I1174 HydrophobicContact CD1-CG2 3.66Å; L1149-I1182 HydrophobicContact CB-CD1 4.31Å
1150	F	93.8	Very high	78.4	Confident	11 Å²	11	80.8 Å²	80.8	5%	0.048	43%	0.434	C	S	.	.	H	α-helix	trans	-56.7	-56.4	-172.7	-176.9	-100.7	0	0	0	112.3	L1146 D1147 Q1152 A1153 V1154 Q1185 M1186 Q1189 I1191	L1146-F1150 HydrophobicContact CB-CB 4.3Å; L1146-F1150 HydrophobicContact CB-CG 4.41Å; L1146-F1150 HydrophobicContact CD1-CD1 3.97Å; L1146-F1150 HydrophobicContact CD1-CE1 4.19Å; L1146-F1150 HydrophobicContact CD2-CD1 4.2Å; L1146-F1150 HydrophobicContact CD2-CD2 4.35Å; L1146-F1150 HydrophobicContact CD2-CE1 4.22Å; L1146-F1150 HydrophobicContact CD2-CE2 4.39Å; L1146-F1150 HydrophobicContact CD2-CG 4.25Å; L1146-F1150 HydrophobicContact CD2-CZ 4.32Å; L1146-F1150 HydrophobicContact CG-CD1 4.48Å; D1147-F1150 WeakPolarHBondContact O-CB 3.18Å; D1147-F1150 PolarHBondContact O-N 3.14Å; F1150-Q1152 VanDerWaalsContact C-N 3.28Å; F1150-Q1152 PolarHBondContact O-N 3.14Å; F1150-A1153 CarbonylContact O-C 3.54Å; F1150-A1153 WeakPolarHBondContact O-CA 3.41Å; F1150-A1153 WeakPolarHBondContact O-CB 3.3Å; F1150-A1153 PolarHBondContact O-N 3.04Å; F1150-V1154 HydrophobicContact CD1-CG2 4.03Å; F1150-V1154 HydrophobicContact CE1-CG2 3.7Å; F1150-V1154 HydrophobicContact CE2-CG2 4.21Å; F1150-V1154 HydrophobicContact CG-CG2 4.44Å; F1150-V1154 HydrophobicContact CZ-CG2 3.8Å; F1150-V1154 WeakPolarHBondContact O-CG2 3.49Å; F1150-V1154 PolarHBondContact O-N 3.09Å; F1150-Q1185 HydrophobicContact CD2-CB 3.99Å; F1150-Q1185 HydrophobicContact CE2-CB 3.59Å; F1150-M1186 HydrophobicContact CE2-CG 3.76Å; F1150-M1186 HydrophobicContact CZ-CG 4.18Å; F1150-Q1189 HydrophobicContact CZ-CB 4.43Å; F1150-Q1189 HydrophobicContact CZ-CG 4.09Å; F1150-I1191 HydrophobicContact CE1-CD1 4.12Å; F1150-I1191 HydrophobicContact CZ-CD1 3.82Å
1151	D	92	Very high	81.2	Confident	125 Å²	125	78.5 Å²	78.5	67%	0.668	42%	0.421	S	S	*	.	H	α-helix	trans	-58	-40.1	-178.9	-59.5	-26.5	0	0	0	112.5	V1154 Q1155	D1151-V1154 PolarHBondContact O-N 2.82Å; D1151-Q1155 PolarHBondContact O-N 3.2Å
1152	Q	92.4	Very high	83.7	Confident	105 Å²	105	76.4 Å²	76.4	49%	0.491	40%	0.404	S	S	.	.	H	α-helix	trans	-67.9	-39	177.7	-55.3	179	23.9	0	0	111.2	L1149 F1150 F1156 F1172	L1149-Q1152 PolarHBondContact O-N 2.91Å; F1150-Q1152 VanDerWaalsContact C-N 3.28Å; F1150-Q1152 PolarHBondContact O-N 3.14Å; Q1152-F1156 WeakPolarHBondContact O-CB 3.42Å; Q1152-F1156 PolarHBondContact O-N 3.06Å; Q1152-F1172 HydrophobicContact CB-CE1 3.64Å; Q1152-F1172 HydrophobicContact CB-CZ 4Å; Q1152-F1172 WeakPolarHBondContact O-CZ 3.47Å
1153	A	93.7	Very high	86.1	Confident	0 Å²	0	72.7 Å²	72.7	0%	0	37%	0.365	C	S	.	.	H	α-helix	trans	-69.2	-36.5	175.6	0	0	0	0	0	111.8	L1149 F1150 F1156 V1157 V1168 F1172 I1182 M1186	L1149-A1153 WeakPolarHBondContact O-CB 3.36Å; L1149-A1153 PolarHBondContact O-N 3.18Å; F1150-A1153 CarbonylContact O-C 3.54Å; F1150-A1153 WeakPolarHBondContact O-CA 3.41Å; F1150-A1153 WeakPolarHBondContact O-CB 3.3Å; F1150-A1153 PolarHBondContact O-N 3.04Å; A1153-F1156 PolarHBondContact O-N 3.3Å; A1153-V1157 WeakPolarHBondContact O-CB 3.49Å; A1153-V1157 VanDerWaalsContact O-CG2 3.3Å; A1153-V1157 WeakPolarHBondContact O-CG2 3.25Å; A1153-V1157 PolarHBondContact O-N 2.84Å; A1153-V1168 HydrophobicContact CB-CG1 4.11Å; A1153-F1172 HydrophobicContact CB-CD2 4.36Å; A1153-F1172 HydrophobicContact CB-CE2 3.9Å; A1153-F1172 HydrophobicContact CB-CZ 4.31Å; A1153-I1182 HydrophobicContact CB-CG2 3.61Å; A1153-M1186 HydrophobicContact CB-CE 3.46Å; A1153-M1186 VanDerWaalsContact CB-CE 3.46Å; A1153-M1186 WeakPolarHBondContact O-CE 3.49Å
1154	V	93.4	Very high	88.4	Confident	27 Å²	27	70.2 Å²	70.2	16%	0.164	34%	0.343	C	S	.	.	H	α-helix	trans	-61.3	-50.2	173	167.7	0	0	0	0	109.6	F1150 D1151 F1156 V1157 T1158 M1186 I1191	F1150-V1154 HydrophobicContact CD1-CG2 4.03Å; F1150-V1154 HydrophobicContact CE1-CG2 3.7Å; F1150-V1154 HydrophobicContact CE2-CG2 4.21Å; F1150-V1154 HydrophobicContact CG-CG2 4.44Å; F1150-V1154 HydrophobicContact CZ-CG2 3.8Å; F1150-V1154 WeakPolarHBondContact O-CG2 3.49Å; F1150-V1154 PolarHBondContact O-N 3.09Å; D1151-V1154 PolarHBondContact O-N 2.82Å; V1154-F1156 PolarHBondContact O-N 3.03Å; V1154-V1157 PolarHBondContact O-N 3.08Å; V1154-T1158 WeakPolarHBondContact O-CG2 3.3Å; V1154-T1158 PolarHBondContact O-N 2.82Å; V1154-T1158 PolarHBondContact O-OG1 3.35Å; V1154-T1158 VanDerWaalsContact O-OG1 3.1Å; V1154-M1186 HydrophobicContact CG2-CE 3.93Å; V1154-M1186 HydrophobicContact CG2-CG 3.98Å; V1154-M1186 HydrophobicContact CG2-SD 4.33Å; V1154-I1191 HydrophobicContact CG1-CD1 4.06Å; V1154-I1191 HydrophobicContact CG1-CG2 4.06Å; V1154-I1191 HydrophobicContact CG2-CD1 3.57Å; V1154-I1191 HydrophobicContact CG2-CG2 4.46Å
1155	Q	91.3	Very high	90.1	Very high	109 Å²	109	65.2 Å²	65.2	51%	0.509	32%	0.32	S	S	.	.	H	α-helix	trans	-56.6	-47.6	175.1	179.8	177.1	-5.5	0	0	111.6	D1151 V1157 T1158 E1159	D1151-Q1155 PolarHBondContact O-N 3.2Å; Q1155-V1157 VanDerWaalsContact C-N 3.34Å; Q1155-V1157 PolarHBondContact O-N 3.26Å; Q1155-T1158 PolarHBondContact O-N 2.92Å; Q1155-T1158 PolarHBondContact O-OG1 3.31Å; Q1155-T1158 VanDerWaalsContact O-OG1 3.1Å; Q1155-E1159 HydrophobicContact CG-CG 4.28Å; Q1155-E1159 VanDerWaalsContact CG-OE1 3.25Å; Q1155-E1159 WeakPolarHBondContact CG-OE1 3.48Å; Q1155-E1159 PolarHBondContact NE2-OE1 2.88Å; Q1155-E1159 VanDerWaalsContact O-CB 3.32Å; Q1155-E1159 WeakPolarHBondContact O-CB 3.1Å; Q1155-E1159 VanDerWaalsContact O-CG 3.29Å; Q1155-E1159 WeakPolarHBondContact O-CG 3.49Å; Q1155-E1159 PolarHBondContact O-N 3.24Å
1156	F	93.2	Very high	91.1	Very high	25 Å²	25	59.5 Å²	59.5	11%	0.11	30%	0.3	C	S	.	.	H	α-helix	trans	-60.4	-40.9	177.1	171.8	-99.9	0	0	0	112.7	Q1152 A1153 V1154 K1160 Q1171 F1172	Q1152-F1156 WeakPolarHBondContact O-CB 3.42Å; Q1152-F1156 PolarHBondContact O-N 3.06Å; A1153-F1156 PolarHBondContact O-N 3.3Å; V1154-F1156 PolarHBondContact O-N 3.03Å; F1156-K1160 HydrophobicContact CD2-CG 3.94Å; F1156-K1160 HydrophobicContact CE1-CG 4.35Å; F1156-K1160 HydrophobicContact CE2-CD 4.24Å; F1156-K1160 HydrophobicContact CE2-CG 3.72Å; F1156-K1160 HydrophobicContact CG-CG 4.38Å; F1156-K1160 HydrophobicContact CZ-CG 3.94Å; F1156-K1160 WeakPolarHBondContact O-CB 3.33Å; F1156-K1160 WeakPolarHBondContact O-CG 3.4Å; F1156-K1160 PolarHBondContact O-N 3.48Å; F1156-Q1171 HydrophobicContact CD1-CB 4.41Å; F1156-Q1171 HydrophobicContact CD1-CG 4.42Å; F1156-Q1171 HydrophobicContact CD2-CB 4.17Å; F1156-Q1171 HydrophobicContact CD2-CG 3.52Å; F1156-Q1171 HydrophobicContact CE1-CB 4.04Å; F1156-Q1171 HydrophobicContact CE1-CG 4.42Å; F1156-Q1171 HydrophobicContact CE2-CB 3.75Å; F1156-Q1171 VanDerWaalsContact CE2-CD 3.41Å; F1156-Q1171 HydrophobicContact CE2-CG 3.49Å; F1156-Q1171 VanDerWaalsContact CE2-CG 3.49Å; F1156-Q1171 HydrophobicContact CG-CB 4.46Å; F1156-Q1171 HydrophobicContact CG-CG 3.99Å; F1156-Q1171 HydrophobicContact CZ-CB 3.68Å; F1156-Q1171 HydrophobicContact CZ-CG 3.97Å; F1156-F1172 HydrophobicContact CB-CE2 3.9Å; F1156-F1172 HydrophobicContact CB-CZ 3.89Å; F1156-F1172 HydrophobicContact CD1-CE2 4.14Å; F1156-F1172 HydrophobicContact CG-CE2 4.06Å; F1156-F1172 HydrophobicContact CG-CZ 4.41Å
1157	V	92.8	Very high	91.5	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-71.3	-38	-179.7	166.9	0	0	0	0	111.8	A1153 V1154 Q1155 R1161 K1162 A1163 V1168 I1183 M1186 V1192 V1203	A1153-V1157 WeakPolarHBondContact O-CB 3.49Å; A1153-V1157 VanDerWaalsContact O-CG2 3.3Å; A1153-V1157 WeakPolarHBondContact O-CG2 3.25Å; A1153-V1157 PolarHBondContact O-N 2.84Å; V1154-V1157 PolarHBondContact O-N 3.08Å; Q1155-V1157 VanDerWaalsContact C-N 3.34Å; Q1155-V1157 PolarHBondContact O-N 3.26Å; V1157-R1161 WeakPolarHBondContact O-CA 3.32Å; V1157-R1161 PolarHBondContact O-N 2.82Å; V1157-K1162 PolarHBondContact O-N 2.94Å; V1157-A1163 HydrophobicContact CG1-CB 3.85Å; V1157-V1168 HydrophobicContact CG2-CG2 4.11Å; V1157-I1183 HydrophobicContact CG2-CD1 4.42Å; V1157-M1186 HydrophobicContact CB-SD 4.12Å; V1157-M1186 HydrophobicContact CG1-SD 4.23Å; V1157-M1186 HydrophobicContact CG2-CE 4.12Å; V1157-M1186 HydrophobicContact CG2-SD 3.93Å; V1157-V1192 HydrophobicContact CG1-CG2 3.84Å; V1157-V1203 HydrophobicContact CG1-CB 4.48Å; V1157-V1203 HydrophobicContact CG1-CG1 4.05Å; V1157-V1203 HydrophobicContact CG1-CG2 3.57Å
1158	T	91.5	Very high	91.7	Very high	11 Å²	11	56.5 Å²	56.5	7%	0.067	29%	0.289	C	S	.	.	H	α-helix	trans	-72.2	-42.4	176.1	55.5	0	0	0	0	112.5	V1154 Q1155 R1161 V1203 A1205	V1154-T1158 WeakPolarHBondContact O-CG2 3.3Å; V1154-T1158 PolarHBondContact O-N 2.82Å; V1154-T1158 PolarHBondContact O-OG1 3.35Å; V1154-T1158 VanDerWaalsContact O-OG1 3.1Å; Q1155-T1158 PolarHBondContact O-N 2.92Å; Q1155-T1158 PolarHBondContact O-OG1 3.31Å; Q1155-T1158 VanDerWaalsContact O-OG1 3.1Å; T1158-R1161 WeakPolarHBondContact O-CD 3.4Å; T1158-R1161 PolarHBondContact O-N 2.98Å; T1158-V1203 HydrophobicContact CG2-CG1 3.99Å; T1158-A1205 HydrophobicContact CG2-CB 3.8Å
1159	E	89.3	Confident	91.8	Very high	103 Å²	103	54.1 Å²	54.1	48%	0.481	27%	0.268	S	S	.	.	H	α-helix	trans	-60.5	-45.6	172.2	-75.6	177	-170.5	0	0	112.2	Q1155 R1161 P1208	Q1155-E1159 HydrophobicContact CG-CG 4.28Å; Q1155-E1159 VanDerWaalsContact CG-OE1 3.25Å; Q1155-E1159 WeakPolarHBondContact CG-OE1 3.48Å; Q1155-E1159 PolarHBondContact NE2-OE1 2.88Å; Q1155-E1159 VanDerWaalsContact O-CB 3.32Å; Q1155-E1159 WeakPolarHBondContact O-CB 3.1Å; Q1155-E1159 VanDerWaalsContact O-CG 3.29Å; Q1155-E1159 WeakPolarHBondContact O-CG 3.49Å; Q1155-E1159 PolarHBondContact O-N 3.24Å; E1159-R1161 VanDerWaalsContact C-N 3.28Å; E1159-R1161 PolarHBondContact O-N 2.87Å; E1159-P1208 HydrophobicContact CG-CG 4Å
1160	K	89.5	Confident	91.8	Very high	131 Å²	131	62.4 Å²	62.4	57%	0.57	30%	0.297	S	S	*	.	H	α-helix	trans	-76.2	-13.7	179.3	-67	-68	-179.4	-171.7	0	113.6	F1156 K1162	F1156-K1160 HydrophobicContact CD2-CG 3.94Å; F1156-K1160 HydrophobicContact CE1-CG 4.35Å; F1156-K1160 HydrophobicContact CE2-CD 4.24Å; F1156-K1160 HydrophobicContact CE2-CG 3.72Å; F1156-K1160 HydrophobicContact CG-CG 4.38Å; F1156-K1160 HydrophobicContact CZ-CG 3.94Å; F1156-K1160 WeakPolarHBondContact O-CB 3.33Å; F1156-K1160 WeakPolarHBondContact O-CG 3.4Å; F1156-K1160 PolarHBondContact O-N 3.48Å; K1160-K1162 PolarHBondContact O-N 3.24Å; K1160-K1162 VanDerWaalsContact O-N 3.07Å
1161	R	89.7	Confident	91.8	Very high	126 Å²	126	67.1 Å²	67.1	48%	0.475	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.5	28.9	-170.3	-64.8	-67.7	-59.2	156.9	9.9	113.4	V1157 T1158 E1159 V1203 A1205	V1157-R1161 WeakPolarHBondContact O-CA 3.32Å; V1157-R1161 PolarHBondContact O-N 2.82Å; T1158-R1161 WeakPolarHBondContact O-CD 3.4Å; T1158-R1161 PolarHBondContact O-N 2.98Å; E1159-R1161 VanDerWaalsContact C-N 3.28Å; E1159-R1161 PolarHBondContact O-N 2.87Å; R1161-V1203 VanDerWaalsContact CZ-O 3.23Å; R1161-V1203 PolarHBondContact NH1-O 3.33Å; R1161-V1203 PolarHBondContact NH2-O 3.26Å; R1161-A1205 PolarHBondContact NH1-O 2.9Å
1162	K	88.4	Confident	91.9	Very high	111 Å²	111	63 Å²	63	48%	0.483	30%	0.295	S	S	.	.			trans	-146.3	106.2	-177.8	-176.3	164.5	-173.9	159.1	0	112.3	V1157 K1160 N1200	V1157-K1162 PolarHBondContact O-N 2.94Å; K1160-K1162 PolarHBondContact O-N 3.24Å; K1160-K1162 VanDerWaalsContact O-N 3.07Å; K1162-N1200 PolarHBondContact NZ-OD1 3.25Å
1163	A	90.4	Very high	91.9	Very high	2 Å²	2	69.2 Å²	69.2	2%	0.017	31%	0.314	C	S	.	.	B	Isolated β-bridge	trans	-77.9	125.7	169.8	0	0	0	0	0	110.6	V1157 I1183 V1192 R1201 V1203	V1157-A1163 HydrophobicContact CG1-CB 3.85Å; A1163-I1183 HydrophobicContact CB-CD1 4.25Å; A1163-V1192 HydrophobicContact CB-CB 4.28Å; A1163-V1192 HydrophobicContact CB-CG1 3.41Å; A1163-V1192 VanDerWaalsContact CB-CG1 3.41Å; A1163-V1192 HydrophobicContact CB-CG2 3.77Å; A1163-R1201 HydrophobicContact CB-CB 3.9Å; A1163-V1203 HydrophobicContact CB-CG2 4.23Å
1164	S	91.3	Very high	91.9	Very high	41 Å²	41	70 Å²	70	29%	0.287	32%	0.318	S	S	.	.			trans	-162.2	137.5	171	56.6	0	0	0	0	111	S1166 G1167 V1168	S1164-S1166 VanDerWaalsContact C-N 3.35Å; S1164-S1166 PolarHBondContact O-N 3.45Å; S1164-G1167 WeakPolarHBondContact O-CA 3.42Å; S1164-G1167 PolarHBondContact O-N 3.44Å; S1164-G1167 PolarHBondContact OG-N 3.09Å; S1164-V1168 PolarHBondContact O-N 3.04Å
1165	I	92.3	Very high	91.7	Very high	36 Å²	36	71 Å²	71	19%	0.185	33%	0.333	C	S	.	.	H	α-helix	trans	-56	-50.1	-178.2	-58.5	174.3	0	0	0	110.2	G1167 V1168 Q1169 Y1176 A1179 A1180 I1183	I1165-G1167 PolarHBondContact O-N 2.98Å; I1165-V1168 PolarHBondContact O-N 3.22Å; I1165-Q1169 VanDerWaalsContact O-CB 3.25Å; I1165-Q1169 WeakPolarHBondContact O-CB 3.12Å; I1165-Q1169 PolarHBondContact O-N 3.35Å; I1165-Y1176 HydrophobicContact CB-CE2 4.26Å; I1165-Y1176 HydrophobicContact CD1-CE2 4.46Å; I1165-Y1176 HydrophobicContact CG2-CD2 3.7Å; I1165-Y1176 HydrophobicContact CG2-CE2 3.54Å; I1165-Y1176 HydrophobicContact CG2-CG 4.37Å; I1165-A1179 HydrophobicContact CG2-CB 3.77Å; I1165-A1180 HydrophobicContact CD1-CB 3.99Å; I1165-A1180 HydrophobicContact CG2-CB 4.25Å; I1165-I1183 HydrophobicContact CG1-CB 4.41Å; I1165-I1183 HydrophobicContact CG1-CG1 4.22Å
1166	S	91.7	Very high	91.8	Very high	60 Å²	60	71.8 Å²	71.8	42%	0.42	33%	0.333	S	S	.	.	H	α-helix	trans	-63.4	-23.6	178.1	-46.4	0	0	0	0	114.1	S1164 R1170	S1164-S1166 VanDerWaalsContact C-N 3.35Å; S1164-S1166 PolarHBondContact O-N 3.45Å; S1166-R1170 WeakPolarHBondContact O-CB 3.19Å; S1166-R1170 WeakPolarHBondContact O-CD 3.48Å; S1166-R1170 WeakPolarHBondContact O-CG 3.49Å; S1166-R1170 PolarHBondContact O-N 2.77Å
1167	G	92	Very high	91.6	Very high	18 Å²	18	76.9 Å²	76.9	19%	0.186	36%	0.361	C	S	.	.	H	α-helix	trans	-71	-54.1	174.2	0	0	0	0	0	111.4	S1164 I1165 Q1169 R1170 Q1171	S1164-G1167 WeakPolarHBondContact O-CA 3.42Å; S1164-G1167 PolarHBondContact O-N 3.44Å; S1164-G1167 PolarHBondContact OG-N 3.09Å; I1165-G1167 PolarHBondContact O-N 2.98Å; G1167-Q1169 VanDerWaalsContact C-N 3.32Å; G1167-Q1169 PolarHBondContact O-N 3.29Å; G1167-R1170 PolarHBondContact O-N 2.96Å; G1167-Q1171 WeakPolarHBondContact O-CB 3.41Å; G1167-Q1171 PolarHBondContact O-N 3.01Å
1168	V	94	Very high	91.6	Very high	1 Å²	1	81.4 Å²	81.4	1%	0.006	38%	0.378	C	S	.	.	H	α-helix	trans	-60.3	-43.6	176.1	-178.3	0	0	0	0	110.5	A1153 V1157 S1164 I1165 R1170 Q1171 F1172 I1174 A1179 I1182 I1183	A1153-V1168 HydrophobicContact CB-CG1 4.11Å; V1157-V1168 HydrophobicContact CG2-CG2 4.11Å; S1164-V1168 PolarHBondContact O-N 3.04Å; I1165-V1168 PolarHBondContact O-N 3.22Å; V1168-R1170 PolarHBondContact O-N 3.45Å; V1168-Q1171 PolarHBondContact O-N 3.3Å; V1168-F1172 HydrophobicContact CG1-CD2 3.77Å; V1168-F1172 HydrophobicContact CG1-CE2 4.38Å; V1168-F1172 WeakPolarHBondContact O-CD2 3.19Å; V1168-F1172 PolarHBondContact O-N 3.21Å; V1168-I1174 HydrophobicContact CG1-CD1 4.07Å; V1168-A1179 HydrophobicContact CB-CB 4.27Å; V1168-A1179 HydrophobicContact CG1-CB 4.31Å; V1168-I1182 HydrophobicContact CG1-CG2 4.05Å; V1168-I1183 HydrophobicContact CG2-CD1 3.8Å; V1168-I1183 HydrophobicContact CG2-CG1 4.22Å
1169	Q	94.3	Very high	91.8	Very high	61 Å²	61	80.9 Å²	80.9	29%	0.285	38%	0.375	S	S	.	.	H	α-helix	trans	-55	-47.1	177	-164.8	-167.9	1.3	0	0	112.5	I1165 G1167 R1173 I1174 A1179	I1165-Q1169 VanDerWaalsContact O-CB 3.25Å; I1165-Q1169 WeakPolarHBondContact O-CB 3.12Å; I1165-Q1169 PolarHBondContact O-N 3.35Å; G1167-Q1169 VanDerWaalsContact C-N 3.32Å; G1167-Q1169 PolarHBondContact O-N 3.29Å; Q1169-R1173 VanDerWaalsContact O-CA 3.31Å; Q1169-R1173 WeakPolarHBondContact O-CA 3.39Å; Q1169-R1173 PolarHBondContact O-N 3Å; Q1169-I1174 WeakPolarHBondContact CG-O 3.3Å; Q1169-I1174 PolarHBondContact O-N 3.21Å; Q1169-A1179 HydrophobicContact CB-CB 3.9Å; Q1169-A1179 HydrophobicContact CG-CB 4.49Å
1170	R	91.6	Very high	91.9	Very high	207 Å²	207	76.3 Å²	76.3	78%	0.781	36%	0.355	S	S	*	.	H	α-helix	trans	-72.9	-39.8	-179.2	-72.8	172.5	-174.8	-166.1	2.5	112.8	S1166 G1167 V1168	S1166-R1170 WeakPolarHBondContact O-CB 3.19Å; S1166-R1170 WeakPolarHBondContact O-CD 3.48Å; S1166-R1170 WeakPolarHBondContact O-CG 3.49Å; S1166-R1170 PolarHBondContact O-N 2.77Å; G1167-R1170 PolarHBondContact O-N 2.96Å; V1168-R1170 PolarHBondContact O-N 3.45Å
1171	Q	93.6	Very high	92.1	Very high	111 Å²	111	74.7 Å²	74.7	52%	0.519	35%	0.345	S	S	.	.	H	α-helix	trans	-67.7	-49.5	-179.4	-175.8	70	11.8	0	0	111.6	F1156 G1167 V1168	F1156-Q1171 HydrophobicContact CD1-CB 4.41Å; F1156-Q1171 HydrophobicContact CD1-CG 4.42Å; F1156-Q1171 HydrophobicContact CD2-CB 4.17Å; F1156-Q1171 HydrophobicContact CD2-CG 3.52Å; F1156-Q1171 HydrophobicContact CE1-CB 4.04Å; F1156-Q1171 HydrophobicContact CE1-CG 4.42Å; F1156-Q1171 HydrophobicContact CE2-CB 3.75Å; F1156-Q1171 VanDerWaalsContact CE2-CD 3.41Å; F1156-Q1171 HydrophobicContact CE2-CG 3.49Å; F1156-Q1171 VanDerWaalsContact CE2-CG 3.49Å; F1156-Q1171 HydrophobicContact CG-CB 4.46Å; F1156-Q1171 HydrophobicContact CG-CG 3.99Å; F1156-Q1171 HydrophobicContact CZ-CB 3.68Å; F1156-Q1171 HydrophobicContact CZ-CG 3.97Å; G1167-Q1171 WeakPolarHBondContact O-CB 3.41Å; G1167-Q1171 PolarHBondContact O-N 3.01Å; V1168-Q1171 PolarHBondContact O-N 3.3Å
1172	F	93.5	Very high	92.3	Very high	39 Å²	39	68.7 Å²	68.7	17%	0.171	32%	0.322	C	S	.	.	H	α-helix	trans	-94.9	-0.7	-172.9	-63.3	-77.3	0	0	0	114	L1149 Q1152 A1153 F1156 V1168 I1174	L1149-F1172 HydrophobicContact CD1-CB 4.26Å; L1149-F1172 HydrophobicContact CD2-CD1 4.38Å; Q1152-F1172 HydrophobicContact CB-CE1 3.64Å; Q1152-F1172 HydrophobicContact CB-CZ 4Å; Q1152-F1172 WeakPolarHBondContact O-CZ 3.47Å; A1153-F1172 HydrophobicContact CB-CD2 4.36Å; A1153-F1172 HydrophobicContact CB-CE2 3.9Å; A1153-F1172 HydrophobicContact CB-CZ 4.31Å; F1156-F1172 HydrophobicContact CB-CE2 3.9Å; F1156-F1172 HydrophobicContact CB-CZ 3.89Å; F1156-F1172 HydrophobicContact CD1-CE2 4.14Å; F1156-F1172 HydrophobicContact CG-CE2 4.06Å; F1156-F1172 HydrophobicContact CG-CZ 4.41Å; V1168-F1172 HydrophobicContact CG1-CD2 3.77Å; V1168-F1172 HydrophobicContact CG1-CE2 4.38Å; V1168-F1172 WeakPolarHBondContact O-CD2 3.19Å; V1168-F1172 PolarHBondContact O-N 3.21Å; F1172-I1174 HydrophobicContact CB-CD1 4.45Å; F1172-I1174 HydrophobicContact CB-CG1 4.33Å; F1172-I1174 HydrophobicContact CB-CG2 4.26Å; F1172-I1174 PolarHBondContact O-N 3.26Å
1173	R	92.1	Very high	92.6	Very high	235 Å²	235	63.5 Å²	63.5	89%	0.887	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.5	35.5	179.4	-56.2	-177	178.2	-171.9	-0.8	113.7	Q1169	Q1169-R1173 VanDerWaalsContact O-CA 3.31Å; Q1169-R1173 WeakPolarHBondContact O-CA 3.39Å; Q1169-R1173 PolarHBondContact O-N 3Å
1174	I	93.3	Very high	92.6	Very high	17 Å²	17	68 Å²	68	9%	0.087	32%	0.32	C	S	.	.			trans	-96.2	163.5	178.6	58	176.8	0	0	0	111.6	L1149 V1168 Q1169 F1172 R1178 A1179 I1182	L1149-I1174 HydrophobicContact CD1-CG2 3.66Å; V1168-I1174 HydrophobicContact CG1-CD1 4.07Å; Q1169-I1174 WeakPolarHBondContact CG-O 3.3Å; Q1169-I1174 PolarHBondContact O-N 3.21Å; F1172-I1174 HydrophobicContact CB-CD1 4.45Å; F1172-I1174 HydrophobicContact CB-CG1 4.33Å; F1172-I1174 HydrophobicContact CB-CG2 4.26Å; F1172-I1174 PolarHBondContact O-N 3.26Å; I1174-R1178 HydrophobicContact CB-CB 4.36Å; I1174-R1178 HydrophobicContact CD1-CB 4.23Å; I1174-R1178 HydrophobicContact CD1-CG 4.11Å; I1174-A1179 HydrophobicContact CD1-CB 3.85Å; I1174-A1179 HydrophobicContact CG1-CB 4.07Å; I1174-I1182 HydrophobicContact CD1-CD1 3.68Å
1175	G	90.4	Very high	92.7	Very high	46 Å²	46	66.7 Å²	66.7	47%	0.474	31%	0.31	S	S	.	.			trans	-69.7	154.8	172.6	0	0	0	0	0	112.7	N1177 R1178 A1179	G1175-N1177 PolarHBondContact O-N 3.18Å; G1175-R1178 PolarHBondContact O-N 2.98Å; G1175-A1179 PolarHBondContact O-N 3.1Å; G1175-A1179 VanDerWaalsContact O-N 3.11Å
1176	Y	93.2	Very high	92.8	Very high	126 Å²	126	65 Å²	65	49%	0.494	30%	0.301	S	S	.	.	H	α-helix	trans	-49.9	-51.5	-177.2	179.9	-93.4	0	0	0	112.5	I1165 R1178 A1179 A1180	I1165-Y1176 HydrophobicContact CB-CE2 4.26Å; I1165-Y1176 HydrophobicContact CD1-CE2 4.46Å; I1165-Y1176 HydrophobicContact CG2-CD2 3.7Å; I1165-Y1176 HydrophobicContact CG2-CE2 3.54Å; I1165-Y1176 HydrophobicContact CG2-CG 4.37Å; Y1176-R1178 VanDerWaalsContact C-N 3.25Å; Y1176-R1178 PolarHBondContact O-N 3.1Å; Y1176-A1179 CarbonylContact O-C 3.57Å; Y1176-A1179 WeakPolarHBondContact O-CA 3.49Å; Y1176-A1179 WeakPolarHBondContact O-CB 3.39Å; Y1176-A1179 PolarHBondContact O-N 2.88Å; Y1176-A1180 HydrophobicContact CE1-CB 4.49Å; Y1176-A1180 PolarHBondContact O-N 2.9Å
1177	N	88.5	Confident	92.8	Very high	133 Å²	133	64.8 Å²	64.8	71%	0.711	29%	0.294	S	S	*	.	H	α-helix	trans	-60.5	-31.9	-177.9	-55.5	10.6	0	0	0	113.1	G1175 R1181	G1175-N1177 PolarHBondContact O-N 3.18Å; N1177-R1181 WeakPolarHBondContact O-CB 3.4Å; N1177-R1181 PolarHBondContact O-N 3.39Å; N1177-R1181 VanDerWaalsContact O-N 3.09Å
1178	R	93.9	Very high	92.7	Very high	95 Å²	95	66.6 Å²	66.6	36%	0.358	31%	0.307	S	S	.	.	H	α-helix	trans	-75.9	-36.6	176.1	-169.4	179	175.7	-171.2	-2.3	111.1	D1147 I1174 G1175 Y1176 I1182	D1147-R1178 IonicContact OD1-CZ 3.33Å; D1147-R1178 IonicContact OD1-NE 3.17Å; D1147-R1178 PolarHBondContact OD1-NE 3.3Å; D1147-R1178 VanDerWaalsContact OD1-NE 3.17Å; D1147-R1178 IonicContact OD1-NH2 2.68Å; D1147-R1178 PolarHBondContact OD1-NH2 3.17Å; D1147-R1178 WeakPolarHBondContact OD2-CG 3.48Å; D1147-R1178 IonicContact OD2-CZ 3.62Å; D1147-R1178 IonicContact OD2-NE 2.79Å; D1147-R1178 PolarHBondContact OD2-NE 3.11Å; D1147-R1178 IonicContact OD2-NH2 3.61Å; I1174-R1178 HydrophobicContact CB-CB 4.36Å; I1174-R1178 HydrophobicContact CD1-CB 4.23Å; I1174-R1178 HydrophobicContact CD1-CG 4.11Å; G1175-R1178 PolarHBondContact O-N 2.98Å; Y1176-R1178 VanDerWaalsContact C-N 3.25Å; Y1176-R1178 PolarHBondContact O-N 3.1Å; R1178-I1182 HydrophobicContact CG-CD1 4.24Å; R1178-I1182 WeakPolarHBondContact O-CB 3.48Å; R1178-I1182 VanDerWaalsContact O-CG1 3.24Å; R1178-I1182 WeakPolarHBondContact O-CG1 3.08Å; R1178-I1182 PolarHBondContact O-N 2.91Å
1179	A	94.2	Very high	92.5	Very high	0 Å²	0	71.5 Å²	71.5	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-68.6	-34.7	173	0	0	0	0	0	112.5	I1165 V1168 Q1169 I1174 G1175 Y1176 I1183	I1165-A1179 HydrophobicContact CG2-CB 3.77Å; V1168-A1179 HydrophobicContact CB-CB 4.27Å; V1168-A1179 HydrophobicContact CG1-CB 4.31Å; Q1169-A1179 HydrophobicContact CB-CB 3.9Å; Q1169-A1179 HydrophobicContact CG-CB 4.49Å; I1174-A1179 HydrophobicContact CD1-CB 3.85Å; I1174-A1179 HydrophobicContact CG1-CB 4.07Å; G1175-A1179 PolarHBondContact O-N 3.1Å; G1175-A1179 VanDerWaalsContact O-N 3.11Å; Y1176-A1179 CarbonylContact O-C 3.57Å; Y1176-A1179 WeakPolarHBondContact O-CA 3.49Å; Y1176-A1179 WeakPolarHBondContact O-CB 3.39Å; Y1176-A1179 PolarHBondContact O-N 2.88Å; A1179-I1183 WeakPolarHBondContact O-CG1 3.47Å; A1179-I1183 PolarHBondContact O-N 2.88Å; A1179-I1183 VanDerWaalsContact O-N 3.14Å
1180	A	92.7	Very high	92.3	Very high	7 Å²	7	70.8 Å²	70.8	6%	0.058	34%	0.339	C	S	.	.	H	α-helix	trans	-63	-56.7	174	0	0	0	0	0	110.1	I1165 Y1176 I1182 I1183 E1184	I1165-A1180 HydrophobicContact CD1-CB 3.99Å; I1165-A1180 HydrophobicContact CG2-CB 4.25Å; Y1176-A1180 HydrophobicContact CE1-CB 4.49Å; Y1176-A1180 PolarHBondContact O-N 2.9Å; A1180-I1182 VanDerWaalsContact C-N 3.26Å; A1180-I1182 PolarHBondContact O-N 3.39Å; A1180-I1183 CarbonylContact O-C 3.58Å; A1180-I1183 WeakPolarHBondContact O-CA 3.46Å; A1180-I1183 WeakPolarHBondContact O-CB 3.36Å; A1180-I1183 PolarHBondContact O-N 2.97Å; A1180-E1184 VanDerWaalsContact C-CD 3.48Å; A1180-E1184 WeakPolarHBondContact CB-OE1 3.12Å; A1180-E1184 WeakPolarHBondContact O-CG 3.25Å; A1180-E1184 PolarHBondContact O-N 2.79Å
1181	R	93.2	Very high	92.3	Very high	96 Å²	96	62.2 Å²	62.2	36%	0.362	31%	0.308	S	S	.	.	H	α-helix	trans	-53.1	-39.3	174.8	-172.3	-178.6	67.2	161.8	2.6	113.7	D1147 N1177 E1184 Q1185	D1147-R1181 IonicContact OD2-CZ 2.71Å; D1147-R1181 IonicContact OD2-NH2 2.74Å; D1147-R1181 PolarHBondContact OD2-NH2 3.25Å; N1177-R1181 WeakPolarHBondContact O-CB 3.4Å; N1177-R1181 PolarHBondContact O-N 3.39Å; N1177-R1181 VanDerWaalsContact O-N 3.09Å; R1181-E1184 WeakPolarHBondContact CA-OE2 3.35Å; R1181-E1184 PolarHBondContact O-N 3.37Å; R1181-Q1185 HydrophobicContact CG-CG 4.48Å; R1181-Q1185 WeakPolarHBondContact O-CB 3.47Å; R1181-Q1185 VanDerWaalsContact O-CG 3.3Å; R1181-Q1185 WeakPolarHBondContact O-CG 3.26Å; R1181-Q1185 PolarHBondContact O-N 2.77Å
1182	I	94.7	Very high	92.3	Very high	0 Å²	0	57 Å²	57	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-66.7	-36.7	176.7	-76.2	170.1	0	0	0	111.8	D1147 L1149 A1153 V1168 I1174 R1178 A1180 M1186	D1147-I1182 HydrophobicContact CB-CD1 4.03Å; D1147-I1182 HydrophobicContact CB-CG1 3.72Å; L1149-I1182 HydrophobicContact CB-CD1 4.31Å; A1153-I1182 HydrophobicContact CB-CG2 3.61Å; V1168-I1182 HydrophobicContact CG1-CG2 4.05Å; I1174-I1182 HydrophobicContact CD1-CD1 3.68Å; R1178-I1182 HydrophobicContact CG-CD1 4.24Å; R1178-I1182 WeakPolarHBondContact O-CB 3.48Å; R1178-I1182 VanDerWaalsContact O-CG1 3.24Å; R1178-I1182 WeakPolarHBondContact O-CG1 3.08Å; R1178-I1182 PolarHBondContact O-N 2.91Å; A1180-I1182 VanDerWaalsContact C-N 3.26Å; A1180-I1182 PolarHBondContact O-N 3.39Å; I1182-M1186 HydrophobicContact CG2-CE 3.69Å; I1182-M1186 WeakPolarHBondContact O-CG 3.31Å; I1182-M1186 PolarHBondContact O-N 3.19Å; I1182-M1186 VanDerWaalsContact O-N 3.14Å
1183	I	93.4	Very high	92.1	Very high	2 Å²	2	56.5 Å²	56.5	1%	0.01	29%	0.285	C	S	.	.	H	α-helix	trans	-71.7	-40.5	173.9	-69.3	-68.4	0	0	0	111.3	V1157 A1163 I1165 V1168 A1179 A1180 Q1185 M1186 E1187	V1157-I1183 HydrophobicContact CG2-CD1 4.42Å; A1163-I1183 HydrophobicContact CB-CD1 4.25Å; I1165-I1183 HydrophobicContact CG1-CB 4.41Å; I1165-I1183 HydrophobicContact CG1-CG1 4.22Å; V1168-I1183 HydrophobicContact CG2-CD1 3.8Å; V1168-I1183 HydrophobicContact CG2-CG1 4.22Å; A1179-I1183 WeakPolarHBondContact O-CG1 3.47Å; A1179-I1183 PolarHBondContact O-N 2.88Å; A1179-I1183 VanDerWaalsContact O-N 3.14Å; A1180-I1183 CarbonylContact O-C 3.58Å; A1180-I1183 WeakPolarHBondContact O-CA 3.46Å; A1180-I1183 WeakPolarHBondContact O-CB 3.36Å; A1180-I1183 PolarHBondContact O-N 2.97Å; I1183-Q1185 VanDerWaalsContact C-N 3.33Å; I1183-Q1185 PolarHBondContact O-N 3.36Å; I1183-M1186 HydrophobicContact CD1-SD 4.14Å; I1183-M1186 WeakPolarHBondContact O-CB 3.48Å; I1183-M1186 PolarHBondContact O-N 3.37Å; I1183-E1187 PolarHBondContact O-N 3.17Å
1184	E	91.4	Very high	91.9	Very high	96 Å²	96	52 Å²	52	45%	0.449	27%	0.274	S	S	.	.	H	α-helix	trans	-62.1	-39.3	174.2	-68.3	148.3	-153.5	0	0	111.2	A1180 R1181 M1186 E1187 A1188	A1180-E1184 VanDerWaalsContact C-CD 3.48Å; A1180-E1184 WeakPolarHBondContact CB-OE1 3.12Å; A1180-E1184 WeakPolarHBondContact O-CG 3.25Å; A1180-E1184 PolarHBondContact O-N 2.79Å; R1181-E1184 WeakPolarHBondContact CA-OE2 3.35Å; R1181-E1184 PolarHBondContact O-N 3.37Å; E1184-M1186 VanDerWaalsContact C-N 3.33Å; E1184-M1186 PolarHBondContact O-N 3.11Å; E1184-E1187 WeakPolarHBondContact O-CB 3.19Å; E1184-E1187 PolarHBondContact O-N 2.82Å; E1184-A1188 WeakPolarHBondContact O-CB 3.25Å; E1184-A1188 PolarHBondContact O-N 3.23Å
1185	Q	93.4	Very high	91.6	Very high	15 Å²	15	57 Å²	57	7%	0.07	30%	0.297	C	S	.	.	H	α-helix	trans	-66.4	-30.5	171.5	-74.7	179.2	-13	0	0	112.3	E1144 F1150 R1181 I1183 Q1189	E1144-Q1185 PolarHBondContact OE2-NE2 2.74Å; E1144-Q1185 VanDerWaalsContact OE2-NE2 3.08Å; F1150-Q1185 HydrophobicContact CD2-CB 3.99Å; F1150-Q1185 HydrophobicContact CE2-CB 3.59Å; R1181-Q1185 HydrophobicContact CG-CG 4.48Å; R1181-Q1185 WeakPolarHBondContact O-CB 3.47Å; R1181-Q1185 VanDerWaalsContact O-CG 3.3Å; R1181-Q1185 WeakPolarHBondContact O-CG 3.26Å; R1181-Q1185 PolarHBondContact O-N 2.77Å; I1183-Q1185 VanDerWaalsContact C-N 3.33Å; I1183-Q1185 PolarHBondContact O-N 3.36Å; Q1185-Q1189 WeakPolarHBondContact O-CB 3.29Å; Q1185-Q1189 WeakPolarHBondContact O-CG 3.32Å; Q1185-Q1189 PolarHBondContact O-N 3.28Å; Q1185-Q1189 VanDerWaalsContact O-N 3.16Å
1186	M	94	Very high	91.1	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-73.4	-36.2	173.8	-72	179	-160.3	0	0	112.9	F1150 A1153 V1154 V1157 I1182 I1183 E1184 Q1189 G1190 I1191 V1192	F1150-M1186 HydrophobicContact CE2-CG 3.76Å; F1150-M1186 HydrophobicContact CZ-CG 4.18Å; A1153-M1186 HydrophobicContact CB-CE 3.46Å; A1153-M1186 VanDerWaalsContact CB-CE 3.46Å; A1153-M1186 WeakPolarHBondContact O-CE 3.49Å; V1154-M1186 HydrophobicContact CG2-CE 3.93Å; V1154-M1186 HydrophobicContact CG2-CG 3.98Å; V1154-M1186 HydrophobicContact CG2-SD 4.33Å; V1157-M1186 HydrophobicContact CB-SD 4.12Å; V1157-M1186 HydrophobicContact CG1-SD 4.23Å; V1157-M1186 HydrophobicContact CG2-CE 4.12Å; V1157-M1186 HydrophobicContact CG2-SD 3.93Å; I1182-M1186 HydrophobicContact CG2-CE 3.69Å; I1182-M1186 WeakPolarHBondContact O-CG 3.31Å; I1182-M1186 PolarHBondContact O-N 3.19Å; I1182-M1186 VanDerWaalsContact O-N 3.14Å; I1183-M1186 HydrophobicContact CD1-SD 4.14Å; I1183-M1186 WeakPolarHBondContact O-CB 3.48Å; I1183-M1186 PolarHBondContact O-N 3.37Å; E1184-M1186 VanDerWaalsContact C-N 3.33Å; E1184-M1186 PolarHBondContact O-N 3.11Å; M1186-Q1189 PolarHBondContact O-N 2.79Å; M1186-G1190 PolarHBondContact O-N 3.12Å; M1186-I1191 HydrophobicContact CB-CB 4.17Å; M1186-I1191 WeakPolarHBondContact O-CB 3.42Å; M1186-I1191 PolarHBondContact O-N 2.68Å; M1186-V1192 HydrophobicContact CB-CB 3.99Å; M1186-V1192 HydrophobicContact CB-CG2 3.75Å; M1186-V1192 HydrophobicContact CG-CG2 4.44Å; M1186-V1192 PolarHBondContact O-N 3.36Å; M1186-V1192 HydrophobicContact SD-CG2 3.96Å
1187	E	92.5	Very high	89.9	Confident	55 Å²	55	59.3 Å²	59.3	26%	0.257	31%	0.309	S	S	.	.	H	α-helix	trans	-63.2	-50.8	172.4	163.6	174.4	-122.7	0	0	110.6	I1183 E1184 Q1189 G1190 E1194 R1201	I1183-E1187 PolarHBondContact O-N 3.17Å; E1184-E1187 WeakPolarHBondContact O-CB 3.19Å; E1184-E1187 PolarHBondContact O-N 2.82Å; E1187-Q1189 PolarHBondContact O-N 3.49Å; E1187-G1190 PolarHBondContact O-N 3.19Å; E1187-E1194 WeakPolarHBondContact OE1-CA 3.44Å; E1187-R1201 VanDerWaalsContact CD-NH2 3.33Å; E1187-R1201 IonicContact OE1-CZ 3.11Å; E1187-R1201 IonicContact OE1-NH1 3.8Å; E1187-R1201 PolarHBondContact OE1-NH1 3.21Å; E1187-R1201 IonicContact OE1-NH2 3.11Å; E1187-R1201 PolarHBondContact OE1-NH2 2.84Å; E1187-R1201 IonicContact OE2-CZ 2.65Å; E1187-R1201 IonicContact OE2-NH1 3.56Å; E1187-R1201 PolarHBondContact OE2-NH1 3.04Å; E1187-R1201 VanDerWaalsContact OE2-NH1 3.17Å; E1187-R1201 IonicContact OE2-NH2 3.48Å; E1187-R1201 PolarHBondContact OE2-NH2 2.95Å
1188	A	88.5	Confident	89.3	Confident	56 Å²	56	58.8 Å²	58.8	46%	0.463	31%	0.306	S	S	.	.	H	α-helix	trans	-61.6	-26.1	176.2	0	0	0	0	0	114	E1184	E1184-A1188 WeakPolarHBondContact O-CB 3.25Å; E1184-A1188 PolarHBondContact O-N 3.23Å
1189	Q	91	Very high	88.3	Confident	105 Å²	105	56.3 Å²	56.3	49%	0.491	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.5	4.7	174.4	-64.6	-64.6	-36.5	0	0	113.6	F1150 Q1185 M1186 E1187 I1191	F1150-Q1189 HydrophobicContact CZ-CB 4.43Å; F1150-Q1189 HydrophobicContact CZ-CG 4.09Å; Q1185-Q1189 WeakPolarHBondContact O-CB 3.29Å; Q1185-Q1189 WeakPolarHBondContact O-CG 3.32Å; Q1185-Q1189 PolarHBondContact O-N 3.28Å; Q1185-Q1189 VanDerWaalsContact O-N 3.16Å; M1186-Q1189 PolarHBondContact O-N 2.79Å; E1187-Q1189 PolarHBondContact O-N 3.49Å; Q1189-I1191 HydrophobicContact CB-CD1 4Å; Q1189-I1191 HydrophobicContact CB-CG1 4.01Å; Q1189-I1191 PolarHBondContact O-N 3.49Å
1190	G	89.8	Confident	87.6	Confident	46 Å²	46	59.7 Å²	59.7	47%	0.474	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.6	16.6	178.4	0	0	0	0	0	115.2	M1186 E1187	M1186-G1190 PolarHBondContact O-N 3.12Å; E1187-G1190 PolarHBondContact O-N 3.19Å
1191	I	91.8	Very high	87.5	Confident	27 Å²	27	61 Å²	61	14%	0.138	33%	0.332	C	S	.	.	S	Bend	trans	-78.6	-30.9	178.6	-57.2	177.7	0	0	0	110.2	F1150 V1154 M1186 Q1189 L1204 A1205	F1150-I1191 HydrophobicContact CE1-CD1 4.12Å; F1150-I1191 HydrophobicContact CZ-CD1 3.82Å; V1154-I1191 HydrophobicContact CG1-CD1 4.06Å; V1154-I1191 HydrophobicContact CG1-CG2 4.06Å; V1154-I1191 HydrophobicContact CG2-CD1 3.57Å; V1154-I1191 HydrophobicContact CG2-CG2 4.46Å; M1186-I1191 HydrophobicContact CB-CB 4.17Å; M1186-I1191 WeakPolarHBondContact O-CB 3.42Å; M1186-I1191 PolarHBondContact O-N 2.68Å; Q1189-I1191 HydrophobicContact CB-CD1 4Å; Q1189-I1191 HydrophobicContact CB-CG1 4.01Å; Q1189-I1191 PolarHBondContact O-N 3.49Å; I1191-L1204 PolarHBondContact O-N 3.38Å; I1191-A1205 HydrophobicContact CB-CB 4.45Å; I1191-A1205 HydrophobicContact CG2-CB 3.77Å; I1191-A1205 PolarHBondContact O-N 3.49Å; I1191-A1205 VanDerWaalsContact O-N 3.11Å
1192	V	93.1	Very high	87.2	Confident	2 Å²	2	63.4 Å²	63.4	1%	0.012	35%	0.347	C	S	.	.	B	Isolated β-bridge	trans	-133.9	146	-173.2	171.2	0	0	0	0	108.7	V1157 A1163 M1186 R1201 E1202	V1157-V1192 HydrophobicContact CG1-CG2 3.84Å; A1163-V1192 HydrophobicContact CB-CB 4.28Å; A1163-V1192 HydrophobicContact CB-CG1 3.41Å; A1163-V1192 VanDerWaalsContact CB-CG1 3.41Å; A1163-V1192 HydrophobicContact CB-CG2 3.77Å; M1186-V1192 HydrophobicContact CB-CB 3.99Å; M1186-V1192 HydrophobicContact CB-CG2 3.75Å; M1186-V1192 HydrophobicContact CG-CG2 4.44Å; M1186-V1192 PolarHBondContact O-N 3.36Å; M1186-V1192 HydrophobicContact SD-CG2 3.96Å; V1192-R1201 HydrophobicContact CG1-CB 3.63Å; V1192-R1201 HydrophobicContact CG1-CG 4.34Å; V1192-E1202 CarbonylContact C-O 3.54Å; V1192-E1202 VanDerWaalsContact CA-O 3.31Å; V1192-E1202 WeakPolarHBondContact CA-O 3.37Å
1193	S	90	Very high	87.1	Confident	27 Å²	27	63.7 Å²	63.7	19%	0.189	35%	0.349	C	S	.	.			trans	-73.2	164.8	177	77.1	0	0	0	0	112.5	R1201 E1202	S1193-R1201 PolarHBondContact O-NH1 2.85Å; S1193-E1202 PolarHBondContact N-O 3.03Å; S1193-E1202 PolarHBondContact OG-N 2.9Å
1194	E	86.7	Confident	86.9	Confident	140 Å²	140	68.6 Å²	68.6	65%	0.654	37%	0.374	S	S	*	.			trans	-53.1	159.6	158.6	-62.1	-175.1	172.7	0	0	111.7	E1187 G1196	E1187-E1194 WeakPolarHBondContact OE1-CA 3.44Å; E1194-G1196 PolarHBondContact O-N 2.96Å
1195	Q	86.5	Confident	86.7	Confident	122 Å²	122	65.1 Å²	65.1	57%	0.57	36%	0.362	S	S	*	.			trans	-74.1	109.5	-180	-173.6	167.8	38.8	0	0	110.5	G1199 R1201	Q1195-G1199 PolarHBondContact NE2-O 3.25Å; Q1195-R1201 HydrophobicContact CB-CG 4.1Å; Q1195-R1201 HydrophobicContact CG-CG 4.47Å
1196	G	79.8	Confident	86.2	Confident	35 Å²	35	68.6 Å²	68.6	36%	0.361	39%	0.386	S	S	.	.			trans	-66.5	162.1	176.4	0	0	0	0	0	112.2	E1194 N1198 G1199 N1200	E1194-G1196 PolarHBondContact O-N 2.96Å; G1196-N1198 PolarHBondContact O-N 3.01Å; G1196-G1199 PolarHBondContact O-N 2.95Å; G1196-N1200 PolarHBondContact N-O 3.38Å
1197	H	70	Confident	85.4	Confident	187 Å²	187	72 Å²	72	87%	0.866	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.8	-20.8	-176.9	-171.2	90.7	0	0	0	114.7	G1199	H1197-G1199 VanDerWaalsContact C-N 3.35Å
1198	N	75.6	Confident	84.6	Confident	122 Å²	122	73 Å²	73	65%	0.652	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.4	8.1	174.9	69	26.8	0	0	0	114.6	G1196 N1200	G1196-N1198 PolarHBondContact O-N 3.01Å; N1198-N1200 VanDerWaalsContact C-N 3.25Å; N1198-N1200 PolarHBondContact O-N 3.24Å; N1198-N1200 PolarHBondContact O-ND2 2.76Å; N1198-N1200 VanDerWaalsContact OD1-CB 3.29Å; N1198-N1200 WeakPolarHBondContact OD1-CB 3.31Å; N1198-N1200 PolarHBondContact OD1-N 3.43Å; N1198-N1200 PolarHBondContact OD1-ND2 3.42Å
1199	G	72.4	Confident	83.8	Confident	42 Å²	42	79.5 Å²	79.5	43%	0.433	44%	0.438	S	S	.	.	S	Bend	trans	76	-3.9	-179.4	0	0	0	0	0	115.9	Q1195 G1196 H1197	Q1195-G1199 PolarHBondContact NE2-O 3.25Å; G1196-G1199 PolarHBondContact O-N 2.95Å; H1197-G1199 VanDerWaalsContact C-N 3.35Å
1200	N	79.8	Confident	81.9	Confident	72 Å²	72	86.1 Å²	86.1	39%	0.385	48%	0.477	S	S	.	.			trans	-88.4	161.4	175	-58	-89.4	0	0	0	111.2	K1162 G1196 N1198	K1162-N1200 PolarHBondContact NZ-OD1 3.25Å; G1196-N1200 PolarHBondContact N-O 3.38Å; N1198-N1200 VanDerWaalsContact C-N 3.25Å; N1198-N1200 PolarHBondContact O-N 3.24Å; N1198-N1200 PolarHBondContact O-ND2 2.76Å; N1198-N1200 VanDerWaalsContact OD1-CB 3.29Å; N1198-N1200 WeakPolarHBondContact OD1-CB 3.31Å; N1198-N1200 PolarHBondContact OD1-N 3.43Å; N1198-N1200 PolarHBondContact OD1-ND2 3.42Å
1201	R	89	Confident	81.5	Confident	34 Å²	34	88.2 Å²	88.2	13%	0.128	48%	0.477	C	S	.	.	B	Isolated β-bridge	trans	-124.8	132.5	172.7	-67.7	168.2	168.3	-85.2	14.1	108.5	A1163 E1187 V1192 S1193 Q1195	A1163-R1201 HydrophobicContact CB-CB 3.9Å; E1187-R1201 VanDerWaalsContact CD-NH2 3.33Å; E1187-R1201 IonicContact OE1-CZ 3.11Å; E1187-R1201 IonicContact OE1-NH1 3.8Å; E1187-R1201 PolarHBondContact OE1-NH1 3.21Å; E1187-R1201 IonicContact OE1-NH2 3.11Å; E1187-R1201 PolarHBondContact OE1-NH2 2.84Å; E1187-R1201 IonicContact OE2-CZ 2.65Å; E1187-R1201 IonicContact OE2-NH1 3.56Å; E1187-R1201 PolarHBondContact OE2-NH1 3.04Å; E1187-R1201 VanDerWaalsContact OE2-NH1 3.17Å; E1187-R1201 IonicContact OE2-NH2 3.48Å; E1187-R1201 PolarHBondContact OE2-NH2 2.95Å; V1192-R1201 HydrophobicContact CG1-CB 3.63Å; V1192-R1201 HydrophobicContact CG1-CG 4.34Å; S1193-R1201 PolarHBondContact O-NH1 2.85Å; Q1195-R1201 HydrophobicContact CB-CG 4.1Å; Q1195-R1201 HydrophobicContact CG-CG 4.47Å
1202	E	88.9	Confident	80.9	Confident	146 Å²	146	91.4 Å²	91.4	68%	0.682	50%	0.495	S	S	*	.			trans	-81.1	155.5	177.2	-59.6	-153.4	150.5	0	0	111.2	V1192 S1193	V1192-E1202 CarbonylContact C-O 3.54Å; V1192-E1202 VanDerWaalsContact CA-O 3.31Å; V1192-E1202 WeakPolarHBondContact CA-O 3.37Å; S1193-E1202 PolarHBondContact N-O 3.03Å; S1193-E1202 PolarHBondContact OG-N 2.9Å
1203	V	92.2	Very high	80.3	Confident	6 Å²	6	96.3 Å²	96.3	4%	0.036	52%	0.521	C	S	.	.	B	Isolated β-bridge	trans	-102.3	104.6	177.9	-172.5	0	0	0	0	108.8	V1157 T1158 R1161 A1163	V1157-V1203 HydrophobicContact CG1-CB 4.48Å; V1157-V1203 HydrophobicContact CG1-CG1 4.05Å; V1157-V1203 HydrophobicContact CG1-CG2 3.57Å; T1158-V1203 HydrophobicContact CG2-CG1 3.99Å; R1161-V1203 VanDerWaalsContact CZ-O 3.23Å; R1161-V1203 PolarHBondContact NH1-O 3.33Å; R1161-V1203 PolarHBondContact NH2-O 3.26Å; A1163-V1203 HydrophobicContact CB-CG2 4.23Å
1204	L	89.5	Confident	79.7	Confident	105 Å²	105	100.4 Å²	100.4	55%	0.55	54%	0.541	S	S	.	.			trans	-75.8	-36.2	-176	-58.2	177.5	0	0	0	111.4	I1191	I1191-L1204 PolarHBondContact O-N 3.38Å
1205	A	86.3	Confident	79.3	Confident	23 Å²	23	97.9 Å²	97.9	19%	0.19	53%	0.534	C	S	.	.	S	Bend	trans	-63.8	140.3	175.3	0	0	0	0	0	111.7	T1158 R1161 I1191	T1158-A1205 HydrophobicContact CG2-CB 3.8Å; R1161-A1205 PolarHBondContact NH1-O 2.9Å; I1191-A1205 HydrophobicContact CB-CB 4.45Å; I1191-A1205 HydrophobicContact CG2-CB 3.77Å; I1191-A1205 PolarHBondContact O-N 3.49Å; I1191-A1205 VanDerWaalsContact O-N 3.11Å
1206	P	82.7	Confident	78.8	Confident	89 Å²	89	96.3 Å²	96.3	58%	0.578	53%	0.531	S	S	*	.	P	Polyproline II helix	trans	-64.2	157.2	176.4	28.6	-35.3	0	0	0	111.5
1207	P	78.4	Confident	78.7	Confident	72 Å²	72	100.7 Å²	100.7	47%	0.468	54%	0.544	S	S	.	.	P	Polyproline II helix	trans	-61.5	153.8	167.9	29.9	-35.4	0	0	0	110.5
1208	P	74.8	Confident	79.4	Confident	76 Å²	76	94.1 Å²	94.1	49%	0.494	52%	0.519	S	S	.	.	P	Polyproline II helix	trans	-59	146.9	170.9	26.2	-33.8	0	0	0	111	E1159	E1159-P1208 HydrophobicContact CG-CG 4Å
1209	F	72.9	Confident	79.7	Confident	191 Å²	191	91.8 Å²	91.8	84%	0.838	51%	0.508	S	S	*	.	P	Polyproline II helix	trans	-86.6	136.6	173.1	-66.4	-91	0	0	0	110.1
1210	D	49.6	Very low	80.3	Confident	245 Å²	245	96.3 Å²	96.3	100%	1.31	51%	0.514	S	S	*	.			trans	-71.8	0	166.8	-73.1	-46.8	0	0	0	112.2

Retrieved 1,210 of 1,210 residues in 1643.5 ms (Link to these results)

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