A0A077Z093_TRITR Loading...

DNA-directed RNA polymerase subunit

DNA-dependent RNA polymerase catalyzes the transcription of DNA into RNA using the four ribonucleoside triphosphates as substrates.

AlphaFold DB , UniProt , Accession A0A077Z093, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 1,392 aa.

						>A0A077Z093_TRITR|A0A077Z093
MVKLQYRVADRHYKIESIKFTPADHRSLRQEAVVQIVKTQLYVKEKDFVPLEFGPLDRRMGPNNAISKCATCGNSFQNCAGHFGFLDLELPIFHLGFFRHTVQILQSICKNCCSVLLNPKDKATYLKKLESGRLTYSAQKSVYKAITDKCKKTTVCPHCNYVNGKVKALPGHFMKIVYDRSKTSSKKMVKDQVESNSEAQNVQTNSDVSLLNPLAALNLFLRIPSGDIPLLVMSRGSGHPSDLILQRIPVPPATIRPSVKAAGGSNEDDLTIKIMEICCINQAIHSSETKSASVETVAENWNCLQMLHALYLNSEVPGLPPQMKTQKFIRSLAQRLKGKEGRFRKNLSGKRVDYSGRTVISPDPNLQIFEVGVPLLVAKQLTFPECVTHLNFKRLKEAVNNGPNVYPGATYYTERGSTVKKFLNPSNRERAVRTLKFGDTVDRHMMDGDVVLFNRQPSLHRLSMMGHFVKVLPYRTFRFNECACTPYNADFDGDEMNLHFPQTHEARAEVVSLMNVRNNLVTPRNGEPLIAATQDFITGAYLLTKRDVFLNKVDFWKLAGCMFSHMNGVRKMDIPKPAILKPVTVWTGKQVFSLVLRPAKTSPALNLNTKGKSYTNNREFCRNESYVVIRNGVLLAGVMEKSLVGSGSKNGVFYMLMRDFGPQAAVEAMWRLARVSSNFLMERGFSIGIGDVTPSDDLLAEKIRLVKEGYTACDHFMNQLKTGKLNPQPGCTPEQTLEAVMLKELSAVRDRAGRACMGKLNRHNAPLIMALCGSKGSVINVSQMIACVGQQAINGRRPADGFINRCFPHFKPSHPTPDAKGFIDSSFYSGLNPNQFFFHAMAGREGLIDTAVKTAETGYMQRRLVKCLEDLCLHYDNTVRNSDGCIAQFQFGGDRIDPTQMECTDEVVNLNHGWEHSLSSVTCSCEQDVMNGDAMRDCFEKHLKSAVELYDDFFRSALSTFCEGKIAEADSIHSMATFCPAHSEGRPSDSCKSCFSHQCKKKLLMKSTLPSSEQFSQFLNTCIKKYRCAIAEPGTAVGAIAATSIGEPSTQMTLKTFHFAGVASMNITQGVPRIREIVNAVGNISTPVITVALSQEKSEQFARLVKGRLERTTLGEVTESVECTYRKDTCFLLLKISIERIKLLQLEVTLADIVDCILTAKLFVRLLPRQVSIRGNRYISIEVEGTKKMFAASLLIHLRKSLLEIVVHGLPSVKRCTINADEKVGETMNLLAESNDFLRVLGILGVDPNRTVSNNPIEVAKTLGIEAARRSIISEIQATMASHGIGLDIRHLMILADMMTCTGSITGMTRQGLPKVKDSVILQASFEKTTDHLYAAAYHGHNDSVTGVSESIILGAPISLGTGMIDLFYKVPEIKLKKRPLFFDSRTSLFTC
					

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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	44	Very low	69.2	Low	238 Å²	238	164.2 Å²	164.2	100%	1.172	79%	0.793	S	S	*	*				0	106.8	0	-79.8	-177.2	176.4	0	0	108.5	K3	M1-K3 PolarHBondContact O-N 3.26Å
2	V	50.4	Low	69.9	Low	145 Å²	145	165.3 Å²	165.3	88%	0.879	80%	0.796	S	S	*	*			trans	-65.5	114.3	168.7	-176.5	0	0	0	0	106	L4	V2-L4 PolarHBondContact O-N 3.48Å
3	K	62.5	Low	70.8	Confident	198 Å²	198	166.5 Å²	166.5	86%	0.861	79%	0.789	S	S	*	*			trans	-59	115.4	175.7	-76.4	180	176.3	177.2	0	107.2	M1 Q5	M1-K3 PolarHBondContact O-N 3.26Å; K3-Q5 PolarHBondContact O-N 3.43Å
4	L	74.7	Confident	71.6	Confident	173 Å²	173	165.4 Å²	165.4	91%	0.906	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-57.7	122	175.7	-89.8	150.8	0	0	0	108.7	V2	V2-L4 PolarHBondContact O-N 3.48Å
5	Q	80.2	Confident	72.7	Confident	180 Å²	180	160.1 Å²	160.1	84%	0.841	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-64.2	134.6	173.8	-169.7	174.8	6.9	0	0	108.8	K3 R7	K3-Q5 PolarHBondContact O-N 3.43Å; Q5-R7 PolarHBondContact O-N 3.14Å; Q5-R7 VanDerWaalsContact O-N 3.12Å
6	Y	82.4	Confident	73.7	Confident	198 Å²	198	160.3 Å²	160.3	78%	0.776	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-56.7	120.6	175.9	177	-99.7	0	0	0	109.6	V8	Y6-V8 HydrophobicContact CE1-CG2 3.67Å
7	R	77.3	Confident	74.8	Confident	225 Å²	225	153.8 Å²	153.8	85%	0.849	73%	0.733	S	S	*	*			trans	-127.2	123.2	174.4	-160.7	178.9	-173	-176.1	1.9	106.5	Q5 A9	Q5-R7 PolarHBondContact O-N 3.14Å; Q5-R7 VanDerWaalsContact O-N 3.12Å; R7-A9 PolarHBondContact O-N 3.32Å
8	V	76.8	Confident	75.7	Confident	66 Å²	66	147.7 Å²	147.7	40%	0.4	71%	0.705	S	S	.	*			trans	-62.4	113.3	172.8	-177.8	0	0	0	0	106.7	Y6 D10 R11	Y6-V8 HydrophobicContact CE1-CG2 3.67Å; V8-D10 VanDerWaalsContact C-N 3.34Å; V8-D10 PolarHBondContact O-N 3.35Å; V8-R11 HydrophobicContact CB-CG 4.35Å; V8-R11 HydrophobicContact CG1-CG 3.78Å
9	A	69.1	Low	76.5	Confident	87 Å²	87	145.8 Å²	145.8	72%	0.719	69%	0.694	S	S	*	*	S	Bend	trans	-64.8	-37.7	-168.7	0	0	0	0	0	112.2	R7	R7-A9 PolarHBondContact O-N 3.32Å
10	D	67.5	Low	77.3	Confident	128 Å²	128	140.4 Å²	140.4	68%	0.684	67%	0.667	S	S	*	*			trans	-142.1	88.3	-173.2	-62.4	-55.4	0	0	0	111.5	V8	V8-D10 VanDerWaalsContact C-N 3.34Å; V8-D10 PolarHBondContact O-N 3.35Å
11	R	76.4	Confident	77.9	Confident	168 Å²	168	136.4 Å²	136.4	63%	0.634	65%	0.652	S	S	*	*			trans	-85.2	109.2	164.7	-81.1	-171.4	176.7	176.8	-1.2	109	V8 Y13	V8-R11 HydrophobicContact CB-CG 4.35Å; V8-R11 HydrophobicContact CG1-CG 3.78Å; R11-Y13 HydrophobicContact CB-CD2 4.27Å; R11-Y13 HydrophobicContact CB-CE1 4.49Å; R11-Y13 HydrophobicContact CB-CE2 3.56Å; R11-Y13 WeakPolarHBondContact CD-OH 3.24Å; R11-Y13 PolarHBondContact NH1-OH 2.94Å; R11-Y13 WeakPolarHBondContact O-CD2 3.39Å
12	H	77.1	Confident	80.1	Confident	178 Å²	178	125.7 Å²	125.7	82%	0.824	60%	0.6	S	S	*	*			trans	-78.5	123.4	168.3	-63.5	-68.9	0	0	0	109.5
13	Y	82.5	Confident	81.7	Confident	181 Å²	181	121.4 Å²	121.4	71%	0.71	58%	0.58	S	S	*	*			trans	-111.1	141.7	175.3	-62.3	-80.9	0	0	0	109.6	R11	R11-Y13 HydrophobicContact CB-CD2 4.27Å; R11-Y13 HydrophobicContact CB-CE1 4.49Å; R11-Y13 HydrophobicContact CB-CE2 3.56Å; R11-Y13 WeakPolarHBondContact CD-OH 3.24Å; R11-Y13 PolarHBondContact NH1-OH 2.94Å; R11-Y13 WeakPolarHBondContact O-CD2 3.39Å
14	K	81.7	Confident	82.8	Confident	151 Å²	151	114 Å²	114	66%	0.657	55%	0.55	S	S	*	.			trans	-97.7	138.7	172	-175.1	176.9	177.6	-179.6	0	109	E16	K14-E16 PolarHBondContact O-N 2.93Å
15	I	88.8	Confident	83.4	Confident	85 Å²	85	108.5 Å²	108.5	44%	0.436	52%	0.519	S	S	.	.			trans	-73.9	122.4	173.5	-58.3	173.2	0	0	0	108.2	I18 V1345 L1354	I15-I18 HydrophobicContact CG2-CG1 4.47Å; I15-V1345 HydrophobicContact CG2-CG2 4.11Å; I15-L1354 HydrophobicContact CG2-CD1 4.35Å
16	E	88.7	Confident	83.8	Confident	163 Å²	163	108.6 Å²	108.6	76%	0.762	51%	0.512	S	S	*	.			trans	-99.4	-45	-179.4	-174.2	-178	177.7	0	0	112.4	K14 V1345	K14-E16 PolarHBondContact O-N 2.93Å; E16-V1345 PolarHBondContact O-N 3.38Å
17	S	91.1	Very high	84	Confident	51 Å²	51	101.5 Å²	101.5	36%	0.357	49%	0.491	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	161.1	-179.2	59.8	0	0	0	0	112.3	N1342 D1343	S17-N1342 WeakPolarHBondContact CB-OD1 3.43Å; S17-N1342 PolarHBondContact OG-ND2 2.76Å; S17-N1342 PolarHBondContact OG-OD1 3.17Å; S17-D1343 CarbonylContact C-O 3.46Å; S17-D1343 VanDerWaalsContact CA-O 3.28Å; S17-D1343 WeakPolarHBondContact CA-O 3.48Å; S17-D1343 WeakPolarHBondContact CB-O 3.45Å
18	I	91.9	Very high	84.6	Confident	44 Å²	44	92 Å²	92	23%	0.226	46%	0.457	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	117.7	177.7	-65.3	172.8	0	0	0	109.2	I15 F20 I1321 N1342 D1343 V1345 L1354	I15-I18 HydrophobicContact CG2-CG1 4.47Å; I18-F20 HydrophobicContact CB-CE2 4.44Å; I18-F20 HydrophobicContact CG2-CD2 4.31Å; I18-F20 HydrophobicContact CG2-CE1 4.24Å; I18-F20 HydrophobicContact CG2-CE2 3.85Å; I18-F20 HydrophobicContact CG2-CZ 3.81Å; I18-I1321 HydrophobicContact CD1-CD1 3.63Å; I18-N1342 VanDerWaalsContact C-OD1 3.3Å; I18-N1342 PolarHBondContact O-OD1 2.69Å; I18-D1343 PolarHBondContact N-O 3.18Å; I18-D1343 PolarHBondContact O-N 3.34Å; I18-V1345 HydrophobicContact CD1-CG2 4.42Å; I18-V1345 HydrophobicContact CG1-CG2 4.37Å; I18-L1354 HydrophobicContact CD1-CD1 3.53Å; I18-L1354 HydrophobicContact CD1-CD2 3.83Å; I18-L1354 HydrophobicContact CD1-CG 4.28Å; I18-L1354 HydrophobicContact CG1-CD1 4.5Å
19	K	91	Very high	85.2	Confident	112 Å²	112	95.7 Å²	95.7	49%	0.487	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	121.2	175.2	-168.3	177.3	177.5	-178.3	0	110.8	T21 S237 N1342	K19-T21 HydrophobicContact CG-CG2 4.24Å; K19-S237 WeakPolarHBondContact CE-OG 3.38Å; K19-S237 PolarHBondContact NZ-OG 3.45Å; K19-N1342 PolarHBondContact N-OD1 3.22Å
20	F	91.9	Very high	86.3	Confident	37 Å²	37	99.7 Å²	99.7	16%	0.162	47%	0.468	C	S	.	.			trans	-94.8	124.7	176.6	-65.6	-85.5	0	0	0	110.5	I18 V1320 I1321 L1333 A1336 A1337 G1340 H1341 D1343	I18-F20 HydrophobicContact CB-CE2 4.44Å; I18-F20 HydrophobicContact CG2-CD2 4.31Å; I18-F20 HydrophobicContact CG2-CE1 4.24Å; I18-F20 HydrophobicContact CG2-CE2 3.85Å; I18-F20 HydrophobicContact CG2-CZ 3.81Å; F20-V1320 HydrophobicContact CE2-CB 4.09Å; F20-V1320 HydrophobicContact CE2-CG1 4.28Å; F20-V1320 HydrophobicContact CZ-CG1 4.36Å; F20-I1321 HydrophobicContact CZ-CG1 4.15Å; F20-L1333 HydrophobicContact CE1-CD2 3.94Å; F20-L1333 HydrophobicContact CZ-CD2 4.39Å; F20-A1336 HydrophobicContact CB-CB 4.12Å; F20-A1336 HydrophobicContact CD2-CB 4.17Å; F20-A1336 HydrophobicContact CG-CB 4.09Å; F20-A1337 HydrophobicContact CB-CB 4.48Å; F20-G1340 CarbonylContact O-C 3.37Å; F20-G1340 WeakPolarHBondContact O-CA 2.93Å; F20-H1341 PolarHBondContact N-O 3.21Å; F20-D1343 HydrophobicContact CD2-CB 4.39Å; F20-D1343 HydrophobicContact CE2-CB 3.8Å
21	T	90.6	Very high	87.3	Confident	57 Å²	57	100.4 Å²	100.4	35%	0.35	47%	0.467	S	S	.	.			trans	-142.9	151.8	176.2	54.7	0	0	0	0	110.9	K19 S237	K19-T21 HydrophobicContact CG-CG2 4.24Å; T21-S237 WeakPolarHBondContact CB-O 3.2Å; T21-S237 WeakPolarHBondContact CG2-O 3.31Å
22	P	89	Confident	88.1	Confident	12 Å²	12	93.1 Å²	93.1	8%	0.078	44%	0.443	C	S	.	.	P	Polyproline II helix	trans	-64.8	141.5	164.2	31.1	-34.2	0	0	0	108.7	F97 D242 A1337	P22-F97 HydrophobicContact CB-CZ 4.32Å; P22-D242 HydrophobicContact CB-CB 4.35Å; P22-D242 HydrophobicContact CG-CB 4.38Å; P22-A1337 WeakPolarHBondContact CD-O 3.2Å
23	A	84.8	Confident	88.9	Confident	55 Å²	55	87.6 Å²	87.6	46%	0.455	42%	0.422	S	S	.	.	P	Polyproline II helix	trans	-79.8	131	174.3	0	0	0	0	0	109.4	L28	A23-L28 HydrophobicContact CB-CD1 4.25Å; A23-L28 HydrophobicContact CB-CD2 3.61Å; A23-L28 HydrophobicContact CB-CG 3.76Å
24	D	86.6	Confident	89.5	Confident	43 Å²	43	79.2 Å²	79.2	23%	0.23	39%	0.389	C	S	.	.	P	Polyproline II helix	trans	-76.9	153.2	172.2	73.2	-60.2	0	0	0	110.3	R26 S27 L28	D24-R26 PolarHBondContact O-N 3.07Å; D24-R26 VanDerWaalsContact O-N 3.13Å; D24-R26 WeakPolarHBondContact OD2-CA 3.38Å; D24-R26 VanDerWaalsContact OD2-CB 3.24Å; D24-R26 WeakPolarHBondContact OD2-CB 2.97Å; D24-R26 PolarHBondContact OD2-N 3.05Å; D24-R26 VanDerWaalsContact OD2-N 3.11Å; D24-S27 PolarHBondContact O-N 3.12Å; D24-S27 WeakPolarHBondContact OD1-CB 3.15Å; D24-S27 PolarHBondContact OD1-N 2.89Å; D24-S27 PolarHBondContact OD1-OG 2.99Å; D24-S27 PolarHBondContact OD2-N 2.76Å; D24-L28 WeakPolarHBondContact O-CG 3.49Å; D24-L28 PolarHBondContact O-N 3.05Å; D24-L28 VanDerWaalsContact O-N 3.08Å
25	H	85.5	Confident	90.1	Very high	58 Å²	58	75.2 Å²	75.2	27%	0.269	37%	0.373	S	S	.	.	H	α-helix	trans	-60.1	-27.1	-177.8	67.5	-81.3	0	0	0	112.9	R29 R247	H25-R29 PolarHBondContact O-N 3.27Å; H25-R247 PolarHBondContact O-NH1 3.03Å
26	R	88.7	Confident	90.4	Very high	181 Å²	181	71.3 Å²	71.3	68%	0.683	35%	0.353	S	S	*	.	H	α-helix	trans	-77.5	-47.3	-179.7	-53.9	-178.5	176.7	177.2	-3.2	111	D24 L28 R29 Q30	D24-R26 PolarHBondContact O-N 3.07Å; D24-R26 VanDerWaalsContact O-N 3.13Å; D24-R26 WeakPolarHBondContact OD2-CA 3.38Å; D24-R26 VanDerWaalsContact OD2-CB 3.24Å; D24-R26 WeakPolarHBondContact OD2-CB 2.97Å; D24-R26 PolarHBondContact OD2-N 3.05Å; D24-R26 VanDerWaalsContact OD2-N 3.11Å; R26-L28 VanDerWaalsContact C-N 3.27Å; R26-L28 PolarHBondContact O-N 3.46Å; R26-R29 WeakPolarHBondContact O-CB 3.44Å; R26-R29 PolarHBondContact O-N 3.32Å; R26-Q30 PolarHBondContact O-N 3.34Å
27	S	87.1	Confident	90.5	Very high	50 Å²	50	66.7 Å²	66.7	35%	0.35	34%	0.335	S	S	.	.	H	α-helix	trans	-62.2	-36.9	175.9	-55	0	0	0	0	111.9	D24 R29 Q30 E31	D24-S27 PolarHBondContact O-N 3.12Å; D24-S27 WeakPolarHBondContact OD1-CB 3.15Å; D24-S27 PolarHBondContact OD1-N 2.89Å; D24-S27 PolarHBondContact OD1-OG 2.99Å; D24-S27 PolarHBondContact OD2-N 2.76Å; S27-R29 PolarHBondContact O-N 3.19Å; S27-Q30 WeakPolarHBondContact O-CB 3.36Å; S27-Q30 PolarHBondContact O-N 3.31Å; S27-E31 PolarHBondContact O-N 3.28Å
28	L	89.2	Confident	90.5	Very high	25 Å²	25	68.9 Å²	68.9	13%	0.131	34%	0.338	C	S	.	.	H	α-helix	trans	-57.2	-37.5	173.8	-74.8	-179.8	0	0	0	112.9	A23 D24 R26 A32 P249	A23-L28 HydrophobicContact CB-CD1 4.25Å; A23-L28 HydrophobicContact CB-CD2 3.61Å; A23-L28 HydrophobicContact CB-CG 3.76Å; D24-L28 WeakPolarHBondContact O-CG 3.49Å; D24-L28 PolarHBondContact O-N 3.05Å; D24-L28 VanDerWaalsContact O-N 3.08Å; R26-L28 VanDerWaalsContact C-N 3.27Å; R26-L28 PolarHBondContact O-N 3.46Å; L28-A32 WeakPolarHBondContact O-CB 3.39Å; L28-A32 PolarHBondContact O-N 3.35Å; L28-P249 HydrophobicContact CD2-CB 4Å; L28-P249 HydrophobicContact CD2-CG 4.23Å
29	R	90.8	Very high	90.4	Very high	143 Å²	143	68.5 Å²	68.5	54%	0.54	34%	0.338	S	S	.	.	H	α-helix	trans	-72.8	-34.9	175.2	-172.2	176.9	179.4	157.2	1.1	112	H25 R26 S27 F85	H25-R29 PolarHBondContact O-N 3.27Å; R26-R29 WeakPolarHBondContact O-CB 3.44Å; R26-R29 PolarHBondContact O-N 3.32Å; S27-R29 PolarHBondContact O-N 3.19Å; R29-F85 HydrophobicContact CG-CE1 4.18Å; R29-F85 HydrophobicContact CG-CZ 4.09Å
30	Q	91.7	Very high	90.3	Very high	171 Å²	171	67.5 Å²	67.5	80%	0.799	34%	0.335	S	S	*	.	H	α-helix	trans	-71.9	-35.5	-177.1	-155.9	173.6	9.1	0	0	112	R26 S27	R26-Q30 PolarHBondContact O-N 3.34Å; S27-Q30 WeakPolarHBondContact O-CB 3.36Å; S27-Q30 PolarHBondContact O-N 3.31Å
31	E	89.1	Confident	90.1	Very high	143 Å²	143	67 Å²	67	67%	0.668	33%	0.334	S	S	*	.	H	α-helix	trans	-78.6	-27.5	174.4	-74.1	-165.9	157.5	0	0	113.7	S27	S27-E31 PolarHBondContact O-N 3.28Å
32	A	92.6	Very high	90	Very high	15 Å²	15	66.6 Å²	66.6	12%	0.124	33%	0.326	C	S	.	.			trans	-80.9	139.7	-174.6	0	0	0	0	0	112.6	L28 F83 F85	L28-A32 WeakPolarHBondContact O-CB 3.39Å; L28-A32 PolarHBondContact O-N 3.35Å; A32-F83 CarbonylContact C-O 3.56Å; A32-F83 VanDerWaalsContact CA-O 3.31Å; A32-F83 WeakPolarHBondContact CA-O 3.32Å; A32-F85 HydrophobicContact CB-CB 3.96Å; A32-F85 HydrophobicContact CB-CD1 3.53Å; A32-F85 HydrophobicContact CB-CE1 4.49Å; A32-F85 HydrophobicContact CB-CG 4.19Å
33	V	93.8	Very high	89.9	Confident	63 Å²	63	68 Å²	68	38%	0.382	34%	0.335	S	S	.	.	S	Bend	trans	-93.1	-24.7	-173.5	-166.6	0	0	0	0	112.3	T71 H82 F83	V33-T71 HydrophobicContact CG1-CG2 3.97Å; V33-H82 HydrophobicContact CB-CB 4.49Å; V33-H82 HydrophobicContact CG2-CB 3.63Å; V33-F83 PolarHBondContact N-O 3.28Å
34	V	94.4	Very high	89.6	Confident	4 Å²	4	74 Å²	74	2%	0.024	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	142	-177.1	66.3	0	0	0	0	111.7	I36 F53 M60 G84 F85	V34-I36 HydrophobicContact CG1-CD1 4.21Å; V34-F53 HydrophobicContact CG2-CD1 3.96Å; V34-F53 HydrophobicContact CG2-CE1 4.41Å; V34-M60 HydrophobicContact CG1-CG 3.5Å; V34-M60 VanDerWaalsContact CG1-CG 3.5Å; V34-M60 HydrophobicContact CG1-SD 4Å; V34-G84 CarbonylContact O-C 3.53Å; V34-G84 WeakPolarHBondContact O-CA 3.38Å; V34-F85 PolarHBondContact O-N 3.33Å
35	Q	95.1	Very high	89.1	Confident	68 Å²	68	80.5 Å²	80.5	32%	0.318	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	131.3	168.9	-172.8	174.5	0.2	0	0	110.2	V37 F85	Q35-V37 HydrophobicContact CG-CG1 4.37Å; Q35-F85 WeakPolarHBondContact CA-O 3.48Å; Q35-F85 HydrophobicContact CB-CD1 4.37Å; Q35-F85 HydrophobicContact CB-CE1 3.73Å; Q35-F85 HydrophobicContact CB-CE2 3.96Å; Q35-F85 HydrophobicContact CB-CZ 3.5Å; Q35-F85 VanDerWaalsContact CB-CZ 3.5Å; Q35-F85 HydrophobicContact CG-CD2 4.19Å; Q35-F85 HydrophobicContact CG-CE1 4.3Å; Q35-F85 HydrophobicContact CG-CE2 3.58Å; Q35-F85 HydrophobicContact CG-CZ 3.66Å
36	I	94	Very high	88.6	Confident	3 Å²	3	84 Å²	84	2%	0.015	39%	0.394	C	S	.	.			trans	-90.8	117.4	175.6	-51.1	-60.5	0	0	0	108.9	V34 G54 P55 M60 F85 V250	V34-I36 HydrophobicContact CG1-CD1 4.21Å; I36-G54 VanDerWaalsContact CD1-O 3.28Å; I36-G54 WeakPolarHBondContact CD1-O 3.48Å; I36-P55 HydrophobicContact CG2-CG 4.33Å; I36-M60 HydrophobicContact CD1-CE 3.55Å; I36-M60 HydrophobicContact CD1-SD 3.94Å; I36-F85 PolarHBondContact N-O 3.18Å; I36-V250 HydrophobicContact CG1-CB 4.27Å; I36-V250 HydrophobicContact CG1-CG1 4.15Å; I36-V250 HydrophobicContact CG1-CG2 3.95Å
37	V	91.8	Very high	87.9	Confident	65 Å²	65	82.1 Å²	82.1	39%	0.394	40%	0.398	S	S	.	.			trans	-127.6	-24.7	-179.9	-90.5	0	0	0	0	112.6	Q35 F53 Q282	Q35-V37 HydrophobicContact CG-CG1 4.37Å; V37-F53 HydrophobicContact CG2-CB 3.73Å; V37-F53 HydrophobicContact CG2-CD1 4.47Å; V37-F53 HydrophobicContact CG2-CG 4.37Å; V37-F53 PolarHBondContact N-O 2.94Å; V37-Q282 PolarHBondContact O-NE2 3.47Å
38	K	91.2	Very high	87.3	Confident	97 Å²	97	83.7 Å²	83.7	42%	0.422	40%	0.399	S	S	.	.			trans	-95.6	140	-179.8	-62.2	-169.2	-175.2	174.2	0	110.9	L51 F53	K38-L51 HydrophobicContact CB-CD2 4.02Å; K38-L51 HydrophobicContact CD-CD2 3.58Å; K38-L51 HydrophobicContact CD-CG 4.09Å; K38-L51 HydrophobicContact CG-CD2 4.45Å; K38-F53 PolarHBondContact N-O 2.9Å
39	T	88.4	Confident	87.1	Confident	36 Å²	36	84.7 Å²	84.7	22%	0.221	41%	0.406	C	S	.	.			trans	-84.2	-31.4	178.6	48.6	0	0	0	0	113.1	M275 C278 C279	T39-M275 WeakPolarHBondContact O-CG 3.49Å; T39-C278 HydrophobicContact CG2-CB 4.14Å; T39-C279 HydrophobicContact CG2-CB 3.86Å
40	Q	88.8	Confident	87	Confident	91 Å²	91	78.4 Å²	78.4	43%	0.425	38%	0.383	S	S	.	.			trans	-67.6	134.3	-179	-68.1	175.1	7.9	0	0	111.4	L51	Q40-L51 HydrophobicContact CB-CD2 3.76Å
41	L	88.8	Confident	86.9	Confident	27 Å²	27	71.3 Å²	71.3	14%	0.141	35%	0.351	C	S	.	.	S	Bend	trans	-79.6	-40	-178.1	-62.3	174.7	0	0	0	112.7	P50 L51 P55 L56 E267 T271 M275	L41-P50 WeakPolarHBondContact O-CA 3.34Å; L41-L51 PolarHBondContact O-N 2.89Å; L41-P55 HydrophobicContact CD2-CB 3.94Å; L41-P55 HydrophobicContact CD2-CG 3.85Å; L41-L56 HydrophobicContact CB-CD1 4.3Å; L41-L56 HydrophobicContact CD2-CD1 4.37Å; L41-L56 HydrophobicContact CD2-CG 4.36Å; L41-E267 HydrophobicContact CD1-CG 4.05Å; L41-T271 HydrophobicContact CD2-CG2 3.72Å; L41-M275 HydrophobicContact CD1-SD 4.19Å; L41-M275 HydrophobicContact CD2-SD 4.49Å; L41-M275 HydrophobicContact CG-SD 4.11Å
42	Y	88.9	Confident	86.9	Confident	48 Å²	48	70.6 Å²	70.6	19%	0.188	35%	0.347	C	S	.	.	B	Isolated β-bridge	trans	-125.3	153.9	-172.7	-64.8	-69	0	0	0	111.1	K44 F48 V49 L56 S265 E267	Y42-K44 PolarHBondContact O-N 3.3Å; Y42-F48 HydrophobicContact CE1-CB 4.42Å; Y42-V49 WeakPolarHBondContact CA-O 3.47Å; Y42-L56 HydrophobicContact CE1-CD1 4.23Å; Y42-L56 HydrophobicContact CE2-CD1 4.33Å; Y42-S265 PolarHBondContact OH-OG 3.26Å; Y42-E267 PolarHBondContact OH-OE1 3.07Å
43	V	86	Confident	87	Confident	43 Å²	43	73.6 Å²	73.6	26%	0.261	36%	0.358	S	S	.	.			trans	-69.1	124.2	169.7	-176.8	0	0	0	0	108.4	E45 K46 V49 L51	V43-E45 HydrophobicContact CG1-CB 4.45Å; V43-E45 PolarHBondContact O-N 3.43Å; V43-K46 HydrophobicContact CB-CB 4.37Å; V43-K46 HydrophobicContact CG1-CB 4.45Å; V43-K46 PolarHBondContact O-N 2.93Å; V43-V49 HydrophobicContact CG2-CG1 4.38Å; V43-V49 PolarHBondContact N-O 3.03Å; V43-L51 HydrophobicContact CG2-CD1 3.75Å
44	K	79	Confident	86.9	Confident	179 Å²	179	70.6 Å²	70.6	78%	0.778	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	-32.2	-177.1	-72.6	-174.3	176.7	-176.6	0	114	Y42	Y42-K44 PolarHBondContact O-N 3.3Å
45	E	76.8	Confident	86.7	Confident	181 Å²	181	70.4 Å²	70.4	85%	0.846	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88	-10.1	-175.3	-64.3	169	-177.4	0	0	113.7	V43	V43-E45 HydrophobicContact CG1-CB 4.45Å; V43-E45 PolarHBondContact O-N 3.43Å
46	K	74.5	Confident	86.6	Confident	131 Å²	131	67.1 Å²	67.1	57%	0.57	32%	0.323	S	S	*	.	S	Bend	trans	-133.8	116.3	-175.2	-67.8	-174.9	179.9	177.3	0	111	V43 F48 V49	V43-K46 HydrophobicContact CB-CB 4.37Å; V43-K46 HydrophobicContact CG1-CB 4.45Å; V43-K46 PolarHBondContact O-N 2.93Å; K46-F48 PolarHBondContact O-N 3.18Å; K46-V49 HydrophobicContact CB-CB 4.05Å; K46-V49 HydrophobicContact CB-CG2 3.81Å; K46-V49 HydrophobicContact CD-CG2 4.49Å; K46-V49 PolarHBondContact O-N 2.73Å
47	D	73.7	Confident	86.5	Confident	142 Å²	142	67.3 Å²	67.3	76%	0.759	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	121.3	-179.5	-82	-19.7	0	0	0	112.4	V49	D47-V49 PolarHBondContact O-N 2.61Å; D47-V49 VanDerWaalsContact O-N 3.1Å
48	F	75.4	Confident	86.5	Confident	83 Å²	83	69.1 Å²	69.1	36%	0.364	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.1	23.3	173.5	-49.7	-74	0	0	0	115.6	Y42 K46 P50	Y42-F48 HydrophobicContact CE1-CB 4.42Å; K46-F48 PolarHBondContact O-N 3.18Å; F48-P50 WeakPolarHBondContact O-CD 3.49Å
49	V	84.5	Confident	86.6	Confident	46 Å²	46	67.5 Å²	67.5	28%	0.279	32%	0.315	S	S	.	.			trans	-88.3	115.4	169.4	-178.9	0	0	0	0	108.7	Y42 V43 K46 D47 L51	Y42-V49 WeakPolarHBondContact CA-O 3.47Å; V43-V49 HydrophobicContact CG2-CG1 4.38Å; V43-V49 PolarHBondContact N-O 3.03Å; K46-V49 HydrophobicContact CB-CB 4.05Å; K46-V49 HydrophobicContact CB-CG2 3.81Å; K46-V49 HydrophobicContact CD-CG2 4.49Å; K46-V49 PolarHBondContact O-N 2.73Å; D47-V49 PolarHBondContact O-N 2.61Å; D47-V49 VanDerWaalsContact O-N 3.1Å; V49-L51 PolarHBondContact O-N 3.03Å
50	P	87.4	Confident	86.9	Confident	10 Å²	10	65.8 Å²	65.8	7%	0.065	31%	0.305	C	S	.	.	B	Isolated β-bridge	trans	-60.2	138.5	179.5	-20.4	31.5	0	0	0	111.1	L41 F48 L56 R58	L41-P50 WeakPolarHBondContact O-CA 3.34Å; F48-P50 WeakPolarHBondContact O-CD 3.49Å; P50-L56 HydrophobicContact CB-CB 3.92Å; P50-L56 WeakPolarHBondContact CB-O 3.34Å; P50-L56 HydrophobicContact CG-CB 4.48Å; P50-R58 HydrophobicContact CG-CG 4.29Å
51	L	90.1	Very high	87.1	Confident	23 Å²	23	61.5 Å²	61.5	12%	0.12	28%	0.284	C	S	.	.	P	Polyproline II helix	trans	-73.7	137.7	177.9	-170.2	67.3	0	0	0	110.8	K38 Q40 L41 V43 V49 G54	K38-L51 HydrophobicContact CB-CD2 4.02Å; K38-L51 HydrophobicContact CD-CD2 3.58Å; K38-L51 HydrophobicContact CD-CG 4.09Å; K38-L51 HydrophobicContact CG-CD2 4.45Å; Q40-L51 HydrophobicContact CB-CD2 3.76Å; L41-L51 PolarHBondContact O-N 2.89Å; V43-L51 HydrophobicContact CG2-CD1 3.75Å; V49-L51 PolarHBondContact O-N 3.03Å; L51-G54 PolarHBondContact O-N 3.01Å
52	E	90.3	Very high	87.2	Confident	128 Å²	128	60.2 Å²	60.2	60%	0.598	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	140.6	172.3	-64.7	-170.8	166.1	0	0	111.2	G54	E52-G54 PolarHBondContact O-N 3.47Å
53	F	93.3	Very high	87.1	Confident	77 Å²	77	58 Å²	58	34%	0.338	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.5	16.3	-174.6	-51	-89.8	0	0	0	114.5	V34 V37 K38 D57	V34-F53 HydrophobicContact CG2-CD1 3.96Å; V34-F53 HydrophobicContact CG2-CE1 4.41Å; V37-F53 HydrophobicContact CG2-CB 3.73Å; V37-F53 HydrophobicContact CG2-CD1 4.47Å; V37-F53 HydrophobicContact CG2-CG 4.37Å; V37-F53 PolarHBondContact N-O 2.94Å; K38-F53 PolarHBondContact N-O 2.9Å; F53-D57 PolarHBondContact N-OD2 3.49Å
54	G	92.2	Very high	87.1	Confident	0 Å²	0	58.1 Å²	58.1	0%	0	27%	0.268	C	S	.	.	S	Bend	trans	-102.6	172.9	171	0	0	0	0	0	113.1	I36 L51 E52 L56 D57	I36-G54 VanDerWaalsContact CD1-O 3.28Å; I36-G54 WeakPolarHBondContact CD1-O 3.48Å; L51-G54 PolarHBondContact O-N 3.01Å; E52-G54 PolarHBondContact O-N 3.47Å; G54-L56 PolarHBondContact O-N 3.44Å; G54-D57 WeakPolarHBondContact O-CB 3.48Å; G54-D57 PolarHBondContact O-N 3.38Å; G54-D57 VanDerWaalsContact O-N 3.08Å
55	P	91.6	Very high	87.3	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-17	-173.5	-25.2	34.2	0	0	0	116.3	I36 L41 M60 R256 T271 I274 M275	I36-P55 HydrophobicContact CG2-CG 4.33Å; L41-P55 HydrophobicContact CD2-CB 3.94Å; L41-P55 HydrophobicContact CD2-CG 3.85Å; P55-M60 WeakPolarHBondContact O-CE 3.44Å; P55-R256 PolarHBondContact O-NH2 3.19Å; P55-T271 HydrophobicContact CB-CG2 4.21Å; P55-I274 HydrophobicContact CB-CG2 4.17Å; P55-I274 HydrophobicContact CG-CG2 4.29Å; P55-M275 HydrophobicContact CG-CB 4.47Å
56	L	92	Very high	87.6	Confident	0 Å²	0	52 Å²	52	0%	0	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.4	17.5	-179.7	-65.6	177.6	0	0	0	113	L41 Y42 P50 G54 R58 N63 T271	L41-L56 HydrophobicContact CB-CD1 4.3Å; L41-L56 HydrophobicContact CD2-CD1 4.37Å; L41-L56 HydrophobicContact CD2-CG 4.36Å; Y42-L56 HydrophobicContact CE1-CD1 4.23Å; Y42-L56 HydrophobicContact CE2-CD1 4.33Å; P50-L56 HydrophobicContact CB-CB 3.92Å; P50-L56 WeakPolarHBondContact CB-O 3.34Å; P50-L56 HydrophobicContact CG-CB 4.48Å; G54-L56 PolarHBondContact O-N 3.44Å; L56-R58 PolarHBondContact O-N 2.98Å; L56-N63 HydrophobicContact CD2-CB 4.44Å; L56-T271 HydrophobicContact CD1-CG2 4.35Å; L56-T271 HydrophobicContact CD2-CG2 3.76Å; L56-T271 HydrophobicContact CG-CG2 3.92Å
57	D	92.9	Very high	88.1	Confident	6 Å²	6	46.2 Å²	46.2	3%	0.032	24%	0.236	C	C	.	.			trans	-51.7	130.5	-180	-168.5	-39.4	0	0	0	111.9	F53 G54 R59 M60	F53-D57 PolarHBondContact N-OD2 3.49Å; G54-D57 WeakPolarHBondContact O-CB 3.48Å; G54-D57 PolarHBondContact O-N 3.38Å; G54-D57 VanDerWaalsContact O-N 3.08Å; D57-R59 PolarHBondContact O-N 3.26Å; D57-R59 VanDerWaalsContact O-N 3.14Å; D57-R59 WeakPolarHBondContact OD1-CB 3.38Å; D57-R59 WeakPolarHBondContact OD1-CG 3.04Å; D57-R59 PolarHBondContact OD1-N 2.96Å; D57-R59 IonicContact OD1-NE 2.77Å; D57-R59 PolarHBondContact OD1-NE 3.45Å; D57-R59 IonicContact OD2-CZ 2.74Å; D57-R59 IonicContact OD2-NE 2.77Å; D57-R59 PolarHBondContact OD2-NE 3.45Å; D57-R59 VanDerWaalsContact OD2-NE 3.1Å; D57-R59 IonicContact OD2-NH2 2.61Å; D57-R59 PolarHBondContact OD2-NH2 2.85Å; D57-M60 HydrophobicContact CB-CE 3.98Å; D57-M60 WeakPolarHBondContact O-CB 3.23Å; D57-M60 PolarHBondContact O-N 3.06Å
58	R	91.6	Very high	88.9	Confident	103 Å²	103	46.6 Å²	46.6	39%	0.389	23%	0.231	S	C	.	.	G	3₁₀ helix	trans	-64.4	-16.9	-177.5	-67.1	-178.1	176.5	170.3	0.7	113.6	P50 L56 M60 G61 A70	P50-R58 HydrophobicContact CG-CG 4.29Å; L56-R58 PolarHBondContact O-N 2.98Å; R58-M60 PolarHBondContact O-N 2.87Å; R58-G61 PolarHBondContact O-N 3.08Å; R58-G61 VanDerWaalsContact O-N 3.12Å; R58-A70 HydrophobicContact CB-CB 4.15Å; R58-A70 PolarHBondContact O-N 3.05Å
59	R	93.5	Very high	89.7	Confident	64 Å²	64	42.9 Å²	42.9	24%	0.242	22%	0.216	C	C	.	.	G	3₁₀ helix	trans	-64.3	-28.4	170.1	-70.7	177.7	-74.9	-171.7	-4.4	112.3	D57 G61 A70 T71 H82	D57-R59 PolarHBondContact O-N 3.26Å; D57-R59 VanDerWaalsContact O-N 3.14Å; D57-R59 WeakPolarHBondContact OD1-CB 3.38Å; D57-R59 WeakPolarHBondContact OD1-CG 3.04Å; D57-R59 PolarHBondContact OD1-N 2.96Å; D57-R59 IonicContact OD1-NE 2.77Å; D57-R59 PolarHBondContact OD1-NE 3.45Å; D57-R59 IonicContact OD2-CZ 2.74Å; D57-R59 IonicContact OD2-NE 2.77Å; D57-R59 PolarHBondContact OD2-NE 3.45Å; D57-R59 VanDerWaalsContact OD2-NE 3.1Å; D57-R59 IonicContact OD2-NH2 2.61Å; D57-R59 PolarHBondContact OD2-NH2 2.85Å; R59-G61 PolarHBondContact O-N 3.27Å; R59-A70 HydrophobicContact CG-CB 3.93Å; R59-T71 VanDerWaalsContact CA-OG1 3.31Å; R59-T71 WeakPolarHBondContact CA-OG1 3.45Å; R59-T71 PolarHBondContact O-OG1 3.36Å; R59-H82 PolarHBondContact O-CD2 2.82Å
60	M	93.9	Very high	90.1	Very high	0 Å²	0	44 Å²	44	0%	0	23%	0.23	C	C	.	.	G	3₁₀ helix	trans	-79.7	-1.5	173.8	-64.3	-173.5	-72.7	0	0	113.5	V34 I36 P55 D57 R58 H82 V250 A253	V34-M60 HydrophobicContact CG1-CG 3.5Å; V34-M60 VanDerWaalsContact CG1-CG 3.5Å; V34-M60 HydrophobicContact CG1-SD 4Å; I36-M60 HydrophobicContact CD1-CE 3.55Å; I36-M60 HydrophobicContact CD1-SD 3.94Å; P55-M60 WeakPolarHBondContact O-CE 3.44Å; D57-M60 HydrophobicContact CB-CE 3.98Å; D57-M60 WeakPolarHBondContact O-CB 3.23Å; D57-M60 PolarHBondContact O-N 3.06Å; R58-M60 PolarHBondContact O-N 2.87Å; M60-H82 WeakPolarHBondContact CA-O 3.35Å; M60-H82 WeakPolarHBondContact CB-O 3.49Å; M60-H82 PolarHBondContact O-N 2.61Å; M60-H82 VanDerWaalsContact O-N 3.12Å; M60-V250 HydrophobicContact CE-CG1 4.31Å; M60-V250 HydrophobicContact SD-CB 4.44Å; M60-V250 HydrophobicContact SD-CG1 3.66Å; M60-A253 PolarHBondContact O-N 3.43Å
61	G	92.9	Very high	90.4	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	25%	0.245	C	C	.	.			trans	115.3	165.6	-175.7	0	0	0	0	0	112.5	R58 R59	R58-G61 PolarHBondContact O-N 3.08Å; R58-G61 VanDerWaalsContact O-N 3.12Å; R59-G61 PolarHBondContact O-N 3.27Å
62	P	91.2	Very high	90.5	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	26%	0.255	C	S	.	.			trans	-71.5	139.5	176.1	30.5	-34.2	0	0	0	110.7	S67 F76 C79	P62-S67 VanDerWaalsContact CB-O 3.22Å; P62-S67 WeakPolarHBondContact CB-O 3.4Å; P62-S67 WeakPolarHBondContact CB-OG 3.45Å; P62-F76 HydrophobicContact CG-CB 4.02Å; P62-F76 HydrophobicContact CG-CD2 4.19Å; P62-F76 WeakPolarHBondContact O-CD2 3.45Å; P62-C79 HydrophobicContact CG-CB 4.32Å
63	N	86.5	Confident	90.6	Very high	2 Å²	2	43.9 Å²	43.9	1%	0.011	25%	0.249	C	C	.	.	S	Bend	trans	-92.7	-7.6	177.2	66.3	-35.2	0	0	0	113.2	L56 A253 S258	L56-N63 HydrophobicContact CD2-CB 4.44Å; N63-A253 HydrophobicContact CB-CB 4.26Å; N63-S258 PolarHBondContact ND2-OG 3.12Å; N63-S258 PolarHBondContact O-N 2.96Å
64	N	85.4	Confident	90.5	Very high	45 Å²	45	43.6 Å²	43.6	24%	0.241	25%	0.251	C	S	.	.	S	Bend	trans	-147.4	167.7	177.8	63.4	32.7	0	0	0	111.3	I66 S67	N64-I66 PolarHBondContact O-N 3.03Å; N64-I66 PolarHBondContact OD1-N 3.03Å; N64-S67 PolarHBondContact N-OG 2.91Å; N64-S67 PolarHBondContact O-N 3.46Å; N64-S67 PolarHBondContact O-OG 2.99Å; N64-S67 VanDerWaalsContact O-OG 3.12Å; N64-S67 VanDerWaalsContact OD1-CB 3.23Å; N64-S67 WeakPolarHBondContact OD1-CB 2.92Å; N64-S67 PolarHBondContact OD1-N 3.41Å; N64-S67 PolarHBondContact OD1-OG 2.78Å
65	A	83.1	Confident	90.3	Very high	85 Å²	85	45.7 Å²	45.7	70%	0.702	27%	0.266	S	S	*	.	S	Bend	trans	-65.8	-22.1	-176.6	0	0	0	0	0	114.7
66	I	84	Confident	90.1	Very high	146 Å²	146	48.7 Å²	48.7	75%	0.749	28%	0.279	S	S	*	.	S	Bend	trans	-83.9	-34.3	-175.4	-56.1	170.6	0	0	0	110.9	N64	N64-I66 PolarHBondContact O-N 3.03Å; N64-I66 PolarHBondContact OD1-N 3.03Å
67	S	84.8	Confident	89.8	Confident	11 Å²	11	57 Å²	57	8%	0.077	32%	0.318	C	S	.	.			trans	-76.8	151.6	-178	53.2	0	0	0	0	112	P62 N64	P62-S67 VanDerWaalsContact CB-O 3.22Å; P62-S67 WeakPolarHBondContact CB-O 3.4Å; P62-S67 WeakPolarHBondContact CB-OG 3.45Å; N64-S67 PolarHBondContact N-OG 2.91Å; N64-S67 PolarHBondContact O-N 3.46Å; N64-S67 PolarHBondContact O-OG 2.99Å; N64-S67 VanDerWaalsContact O-OG 3.12Å; N64-S67 VanDerWaalsContact OD1-CB 3.23Å; N64-S67 WeakPolarHBondContact OD1-CB 2.92Å; N64-S67 PolarHBondContact OD1-N 3.41Å; N64-S67 PolarHBondContact OD1-OG 2.78Å
68	K	90.5	Very high	89.7	Confident	149 Å²	149	62.1 Å²	62.1	65%	0.648	35%	0.345	S	S	*	.	B	Isolated β-bridge	trans	-108.9	152.6	171.8	-65.5	-176.2	-179.9	-179.1	0	109.7
69	C	92.7	Very high	89.7	Confident	6 Å²	6	57.6 Å²	57.6	4%	0.041	33%	0.329	C	S	.	.			trans	-67.1	136.4	173.6	-172.8	0	0	0	0	110.9	T71 C72 G73 N74 H82	C69-T71 VanDerWaalsContact C-N 3.31Å; C69-T71 PolarHBondContact SG-N 3.34Å; C69-C72 WeakPolarHBondContact CB-SG 3.42Å; C69-C72 PolarHBondContact SG-N 2.92Å; C69-C72 VanDerWaalsContact SG-SG 3.6Å; C69-G73 VanDerWaalsContact O-CA 3.28Å; C69-G73 WeakPolarHBondContact O-CA 3.38Å; C69-G73 PolarHBondContact O-N 3.13Å; C69-G73 VanDerWaalsContact O-N 3.13Å; C69-N74 PolarHBondContact N-O 3.08Å; C69-H82 PolarHBondContact SG-CD2 3.42Å
70	A	92.5	Very high	89.6	Confident	69 Å²	69	59.2 Å²	59.2	57%	0.57	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.2	-21.1	172.9	0	0	0	0	0	113	R58 R59	R58-A70 HydrophobicContact CB-CB 4.15Å; R58-A70 PolarHBondContact O-N 3.05Å; R59-A70 HydrophobicContact CG-CB 3.93Å
71	T	93.2	Very high	89.5	Confident	63 Å²	63	59.9 Å²	59.9	39%	0.387	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.3	-52.5	-176.6	-51.5	0	0	0	0	112.2	V33 R59 C69	V33-T71 HydrophobicContact CG1-CG2 3.97Å; R59-T71 VanDerWaalsContact CA-OG1 3.31Å; R59-T71 WeakPolarHBondContact CA-OG1 3.45Å; R59-T71 PolarHBondContact O-OG1 3.36Å; C69-T71 VanDerWaalsContact C-N 3.31Å; C69-T71 PolarHBondContact SG-N 3.34Å
72	C	92.9	Very high	89.7	Confident	49 Å²	49	62 Å²	62	33%	0.331	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.9	-6.3	-177.9	63.1	0	0	0	0	115	C69 N74 C79 H82	C69-C72 WeakPolarHBondContact CB-SG 3.42Å; C69-C72 PolarHBondContact SG-N 2.92Å; C69-C72 VanDerWaalsContact SG-SG 3.6Å; C72-N74 PolarHBondContact O-N 3.01Å; C72-C79 VanDerWaalsContact SG-SG 3.65Å; C72-H82 PolarHBondContact SG-NE2 3.04Å
73	G	91.8	Very high	89.8	Confident	46 Å²	46	66.3 Å²	66.3	47%	0.474	39%	0.392	S	S	.	.			trans	70.6	-6.1	-178.6	0	0	0	0	0	115.6	C69	C69-G73 VanDerWaalsContact O-CA 3.28Å; C69-G73 WeakPolarHBondContact O-CA 3.38Å; C69-G73 PolarHBondContact O-N 3.13Å; C69-G73 VanDerWaalsContact O-N 3.13Å
74	N	90.3	Very high	90.2	Very high	71 Å²	71	66.3 Å²	66.3	38%	0.38	39%	0.392	S	S	.	.			trans	-73.9	155.3	-179	-71.1	-27.7	0	0	0	112.7	C69 C72 N78 C79	C69-N74 PolarHBondContact N-O 3.08Å; C72-N74 PolarHBondContact O-N 3.01Å; N74-N78 HydrophobicContact CB-CB 4.16Å; N74-C79 HydrophobicContact CB-CB 4.03Å
75	S	89.5	Confident	90.7	Very high	44 Å²	44	64.7 Å²	64.7	31%	0.308	38%	0.383	S	S	.	.	B	Isolated β-bridge	trans	-73.2	171.5	170.7	64.8	0	0	0	0	111.6	Q77 N78 C79	S75-Q77 VanDerWaalsContact C-N 3.26Å; S75-Q77 PolarHBondContact O-N 3.06Å; S75-N78 PolarHBondContact O-N 3.36Å; S75-C79 WeakPolarHBondContact O-CB 3.45Å; S75-C79 PolarHBondContact O-N 3.27Å
76	F	87.6	Confident	91.3	Very high	63 Å²	63	60.8 Å²	60.8	28%	0.276	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.1	-35.6	179.2	-175.5	-94.4	0	0	0	114.7	P62 T254 P257	P62-F76 HydrophobicContact CG-CB 4.02Å; P62-F76 HydrophobicContact CG-CD2 4.19Å; P62-F76 WeakPolarHBondContact O-CD2 3.45Å; F76-T254 HydrophobicContact CD2-CG2 4.3Å; F76-T254 HydrophobicContact CE2-CG2 4.28Å; F76-P257 HydrophobicContact CE2-CB 4.31Å; F76-P257 HydrophobicContact CZ-CB 4.18Å
77	Q	85.7	Confident	91.8	Very high	174 Å²	174	55.8 Å²	55.8	81%	0.813	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.6	-33.6	-179.6	-75.9	178.6	-15	0	0	113.6	S75	S75-Q77 VanDerWaalsContact C-N 3.26Å; S75-Q77 PolarHBondContact O-N 3.06Å
78	N	89.3	Confident	92.2	Very high	114 Å²	114	56.1 Å²	56.1	61%	0.61	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.2	-13.8	-173.2	-64.7	-14	0	0	0	112.9	N74 S75 A80	N74-N78 HydrophobicContact CB-CB 4.16Å; S75-N78 PolarHBondContact O-N 3.36Å; N78-A80 PolarHBondContact O-N 3.43Å
79	C	91.9	Very high	92.2	Very high	9 Å²	9	52.8 Å²	52.8	6%	0.061	31%	0.313	C	S	.	.			trans	-78	116.4	177.9	178.5	0	0	0	0	110.1	P62 C72 N74 S75 G81	P62-C79 HydrophobicContact CG-CB 4.32Å; C72-C79 VanDerWaalsContact SG-SG 3.65Å; N74-C79 HydrophobicContact CB-CB 4.03Å; S75-C79 WeakPolarHBondContact O-CB 3.45Å; S75-C79 PolarHBondContact O-N 3.27Å; C79-G81 PolarHBondContact O-N 2.71Å; C79-G81 PolarHBondContact SG-N 2.74Å
80	A	91.2	Very high	92.3	Very high	98 Å²	98	53.5 Å²	53.5	81%	0.81	32%	0.316	S	S	*	.			trans	-62.8	-23.9	172.8	0	0	0	0	0	112.7	N78	N78-A80 PolarHBondContact O-N 3.43Å
81	G	93.3	Very high	92.4	Very high	14 Å²	14	50.7 Å²	50.7	14%	0.144	29%	0.292	C	S	.	.			trans	90.9	156.1	-173.8	0	0	0	0	0	111.9	C79	C79-G81 PolarHBondContact O-N 2.71Å; C79-G81 PolarHBondContact SG-N 2.74Å
82	H	95.3	Very high	92.5	Very high	44 Å²	44	47.7 Å²	47.7	20%	0.204	27%	0.273	C	S	.	.			trans	-130.8	139.6	-179.2	-51.3	-78.6	0	0	0	110.6	V33 R59 M60 C69 C72 P252	V33-H82 HydrophobicContact CB-CB 4.49Å; V33-H82 HydrophobicContact CG2-CB 3.63Å; R59-H82 PolarHBondContact O-CD2 2.82Å; M60-H82 WeakPolarHBondContact CA-O 3.35Å; M60-H82 WeakPolarHBondContact CB-O 3.49Å; M60-H82 PolarHBondContact O-N 2.61Å; M60-H82 VanDerWaalsContact O-N 3.12Å; C69-H82 PolarHBondContact SG-CD2 3.42Å; C72-H82 PolarHBondContact SG-NE2 3.04Å; H82-P252 WeakPolarHBondContact O-CA 3.34Å
83	F	95.3	Very high	92.6	Very high	91 Å²	91	45.6 Å²	45.6	40%	0.399	26%	0.259	S	S	.	.			trans	-73.8	145.1	179.5	-76	-86.7	0	0	0	111.3	A32 V33 P251 P252	A32-F83 CarbonylContact C-O 3.56Å; A32-F83 VanDerWaalsContact CA-O 3.31Å; A32-F83 WeakPolarHBondContact CA-O 3.32Å; V33-F83 PolarHBondContact N-O 3.28Å; F83-P251 HydrophobicContact CE1-CB 4.45Å; F83-P252 HydrophobicContact CD2-CG 4.48Å; F83-P252 HydrophobicContact CE2-CG 4.49Å
84	G	94.9	Very high	92.6	Very high	1 Å²	1	44.6 Å²	44.6	1%	0.01	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	178.5	159.4	0	0	0	0	0	110.3	V34 V250	V34-G84 CarbonylContact O-C 3.53Å; V34-G84 WeakPolarHBondContact O-CA 3.38Å; G84-V250 PolarHBondContact N-O 2.51Å; G84-V250 PolarHBondContact O-N 3.35Å
85	F	95.4	Very high	92.7	Very high	12 Å²	12	43 Å²	43	5%	0.053	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	154.5	171.7	73.9	-85	0	0	0	112	R29 A32 V34 Q35 I36 D87 R247 I248	R29-F85 HydrophobicContact CG-CE1 4.18Å; R29-F85 HydrophobicContact CG-CZ 4.09Å; A32-F85 HydrophobicContact CB-CB 3.96Å; A32-F85 HydrophobicContact CB-CD1 3.53Å; A32-F85 HydrophobicContact CB-CE1 4.49Å; A32-F85 HydrophobicContact CB-CG 4.19Å; V34-F85 PolarHBondContact O-N 3.33Å; Q35-F85 WeakPolarHBondContact CA-O 3.48Å; Q35-F85 HydrophobicContact CB-CD1 4.37Å; Q35-F85 HydrophobicContact CB-CE1 3.73Å; Q35-F85 HydrophobicContact CB-CE2 3.96Å; Q35-F85 HydrophobicContact CB-CZ 3.5Å; Q35-F85 VanDerWaalsContact CB-CZ 3.5Å; Q35-F85 HydrophobicContact CG-CD2 4.19Å; Q35-F85 HydrophobicContact CG-CE1 4.3Å; Q35-F85 HydrophobicContact CG-CE2 3.58Å; Q35-F85 HydrophobicContact CG-CZ 3.66Å; I36-F85 PolarHBondContact N-O 3.18Å; F85-D87 WeakPolarHBondContact CD2-OD1 3.46Å; F85-D87 WeakPolarHBondContact CE2-OD1 3.39Å; F85-R247 HydrophobicContact CB-CG 3.95Å; F85-R247 HydrophobicContact CD2-CG 3.95Å; F85-R247 HydrophobicContact CG-CG 4.37Å; F85-I248 WeakPolarHBondContact CA-O 3.22Å
86	L	94.5	Very high	92.8	Very high	3 Å²	3	41.7 Å²	41.7	2%	0.016	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	121.3	173.5	-175.5	148.1	0	0	0	108.6	L88 R247 I248 V250 I277 C278	L86-L88 HydrophobicContact CD2-CD2 3.77Å; L86-L88 HydrophobicContact CD2-CG 4.43Å; L86-R247 CarbonylContact O-C 3.58Å; L86-R247 WeakPolarHBondContact O-CA 3.36Å; L86-I248 HydrophobicContact CB-CB 4.5Å; L86-I248 PolarHBondContact N-O 3.01Å; L86-I248 PolarHBondContact O-N 2.95Å; L86-V250 HydrophobicContact CB-CG2 4.07Å; L86-I277 HydrophobicContact CD1-CG2 4.46Å; L86-I277 HydrophobicContact CD2-CG2 4.18Å; L86-C278 HydrophobicContact CD1-CB 3.67Å
87	D	94.4	Very high	93	Very high	41 Å²	41	39.3 Å²	39.3	22%	0.219	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	132.2	176	-78.7	-9.9	0	0	0	109.9	F85 R247 N281	F85-D87 WeakPolarHBondContact CD2-OD1 3.46Å; F85-D87 WeakPolarHBondContact CE2-OD1 3.39Å; D87-R247 VanDerWaalsContact CG-NH2 3.27Å; D87-R247 IonicContact OD1-CZ 2.61Å; D87-R247 IonicContact OD1-NE 3.05Å; D87-R247 PolarHBondContact OD1-NE 2.82Å; D87-R247 IonicContact OD1-NH2 3.03Å; D87-R247 PolarHBondContact OD1-NH2 3.4Å; D87-R247 IonicContact OD2-NH2 2.75Å; D87-R247 PolarHBondContact OD2-NH2 3.35Å; D87-N281 PolarHBondContact O-ND2 2.63Å
88	L	94	Very high	93.4	Very high	18 Å²	18	32.5 Å²	32.5	9%	0.094	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	133.9	175.9	-60.9	168.1	0	0	0	109.4	L86 I92 L245 Q246 I248 N281 L304	L86-L88 HydrophobicContact CD2-CD2 3.77Å; L86-L88 HydrophobicContact CD2-CG 4.43Å; L88-I92 HydrophobicContact CD1-CD1 3.73Å; L88-I92 HydrophobicContact CD1-CG1 3.73Å; L88-L245 HydrophobicContact CD1-CB 4.33Å; L88-Q246 WeakPolarHBondContact CB-O 3.33Å; L88-Q246 PolarHBondContact N-O 2.88Å; L88-I248 HydrophobicContact CD1-CD1 4.03Å; L88-I248 HydrophobicContact CD1-CG1 3.87Å; L88-I248 HydrophobicContact CD2-CD1 3.67Å; L88-I248 HydrophobicContact CD2-CG1 4.22Å; L88-I248 HydrophobicContact CG-CD1 4.18Å; L88-I248 HydrophobicContact CG-CG1 4.17Å; L88-N281 WeakPolarHBondContact CA-OD1 3.5Å; L88-L304 HydrophobicContact CD2-CD1 4.22Å; L88-L304 HydrophobicContact CD2-CD2 4Å; L88-L304 HydrophobicContact CD2-CG 4.45Å
89	E	91.8	Very high	93.5	Very high	78 Å²	78	35.7 Å²	35.7	36%	0.364	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	-41.9	175.4	-62	-59.4	140.2	0	0	111.1	N281 I284 H285	E89-N281 PolarHBondContact N-OD1 3.11Å; E89-I284 HydrophobicContact CB-CG2 4.05Å; E89-H285 HydrophobicContact CG-CB 3.8Å; E89-H285 IonicContact OE1-CG 3.29Å; E89-H285 IonicContact OE1-ND1 2.72Å; E89-H285 PolarHBondContact OE1-ND1 2.9Å; E89-H285 IonicContact OE2-CE1 2.73Å; E89-H285 IonicContact OE2-CG 3.1Å; E89-H285 IonicContact OE2-ND1 3.33Å; E89-H285 PolarHBondContact OE2-ND1 3.37Å
90	L	93	Very high	93.6	Very high	21 Å²	21	36.3 Å²	36.3	11%	0.11	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	135.7	176.1	-66.5	173.9	0	0	0	110.7	I284 V297 W301	L90-I284 HydrophobicContact CD1-CG2 3.91Å; L90-I284 HydrophobicContact CG-CG2 4.17Å; L90-V297 HydrophobicContact CD1-CG1 4.03Å; L90-W301 HydrophobicContact CB-CD2 4.34Å; L90-W301 HydrophobicContact CB-CG 4.29Å; L90-W301 HydrophobicContact CB-CZ2 4.36Å; L90-W301 HydrophobicContact CD1-CB 4.21Å; L90-W301 HydrophobicContact CD1-CD2 4.01Å; L90-W301 HydrophobicContact CD1-CE3 4.41Å; L90-W301 HydrophobicContact CD1-CG 3.93Å
91	P	95.2	Very high	93.7	Very high	10 Å²	10	31.6 Å²	31.6	7%	0.065	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	149.2	-178.8	25.9	-32.9	0	0	0	111.7	P213 L214 L217 I244 L245 Q246 W301	P91-P213 HydrophobicContact CB-CB 4.5Å; P91-P213 HydrophobicContact CG-CB 4.48Å; P91-P213 VanDerWaalsContact O-CB 3.25Å; P91-P213 WeakPolarHBondContact O-CB 3.33Å; P91-L214 HydrophobicContact CG-CB 4.14Å; P91-L214 HydrophobicContact CG-CD1 3.65Å; P91-L217 HydrophobicContact CB-CD2 4.27Å; P91-L217 HydrophobicContact CG-CD2 4.26Å; P91-I244 HydrophobicContact CB-CG2 3.77Å; P91-L245 VanDerWaalsContact CA-O 3.29Å; P91-L245 WeakPolarHBondContact CA-O 3.4Å; P91-Q246 HydrophobicContact CB-CG 4.35Å; P91-W301 VanDerWaalsContact O-CZ2 3.28Å; P91-W301 WeakPolarHBondContact O-CZ2 3.4Å; P91-W301 PolarHBondContact O-NE1 3.13Å
92	I	94.9	Very high	93.8	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	151.3	179.2	65.9	-179.9	0	0	0	111.5	L88 L245 I248 L304 Q305 H308	L88-I92 HydrophobicContact CD1-CD1 3.73Å; L88-I92 HydrophobicContact CD1-CG1 3.73Å; I92-L245 HydrophobicContact CD1-CD1 4.42Å; I92-L245 HydrophobicContact CG1-CB 3.78Å; I92-L245 HydrophobicContact CG1-CD1 4.23Å; I92-L245 PolarHBondContact N-O 3.06Å; I92-L245 PolarHBondContact O-N 3.1Å; I92-I248 HydrophobicContact CD1-CD1 4.36Å; I92-L304 HydrophobicContact CG2-CD2 4.05Å; I92-L304 HydrophobicContact CG2-CG 4.25Å; I92-Q305 HydrophobicContact CB-CG 3.7Å; I92-Q305 HydrophobicContact CG2-CG 3.83Å; I92-H308 HydrophobicContact CD1-CB 3.6Å; I92-H308 VanDerWaalsContact CD1-CG 3.49Å
93	F	94.7	Very high	93.7	Very high	5 Å²	5	30.9 Å²	30.9	2%	0.022	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	137.7	171.4	-70.1	-51.7	0	0	0	110.4	F98 T101 M174 I176 P213 A216 I244	F93-F98 HydrophobicContact CB-CD2 4.11Å; F93-F98 HydrophobicContact CD2-CD2 4.3Å; F93-F98 HydrophobicContact CD2-CE2 4.04Å; F93-F98 HydrophobicContact CE2-CE2 4.45Å; F93-F98 HydrophobicContact CG-CD2 4.14Å; F93-F98 HydrophobicContact CG-CE2 4.33Å; F93-T101 HydrophobicContact CD1-CG2 4.04Å; F93-T101 HydrophobicContact CE1-CG2 3.87Å; F93-M174 HydrophobicContact CB-CE 3.2Å; F93-M174 HydrophobicContact CG-CE 4.3Å; F93-M174 WeakPolarHBondContact O-CE 3.46Å; F93-I176 HydrophobicContact CE1-CD1 4.19Å; F93-I176 HydrophobicContact CE2-CD1 4.14Å; F93-I176 HydrophobicContact CZ-CD1 3.78Å; F93-P213 HydrophobicContact CD1-CB 4.3Å; F93-P213 HydrophobicContact CD1-CG 4.36Å; F93-P213 HydrophobicContact CD2-CB 4.5Å; F93-P213 HydrophobicContact CD2-CG 3.71Å; F93-P213 HydrophobicContact CE1-CB 4.19Å; F93-P213 HydrophobicContact CE1-CG 4.33Å; F93-P213 HydrophobicContact CE2-CB 4.38Å; F93-P213 HydrophobicContact CE2-CG 3.67Å; F93-P213 HydrophobicContact CG-CB 4.44Å; F93-P213 HydrophobicContact CG-CG 4.05Å; F93-P213 HydrophobicContact CZ-CB 4.22Å; F93-P213 HydrophobicContact CZ-CG 3.98Å; F93-A216 HydrophobicContact CE1-CB 3.84Å; F93-A216 HydrophobicContact CZ-CB 4.18Å; F93-I244 HydrophobicContact CD1-CD1 4.26Å; F93-I244 HydrophobicContact CD1-CG1 4.36Å; F93-I244 HydrophobicContact CE1-CD1 4.03Å
94	H	93.6	Very high	93.7	Very high	25 Å²	25	26.5 Å²	26.5	12%	0.116	13%	0.125	C	C	.	.			trans	-82.7	124.9	172.4	-171.6	-60.3	0	0	0	110.7	G96 F97 F98 L243 L245 Y1334	H94-G96 PolarHBondContact ND1-N 2.79Å; H94-G96 PolarHBondContact O-N 2.85Å; H94-F97 HydrophobicContact CB-CB 4.31Å; H94-F97 HydrophobicContact CB-CD2 3.85Å; H94-F97 AromaticContact CD2-CD2 3.92Å; H94-F97 AromaticContact CG-CD2 3.54Å; H94-F97 AromaticContact ND1-CD2 3.68Å; H94-F97 PolarHBondContact O-N 3.32Å; H94-F97 VanDerWaalsContact O-N 3.1Å; H94-F98 PolarHBondContact O-N 2.92Å; H94-L243 WeakPolarHBondContact CB-O 3.36Å; H94-L245 HydrophobicContact CB-CD1 3.81Å; H94-L245 HydrophobicContact CB-CG 4.19Å; H94-Y1334 AromaticContact CE1-CE1 3.43Å; H94-Y1334 VanDerWaalsContact CE1-CE1 3.43Å; H94-Y1334 WeakPolarHBondContact CE1-CE1 3.33Å; H94-Y1334 AromaticContact CE1-CZ 3.82Å
95	L	91.5	Very high	93.6	Very high	37 Å²	37	26.5 Å²	26.5	19%	0.194	13%	0.125	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.8	-49.1	-177	179	64.7	0	0	0	113.1	F97 F98 M174 A309 L312 N313 V316	L95-F97 VanDerWaalsContact C-N 3.33Å; L95-F97 PolarHBondContact O-N 3.15Å; L95-F98 WeakPolarHBondContact O-CB 3.47Å; L95-F98 PolarHBondContact O-N 3.39Å; L95-M174 HydrophobicContact CB-SD 4.37Å; L95-M174 HydrophobicContact CD1-SD 3.78Å; L95-A309 HydrophobicContact CD2-CB 4.3Å; L95-L312 HydrophobicContact CB-CD1 4.02Å; L95-N313 HydrophobicContact CD2-CB 3.79Å; L95-V316 HydrophobicContact CD1-CG1 3.73Å; L95-V316 HydrophobicContact CD2-CG1 4.33Å; L95-V316 HydrophobicContact CD2-CG2 3.85Å
96	G	90.7	Very high	93.5	Very high	18 Å²	18	27.6 Å²	27.6	19%	0.186	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-33.4	178.7	0	0	0	0	0	114.9	H94	H94-G96 PolarHBondContact ND1-N 2.79Å; H94-G96 PolarHBondContact O-N 2.85Å
97	F	93.6	Very high	93.5	Very high	13 Å²	13	27.5 Å²	27.5	6%	0.057	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.8	-9.3	-178.8	-60.6	-57.9	0	0	0	113.4	P22 H94 L95 R99 H100 T101 L243 Y1334 A1337	P22-F97 HydrophobicContact CB-CZ 4.32Å; H94-F97 HydrophobicContact CB-CB 4.31Å; H94-F97 HydrophobicContact CB-CD2 3.85Å; H94-F97 AromaticContact CD2-CD2 3.92Å; H94-F97 AromaticContact CG-CD2 3.54Å; H94-F97 AromaticContact ND1-CD2 3.68Å; H94-F97 PolarHBondContact O-N 3.32Å; H94-F97 VanDerWaalsContact O-N 3.1Å; L95-F97 VanDerWaalsContact C-N 3.33Å; L95-F97 PolarHBondContact O-N 3.15Å; F97-R99 VanDerWaalsContact C-N 3.26Å; F97-R99 PolarHBondContact O-N 3.24Å; F97-R99 VanDerWaalsContact O-N 3.1Å; F97-H100 CarbonylContact O-C 3.58Å; F97-H100 WeakPolarHBondContact O-CA 3.32Å; F97-H100 WeakPolarHBondContact O-CB 3.33Å; F97-H100 PolarHBondContact O-N 3.02Å; F97-T101 PolarHBondContact O-N 3.31Å; F97-T101 PolarHBondContact O-OG1 3.28Å; F97-L243 HydrophobicContact CB-CB 4.24Å; F97-L243 HydrophobicContact CB-CD2 3.86Å; F97-L243 HydrophobicContact CD1-CD2 3.72Å; F97-L243 HydrophobicContact CD2-CD2 4.06Å; F97-L243 HydrophobicContact CE1-CD2 4.26Å; F97-L243 HydrophobicContact CG-CD2 3.61Å; F97-Y1334 HydrophobicContact CE1-CD1 4.19Å; F97-Y1334 WeakPolarHBondContact CE1-O 3.38Å; F97-Y1334 HydrophobicContact CE2-CD1 4.45Å; F97-Y1334 HydrophobicContact CZ-CD1 4.04Å; F97-A1337 HydrophobicContact CE1-CB 4.16Å; F97-A1337 HydrophobicContact CZ-CB 4.08Å
98	F	93.3	Very high	93.5	Very high	30 Å²	30	25.5 Å²	25.5	13%	0.132	12%	0.119	C	C	.	.	H	α-helix	trans	-51.5	-41.6	-174.6	-177.1	-107.1	0	0	0	113.6	F93 H94 L95 H100 T101 V102 A168 M174 I176	F93-F98 HydrophobicContact CB-CD2 4.11Å; F93-F98 HydrophobicContact CD2-CD2 4.3Å; F93-F98 HydrophobicContact CD2-CE2 4.04Å; F93-F98 HydrophobicContact CE2-CE2 4.45Å; F93-F98 HydrophobicContact CG-CD2 4.14Å; F93-F98 HydrophobicContact CG-CE2 4.33Å; H94-F98 PolarHBondContact O-N 2.92Å; L95-F98 WeakPolarHBondContact O-CB 3.47Å; L95-F98 PolarHBondContact O-N 3.39Å; F98-H100 VanDerWaalsContact C-N 3.32Å; F98-H100 PolarHBondContact O-N 2.92Å; F98-T101 WeakPolarHBondContact O-CB 3.47Å; F98-T101 PolarHBondContact O-N 3.11Å; F98-V102 HydrophobicContact CE1-CG2 4.18Å; F98-V102 HydrophobicContact CE2-CG2 4.48Å; F98-V102 HydrophobicContact CZ-CG2 4.15Å; F98-V102 WeakPolarHBondContact O-CG2 3.31Å; F98-V102 PolarHBondContact O-N 3.03Å; F98-A168 HydrophobicContact CE1-CB 4.11Å; F98-A168 HydrophobicContact CZ-CB 4.36Å; F98-M174 HydrophobicContact CB-CE 4.23Å; F98-M174 HydrophobicContact CD1-CG 4.47Å; F98-M174 HydrophobicContact CD2-CB 4.3Å; F98-M174 HydrophobicContact CD2-CE 3.74Å; F98-M174 HydrophobicContact CD2-CG 4.27Å; F98-M174 HydrophobicContact CE2-CB 3.92Å; F98-M174 HydrophobicContact CE2-CE 4.37Å; F98-M174 HydrophobicContact CE2-CG 4.28Å; F98-M174 WeakPolarHBondContact CE2-O 3.4Å; F98-M174 HydrophobicContact CG-CE 4.12Å; F98-M174 HydrophobicContact CG-CG 4.36Å; F98-M174 HydrophobicContact CZ-CB 4.15Å; F98-M174 HydrophobicContact CZ-CG 4.42Å; F98-I176 HydrophobicContact CE2-CD1 3.78Å; F98-I176 HydrophobicContact CE2-CG1 3.74Å; F98-I176 HydrophobicContact CZ-CD1 4.23Å; F98-I176 HydrophobicContact CZ-CG1 3.77Å
99	R	92	Very high	93.5	Very high	182 Å²	182	24.7 Å²	24.7	69%	0.687	12%	0.115	S	C	*	.	H	α-helix	trans	-60.4	-41.5	175.2	-179.7	178	173.6	162.9	-0.3	112.3	F97 Q103	F97-R99 VanDerWaalsContact C-N 3.26Å; F97-R99 PolarHBondContact O-N 3.24Å; F97-R99 VanDerWaalsContact O-N 3.1Å; R99-Q103 WeakPolarHBondContact O-CG 3.44Å; R99-Q103 PolarHBondContact O-N 3.49Å; R99-Q103 VanDerWaalsContact O-N 3.15Å
100	H	92.9	Very high	93.6	Very high	21 Å²	21	22 Å²	22	10%	0.097	10%	0.102	C	C	.	.	H	α-helix	trans	-72.1	-39.9	178.9	-57.1	86.3	0	0	0	110.8	F97 F98 V102 Q103 I104 Y1338	F97-H100 CarbonylContact O-C 3.58Å; F97-H100 WeakPolarHBondContact O-CA 3.32Å; F97-H100 WeakPolarHBondContact O-CB 3.33Å; F97-H100 PolarHBondContact O-N 3.02Å; F98-H100 VanDerWaalsContact C-N 3.32Å; F98-H100 PolarHBondContact O-N 2.92Å; H100-V102 VanDerWaalsContact C-N 3.32Å; H100-V102 PolarHBondContact O-N 3.39Å; H100-Q103 WeakPolarHBondContact O-CB 3.46Å; H100-Q103 PolarHBondContact O-N 3.01Å; H100-I104 WeakPolarHBondContact O-CG1 3.46Å; H100-I104 PolarHBondContact O-N 3.05Å; H100-Y1338 HydrophobicContact CB-CD2 3.58Å; H100-Y1338 HydrophobicContact CB-CE2 3.58Å; H100-Y1338 HydrophobicContact CB-CG 4.14Å; H100-Y1338 AromaticContact CD2-CD1 3.4Å; H100-Y1338 VanDerWaalsContact CD2-CD1 3.4Å; H100-Y1338 WeakPolarHBondContact CD2-CD1 3.26Å; H100-Y1338 AromaticContact CD2-CD2 3.87Å; H100-Y1338 AromaticContact CD2-CE1 3.77Å; H100-Y1338 AromaticContact CD2-CG 3.48Å; H100-Y1338 VanDerWaalsContact CD2-CG 3.48Å; H100-Y1338 AromaticContact CG-CD2 3.79Å; H100-Y1338 AromaticContact CG-CG 3.81Å
101	T	94.7	Very high	93.5	Very high	0 Å²	0	25 Å²	25	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-53.7	-47.8	171.6	-52.5	0	0	0	0	111.3	F93 F97 F98 Q103 I104 L105 I176 F220	F93-T101 HydrophobicContact CD1-CG2 4.04Å; F93-T101 HydrophobicContact CE1-CG2 3.87Å; F97-T101 PolarHBondContact O-N 3.31Å; F97-T101 PolarHBondContact O-OG1 3.28Å; F98-T101 WeakPolarHBondContact O-CB 3.47Å; F98-T101 PolarHBondContact O-N 3.11Å; T101-Q103 VanDerWaalsContact C-N 3.33Å; T101-Q103 PolarHBondContact O-N 2.92Å; T101-I104 PolarHBondContact O-N 3.34Å; T101-L105 HydrophobicContact CG2-CD1 4.21Å; T101-L105 WeakPolarHBondContact O-CB 3.47Å; T101-L105 VanDerWaalsContact O-CG 3.31Å; T101-L105 WeakPolarHBondContact O-CG 3.49Å; T101-L105 PolarHBondContact O-N 3.42Å; T101-I176 HydrophobicContact CG2-CD1 4.46Å; T101-F220 HydrophobicContact CG2-CE2 3.84Å; T101-F220 HydrophobicContact CG2-CZ 3.71Å
102	V	94	Very high	93.3	Very high	12 Å²	12	26.3 Å²	26.3	7%	0.073	13%	0.127	C	C	.	.	H	α-helix	trans	-62.5	-40.2	176.6	173.8	0	0	0	0	111.6	F98 H100 L105 Q106 A168 I176	F98-V102 HydrophobicContact CE1-CG2 4.18Å; F98-V102 HydrophobicContact CE2-CG2 4.48Å; F98-V102 HydrophobicContact CZ-CG2 4.15Å; F98-V102 WeakPolarHBondContact O-CG2 3.31Å; F98-V102 PolarHBondContact O-N 3.03Å; H100-V102 VanDerWaalsContact C-N 3.32Å; H100-V102 PolarHBondContact O-N 3.39Å; V102-L105 PolarHBondContact O-N 3.01Å; V102-Q106 VanDerWaalsContact O-CG 3.25Å; V102-Q106 WeakPolarHBondContact O-CG 3.47Å; V102-Q106 PolarHBondContact O-N 3.06Å; V102-A168 HydrophobicContact CG2-CB 4.36Å; V102-I176 HydrophobicContact CG2-CD1 3.72Å; V102-I176 HydrophobicContact CG2-CG1 3.95Å
103	Q	93.8	Very high	93.2	Very high	30 Å²	30	26.3 Å²	26.3	14%	0.14	13%	0.127	C	C	.	.	H	α-helix	trans	-68.2	-40.3	178.6	-72.5	172.4	-25.4	0	0	112.7	R99 H100 T101 Q106 S107 Y143 T147	R99-Q103 WeakPolarHBondContact O-CG 3.44Å; R99-Q103 PolarHBondContact O-N 3.49Å; R99-Q103 VanDerWaalsContact O-N 3.15Å; H100-Q103 WeakPolarHBondContact O-CB 3.46Å; H100-Q103 PolarHBondContact O-N 3.01Å; T101-Q103 VanDerWaalsContact C-N 3.33Å; T101-Q103 PolarHBondContact O-N 2.92Å; Q103-Q106 WeakPolarHBondContact O-CB 3.37Å; Q103-Q106 PolarHBondContact O-N 3.19Å; Q103-Q106 VanDerWaalsContact O-N 3.11Å; Q103-S107 PolarHBondContact O-N 3.46Å; Q103-S107 PolarHBondContact O-OG 2.9Å; Q103-Y143 VanDerWaalsContact CB-OH 3.25Å; Q103-Y143 WeakPolarHBondContact CB-OH 3.47Å; Q103-Y143 VanDerWaalsContact OE1-CE1 3.3Å; Q103-Y143 PolarHBondContact OE1-OH 2.94Å; Q103-T147 HydrophobicContact CB-CG2 4.38Å; Q103-T147 HydrophobicContact CG-CG2 4.42Å
104	I	94.2	Very high	93.1	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-61.8	-48	173.4	-66.5	165.6	0	0	0	109.4	H100 T101 Q106 S107 I108 F220 I223 L231 P240 L243 Y1338	H100-I104 WeakPolarHBondContact O-CG1 3.46Å; H100-I104 PolarHBondContact O-N 3.05Å; T101-I104 PolarHBondContact O-N 3.34Å; I104-Q106 PolarHBondContact O-N 2.9Å; I104-S107 WeakPolarHBondContact O-CA 3.47Å; I104-S107 PolarHBondContact O-N 3.4Å; I104-I108 HydrophobicContact CG2-CG2 4.22Å; I104-I108 PolarHBondContact O-N 2.82Å; I104-F220 HydrophobicContact CB-CE1 4.06Å; I104-F220 HydrophobicContact CB-CZ 4.06Å; I104-F220 HydrophobicContact CD1-CZ 4.46Å; I104-F220 HydrophobicContact CG2-CD1 4.1Å; I104-F220 HydrophobicContact CG2-CE1 3.48Å; I104-F220 VanDerWaalsContact CG2-CE1 3.48Å; I104-F220 HydrophobicContact CG2-CZ 3.96Å; I104-I223 HydrophobicContact CG2-CD1 4.04Å; I104-L231 HydrophobicContact CG1-CD1 4.34Å; I104-L231 HydrophobicContact CG1-CD2 4.45Å; I104-L231 HydrophobicContact CG2-CD1 3.96Å; I104-L231 HydrophobicContact CG2-CD2 4.42Å; I104-P240 HydrophobicContact CD1-CB 4.36Å; I104-L243 HydrophobicContact CD1-CD1 3.43Å; I104-L243 VanDerWaalsContact CD1-CD1 3.43Å; I104-Y1338 HydrophobicContact CD1-CE2 3.82Å
105	L	94.4	Very high	93.1	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-61.1	-25.5	175.6	-69.9	170.7	0	0	0	112.2	T101 V102 I108 K110 V166 I176 L211 A216 L219 F220	T101-L105 HydrophobicContact CG2-CD1 4.21Å; T101-L105 WeakPolarHBondContact O-CB 3.47Å; T101-L105 VanDerWaalsContact O-CG 3.31Å; T101-L105 WeakPolarHBondContact O-CG 3.49Å; T101-L105 PolarHBondContact O-N 3.42Å; V102-L105 PolarHBondContact O-N 3.01Å; L105-I108 HydrophobicContact CD2-CD1 4.47Å; L105-K110 WeakPolarHBondContact O-CE 3.41Å; L105-K110 PolarHBondContact O-NZ 2.8Å; L105-V166 HydrophobicContact CB-CG1 4.1Å; L105-I176 HydrophobicContact CD1-CD1 3.81Å; L105-I176 HydrophobicContact CD1-CG2 4.31Å; L105-L211 HydrophobicContact CD1-CD1 4.33Å; L105-L211 HydrophobicContact CD2-CD1 4.49Å; L105-A216 HydrophobicContact CD1-CB 4.29Å; L105-A216 HydrophobicContact CD2-CB 4.49Å; L105-L219 HydrophobicContact CD2-CD1 3.91Å; L105-F220 HydrophobicContact CD2-CE1 3.7Å; L105-F220 HydrophobicContact CD2-CZ 4.31Å; L105-F220 HydrophobicContact CG-CE1 3.86Å; L105-F220 HydrophobicContact CG-CZ 4.05Å
106	Q	93.5	Very high	93.2	Very high	36 Å²	36	23.9 Å²	23.9	17%	0.168	12%	0.116	C	C	.	.	H	α-helix	trans	-76.6	-26.6	171.4	-75.5	168	-11.4	0	0	112.9	V102 Q103 I104 K151 V166	V102-Q106 VanDerWaalsContact O-CG 3.25Å; V102-Q106 WeakPolarHBondContact O-CG 3.47Å; V102-Q106 PolarHBondContact O-N 3.06Å; Q103-Q106 WeakPolarHBondContact O-CB 3.37Å; Q103-Q106 PolarHBondContact O-N 3.19Å; Q103-Q106 VanDerWaalsContact O-N 3.11Å; I104-Q106 PolarHBondContact O-N 2.9Å; Q106-K151 HydrophobicContact CB-CG 4.21Å; Q106-V166 HydrophobicContact CG-CB 3.89Å; Q106-V166 HydrophobicContact CG-CG1 4.27Å; Q106-V166 PolarHBondContact NE2-O 3.04Å
107	S	93.9	Very high	93.3	Very high	0 Å²	0	23 Å²	23	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-91.7	-22.5	-173.4	-61.3	0	0	0	0	114.6	Q103 I104 L116	Q103-S107 PolarHBondContact O-N 3.46Å; Q103-S107 PolarHBondContact O-OG 2.9Å; I104-S107 WeakPolarHBondContact O-CA 3.47Å; I104-S107 PolarHBondContact O-N 3.4Å; S107-L116 WeakPolarHBondContact O-CB 3.11Å; S107-L116 WeakPolarHBondContact O-CG 3.29Å; S107-L116 PolarHBondContact O-N 2.75Å
108	I	94.5	Very high	93.2	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	13%	0.125	C	C	.	.	B	Isolated β-bridge	trans	-99.4	154.9	-178.3	68.7	175.9	0	0	0	113.4	I104 L105 K110 V115 L219 F220 I223	I104-I108 HydrophobicContact CG2-CG2 4.22Å; I104-I108 PolarHBondContact O-N 2.82Å; L105-I108 HydrophobicContact CD2-CD1 4.47Å; I108-K110 WeakPolarHBondContact O-CD 3.13Å; I108-K110 PolarHBondContact O-NZ 2.71Å; I108-V115 HydrophobicContact CG2-CG2 4.36Å; I108-L219 HydrophobicContact CD1-CB 4.32Å; I108-F220 HydrophobicContact CD1-CD1 4.35Å; I108-F220 HydrophobicContact CD1-CE1 4.43Å; I108-I223 HydrophobicContact CD1-CD1 4.11Å; I108-I223 HydrophobicContact CD1-CG1 4.28Å; I108-I223 HydrophobicContact CG2-CD1 4.15Å; I108-I223 HydrophobicContact CG2-CG1 4.41Å
109	C	94.3	Very high	93	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	15%	0.147	C	C	.	.			trans	-72.1	137.9	167.6	-179.2	0	0	0	0	111.3	N111 C113 S114 L116 C156 C159 N163	C109-N111 PolarHBondContact O-N 3.32Å; C109-N111 PolarHBondContact SG-N 2.93Å; C109-N111 VanDerWaalsContact SG-N 3.44Å; C109-C113 WeakPolarHBondContact O-CA 3.5Å; C109-C113 PolarHBondContact O-N 2.84Å; C109-S114 PolarHBondContact N-O 3.49Å; C109-L116 HydrophobicContact CB-CD2 3.86Å; C109-C156 HydrophobicContact CB-CB 4.19Å; C109-C159 VanDerWaalsContact SG-SG 3.67Å; C109-N163 WeakPolarHBondContact CA-OD1 3.31Å
110	K	92.3	Very high	93	Very high	22 Å²	22	29 Å²	29	10%	0.096	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.7	-8.9	-176.9	-76.9	56.6	170.8	-175.1	0	112.8	L105 I108 Y161 N163 Y178 L219	L105-K110 WeakPolarHBondContact O-CE 3.41Å; L105-K110 PolarHBondContact O-NZ 2.8Å; I108-K110 WeakPolarHBondContact O-CD 3.13Å; I108-K110 PolarHBondContact O-NZ 2.71Å; K110-Y161 HydrophobicContact CB-CE1 4.28Å; K110-N163 PolarHBondContact N-OD1 3.15Å; K110-Y178 HydrophobicContact CB-CE1 4.49Å; K110-Y178 HydrophobicContact CD-CE2 4.2Å; K110-Y178 HydrophobicContact CG-CD2 4.48Å; K110-Y178 HydrophobicContact CG-CE1 4.34Å; K110-Y178 HydrophobicContact CG-CE2 4.14Å; K110-L219 WeakPolarHBondContact O-CD2 3.28Å
111	N	91.1	Very high	92.9	Very high	83 Å²	83	29.6 Å²	29.6	44%	0.444	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.9	-65	175.6	-168.6	32	0	0	0	111.4	C109 Y161 R222	C109-N111 PolarHBondContact O-N 3.32Å; C109-N111 PolarHBondContact SG-N 2.93Å; C109-N111 VanDerWaalsContact SG-N 3.44Å; N111-Y161 HydrophobicContact CB-CD1 3.88Å; N111-Y161 HydrophobicContact CB-CD2 3.89Å; N111-Y161 HydrophobicContact CB-CE1 4.28Å; N111-Y161 HydrophobicContact CB-CE2 4.32Å; N111-Y161 HydrophobicContact CB-CG 3.64Å; N111-R222 PolarHBondContact O-NH1 3.43Å
112	C	91.8	Very high	92.7	Very high	38 Å²	38	31 Å²	31	26%	0.257	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.4	-2.8	-176.2	70.9	0	0	0	0	115.3	S114 C156 C159	C112-S114 PolarHBondContact O-N 3.16Å; C112-C156 VanDerWaalsContact SG-SG 3.7Å; C112-C159 HydrophobicContact CB-CB 4.03Å; C112-C159 PolarHBondContact SG-SG 3.19Å
113	C	93.2	Very high	92.5	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	18%	0.182	C	C	.	.			trans	61.1	0.5	177.6	-52.7	0	0	0	0	116.7	C109 R222 I223	C109-C113 WeakPolarHBondContact O-CA 3.5Å; C109-C113 PolarHBondContact O-N 2.84Å; C113-R222 HydrophobicContact CB-CB 4.02Å; C113-R222 WeakPolarHBondContact CB-O 3.33Å; C113-I223 HydrophobicContact CB-CG1 4.28Å
114	S	92.5	Very high	92.5	Very high	14 Å²	14	35.3 Å²	35.3	10%	0.098	20%	0.196	C	C	.	.			trans	-69.7	151.9	171.8	-58.3	0	0	0	0	111.5	C109 C112	C109-S114 PolarHBondContact N-O 3.49Å; C112-S114 PolarHBondContact O-N 3.16Å
115	V	93.6	Very high	92.4	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	20%	0.202	C	C	.	.	B	Isolated β-bridge	trans	-66.2	138.9	177.7	171.6	0	0	0	0	110.7	I108 L117 D227 L231	I108-V115 HydrophobicContact CG2-CG2 4.36Å; V115-L117 HydrophobicContact CG1-CB 4.26Å; V115-L117 HydrophobicContact CG1-CD1 3.87Å; V115-L117 HydrophobicContact CG1-CG 3.85Å; V115-L117 PolarHBondContact O-N 3.45Å; V115-D227 HydrophobicContact CG2-CB 3.92Å; V115-D227 PolarHBondContact N-OD2 3.33Å; V115-L231 HydrophobicContact CG2-CD2 4.05Å; V115-L231 HydrophobicContact CG2-CG 4.41Å
116	L	93.7	Very high	92.2	Very high	2 Å²	2	38.6 Å²	38.6	1%	0.01	21%	0.211	C	C	.	.	S	Bend	trans	-77.5	53.5	-176.5	-64.3	171.6	0	0	0	112.9	S107 C109 C150 T153 C156 N163	S107-L116 WeakPolarHBondContact O-CB 3.11Å; S107-L116 WeakPolarHBondContact O-CG 3.29Å; S107-L116 PolarHBondContact O-N 2.75Å; C109-L116 HydrophobicContact CB-CD2 3.86Å; L116-C150 HydrophobicContact CB-CB 4.16Å; L116-T153 HydrophobicContact CB-CG2 4.27Å; L116-T153 PolarHBondContact O-OG1 2.9Å; L116-C156 HydrophobicContact CD2-CB 3.97Å; L116-N163 HydrophobicContact CD1-CB 4.43Å; L116-N163 WeakPolarHBondContact CD2-ND2 3.39Å
117	L	92.1	Very high	91.9	Very high	1 Å²	1	44.9 Å²	44.9	1%	0.005	24%	0.238	C	C	.	.			trans	-124	146.5	176.1	-71.9	175.1	0	0	0	110.8	V115 D121 Y125 I146 K149 P157 L230	V115-L117 HydrophobicContact CG1-CB 4.26Å; V115-L117 HydrophobicContact CG1-CD1 3.87Å; V115-L117 HydrophobicContact CG1-CG 3.85Å; V115-L117 PolarHBondContact O-N 3.45Å; L117-D121 HydrophobicContact CB-CB 4.43Å; L117-D121 HydrophobicContact CD2-CB 4.26Å; L117-Y125 HydrophobicContact CD1-CD2 3.97Å; L117-Y125 HydrophobicContact CD1-CE2 4.45Å; L117-Y125 HydrophobicContact CD2-CE2 4.27Å; L117-I146 HydrophobicContact CD1-CG2 4.08Å; L117-K149 HydrophobicContact CD2-CB 4.31Å; L117-K149 HydrophobicContact CD2-CD 4.13Å; L117-K149 HydrophobicContact CD2-CG 4.21Å; L117-P157 WeakPolarHBondContact O-CG 3.17Å; L117-L230 HydrophobicContact CD1-CD2 4.37Å
118	N	91.1	Very high	91.6	Very high	79 Å²	79	50.1 Å²	50.1	42%	0.422	26%	0.261	S	S	.	.			trans	-71.7	151.2	174.3	-57.7	-4.2	0	0	0	109.4	K120 D121 K122	N118-K120 VanDerWaalsContact C-N 3.27Å; N118-K120 PolarHBondContact O-N 3.14Å; N118-K120 VanDerWaalsContact O-N 3.13Å; N118-D121 WeakPolarHBondContact O-CB 3.44Å; N118-D121 PolarHBondContact O-N 3.3Å; N118-K122 WeakPolarHBondContact O-CB 3.45Å; N118-K122 PolarHBondContact O-N 3.21Å
119	P	89.3	Confident	91.2	Very high	92 Å²	92	51.6 Å²	51.6	60%	0.597	27%	0.269	S	S	*	.	H	α-helix	trans	-53.5	-38.6	-177.1	-27.8	34.2	0	0	0	114.5	K122 A123	P119-K122 WeakPolarHBondContact O-CB 3.2Å; P119-K122 PolarHBondContact O-N 2.77Å; P119-A123 PolarHBondContact O-N 3.48Å
120	K	91.5	Very high	90.6	Very high	180 Å²	180	57 Å²	57	78%	0.783	29%	0.294	S	S	*	.	H	α-helix	trans	-62.5	-45.6	174.9	-81	-173.1	175.7	-179.8	0	113	N118 K122 T124	N118-K120 VanDerWaalsContact C-N 3.27Å; N118-K120 PolarHBondContact O-N 3.14Å; N118-K120 VanDerWaalsContact O-N 3.13Å; K120-K122 VanDerWaalsContact C-N 3.33Å; K120-T124 WeakPolarHBondContact O-CB 3.23Å; K120-T124 PolarHBondContact O-N 3.26Å; K120-T124 PolarHBondContact O-OG1 2.87Å
121	D	91.3	Very high	90	Very high	33 Å²	33	58.4 Å²	58.4	18%	0.176	31%	0.307	C	S	.	.	H	α-helix	trans	-65.7	-41.8	178	-73.2	-40.1	0	0	0	110.6	L117 N118 A123 T124 Y125 K149	L117-D121 HydrophobicContact CB-CB 4.43Å; L117-D121 HydrophobicContact CD2-CB 4.26Å; N118-D121 WeakPolarHBondContact O-CB 3.44Å; N118-D121 PolarHBondContact O-N 3.3Å; D121-A123 PolarHBondContact O-N 2.7Å; D121-T124 WeakPolarHBondContact O-CB 3.35Å; D121-T124 PolarHBondContact O-N 2.72Å; D121-T124 VanDerWaalsContact O-N 3.12Å; D121-Y125 HydrophobicContact CB-CD2 4.27Å; D121-Y125 HydrophobicContact CB-CE2 4.16Å; D121-Y125 WeakPolarHBondContact O-CD2 3.34Å; D121-Y125 PolarHBondContact O-N 3.1Å; D121-K149 IonicContact OD1-NZ 3.86Å; D121-K149 PolarHBondContact OD1-NZ 2.86Å; D121-K149 WeakPolarHBondContact OD2-CE 3.31Å; D121-K149 IonicContact OD2-NZ 3.05Å; D121-K149 PolarHBondContact OD2-NZ 3.31Å
122	K	90.7	Very high	88.9	Confident	30 Å²	30	58.7 Å²	58.7	13%	0.13	33%	0.329	C	S	.	.	H	α-helix	trans	-54.6	-51.8	177.1	-154.6	176	-176.8	172.1	0	111.1	N118 P119 K120 T124 Y125 L126 D227 L230	N118-K122 WeakPolarHBondContact O-CB 3.45Å; N118-K122 PolarHBondContact O-N 3.21Å; P119-K122 WeakPolarHBondContact O-CB 3.2Å; P119-K122 PolarHBondContact O-N 2.77Å; K120-K122 VanDerWaalsContact C-N 3.33Å; K122-T124 VanDerWaalsContact C-N 3.35Å; K122-T124 PolarHBondContact O-N 2.77Å; K122-Y125 PolarHBondContact O-N 3.03Å; K122-L126 HydrophobicContact CG-CD1 4.46Å; K122-L126 WeakPolarHBondContact O-CB 3.37Å; K122-L126 WeakPolarHBondContact O-CG 3.48Å; K122-L126 PolarHBondContact O-N 2.97Å; K122-D227 VanDerWaalsContact CE-CG 3.5Å; K122-D227 WeakPolarHBondContact CE-OD1 3.4Å; K122-D227 IonicContact NZ-OD1 2.95Å; K122-D227 PolarHBondContact NZ-OD1 2.93Å; K122-D227 IonicContact NZ-OD2 3.91Å; K122-D227 PolarHBondContact NZ-OD2 3.32Å; K122-L230 HydrophobicContact CD-CD1 4.06Å; K122-L230 HydrophobicContact CG-CD1 3.37Å; K122-L230 HydrophobicContact CG-CD2 4.41Å; K122-L230 HydrophobicContact CG-CG 4.48Å
123	A	90.7	Very high	87.8	Confident	61 Å²	61	68.4 Å²	68.4	50%	0.504	36%	0.361	S	S	.	.	H	α-helix	trans	-61.9	-40.6	175.8	0	0	0	0	0	112.4	P119 D121 K127	P119-A123 PolarHBondContact O-N 3.48Å; D121-A123 PolarHBondContact O-N 2.7Å; A123-K127 WeakPolarHBondContact O-CB 3.31Å; A123-K127 PolarHBondContact O-N 3.28Å
124	T	92.8	Very high	86.9	Confident	70 Å²	70	71.2 Å²	71.2	43%	0.429	38%	0.375	S	S	.	.	H	α-helix	trans	-63.9	-45.5	179.6	-56.1	0	0	0	0	112	K120 D121 K122 K128	K120-T124 WeakPolarHBondContact O-CB 3.23Å; K120-T124 PolarHBondContact O-N 3.26Å; K120-T124 PolarHBondContact O-OG1 2.87Å; D121-T124 WeakPolarHBondContact O-CB 3.35Å; D121-T124 PolarHBondContact O-N 2.72Å; D121-T124 VanDerWaalsContact O-N 3.12Å; K122-T124 VanDerWaalsContact C-N 3.35Å; K122-T124 PolarHBondContact O-N 2.77Å; T124-K128 WeakPolarHBondContact O-CG 3.38Å; T124-K128 PolarHBondContact O-N 2.89Å; T124-K128 VanDerWaalsContact O-N 3.14Å
125	Y	92.4	Very high	86.2	Confident	33 Å²	33	74 Å²	74	13%	0.129	39%	0.391	C	S	.	.	H	α-helix	trans	-73.3	-38.2	179.7	-71.5	-61.4	0	0	0	112.5	L117 D121 K122 K127 K128 L129 V142 I146 K149	L117-Y125 HydrophobicContact CD1-CD2 3.97Å; L117-Y125 HydrophobicContact CD1-CE2 4.45Å; L117-Y125 HydrophobicContact CD2-CE2 4.27Å; D121-Y125 HydrophobicContact CB-CD2 4.27Å; D121-Y125 HydrophobicContact CB-CE2 4.16Å; D121-Y125 WeakPolarHBondContact O-CD2 3.34Å; D121-Y125 PolarHBondContact O-N 3.1Å; K122-Y125 PolarHBondContact O-N 3.03Å; Y125-K127 VanDerWaalsContact C-N 3.34Å; Y125-K127 PolarHBondContact O-N 2.83Å; Y125-K128 PolarHBondContact O-N 3.29Å; Y125-L129 WeakPolarHBondContact O-CG 3.44Å; Y125-L129 PolarHBondContact O-N 2.81Å; Y125-V142 HydrophobicContact CD1-CG1 4.17Å; Y125-I146 HydrophobicContact CD1-CD1 4.18Å; Y125-I146 HydrophobicContact CD1-CG1 3.8Å; Y125-I146 HydrophobicContact CD2-CG1 3.99Å; Y125-I146 HydrophobicContact CE1-CG1 4.06Å; Y125-I146 HydrophobicContact CE2-CG1 4.24Å; Y125-I146 HydrophobicContact CG-CD1 4.06Å; Y125-I146 HydrophobicContact CG-CG1 3.77Å; Y125-K149 HydrophobicContact CE2-CD 4.42Å
126	L	89.4	Confident	85.6	Confident	36 Å²	36	74.2 Å²	74.2	19%	0.188	39%	0.392	C	S	.	.	H	α-helix	trans	-57.6	-48.5	171.9	-79.8	167.9	0	0	0	110.8	K122 K128 L129 E130 P229 L230	K122-L126 HydrophobicContact CG-CD1 4.46Å; K122-L126 WeakPolarHBondContact O-CB 3.37Å; K122-L126 WeakPolarHBondContact O-CG 3.48Å; K122-L126 PolarHBondContact O-N 2.97Å; L126-K128 VanDerWaalsContact C-N 3.26Å; L126-K128 PolarHBondContact O-N 3.06Å; L126-L129 PolarHBondContact O-N 2.85Å; L126-L129 VanDerWaalsContact O-N 3.08Å; L126-E130 WeakPolarHBondContact O-CB 3.39Å; L126-E130 WeakPolarHBondContact O-CG 3.35Å; L126-E130 PolarHBondContact O-N 2.86Å; L126-P229 HydrophobicContact CD2-CB 3.88Å; L126-P229 HydrophobicContact CD2-CG 4.43Å; L126-L230 HydrophobicContact CD2-CD2 4.22Å; L126-L230 HydrophobicContact CD2-CG 4.1Å; L126-L230 HydrophobicContact CG-CD2 3.85Å; L126-L230 HydrophobicContact CG-CG 4.12Å
127	K	88.4	Confident	84.9	Confident	169 Å²	169	75.5 Å²	75.5	74%	0.735	40%	0.402	S	S	*	.	H	α-helix	trans	-59.2	-35.7	177	-169.3	173.5	-177.1	176.1	0	112.8	A123 Y125	A123-K127 WeakPolarHBondContact O-CB 3.31Å; A123-K127 PolarHBondContact O-N 3.28Å; Y125-K127 VanDerWaalsContact C-N 3.34Å; Y125-K127 PolarHBondContact O-N 2.83Å
128	K	87.7	Confident	84.3	Confident	109 Å²	109	77.1 Å²	77.1	47%	0.474	42%	0.415	S	S	.	.	H	α-helix	trans	-67.8	-44.5	173.8	-75.5	-177.9	179.3	-175.7	0	112.1	T124 Y125 L126 E130 S131	T124-K128 WeakPolarHBondContact O-CG 3.38Å; T124-K128 PolarHBondContact O-N 2.89Å; T124-K128 VanDerWaalsContact O-N 3.14Å; Y125-K128 PolarHBondContact O-N 3.29Å; L126-K128 VanDerWaalsContact C-N 3.26Å; L126-K128 PolarHBondContact O-N 3.06Å; K128-E130 VanDerWaalsContact C-N 3.35Å; K128-S131 WeakPolarHBondContact O-CB 3.29Å; K128-S131 PolarHBondContact O-N 3.25Å; K128-S131 PolarHBondContact O-OG 2.98Å
129	L	85.1	Confident	84	Confident	32 Å²	32	75.5 Å²	75.5	17%	0.168	41%	0.405	C	S	.	.	H	α-helix	trans	-71.7	-29.5	-177.9	-70.6	166.2	0	0	0	113	Y125 L126 S131 L134 Q139 V142 I146 P229 V232	Y125-L129 WeakPolarHBondContact O-CG 3.44Å; Y125-L129 PolarHBondContact O-N 2.81Å; L126-L129 PolarHBondContact O-N 2.85Å; L126-L129 VanDerWaalsContact O-N 3.08Å; L129-S131 PolarHBondContact O-N 2.98Å; L129-L134 HydrophobicContact CD2-CD2 4.43Å; L129-Q139 HydrophobicContact CD2-CG 4.16Å; L129-V142 HydrophobicContact CD2-CB 4.42Å; L129-V142 HydrophobicContact CD2-CG1 3.91Å; L129-V142 HydrophobicContact CG-CG1 4.14Å; L129-I146 HydrophobicContact CD1-CD1 4.27Å; L129-P229 WeakPolarHBondContact CD1-O 3.26Å; L129-V232 HydrophobicContact CD1-CG2 4.19Å; L129-V232 HydrophobicContact CD2-CG1 4.43Å; L129-V232 HydrophobicContact CD2-CG2 4Å
130	E	82.8	Confident	83.8	Confident	112 Å²	112	74 Å²	74	52%	0.523	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.4	-5.8	176.1	-70.3	177.2	167.3	0	0	113.1	L126 K128 G132 R235	L126-E130 WeakPolarHBondContact O-CB 3.39Å; L126-E130 WeakPolarHBondContact O-CG 3.35Å; L126-E130 PolarHBondContact O-N 2.86Å; K128-E130 VanDerWaalsContact C-N 3.35Å; E130-G132 PolarHBondContact O-N 3.37Å; E130-R235 IonicContact OE1-CZ 3.6Å; E130-R235 IonicContact OE1-NH1 4Å; E130-R235 IonicContact OE1-NH2 2.64Å; E130-R235 PolarHBondContact OE1-NH2 2.88Å
131	S	78.5	Confident	83.5	Confident	52 Å²	52	69.1 Å²	69.1	36%	0.364	38%	0.378	S	S	.	.			trans	-68	109.3	172.1	70.9	0	0	0	0	109.6	K128 L129 R133 L134	K128-S131 WeakPolarHBondContact O-CB 3.29Å; K128-S131 PolarHBondContact O-N 3.25Å; K128-S131 PolarHBondContact O-OG 2.98Å; L129-S131 PolarHBondContact O-N 2.98Å; S131-R133 PolarHBondContact O-N 2.92Å; S131-L134 PolarHBondContact O-N 3.43Å; S131-L134 VanDerWaalsContact O-N 3.15Å; S131-L134 WeakPolarHBondContact OG-CD1 3.28Å
132	G	69	Low	83.4	Confident	89 Å²	89	68.6 Å²	68.6	92%	0.918	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	3.7	-175.2	0	0	0	0	0	116.2	E130	E130-G132 PolarHBondContact O-N 3.37Å
133	R	67.9	Low	83.4	Confident	243 Å²	243	67.8 Å²	67.8	92%	0.917	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.1	7.5	178.1	-63.3	-173.8	-176.9	-178.6	0.7	113.4	S131 T135	S131-R133 PolarHBondContact O-N 2.92Å; R133-T135 PolarHBondContact O-N 3.31Å
134	L	75.1	Confident	83.4	Confident	58 Å²	58	71.4 Å²	71.4	30%	0.304	38%	0.376	S	S	.	.			trans	-75.1	117.4	-175.6	-142.4	90.6	0	0	0	110.8	L129 S131 A138 Q139 V142	L129-L134 HydrophobicContact CD2-CD2 4.43Å; S131-L134 PolarHBondContact O-N 3.43Å; S131-L134 VanDerWaalsContact O-N 3.15Å; S131-L134 WeakPolarHBondContact OG-CD1 3.28Å; L134-A138 HydrophobicContact CD2-CB 4.36Å; L134-A138 HydrophobicContact CG-CB 3.96Å; L134-Q139 HydrophobicContact CD2-CB 3.96Å; L134-Q139 HydrophobicContact CD2-CG 4.07Å; L134-V142 HydrophobicContact CD2-CG2 4.34Å
135	T	77.7	Confident	83.4	Confident	72 Å²	72	70.2 Å²	70.2	44%	0.442	37%	0.373	S	S	.	.			trans	-65.2	155.3	172.9	53.7	0	0	0	0	111.5	R133 S137 A138 Q139 D1318	R133-T135 PolarHBondContact O-N 3.31Å; T135-S137 PolarHBondContact O-N 3.36Å; T135-A138 PolarHBondContact O-N 2.89Å; T135-A138 VanDerWaalsContact O-N 3.08Å; T135-A138 VanDerWaalsContact OG1-CB 3.28Å; T135-A138 WeakPolarHBondContact OG1-CB 3.25Å; T135-A138 PolarHBondContact OG1-N 3.48Å; T135-Q139 PolarHBondContact O-N 3.16Å; T135-D1318 VanDerWaalsContact CA-OD2 3.26Å; T135-D1318 WeakPolarHBondContact CA-OD2 3.22Å; T135-D1318 WeakPolarHBondContact CB-OD2 3.5Å
136	Y	79.5	Confident	83.4	Confident	5 Å²	5	68.7 Å²	68.7	2%	0.02	37%	0.368	C	S	.	.	H	α-helix	trans	-59.1	-37	179	178.6	-130.2	0	0	0	111.7	Q139 K140 D1318 V1320 A1336 H1339 H1341	Y136-Q139 WeakPolarHBondContact O-CB 3.49Å; Y136-Q139 PolarHBondContact O-N 3.34Å; Y136-K140 PolarHBondContact O-N 2.84Å; Y136-K140 VanDerWaalsContact OH-CE 3.25Å; Y136-K140 WeakPolarHBondContact OH-CE 3.28Å; Y136-K140 PolarHBondContact OH-NZ 3.06Å; Y136-D1318 PolarHBondContact N-OD2 2.77Å; Y136-V1320 HydrophobicContact CE1-CG2 4.12Å; Y136-A1336 WeakPolarHBondContact OH-CA 3.44Å; Y136-A1336 PolarHBondContact OH-N 3.25Å; Y136-H1339 HydrophobicContact CE2-CB 4.03Å; Y136-H1339 AromaticContact CE2-CD2 3.76Å; Y136-H1341 HydrophobicContact CD2-CB 4.32Å; Y136-H1341 AromaticContact CD2-CG 3.99Å; Y136-H1341 AromaticContact CD2-ND1 3.63Å; Y136-H1341 HydrophobicContact CE2-CB 4.14Å; Y136-H1341 AromaticContact CG-CE1 3.91Å; Y136-H1341 AromaticContact CG-ND1 3.78Å
137	S	78.8	Confident	83.5	Confident	30 Å²	30	67.1 Å²	67.1	21%	0.21	36%	0.359	C	S	.	.	H	α-helix	trans	-64.3	-43.6	173.9	-151.3	0	0	0	0	113.2	T135 Q139 K140 S141 P1314 D1318	T135-S137 PolarHBondContact O-N 3.36Å; S137-Q139 VanDerWaalsContact C-N 3.33Å; S137-K140 PolarHBondContact O-N 3.02Å; S137-S141 PolarHBondContact O-N 2.98Å; S137-S141 PolarHBondContact O-OG 3.41Å; S137-P1314 WeakPolarHBondContact CB-O 3.36Å; S137-P1314 PolarHBondContact OG-O 3.34Å; S137-D1318 PolarHBondContact N-OD1 3.21Å
138	A	81	Confident	83.7	Confident	35 Å²	35	62.1 Å²	62.1	29%	0.289	34%	0.341	S	S	.	.	H	α-helix	trans	-65.6	-38.7	176.2	0	0	0	0	0	111.2	L134 T135 K140 S141 V142	L134-A138 HydrophobicContact CD2-CB 4.36Å; L134-A138 HydrophobicContact CG-CB 3.96Å; T135-A138 PolarHBondContact O-N 2.89Å; T135-A138 VanDerWaalsContact O-N 3.08Å; T135-A138 VanDerWaalsContact OG1-CB 3.28Å; T135-A138 WeakPolarHBondContact OG1-CB 3.25Å; T135-A138 PolarHBondContact OG1-N 3.48Å; A138-K140 VanDerWaalsContact C-N 3.34Å; A138-K140 PolarHBondContact O-N 3.06Å; A138-S141 WeakPolarHBondContact O-CB 3.45Å; A138-S141 PolarHBondContact O-N 3.25Å; A138-S141 VanDerWaalsContact O-N 3.07Å; A138-V142 WeakPolarHBondContact O-CG2 3.13Å; A138-V142 PolarHBondContact O-N 3.28Å
139	Q	84.7	Confident	83.9	Confident	44 Å²	44	60.6 Å²	60.6	21%	0.206	33%	0.334	C	S	.	.	H	α-helix	trans	-57.9	-44.1	176.3	-150.3	-167.1	1.3	0	0	112.1	L129 L134 T135 Y136 S137 S141 V142 Y143 V232	L129-Q139 HydrophobicContact CD2-CG 4.16Å; L134-Q139 HydrophobicContact CD2-CB 3.96Å; L134-Q139 HydrophobicContact CD2-CG 4.07Å; T135-Q139 PolarHBondContact O-N 3.16Å; Y136-Q139 WeakPolarHBondContact O-CB 3.49Å; Y136-Q139 PolarHBondContact O-N 3.34Å; S137-Q139 VanDerWaalsContact C-N 3.33Å; Q139-S141 VanDerWaalsContact C-N 3.33Å; Q139-S141 PolarHBondContact O-N 3.03Å; Q139-V142 PolarHBondContact O-N 3.37Å; Q139-Y143 PolarHBondContact O-N 3.46Å; Q139-V232 VanDerWaalsContact CD-CG1 3.48Å; Q139-V232 HydrophobicContact CG-CG1 3.43Å; Q139-V232 VanDerWaalsContact CG-CG1 3.43Å
140	K	83.8	Confident	84.3	Confident	60 Å²	60	59.1 Å²	59.1	26%	0.261	33%	0.327	S	S	.	.	H	α-helix	trans	-62.6	-36.9	173.9	-76.9	176	176.8	166.5	0	113.3	Y136 S137 A138 Y143 K144	Y136-K140 PolarHBondContact O-N 2.84Å; Y136-K140 VanDerWaalsContact OH-CE 3.25Å; Y136-K140 WeakPolarHBondContact OH-CE 3.28Å; Y136-K140 PolarHBondContact OH-NZ 3.06Å; S137-K140 PolarHBondContact O-N 3.02Å; A138-K140 VanDerWaalsContact C-N 3.34Å; A138-K140 PolarHBondContact O-N 3.06Å; K140-Y143 PolarHBondContact O-N 3.47Å; K140-K144 PolarHBondContact O-N 2.92Å
141	S	85.5	Confident	84.6	Confident	78 Å²	78	58.4 Å²	58.4	55%	0.545	32%	0.322	S	S	.	.	H	α-helix	trans	-67.8	-41.2	177.7	-61.7	0	0	0	0	111.4	S137 A138 Q139 K144 A145	S137-S141 PolarHBondContact O-N 2.98Å; S137-S141 PolarHBondContact O-OG 3.41Å; A138-S141 WeakPolarHBondContact O-CB 3.45Å; A138-S141 PolarHBondContact O-N 3.25Å; A138-S141 VanDerWaalsContact O-N 3.07Å; Q139-S141 VanDerWaalsContact C-N 3.33Å; Q139-S141 PolarHBondContact O-N 3.03Å; S141-K144 PolarHBondContact O-N 3.31Å; S141-A145 PolarHBondContact O-N 3.44Å
142	V	89	Confident	85.1	Confident	22 Å²	22	64.2 Å²	64.2	13%	0.133	34%	0.34	C	S	.	.	H	α-helix	trans	-62.7	-46	172.6	175.7	0	0	0	0	110.8	Y125 L129 L134 A138 Q139 K144 A145 I146	Y125-V142 HydrophobicContact CD1-CG1 4.17Å; L129-V142 HydrophobicContact CD2-CB 4.42Å; L129-V142 HydrophobicContact CD2-CG1 3.91Å; L129-V142 HydrophobicContact CG-CG1 4.14Å; L134-V142 HydrophobicContact CD2-CG2 4.34Å; A138-V142 WeakPolarHBondContact O-CG2 3.13Å; A138-V142 PolarHBondContact O-N 3.28Å; Q139-V142 PolarHBondContact O-N 3.37Å; V142-K144 VanDerWaalsContact C-N 3.31Å; V142-K144 PolarHBondContact O-N 2.95Å; V142-A145 PolarHBondContact O-N 2.87Å; V142-A145 VanDerWaalsContact O-N 3.14Å; V142-I146 HydrophobicContact CG1-CD1 3.87Å; V142-I146 HydrophobicContact CG1-CG1 4.43Å; V142-I146 WeakPolarHBondContact O-CG1 3.44Å; V142-I146 PolarHBondContact O-N 2.81Å
143	Y	90.7	Very high	86.1	Confident	14 Å²	14	61.6 Å²	61.6	6%	0.055	31%	0.307	C	S	.	.	H	α-helix	trans	-56.4	-43.8	176.3	179.7	-126	0	0	0	112.4	Q103 Q139 K140 I146 T147 L231 V232 Y1338	Q103-Y143 VanDerWaalsContact CB-OH 3.25Å; Q103-Y143 WeakPolarHBondContact CB-OH 3.47Å; Q103-Y143 VanDerWaalsContact OE1-CE1 3.3Å; Q103-Y143 PolarHBondContact OE1-OH 2.94Å; Q139-Y143 PolarHBondContact O-N 3.46Å; K140-Y143 PolarHBondContact O-N 3.47Å; Y143-I146 PolarHBondContact O-N 3.37Å; Y143-T147 WeakPolarHBondContact O-CB 3.18Å; Y143-T147 PolarHBondContact O-N 2.9Å; Y143-T147 PolarHBondContact O-OG1 3.05Å; Y143-L231 WeakPolarHBondContact CE2-O 3.24Å; Y143-V232 HydrophobicContact CD2-CB 3.97Å; Y143-V232 HydrophobicContact CD2-CG2 3.75Å; Y143-V232 HydrophobicContact CG-CB 4.25Å; Y143-V232 HydrophobicContact CG-CG2 4.12Å; Y143-Y1338 HydrophobicContact CE1-CE1 4.48Å; Y143-Y1338 PolarHBondContact OH-OH 3.11Å
144	K	91.1	Very high	87	Confident	136 Å²	136	53.4 Å²	53.4	59%	0.591	28%	0.284	S	S	*	.	H	α-helix	trans	-62.6	-45.3	176	-173.9	-179.6	177.7	-173.8	0	111.7	K140 S141 V142 I146 T147 D148	K140-K144 PolarHBondContact O-N 2.92Å; S141-K144 PolarHBondContact O-N 3.31Å; V142-K144 VanDerWaalsContact C-N 3.31Å; V142-K144 PolarHBondContact O-N 2.95Å; K144-I146 VanDerWaalsContact C-N 3.34Å; K144-I146 PolarHBondContact O-N 3.31Å; K144-T147 PolarHBondContact O-N 3.07Å; K144-D148 WeakPolarHBondContact O-CB 3.41Å; K144-D148 PolarHBondContact O-N 3.33Å
145	A	92.7	Very high	87.7	Confident	45 Å²	45	54 Å²	54	37%	0.372	29%	0.289	S	S	.	.	H	α-helix	trans	-61	-42	178.3	0	0	0	0	0	112.2	S141 V142 K149	S141-A145 PolarHBondContact O-N 3.44Å; V142-A145 PolarHBondContact O-N 2.87Å; V142-A145 VanDerWaalsContact O-N 3.14Å; A145-K149 WeakPolarHBondContact O-CB 3.1Å; A145-K149 PolarHBondContact O-N 2.85Å; A145-K149 VanDerWaalsContact O-N 3.11Å
146	I	92.9	Very high	88.4	Confident	1 Å²	1	50.6 Å²	50.6	1%	0.005	27%	0.269	C	S	.	.	H	α-helix	trans	-60.6	-51.8	174.4	-69.3	168.3	0	0	0	110.2	L117 Y125 L129 V142 Y143 K144 D148 K149 C150 L230	L117-I146 HydrophobicContact CD1-CG2 4.08Å; Y125-I146 HydrophobicContact CD1-CD1 4.18Å; Y125-I146 HydrophobicContact CD1-CG1 3.8Å; Y125-I146 HydrophobicContact CD2-CG1 3.99Å; Y125-I146 HydrophobicContact CE1-CG1 4.06Å; Y125-I146 HydrophobicContact CE2-CG1 4.24Å; Y125-I146 HydrophobicContact CG-CD1 4.06Å; Y125-I146 HydrophobicContact CG-CG1 3.77Å; L129-I146 HydrophobicContact CD1-CD1 4.27Å; V142-I146 HydrophobicContact CG1-CD1 3.87Å; V142-I146 HydrophobicContact CG1-CG1 4.43Å; V142-I146 WeakPolarHBondContact O-CG1 3.44Å; V142-I146 PolarHBondContact O-N 2.81Å; Y143-I146 PolarHBondContact O-N 3.37Å; K144-I146 VanDerWaalsContact C-N 3.34Å; K144-I146 PolarHBondContact O-N 3.31Å; I146-D148 VanDerWaalsContact C-N 3.35Å; I146-D148 PolarHBondContact O-N 3.49Å; I146-K149 PolarHBondContact O-N 3.44Å; I146-C150 PolarHBondContact O-N 3.3Å; I146-C150 PolarHBondContact O-SG 3.07Å; I146-L230 WeakPolarHBondContact CD1-O 3.4Å
147	T	92.1	Very high	88.8	Confident	3 Å²	3	52.5 Å²	52.5	2%	0.018	28%	0.282	C	S	.	.	H	α-helix	trans	-61.2	-42.6	-177.4	-52.2	0	0	0	0	111.7	Q103 Y143 K144 K149 C150 K151	Q103-T147 HydrophobicContact CB-CG2 4.38Å; Q103-T147 HydrophobicContact CG-CG2 4.42Å; Y143-T147 WeakPolarHBondContact O-CB 3.18Å; Y143-T147 PolarHBondContact O-N 2.9Å; Y143-T147 PolarHBondContact O-OG1 3.05Å; K144-T147 PolarHBondContact O-N 3.07Å; T147-K149 VanDerWaalsContact C-N 3.33Å; T147-K149 PolarHBondContact O-N 3.45Å; T147-C150 PolarHBondContact O-N 3.1Å; T147-K151 HydrophobicContact CG2-CD 4.45Å; T147-K151 VanDerWaalsContact O-CG 3.29Å; T147-K151 WeakPolarHBondContact O-CG 3.11Å; T147-K151 PolarHBondContact O-N 3.46Å
148	D	92.7	Very high	89.2	Confident	64 Å²	64	56.1 Å²	56.1	34%	0.342	30%	0.295	S	S	.	.	H	α-helix	trans	-70	-29.5	180	-71.9	-18.2	0	0	0	112.7	K144 I146 K151 K152	K144-D148 WeakPolarHBondContact O-CB 3.41Å; K144-D148 PolarHBondContact O-N 3.33Å; I146-D148 VanDerWaalsContact C-N 3.35Å; I146-D148 PolarHBondContact O-N 3.49Å; D148-K151 IonicContact OD1-NZ 3.93Å; D148-K151 PolarHBondContact OD1-NZ 2.97Å; D148-K152 WeakPolarHBondContact O-CG 3.44Å
149	K	92.2	Very high	89.7	Confident	78 Å²	78	56.6 Å²	56.6	34%	0.339	30%	0.296	S	S	.	.	H	α-helix	trans	-71.6	-48	172	-162.1	165.5	-170.1	175.5	0	111	L117 D121 Y125 A145 I146 T147 K151 K152 T153	L117-K149 HydrophobicContact CD2-CB 4.31Å; L117-K149 HydrophobicContact CD2-CD 4.13Å; L117-K149 HydrophobicContact CD2-CG 4.21Å; D121-K149 IonicContact OD1-NZ 3.86Å; D121-K149 PolarHBondContact OD1-NZ 2.86Å; D121-K149 WeakPolarHBondContact OD2-CE 3.31Å; D121-K149 IonicContact OD2-NZ 3.05Å; D121-K149 PolarHBondContact OD2-NZ 3.31Å; Y125-K149 HydrophobicContact CE2-CD 4.42Å; A145-K149 WeakPolarHBondContact O-CB 3.1Å; A145-K149 PolarHBondContact O-N 2.85Å; A145-K149 VanDerWaalsContact O-N 3.11Å; I146-K149 PolarHBondContact O-N 3.44Å; T147-K149 VanDerWaalsContact C-N 3.33Å; T147-K149 PolarHBondContact O-N 3.45Å; K149-K151 VanDerWaalsContact C-N 3.3Å; K149-K151 PolarHBondContact O-N 2.86Å; K149-K152 PolarHBondContact O-N 3.33Å; K149-T153 PolarHBondContact O-N 3.01Å; K149-T153 PolarHBondContact O-OG1 3.44Å
150	C	92.1	Very high	89.9	Confident	1 Å²	1	60.4 Å²	60.4	1%	0.007	32%	0.318	C	S	.	.	H	α-helix	trans	-59	-39.2	178.5	-62.5	0	0	0	0	112.6	L116 I146 T147 K152 T153	L116-C150 HydrophobicContact CB-CB 4.16Å; I146-C150 PolarHBondContact O-N 3.3Å; I146-C150 PolarHBondContact O-SG 3.07Å; T147-C150 PolarHBondContact O-N 3.1Å; C150-K152 PolarHBondContact O-N 3.47Å; C150-T153 WeakPolarHBondContact O-CB 3.31Å; C150-T153 PolarHBondContact O-N 2.96Å; C150-T153 VanDerWaalsContact O-N 3.13Å
151	K	89.5	Confident	90.1	Very high	97 Å²	97	60.5 Å²	60.5	42%	0.422	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-26.7	176.3	-77.5	169.5	-177.5	160.9	0	114.4	Q106 T147 D148 K149	Q106-K151 HydrophobicContact CB-CG 4.21Å; T147-K151 HydrophobicContact CG2-CD 4.45Å; T147-K151 VanDerWaalsContact O-CG 3.29Å; T147-K151 WeakPolarHBondContact O-CG 3.11Å; T147-K151 PolarHBondContact O-N 3.46Å; D148-K151 IonicContact OD1-NZ 3.93Å; D148-K151 PolarHBondContact OD1-NZ 2.97Å; K149-K151 VanDerWaalsContact C-N 3.3Å; K149-K151 PolarHBondContact O-N 2.86Å
152	K	89.4	Confident	90.2	Very high	173 Å²	173	59.2 Å²	59.2	75%	0.752	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.8	-24.5	178.5	-67.4	174.2	-177.5	-179.6	0	111.5	D148 K149 C150 T154	D148-K152 WeakPolarHBondContact O-CG 3.44Å; K149-K152 PolarHBondContact O-N 3.33Å; C150-K152 PolarHBondContact O-N 3.47Å; K152-T154 PolarHBondContact O-N 3.44Å
153	T	89.1	Confident	90.2	Very high	35 Å²	35	58.4 Å²	58.4	22%	0.215	30%	0.301	C	S	.	.			trans	-75.7	108.8	179	-49.5	0	0	0	0	110.6	L116 K149 C150 V155	L116-T153 HydrophobicContact CB-CG2 4.27Å; L116-T153 PolarHBondContact O-OG1 2.9Å; K149-T153 PolarHBondContact O-N 3.01Å; K149-T153 PolarHBondContact O-OG1 3.44Å; C150-T153 WeakPolarHBondContact O-CB 3.31Å; C150-T153 PolarHBondContact O-N 2.96Å; C150-T153 VanDerWaalsContact O-N 3.13Å; T153-V155 VanDerWaalsContact CG2-O 3.29Å; T153-V155 WeakPolarHBondContact CG2-O 3.46Å
154	T	87.4	Confident	90	Very high	70 Å²	70	58.3 Å²	58.3	43%	0.429	30%	0.304	S	S	.	.			trans	-86.6	-44.5	177.6	48.1	0	0	0	0	112	K152 N163 T183	K152-T154 PolarHBondContact O-N 3.44Å; T154-N163 WeakPolarHBondContact O-CB 3.42Å; T154-N163 PolarHBondContact O-N 3.11Å; T154-N163 PolarHBondContact O-ND2 2.59Å; T154-T183 HydrophobicContact CG2-CG2 3.96Å
155	V	90.2	Very high	90	Very high	70 Å²	70	58.7 Å²	58.7	42%	0.424	31%	0.306	S	S	.	.	B	Isolated β-bridge	trans	-93.4	130.8	-179.3	-173.9	0	0	0	0	110.3	T153 P157	T153-V155 VanDerWaalsContact CG2-O 3.29Å; T153-V155 WeakPolarHBondContact CG2-O 3.46Å; V155-P157 WeakPolarHBondContact O-CD 3.43Å
156	C	91.1	Very high	89.9	Confident	1 Å²	1	57.1 Å²	57.1	1%	0.007	29%	0.291	C	S	.	.			trans	-70	126.1	178.1	-178.9	0	0	0	0	111.3	C109 C112 L116 H158 N160 Y161	C109-C156 HydrophobicContact CB-CB 4.19Å; C112-C156 VanDerWaalsContact SG-SG 3.7Å; L116-C156 HydrophobicContact CD2-CB 3.97Å; C156-H158 PolarHBondContact O-N 3.4Å; C156-H158 PolarHBondContact SG-N 3.43Å; C156-H158 VanDerWaalsContact SG-N 3.43Å; C156-N160 VanDerWaalsContact O-CA 3.23Å; C156-N160 WeakPolarHBondContact O-CA 3.4Å; C156-N160 PolarHBondContact O-N 2.89Å; C156-Y161 WeakPolarHBondContact CB-O 3.44Å; C156-Y161 PolarHBondContact N-O 3.19Å
157	P	88.9	Confident	89.8	Confident	46 Å²	46	61.9 Å²	61.9	30%	0.299	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-10.1	178.5	26.1	-31.6	0	0	0	114.6	L117 V155	L117-P157 WeakPolarHBondContact O-CG 3.17Å; V155-P157 WeakPolarHBondContact O-CD 3.43Å
158	H	87.5	Confident	89.6	Confident	106 Å²	106	63.7 Å²	63.7	49%	0.491	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.2	-42	179.4	-94.3	-76.6	0	0	0	113.7	C156	C156-H158 PolarHBondContact O-N 3.4Å; C156-H158 PolarHBondContact SG-N 3.43Å; C156-H158 VanDerWaalsContact SG-N 3.43Å
159	C	91	Very high	89.1	Confident	44 Å²	44	63.1 Å²	63.1	30%	0.297	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-124.3	6.3	-175.2	71.9	0	0	0	0	114.3	C109 C112 Y161	C109-C159 VanDerWaalsContact SG-SG 3.67Å; C112-C159 HydrophobicContact CB-CB 4.03Å; C112-C159 PolarHBondContact SG-SG 3.19Å; C159-Y161 PolarHBondContact O-N 3.02Å; C159-Y161 WeakPolarHBondContact SG-CB 3.5Å
160	N	88.5	Confident	88.2	Confident	125 Å²	125	64.9 Å²	64.9	67%	0.668	34%	0.343	S	S	*	.			trans	57.6	12.4	-178	-66.1	-26.6	0	0	0	116	C156	C156-N160 VanDerWaalsContact O-CA 3.23Å; C156-N160 WeakPolarHBondContact O-CA 3.4Å; C156-N160 PolarHBondContact O-N 2.89Å
161	Y	88.9	Confident	87.3	Confident	61 Å²	61	68.1 Å²	68.1	24%	0.239	38%	0.377	C	S	.	.			trans	-69	135	175.7	-174	-102.9	0	0	0	111.7	K110 N111 C156 C159 N163 R180	K110-Y161 HydrophobicContact CB-CE1 4.28Å; N111-Y161 HydrophobicContact CB-CD1 3.88Å; N111-Y161 HydrophobicContact CB-CD2 3.89Å; N111-Y161 HydrophobicContact CB-CE1 4.28Å; N111-Y161 HydrophobicContact CB-CE2 4.32Å; N111-Y161 HydrophobicContact CB-CG 3.64Å; C156-Y161 WeakPolarHBondContact CB-O 3.44Å; C156-Y161 PolarHBondContact N-O 3.19Å; C159-Y161 PolarHBondContact O-N 3.02Å; C159-Y161 WeakPolarHBondContact SG-CB 3.5Å; Y161-N163 PolarHBondContact O-N 2.91Å; Y161-N163 PolarHBondContact O-ND2 3.03Å; Y161-N163 VanDerWaalsContact O-ND2 3.16Å; Y161-R180 PolarHBondContact OH-NH1 3.04Å
162	V	87.7	Confident	86.9	Confident	52 Å²	52	68.8 Å²	68.8	32%	0.315	38%	0.381	S	S	.	.	B	Isolated β-bridge	trans	-82.9	112.3	177.5	-175.7	0	0	0	0	109.8	T183	V162-T183 HydrophobicContact CG1-CG2 4.31Å
163	N	88.8	Confident	86.7	Confident	5 Å²	5	61.4 Å²	61.4	3%	0.027	35%	0.349	C	S	.	.			trans	-90.4	127.8	178.3	-61.1	-84.6	0	0	0	110.8	C109 K110 L116 T154 Y161 Y178	C109-N163 WeakPolarHBondContact CA-OD1 3.31Å; K110-N163 PolarHBondContact N-OD1 3.15Å; L116-N163 HydrophobicContact CD1-CB 4.43Å; L116-N163 WeakPolarHBondContact CD2-ND2 3.39Å; T154-N163 WeakPolarHBondContact O-CB 3.42Å; T154-N163 PolarHBondContact O-N 3.11Å; T154-N163 PolarHBondContact O-ND2 2.59Å; Y161-N163 PolarHBondContact O-N 2.91Å; Y161-N163 PolarHBondContact O-ND2 3.03Å; Y161-N163 VanDerWaalsContact O-ND2 3.16Å; N163-Y178 WeakPolarHBondContact CA-OH 3.46Å
164	G	86.7	Confident	86.6	Confident	12 Å²	12	60.4 Å²	60.4	12%	0.124	34%	0.342	C	S	.	.			trans	-76.7	-179.1	168.9	0	0	0	0	0	113.5	Y178 D179	G164-Y178 VanDerWaalsContact N-CE2 3.28Å; G164-Y178 PolarHBondContact N-OH 2.96Å; G164-D179 CarbonylContact C-O 3.57Å; G164-D179 WeakPolarHBondContact CA-O 2.98Å
165	K	89.6	Confident	86.7	Confident	144 Å²	144	60.4 Å²	60.4	63%	0.626	34%	0.336	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81	130.9	176.2	-71.9	-171.8	177.7	-176.9	0	110.9	D179	K165-D179 PolarHBondContact N-O 2.89Å; K165-D179 PolarHBondContact O-N 2.94Å
166	V	91.7	Very high	86.8	Confident	11 Å²	11	57 Å²	57	7%	0.067	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	128	170	178.5	0	0	0	0	109.7	L105 Q106 I176 V177 Y178	L105-V166 HydrophobicContact CB-CG1 4.1Å; Q106-V166 HydrophobicContact CG-CB 3.89Å; Q106-V166 HydrophobicContact CG-CG1 4.27Å; Q106-V166 PolarHBondContact NE2-O 3.04Å; V166-I176 HydrophobicContact CG1-CG2 3.67Å; V166-V177 WeakPolarHBondContact CA-O 3.46Å; V166-Y178 HydrophobicContact CG2-CD2 3.63Å; V166-Y178 HydrophobicContact CG2-CE2 4.34Å; V166-Y178 HydrophobicContact CG2-CG 4.47Å
167	K	90.6	Very high	86.8	Confident	101 Å²	101	57.5 Å²	57.5	44%	0.439	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	144.6	177.4	60.1	-175.6	179.3	-174.2	0	111.1	V177	K167-V177 PolarHBondContact N-O 3.28Å; K167-V177 PolarHBondContact O-N 3.43Å
168	A	88.1	Confident	86.8	Confident	41 Å²	41	55.8 Å²	55.8	34%	0.339	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	137	163.2	0	0	0	0	0	108.7	F98 V102 P170	F98-A168 HydrophobicContact CE1-CB 4.11Å; F98-A168 HydrophobicContact CZ-CB 4.36Å; V102-A168 HydrophobicContact CG2-CB 4.36Å; A168-P170 WeakPolarHBondContact O-CD 3.47Å
169	L	82.9	Confident	86.8	Confident	53 Å²	53	51.6 Å²	51.6	28%	0.277	29%	0.287	S	S	.	.	P	Polyproline II helix	trans	-72.7	122.1	-179.4	-123.7	109.6	0	0	0	110.5	G171 H172 K175 V177	L169-G171 PolarHBondContact O-N 3.31Å; L169-H172 HydrophobicContact CB-CB 4.18Å; L169-H172 HydrophobicContact CD2-CB 4.47Å; L169-H172 PolarHBondContact O-N 2.91Å; L169-K175 PolarHBondContact N-O 2.95Å; L169-V177 HydrophobicContact CD1-CB 3.75Å; L169-V177 HydrophobicContact CD1-CG2 3.12Å
170	P	73.4	Confident	86.3	Confident	114 Å²	114	53 Å²	53	74%	0.74	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	133.8	174.8	-15.4	28.6	0	0	0	110.5	A168 H172	A168-P170 WeakPolarHBondContact O-CD 3.47Å; P170-H172 VanDerWaalsContact C-N 3.29Å; P170-H172 PolarHBondContact O-N 3.43Å
171	G	73.3	Confident	85.4	Confident	69 Å²	69	49.2 Å²	49.2	71%	0.711	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.8	2.6	176	0	0	0	0	0	115.5	L169	L169-G171 PolarHBondContact O-N 3.31Å
172	H	80.8	Confident	84.3	Confident	111 Å²	111	54.7 Å²	54.7	51%	0.514	29%	0.294	S	S	.	.	S	Bend	trans	-116.3	142.8	171.4	-67.4	13.8	0	0	0	110.4	L169 P170 M174	L169-H172 HydrophobicContact CB-CB 4.18Å; L169-H172 HydrophobicContact CD2-CB 4.47Å; L169-H172 PolarHBondContact O-N 2.91Å; P170-H172 VanDerWaalsContact C-N 3.29Å; P170-H172 PolarHBondContact O-N 3.43Å; H172-M174 PolarHBondContact O-N 3.14Å
173	F	84.8	Confident	82.9	Confident	18 Å²	18	54.6 Å²	54.6	8%	0.079	29%	0.294	C	S	.	.	S	Bend	trans	-69.5	114.2	-179.7	179.3	-93	0	0	0	110.9	K175 Q305 M306 A309 V316 L319	F173-K175 PolarHBondContact O-N 3.35Å; F173-Q305 HydrophobicContact CE1-CB 4.17Å; F173-M306 HydrophobicContact CD1-CG 3.48Å; F173-M306 VanDerWaalsContact CD1-CG 3.48Å; F173-M306 HydrophobicContact CD1-SD 4.4Å; F173-M306 HydrophobicContact CD2-CG 4.22Å; F173-M306 HydrophobicContact CE1-CB 4.31Å; F173-M306 HydrophobicContact CE1-CG 3.5Å; F173-M306 HydrophobicContact CE2-CG 4.2Å; F173-M306 HydrophobicContact CG-CG 3.87Å; F173-M306 HydrophobicContact CZ-CB 4.46Å; F173-M306 HydrophobicContact CZ-CG 3.88Å; F173-A309 HydrophobicContact CE2-CB 3.77Å; F173-A309 HydrophobicContact CZ-CB 3.39Å; F173-V316 HydrophobicContact CD2-CG1 4.26Å; F173-V316 HydrophobicContact CE2-CB 4.41Å; F173-V316 HydrophobicContact CE2-CG1 3.83Å; F173-L319 HydrophobicContact CD2-CD2 3.88Å; F173-L319 HydrophobicContact CD2-CG 4.29Å; F173-L319 HydrophobicContact CE2-CD2 4.01Å
174	M	86.6	Confident	81	Confident	14 Å²	14	57.2 Å²	57.2	7%	0.069	31%	0.313	C	S	.	.	S	Bend	trans	49.5	30.7	168	-65.4	-174.6	49.7	0	0	117.4	F93 L95 F98 H172	F93-M174 HydrophobicContact CB-CE 3.2Å; F93-M174 HydrophobicContact CG-CE 4.3Å; F93-M174 WeakPolarHBondContact O-CE 3.46Å; L95-M174 HydrophobicContact CB-SD 4.37Å; L95-M174 HydrophobicContact CD1-SD 3.78Å; F98-M174 HydrophobicContact CB-CE 4.23Å; F98-M174 HydrophobicContact CD1-CG 4.47Å; F98-M174 HydrophobicContact CD2-CB 4.3Å; F98-M174 HydrophobicContact CD2-CE 3.74Å; F98-M174 HydrophobicContact CD2-CG 4.27Å; F98-M174 HydrophobicContact CE2-CB 3.92Å; F98-M174 HydrophobicContact CE2-CE 4.37Å; F98-M174 HydrophobicContact CE2-CG 4.28Å; F98-M174 WeakPolarHBondContact CE2-O 3.4Å; F98-M174 HydrophobicContact CG-CE 4.12Å; F98-M174 HydrophobicContact CG-CG 4.36Å; F98-M174 HydrophobicContact CZ-CB 4.15Å; F98-M174 HydrophobicContact CZ-CG 4.42Å; H172-M174 PolarHBondContact O-N 3.14Å
175	K	88.9	Confident	78.8	Confident	70 Å²	70	61.9 Å²	61.9	30%	0.304	34%	0.344	S	S	.	.			trans	-96.1	135.8	173.8	-66.3	-162	178.2	-174.4	0	112.3	L169 F173 L210	L169-K175 PolarHBondContact N-O 2.95Å; F173-K175 PolarHBondContact O-N 3.35Å; K175-L210 HydrophobicContact CB-CD1 4.29Å; K175-L210 HydrophobicContact CD-CD1 4.23Å; K175-L210 HydrophobicContact CD-CD2 4.14Å
176	I	92.6	Very high	76.4	Confident	0 Å²	0	65.4 Å²	65.4	0%	0	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	128.4	179.8	-56.9	174.9	0	0	0	108.7	F93 F98 T101 V102 L105 V166 L211	F93-I176 HydrophobicContact CE1-CD1 4.19Å; F93-I176 HydrophobicContact CE2-CD1 4.14Å; F93-I176 HydrophobicContact CZ-CD1 3.78Å; F98-I176 HydrophobicContact CE2-CD1 3.78Å; F98-I176 HydrophobicContact CE2-CG1 3.74Å; F98-I176 HydrophobicContact CZ-CD1 4.23Å; F98-I176 HydrophobicContact CZ-CG1 3.77Å; T101-I176 HydrophobicContact CG2-CD1 4.46Å; V102-I176 HydrophobicContact CG2-CD1 3.72Å; V102-I176 HydrophobicContact CG2-CG1 3.95Å; L105-I176 HydrophobicContact CD1-CD1 3.81Å; L105-I176 HydrophobicContact CD1-CG2 4.31Å; V166-I176 HydrophobicContact CG1-CG2 3.67Å; I176-L211 HydrophobicContact CB-CB 4.24Å; I176-L211 HydrophobicContact CG2-CB 4.18Å; I176-L211 HydrophobicContact CG2-CD1 4.27Å; I176-L211 PolarHBondContact O-N 3.32Å
177	V	90.7	Very high	73.8	Confident	10 Å²	10	73 Å²	73	6%	0.061	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	139.7	174.9	155.1	0	0	0	0	111.1	V166 K167 L169 D179 V208 L210	V166-V177 WeakPolarHBondContact CA-O 3.46Å; K167-V177 PolarHBondContact N-O 3.28Å; K167-V177 PolarHBondContact O-N 3.43Å; L169-V177 HydrophobicContact CD1-CB 3.75Å; L169-V177 HydrophobicContact CD1-CG2 3.12Å; V177-D179 HydrophobicContact CG1-CB 4.23Å; V177-V208 HydrophobicContact CG1-CG1 3.5Å; V177-V208 VanDerWaalsContact CG1-CG1 3.5Å; V177-L210 HydrophobicContact CG2-CD1 3.82Å
178	Y	90.3	Very high	71.1	Confident	11 Å²	11	76.4 Å²	76.4	4%	0.043	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	112.4	170.2	176.6	-125.6	0	0	0	109.6	K110 N163 G164 V166 R180 V208 S209	K110-Y178 HydrophobicContact CB-CE1 4.49Å; K110-Y178 HydrophobicContact CD-CE2 4.2Å; K110-Y178 HydrophobicContact CG-CD2 4.48Å; K110-Y178 HydrophobicContact CG-CE1 4.34Å; K110-Y178 HydrophobicContact CG-CE2 4.14Å; N163-Y178 WeakPolarHBondContact CA-OH 3.46Å; G164-Y178 VanDerWaalsContact N-CE2 3.28Å; G164-Y178 PolarHBondContact N-OH 2.96Å; V166-Y178 HydrophobicContact CG2-CD2 3.63Å; V166-Y178 HydrophobicContact CG2-CE2 4.34Å; V166-Y178 HydrophobicContact CG2-CG 4.47Å; Y178-R180 HydrophobicContact CE1-CG 3.78Å; Y178-R180 HydrophobicContact CE2-CG 4.32Å; Y178-R180 WeakPolarHBondContact OH-CD 3.12Å; Y178-R180 WeakPolarHBondContact OH-CG 3.39Å; Y178-V208 WeakPolarHBondContact O-CA 3.41Å; Y178-S209 WeakPolarHBondContact CD1-OG 3.28Å; Y178-S209 PolarHBondContact N-O 3.35Å; Y178-S209 PolarHBondContact O-N 3Å; Y178-S209 PolarHBondContact O-OG 3.07Å
179	D	87.3	Confident	68.7	Low	18 Å²	18	80.6 Å²	80.6	10%	0.096	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	110.9	-172.1	174.1	6	0	0	0	110.8	G164 K165 V177 S181 V208	G164-D179 CarbonylContact C-O 3.57Å; G164-D179 WeakPolarHBondContact CA-O 2.98Å; K165-D179 PolarHBondContact N-O 2.89Å; K165-D179 PolarHBondContact O-N 2.94Å; V177-D179 HydrophobicContact CG1-CB 4.23Å; D179-S181 VanDerWaalsContact OD1-CB 3.29Å; D179-S181 WeakPolarHBondContact OD1-CB 3.5Å; D179-S181 PolarHBondContact OD1-N 3.45Å; D179-S181 PolarHBondContact OD1-OG 3.42Å; D179-V208 HydrophobicContact CB-CG1 4.41Å; D179-V208 HydrophobicContact CB-CG2 4.27Å
180	R	80	Confident	66.6	Low	74 Å²	74	87.7 Å²	87.7	28%	0.279	46%	0.46	S	S	.	.			trans	-96.1	-5.9	175.6	-77.1	176.1	66.5	-179.1	-6.9	114	Y161 Y178 K182 T183 D207	Y161-R180 PolarHBondContact OH-NH1 3.04Å; Y178-R180 HydrophobicContact CE1-CG 3.78Å; Y178-R180 HydrophobicContact CE2-CG 4.32Å; Y178-R180 WeakPolarHBondContact OH-CD 3.12Å; Y178-R180 WeakPolarHBondContact OH-CG 3.39Å; R180-K182 PolarHBondContact O-N 3.18Å; R180-K182 VanDerWaalsContact O-N 3.12Å; R180-T183 PolarHBondContact O-N 3.4Å; R180-T183 PolarHBondContact O-OG1 2.94Å; R180-D207 HydrophobicContact CB-CB 3.86Å; R180-D207 PolarHBondContact N-O 3.13Å
181	S	70.7	Confident	64.9	Low	44 Å²	44	89.4 Å²	89.4	31%	0.308	46%	0.463	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-31.8	-169.6	65.9	0	0	0	0	113.7	D179	D179-S181 VanDerWaalsContact OD1-CB 3.29Å; D179-S181 WeakPolarHBondContact OD1-CB 3.5Å; D179-S181 PolarHBondContact OD1-N 3.45Å; D179-S181 PolarHBondContact OD1-OG 3.42Å
182	K	64	Low	63.3	Low	176 Å²	176	94.6 Å²	94.6	77%	0.765	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.7	-11.7	-179.1	-66.6	-168.3	177.2	-170	0	115	R180	R180-K182 PolarHBondContact O-N 3.18Å; R180-K182 VanDerWaalsContact O-N 3.12Å
183	T	58.3	Low	61.4	Low	50 Å²	50	93.2 Å²	93.2	31%	0.307	47%	0.468	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.1	-13.6	-173.8	25.8	0	0	0	0	113.2	T154 V162 R180	T154-T183 HydrophobicContact CG2-CG2 3.96Å; V162-T183 HydrophobicContact CG1-CG2 4.31Å; R180-T183 PolarHBondContact O-N 3.4Å; R180-T183 PolarHBondContact O-OG1 2.94Å
184	S	49.1	Very low	59.5	Low	60 Å²	60	102.1 Å²	102.1	42%	0.42	51%	0.51	S	S	.	.	S	Bend	trans	-93.5	118.8	179.1	-160	0	0	0	0	111	K186	S184-K186 PolarHBondContact O-N 3.2Å
185	S	41.1	Very low	57.8	Low	110 Å²	110	106.7 Å²	106.7	77%	0.769	54%	0.544	S	S	*	.			trans	-70.5	85.9	172.2	-56	0	0	0	0	110.2	K187	S185-K187 PolarHBondContact O-N 3.03Å
186	K	39.9	Very low	55.8	Low	219 Å²	219	108.8 Å²	108.8	95%	0.952	56%	0.558	S	S	*	*	S	Bend	trans	39.1	15.1	160.4	-87.1	-170	178.8	-176.8	0	120.1	S184	S184-K186 PolarHBondContact O-N 3.2Å
187	K	35.9	Very low	53.9	Low	170 Å²	170	113.6 Å²	113.6	74%	0.739	59%	0.592	S	S	*	*			trans	-120.2	124.3	-176.6	-90.7	-172.4	173.2	-177.6	0	111.8	S185	S185-K187 PolarHBondContact O-N 3.03Å
188	M	33.7	Very low	52.2	Low	172 Å²	172	121.4 Å²	121.4	85%	0.847	63%	0.627	S	S	*	*			trans	70.2	95.1	154.3	-62.5	174.1	68.7	0	0	117.3
189	V	38.7	Very low	50.3	Low	130 Å²	130	122.8 Å²	122.8	79%	0.788	64%	0.641	S	S	*	*				-151.5	106.7	122.5	-175.7	0	0	0	0	107
190	K	39.2	Very low	48.3	Very low	202 Å²	202	128.1 Å²	128.1	88%	0.878	67%	0.666	S	S	*	*			trans	-114.6	0.6	176.6	-141.5	-176.7	-178.4	-171	0	113.2
191	D	37.6	Very low	46.8	Very low	150 Å²	150	132.2 Å²	132.2	80%	0.802	69%	0.693	S	S	*	*	S	Bend	trans	-115.5	29	-158.9	-63.2	-17	0	0	0	116.2
192	Q	38.9	Very low	45.8	Very low	177 Å²	177	134.8 Å²	134.8	83%	0.827	71%	0.707	S	S	*	*	S	Bend	trans	-139.1	16.6	177.5	-84.7	-160.2	-14.7	0	0	117.7
193	V	40.5	Very low	44.9	Very low	83 Å²	83	132.1 Å²	132.1	50%	0.503	70%	0.697	S	S	.	*			trans	-136.2	81	-178.4	-168	0	0	0	0	111.7
194	E	46	Very low	44.3	Very low	204 Å²	204	135.4 Å²	135.4	95%	0.953	72%	0.717	S	S	*	*	S	Bend	trans	-112.7	-1.4	164.8	-79.4	-170.3	160.5	0	0	113.4
195	S	49.7	Very low	44.4	Very low	111 Å²	111	136.7 Å²	136.7	78%	0.776	72%	0.719	S	S	*	*	S	Bend	trans	-114.7	9	-168.3	40.3	0	0	0	0	116.9
196	N	48.5	Very low	45	Very low	113 Å²	113	136.5 Å²	136.5	60%	0.604	72%	0.718	S	S	*	*			trans	-153.5	113.3	173.2	-121.8	-14.7	0	0	0	113.9	E198 A199	N196-E198 PolarHBondContact O-N 3.13Å; N196-A199 HydrophobicContact CB-CB 4.5Å; N196-A199 PolarHBondContact O-N 3.31Å
197	S	52.8	Low	46.1	Very low	101 Å²	101	128.6 Å²	128.6	71%	0.706	69%	0.686	S	S	*	*	G	3₁₀ helix	trans	-70.9	-23.8	-176.9	48	0	0	0	0	114	A199	S197-A199 VanDerWaalsContact C-N 3.31Å; S197-A199 PolarHBondContact O-N 2.8Å
198	E	54.3	Low	48	Very low	174 Å²	174	122.8 Å²	122.8	81%	0.813	67%	0.665	S	S	*	*	G	3₁₀ helix	trans	-74.7	-18.1	177	-65.9	-172.9	158.9	0	0	113.5	N196 Q200	N196-E198 PolarHBondContact O-N 3.13Å; E198-Q200 PolarHBondContact O-N 3.24Å
199	A	50.1	Low	50.4	Low	40 Å²	40	117.2 Å²	117.2	33%	0.331	64%	0.643	S	S	.	*	G	3₁₀ helix	trans	-82.6	-8.7	-176.9	0	0	0	0	0	114.3	N196 S197 N201 V202	N196-A199 HydrophobicContact CB-CB 4.5Å; N196-A199 PolarHBondContact O-N 3.31Å; S197-A199 VanDerWaalsContact C-N 3.31Å; S197-A199 PolarHBondContact O-N 2.8Å; A199-N201 VanDerWaalsContact C-N 3.31Å; A199-N201 PolarHBondContact O-N 3.12Å; A199-V202 PolarHBondContact O-N 3.03Å
200	Q	46.2	Very low	52.7	Low	130 Å²	130	115.5 Å²	115.5	61%	0.607	63%	0.629	S	S	*	*	G	3₁₀ helix	trans	-63	-32.4	-176.6	-84.9	-177.3	-15.2	0	0	113.5	E198 V202 Q203	E198-Q200 PolarHBondContact O-N 3.24Å; Q200-V202 PolarHBondContact O-N 3.11Å; Q200-Q203 PolarHBondContact O-N 3.32Å
201	N	47.7	Very low	55.1	Low	160 Å²	160	106.7 Å²	106.7	86%	0.856	59%	0.591	S	S	*	*	G	3₁₀ helix	trans	-74	-12.2	176.6	-76.8	-25.1	0	0	0	113.8	A199	A199-N201 VanDerWaalsContact C-N 3.31Å; A199-N201 PolarHBondContact O-N 3.12Å
202	V	50.7	Low	57.7	Low	98 Å²	98	102.2 Å²	102.2	59%	0.594	57%	0.567	S	S	*	*	G	3₁₀ helix	trans	-95	-7.7	-178.6	-171.3	0	0	0	0	112.2	A199 Q200 T204 N205	A199-V202 PolarHBondContact O-N 3.03Å; Q200-V202 PolarHBondContact O-N 3.11Å; V202-T204 PolarHBondContact O-N 3.04Å; V202-N205 PolarHBondContact O-N 3.33Å; V202-N205 VanDerWaalsContact O-N 3.08Å
203	Q	43.1	Very low	60.3	Low	120 Å²	120	94.1 Å²	94.1	56%	0.561	53%	0.53	S	S	*	.	G	3₁₀ helix	trans	-57.3	-13.4	-175.2	-85.2	-178.9	-16	0	0	115.7	Q200 N205	Q200-Q203 PolarHBondContact O-N 3.32Å; Q203-N205 VanDerWaalsContact C-N 3.26Å; Q203-N205 PolarHBondContact O-N 2.97Å
204	T	46.9	Very low	62.8	Low	120 Å²	120	93.6 Å²	93.6	74%	0.736	52%	0.524	S	S	*	.	G	3₁₀ helix	trans	-76.3	-7.2	175.4	52	0	0	0	0	114.3	V202	V202-T204 PolarHBondContact O-N 3.04Å
205	N	51.7	Low	65.1	Low	87 Å²	87	85.5 Å²	85.5	47%	0.465	49%	0.492	S	S	.	.	G	3₁₀ helix	trans	-129	15.9	-168	-87.3	-26.8	0	0	0	116.6	V202 Q203 D207 V208	V202-N205 PolarHBondContact O-N 3.33Å; V202-N205 VanDerWaalsContact O-N 3.08Å; Q203-N205 VanDerWaalsContact C-N 3.26Å; Q203-N205 PolarHBondContact O-N 2.97Å; N205-D207 PolarHBondContact O-N 2.64Å; N205-V208 HydrophobicContact CB-CG2 4.22Å; N205-V208 WeakPolarHBondContact O-CB 3.47Å; N205-V208 PolarHBondContact O-N 3.2Å
206	S	52	Low	67.2	Low	106 Å²	106	80.2 Å²	80.2	74%	0.741	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	-21.1	-176.6	52.6	0	0	0	0	115.1
207	D	64.5	Low	69.4	Low	52 Å²	52	75.3 Å²	75.3	28%	0.278	43%	0.429	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88	7.3	176.2	-92.9	-22.2	0	0	0	114.7	R180 N205	R180-D207 HydrophobicContact CB-CB 3.86Å; R180-D207 PolarHBondContact N-O 3.13Å; N205-D207 PolarHBondContact O-N 2.64Å
208	V	75.5	Confident	71.4	Confident	49 Å²	49	74.5 Å²	74.5	30%	0.297	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	113.9	179.1	-172	0	0	0	0	109.9	V177 Y178 D179 N205	V177-V208 HydrophobicContact CG1-CG1 3.5Å; V177-V208 VanDerWaalsContact CG1-CG1 3.5Å; Y178-V208 WeakPolarHBondContact O-CA 3.41Å; D179-V208 HydrophobicContact CB-CG1 4.41Å; D179-V208 HydrophobicContact CB-CG2 4.27Å; N205-V208 HydrophobicContact CB-CG2 4.22Å; N205-V208 WeakPolarHBondContact O-CB 3.47Å; N205-V208 PolarHBondContact O-N 3.2Å
209	S	84.5	Confident	73.3	Confident	55 Å²	55	66.8 Å²	66.8	39%	0.385	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	148.9	-179.6	55.5	0	0	0	0	112	Y178	Y178-S209 WeakPolarHBondContact CD1-OG 3.28Å; Y178-S209 PolarHBondContact N-O 3.35Å; Y178-S209 PolarHBondContact O-N 3Å; Y178-S209 PolarHBondContact O-OG 3.07Å
210	L	86.9	Confident	75.4	Confident	94 Å²	94	64.9 Å²	64.9	49%	0.492	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	124.8	174.4	-154.8	97.7	0	0	0	109.6	K175 V177 N212	K175-L210 HydrophobicContact CB-CD1 4.29Å; K175-L210 HydrophobicContact CD-CD1 4.23Å; K175-L210 HydrophobicContact CD-CD2 4.14Å; V177-L210 HydrophobicContact CG2-CD1 3.82Å; L210-N212 PolarHBondContact O-N 3.47Å
211	L	90	Very high	77.7	Confident	16 Å²	16	63.3 Å²	63.3	8%	0.084	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	106	173.4	-75.6	167.8	0	0	0	109.3	L105 I176 A215 L219	L105-L211 HydrophobicContact CD1-CD1 4.33Å; L105-L211 HydrophobicContact CD2-CD1 4.49Å; I176-L211 HydrophobicContact CB-CB 4.24Å; I176-L211 HydrophobicContact CG2-CB 4.18Å; I176-L211 HydrophobicContact CG2-CD1 4.27Å; I176-L211 PolarHBondContact O-N 3.32Å; L211-A215 HydrophobicContact CD2-CB 4.29Å; L211-L219 HydrophobicContact CD2-CD1 4.11Å
212	N	91.3	Very high	79.9	Confident	57 Å²	57	62.3 Å²	62.3	31%	0.305	34%	0.344	S	S	.	.			trans	-82.5	166.4	173.6	69.2	9.1	0	0	0	111.2	L210 L214 A215 A216 W301	L210-N212 PolarHBondContact O-N 3.47Å; N212-L214 VanDerWaalsContact C-N 3.28Å; N212-L214 PolarHBondContact O-N 3.12Å; N212-A215 PolarHBondContact O-N 2.95Å; N212-A215 WeakPolarHBondContact OD1-CB 3.43Å; N212-A215 PolarHBondContact OD1-N 2.87Å; N212-A216 PolarHBondContact O-N 3.08Å; N212-W301 HydrophobicContact CB-CH2 3.78Å; N212-W301 HydrophobicContact CB-CZ3 3.97Å
213	P	93.5	Very high	81.9	Confident	6 Å²	6	58 Å²	58	4%	0.039	32%	0.318	C	S	.	.	H	α-helix	trans	-57.2	-38.1	-179.2	-24.5	30.4	0	0	0	114	P91 F93 A216 L217 I244 W301	P91-P213 HydrophobicContact CB-CB 4.5Å; P91-P213 HydrophobicContact CG-CB 4.48Å; P91-P213 VanDerWaalsContact O-CB 3.25Å; P91-P213 WeakPolarHBondContact O-CB 3.33Å; F93-P213 HydrophobicContact CD1-CB 4.3Å; F93-P213 HydrophobicContact CD1-CG 4.36Å; F93-P213 HydrophobicContact CD2-CB 4.5Å; F93-P213 HydrophobicContact CD2-CG 3.71Å; F93-P213 HydrophobicContact CE1-CB 4.19Å; F93-P213 HydrophobicContact CE1-CG 4.33Å; F93-P213 HydrophobicContact CE2-CB 4.38Å; F93-P213 HydrophobicContact CE2-CG 3.67Å; F93-P213 HydrophobicContact CG-CB 4.44Å; F93-P213 HydrophobicContact CG-CG 4.05Å; F93-P213 HydrophobicContact CZ-CB 4.22Å; F93-P213 HydrophobicContact CZ-CG 3.98Å; P213-A216 PolarHBondContact O-N 3.14Å; P213-L217 WeakPolarHBondContact O-CB 3.15Å; P213-L217 PolarHBondContact O-N 2.88Å; P213-I244 HydrophobicContact CB-CG2 4.31Å; P213-I244 WeakPolarHBondContact O-CD1 3.48Å; P213-W301 HydrophobicContact CB-CZ2 3.92Å; P213-W301 HydrophobicContact CG-CH2 4.34Å; P213-W301 HydrophobicContact CG-CZ2 3.7Å
214	L	93.7	Very high	84.2	Confident	73 Å²	73	54.5 Å²	54.5	38%	0.382	31%	0.306	S	S	.	.	H	α-helix	trans	-65.4	-45.3	-179.8	-168.6	71.3	0	0	0	111.4	P91 N212 L217 N218 W301	P91-L214 HydrophobicContact CG-CB 4.14Å; P91-L214 HydrophobicContact CG-CD1 3.65Å; N212-L214 VanDerWaalsContact C-N 3.28Å; N212-L214 PolarHBondContact O-N 3.12Å; L214-L217 PolarHBondContact O-N 3.46Å; L214-N218 PolarHBondContact O-N 3.33Å; L214-W301 HydrophobicContact CB-CH2 4.11Å
215	A	92.8	Very high	86.2	Confident	33 Å²	33	53.6 Å²	53.6	27%	0.273	30%	0.304	S	S	.	.	H	α-helix	trans	-63.4	-42.4	174.9	0	0	0	0	0	111.7	L211 N212 L217 N218 L219	L211-A215 HydrophobicContact CD2-CB 4.29Å; N212-A215 PolarHBondContact O-N 2.95Å; N212-A215 WeakPolarHBondContact OD1-CB 3.43Å; N212-A215 PolarHBondContact OD1-N 2.87Å; A215-L217 VanDerWaalsContact C-N 3.34Å; A215-L217 PolarHBondContact O-N 3.26Å; A215-N218 PolarHBondContact O-N 3.25Å; A215-L219 WeakPolarHBondContact O-CG 3.43Å; A215-L219 PolarHBondContact O-N 3.4Å
216	A	94.2	Very high	87.9	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-63.2	-39.5	176.2	0	0	0	0	0	112.1	F93 L105 N212 P213 L219 F220 I244	F93-A216 HydrophobicContact CE1-CB 3.84Å; F93-A216 HydrophobicContact CZ-CB 4.18Å; L105-A216 HydrophobicContact CD1-CB 4.29Å; L105-A216 HydrophobicContact CD2-CB 4.49Å; N212-A216 PolarHBondContact O-N 3.08Å; P213-A216 PolarHBondContact O-N 3.14Å; A216-L219 WeakPolarHBondContact O-CB 3.38Å; A216-L219 PolarHBondContact O-N 3.12Å; A216-F220 WeakPolarHBondContact O-CB 3.41Å; A216-F220 WeakPolarHBondContact O-CD1 3.32Å; A216-F220 WeakPolarHBondContact O-CG 3.48Å; A216-F220 PolarHBondContact O-N 3.24Å; A216-I244 HydrophobicContact CB-CD1 3.61Å
217	L	94.6	Very high	89.7	Confident	11 Å²	11	47.1 Å²	47.1	6%	0.058	27%	0.273	C	S	.	.	H	α-helix	trans	-62.8	-46.3	176.2	179.3	62.2	0	0	0	111.3	P91 P213 L214 A215 L219 F220 L221 I244 Q246	P91-L217 HydrophobicContact CB-CD2 4.27Å; P91-L217 HydrophobicContact CG-CD2 4.26Å; P213-L217 WeakPolarHBondContact O-CB 3.15Å; P213-L217 PolarHBondContact O-N 2.88Å; L214-L217 PolarHBondContact O-N 3.46Å; A215-L217 VanDerWaalsContact C-N 3.34Å; A215-L217 PolarHBondContact O-N 3.26Å; L217-L219 VanDerWaalsContact C-N 3.26Å; L217-L219 PolarHBondContact O-N 3.34Å; L217-F220 PolarHBondContact O-N 3.38Å; L217-F220 VanDerWaalsContact O-N 3.11Å; L217-L221 HydrophobicContact CD1-CD1 4.39Å; L217-L221 HydrophobicContact CD1-CG 4.36Å; L217-L221 HydrophobicContact CG-CD1 4.19Å; L217-L221 WeakPolarHBondContact O-CG 3.29Å; L217-L221 PolarHBondContact O-N 3.04Å; L217-I244 HydrophobicContact CB-CD1 4.06Å; L217-I244 HydrophobicContact CB-CG2 4.4Å; L217-I244 HydrophobicContact CD1-CB 4.38Å; L217-Q246 HydrophobicContact CD2-CG 4.23Å
218	N	94.8	Very high	91	Very high	83 Å²	83	45.5 Å²	45.5	44%	0.444	26%	0.264	S	S	.	.	H	α-helix	trans	-63.9	-29.8	176.9	-73.6	-20.9	0	0	0	113.1	L214 A215 R222	L214-N218 PolarHBondContact O-N 3.33Å; A215-N218 PolarHBondContact O-N 3.25Å; N218-R222 WeakPolarHBondContact O-CG 3.37Å; N218-R222 PolarHBondContact O-NE 3.44Å
219	L	95	Very high	91.6	Very high	12 Å²	12	44 Å²	44	6%	0.063	26%	0.256	C	S	.	.	H	α-helix	trans	-71.5	-44.5	170.8	-70.7	168.7	0	0	0	111.1	L105 I108 K110 L211 A215 A216 L217 L221 R222	L105-L219 HydrophobicContact CD2-CD1 3.91Å; I108-L219 HydrophobicContact CD1-CB 4.32Å; K110-L219 WeakPolarHBondContact O-CD2 3.28Å; L211-L219 HydrophobicContact CD2-CD1 4.11Å; A215-L219 WeakPolarHBondContact O-CG 3.43Å; A215-L219 PolarHBondContact O-N 3.4Å; A216-L219 WeakPolarHBondContact O-CB 3.38Å; A216-L219 PolarHBondContact O-N 3.12Å; L217-L219 VanDerWaalsContact C-N 3.26Å; L217-L219 PolarHBondContact O-N 3.34Å; L219-L221 PolarHBondContact O-N 2.94Å; L219-R222 PolarHBondContact O-N 2.97Å
220	F	94.4	Very high	91.9	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-66.1	-36.2	-177.4	-72	-1.5	0	0	0	113.2	T101 I104 L105 I108 A216 L217 R222 I223 H239 P240 I244	T101-F220 HydrophobicContact CG2-CE2 3.84Å; T101-F220 HydrophobicContact CG2-CZ 3.71Å; I104-F220 HydrophobicContact CB-CE1 4.06Å; I104-F220 HydrophobicContact CB-CZ 4.06Å; I104-F220 HydrophobicContact CD1-CZ 4.46Å; I104-F220 HydrophobicContact CG2-CD1 4.1Å; I104-F220 HydrophobicContact CG2-CE1 3.48Å; I104-F220 VanDerWaalsContact CG2-CE1 3.48Å; I104-F220 HydrophobicContact CG2-CZ 3.96Å; L105-F220 HydrophobicContact CD2-CE1 3.7Å; L105-F220 HydrophobicContact CD2-CZ 4.31Å; L105-F220 HydrophobicContact CG-CE1 3.86Å; L105-F220 HydrophobicContact CG-CZ 4.05Å; I108-F220 HydrophobicContact CD1-CD1 4.35Å; I108-F220 HydrophobicContact CD1-CE1 4.43Å; A216-F220 WeakPolarHBondContact O-CB 3.41Å; A216-F220 WeakPolarHBondContact O-CD1 3.32Å; A216-F220 WeakPolarHBondContact O-CG 3.48Å; A216-F220 PolarHBondContact O-N 3.24Å; L217-F220 PolarHBondContact O-N 3.38Å; L217-F220 VanDerWaalsContact O-N 3.11Å; F220-R222 PolarHBondContact O-N 3.4Å; F220-I223 HydrophobicContact CB-CD1 4.48Å; F220-I223 HydrophobicContact CD1-CD1 3.98Å; F220-I223 PolarHBondContact O-N 3.01Å; F220-H239 PolarHBondContact O-CE1 3.03Å; F220-H239 VanDerWaalsContact O-CE1 3.31Å; F220-P240 HydrophobicContact CB-CB 4.02Å; F220-P240 HydrophobicContact CD1-CB 4.5Å; F220-P240 HydrophobicContact CD2-CB 4.15Å; F220-P240 WeakPolarHBondContact CD2-O 3.43Å; F220-P240 HydrophobicContact CG-CB 3.99Å; F220-I244 HydrophobicContact CD2-CD1 4.05Å; F220-I244 HydrophobicContact CD2-CG1 4.27Å; F220-I244 HydrophobicContact CE2-CD1 4.09Å; F220-I244 HydrophobicContact CE2-CG1 4.24Å
221	L	92.9	Very high	92.1	Very high	98 Å²	98	37 Å²	37	51%	0.513	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-24	175	-71.8	170	0	0	0	113.4	L217 L219	L217-L221 HydrophobicContact CD1-CD1 4.39Å; L217-L221 HydrophobicContact CD1-CG 4.36Å; L217-L221 HydrophobicContact CG-CD1 4.19Å; L217-L221 WeakPolarHBondContact O-CG 3.29Å; L217-L221 PolarHBondContact O-N 3.04Å; L219-L221 PolarHBondContact O-N 2.94Å
222	R	94.4	Very high	92	Very high	138 Å²	138	36.4 Å²	36.4	52%	0.521	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.9	2.8	-179.3	-68.1	-170.8	-66.1	144.9	-2.6	113.7	N111 C113 N218 L219 F220 P224	N111-R222 PolarHBondContact O-NH1 3.43Å; C113-R222 HydrophobicContact CB-CB 4.02Å; C113-R222 WeakPolarHBondContact CB-O 3.33Å; N218-R222 WeakPolarHBondContact O-CG 3.37Å; N218-R222 PolarHBondContact O-NE 3.44Å; L219-R222 PolarHBondContact O-N 2.97Å; F220-R222 PolarHBondContact O-N 3.4Å; R222-P224 WeakPolarHBondContact O-CD 3.42Å
223	I	93.1	Very high	91.8	Very high	7 Å²	7	34 Å²	34	4%	0.036	20%	0.198	C	C	.	.	S	Bend	trans	-68.5	127.1	176.6	-64	173.6	0	0	0	108.9	I104 I108 C113 F220 D227 I228 L231 P240	I104-I223 HydrophobicContact CG2-CD1 4.04Å; I108-I223 HydrophobicContact CD1-CD1 4.11Å; I108-I223 HydrophobicContact CD1-CG1 4.28Å; I108-I223 HydrophobicContact CG2-CD1 4.15Å; I108-I223 HydrophobicContact CG2-CG1 4.41Å; C113-I223 HydrophobicContact CB-CG1 4.28Å; F220-I223 HydrophobicContact CB-CD1 4.48Å; F220-I223 HydrophobicContact CD1-CD1 3.98Å; F220-I223 PolarHBondContact O-N 3.01Å; I223-D227 HydrophobicContact CG2-CB 4.33Å; I223-I228 HydrophobicContact CG2-CG1 4.36Å; I223-L231 HydrophobicContact CD1-CD1 4.19Å; I223-L231 HydrophobicContact CG2-CD1 4.47Å; I223-P240 HydrophobicContact CD1-CB 3.96Å; I223-P240 HydrophobicContact CD1-CG 3.96Å
224	P	91.9	Very high	91	Very high	48 Å²	48	35.5 Å²	35.5	31%	0.312	21%	0.209	S	C	.	.			trans	-60.3	138.3	176.8	-22.8	32.9	0	0	0	112.2	R222 G226 D227	R222-P224 WeakPolarHBondContact O-CD 3.42Å; P224-G226 PolarHBondContact O-N 3.14Å; P224-D227 WeakPolarHBondContact O-CB 3.4Å; P224-D227 PolarHBondContact O-N 3.01Å
225	S	88.3	Confident	89.8	Confident	101 Å²	101	40.1 Å²	40.1	71%	0.706	22%	0.221	S	C	*	.	G	3₁₀ helix	trans	-59.5	-33.4	-177.3	-33.8	0	0	0	0	113.1	D227 I228	S225-D227 PolarHBondContact O-N 3.48Å; S225-I228 PolarHBondContact O-N 3.49Å
226	G	87.5	Confident	88.7	Confident	49 Å²	49	43 Å²	43	51%	0.505	25%	0.254	S	S	.	.	G	3₁₀ helix	trans	-67.2	-16.4	175.8	0	0	0	0	0	114.5	P224	P224-G226 PolarHBondContact O-N 3.14Å
227	D	90.6	Very high	87.5	Confident	8 Å²	8	44.5 Å²	44.5	4%	0.043	26%	0.264	C	S	.	.	G	3₁₀ helix	trans	-94.6	-19.1	-178.4	-70.9	22.8	0	0	0	112.4	V115 K122 I223 P224 S225 P229 L230	V115-D227 HydrophobicContact CG2-CB 3.92Å; V115-D227 PolarHBondContact N-OD2 3.33Å; K122-D227 VanDerWaalsContact CE-CG 3.5Å; K122-D227 WeakPolarHBondContact CE-OD1 3.4Å; K122-D227 IonicContact NZ-OD1 2.95Å; K122-D227 PolarHBondContact NZ-OD1 2.93Å; K122-D227 IonicContact NZ-OD2 3.91Å; K122-D227 PolarHBondContact NZ-OD2 3.32Å; I223-D227 HydrophobicContact CG2-CB 4.33Å; P224-D227 WeakPolarHBondContact O-CB 3.4Å; P224-D227 PolarHBondContact O-N 3.01Å; S225-D227 PolarHBondContact O-N 3.48Å; D227-P229 VanDerWaalsContact C-CD 3.47Å; D227-L230 VanDerWaalsContact O-CB 3.31Å; D227-L230 WeakPolarHBondContact O-CB 3.48Å; D227-L230 PolarHBondContact O-N 3.15Å
228	I	90.5	Very high	86.7	Confident	18 Å²	18	44.6 Å²	44.6	9%	0.092	27%	0.268	C	S	.	.	G	3₁₀ helix	trans	-54.9	-43.3	-178.7	-61.4	174.7	0	0	0	112.4	I223 S225 L230 L231 M233	I223-I228 HydrophobicContact CG2-CG1 4.36Å; S225-I228 PolarHBondContact O-N 3.49Å; I228-L230 PolarHBondContact O-N 3.45Å; I228-L231 WeakPolarHBondContact O-CB 3.12Å; I228-L231 PolarHBondContact O-N 2.94Å; I228-M233 HydrophobicContact CG2-CB 3.99Å
229	P	88.5	Confident	86.4	Confident	18 Å²	18	43 Å²	43	12%	0.117	26%	0.258	C	S	.	.	G	3₁₀ helix	trans	-59.2	-30.6	177.2	-24.8	35.3	0	0	0	113.6	L126 L129 D227 L231 V232 R235	L126-P229 HydrophobicContact CD2-CB 3.88Å; L126-P229 HydrophobicContact CD2-CG 4.43Å; L129-P229 WeakPolarHBondContact CD1-O 3.26Å; D227-P229 VanDerWaalsContact C-CD 3.47Å; P229-L231 VanDerWaalsContact C-N 3.26Å; P229-L231 PolarHBondContact O-N 2.93Å; P229-V232 VanDerWaalsContact O-CA 3.32Å; P229-V232 WeakPolarHBondContact O-CA 3.34Å; P229-V232 PolarHBondContact O-N 2.8Å; P229-R235 HydrophobicContact CG-CG 4.05Å
230	L	90.5	Very high	86.2	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	26%	0.255	C	S	.	.	G	3₁₀ helix	trans	-70.5	-23.2	177.8	-64.7	159.4	0	0	0	112.9	L117 K122 L126 I146 D227 I228 V232	L117-L230 HydrophobicContact CD1-CD2 4.37Å; K122-L230 HydrophobicContact CD-CD1 4.06Å; K122-L230 HydrophobicContact CG-CD1 3.37Å; K122-L230 HydrophobicContact CG-CD2 4.41Å; K122-L230 HydrophobicContact CG-CG 4.48Å; L126-L230 HydrophobicContact CD2-CD2 4.22Å; L126-L230 HydrophobicContact CD2-CG 4.1Å; L126-L230 HydrophobicContact CG-CD2 3.85Å; L126-L230 HydrophobicContact CG-CG 4.12Å; I146-L230 WeakPolarHBondContact CD1-O 3.4Å; D227-L230 VanDerWaalsContact O-CB 3.31Å; D227-L230 WeakPolarHBondContact O-CB 3.48Å; D227-L230 PolarHBondContact O-N 3.15Å; I228-L230 PolarHBondContact O-N 3.45Å; L230-V232 PolarHBondContact O-N 3.49Å
231	L	90.9	Very high	86.1	Confident	2 Å²	2	42.9 Å²	42.9	1%	0.01	26%	0.258	C	S	.	.	G	3₁₀ helix	trans	-78.4	-0.9	169.2	-56.9	177.3	0	0	0	112	I104 V115 Y143 I223 I228 P229 M233 P240 Y1338	I104-L231 HydrophobicContact CG1-CD1 4.34Å; I104-L231 HydrophobicContact CG1-CD2 4.45Å; I104-L231 HydrophobicContact CG2-CD1 3.96Å; I104-L231 HydrophobicContact CG2-CD2 4.42Å; V115-L231 HydrophobicContact CG2-CD2 4.05Å; V115-L231 HydrophobicContact CG2-CG 4.41Å; Y143-L231 WeakPolarHBondContact CE2-O 3.24Å; I223-L231 HydrophobicContact CD1-CD1 4.19Å; I223-L231 HydrophobicContact CG2-CD1 4.47Å; I228-L231 WeakPolarHBondContact O-CB 3.12Å; I228-L231 PolarHBondContact O-N 2.94Å; P229-L231 VanDerWaalsContact C-N 3.26Å; P229-L231 PolarHBondContact O-N 2.93Å; L231-M233 VanDerWaalsContact C-N 3.34Å; L231-P240 HydrophobicContact CD1-CG 4.03Å; L231-Y1338 PolarHBondContact O-OH 2.91Å
232	V	88.4	Confident	86	Confident	2 Å²	2	39.6 Å²	39.6	1%	0.012	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.7	44.5	177.3	-168	0	0	0	0	111	L129 Q139 Y143 P229 L230 H1339	L129-V232 HydrophobicContact CD1-CG2 4.19Å; L129-V232 HydrophobicContact CD2-CG1 4.43Å; L129-V232 HydrophobicContact CD2-CG2 4Å; Q139-V232 VanDerWaalsContact CD-CG1 3.48Å; Q139-V232 HydrophobicContact CG-CG1 3.43Å; Q139-V232 VanDerWaalsContact CG-CG1 3.43Å; Y143-V232 HydrophobicContact CD2-CB 3.97Å; Y143-V232 HydrophobicContact CD2-CG2 3.75Å; Y143-V232 HydrophobicContact CG-CB 4.25Å; Y143-V232 HydrophobicContact CG-CG2 4.12Å; P229-V232 VanDerWaalsContact O-CA 3.32Å; P229-V232 WeakPolarHBondContact O-CA 3.34Å; P229-V232 PolarHBondContact O-N 2.8Å; L230-V232 PolarHBondContact O-N 3.49Å; V232-H1339 PolarHBondContact O-ND1 3.03Å
233	M	88	Confident	85.9	Confident	7 Å²	7	33 Å²	33	3%	0.034	22%	0.216	C	C	.	.			trans	-108.8	145.7	168.5	-63.1	-174.3	71.3	0	0	109.5	I228 L231 P240 Y1338	I228-M233 HydrophobicContact CG2-CB 3.99Å; L231-M233 VanDerWaalsContact C-N 3.34Å; M233-P240 HydrophobicContact SD-CG 3.97Å; M233-Y1338 HydrophobicContact CG-CE1 4.35Å; M233-Y1338 HydrophobicContact CG-CE2 4.1Å; M233-Y1338 HydrophobicContact SD-CE2 4Å
234	S	76.6	Confident	86	Confident	37 Å²	37	32.9 Å²	32.9	26%	0.259	22%	0.216	S	C	.	.			trans	-70.3	136.2	-176.7	-174.9	0	0	0	0	112.7	G236 S237	S234-G236 PolarHBondContact O-N 3.29Å; S234-S237 PolarHBondContact OG-OG 3.49Å
235	R	68.8	Low	86	Confident	170 Å²	170	31.6 Å²	31.6	64%	0.642	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.6	125.7	179.7	-74.3	-174.5	179.4	-176.9	0.4	110.3	E130 P229 S237	E130-R235 IonicContact OE1-CZ 3.6Å; E130-R235 IonicContact OE1-NH1 4Å; E130-R235 IonicContact OE1-NH2 2.64Å; E130-R235 PolarHBondContact OE1-NH2 2.88Å; P229-R235 HydrophobicContact CG-CG 4.05Å; R235-S237 VanDerWaalsContact C-N 3.3Å; R235-S237 PolarHBondContact O-N 2.66Å
236	G	68.6	Low	86.2	Confident	93 Å²	93	29.9 Å²	29.9	96%	0.959	19%	0.187	S	C	*	.	T	Hydrogen-bonded Turn	trans	82.2	-10.1	171.2	0	0	0	0	0	116.3	S234	S234-G236 PolarHBondContact O-N 3.29Å
237	S	69.8	Low	86.5	Confident	32 Å²	32	28.6 Å²	28.6	22%	0.224	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-123.7	11.8	-177.4	56.2	0	0	0	0	114.9	K19 T21 S234 R235	K19-S237 WeakPolarHBondContact CE-OG 3.38Å; K19-S237 PolarHBondContact NZ-OG 3.45Å; T21-S237 WeakPolarHBondContact CB-O 3.2Å; T21-S237 WeakPolarHBondContact CG2-O 3.31Å; S234-S237 PolarHBondContact OG-OG 3.49Å; R235-S237 VanDerWaalsContact C-N 3.3Å; R235-S237 PolarHBondContact O-N 2.66Å
238	G	76.4	Confident	86.7	Confident	13 Å²	13	28.4 Å²	28.4	13%	0.134	17%	0.166	C	C	.	.			trans	-168.2	131.7	169.8	0	0	0	0	0	111.8
239	H	89.2	Confident	86.8	Confident	49 Å²	49	29.8 Å²	29.8	23%	0.227	18%	0.176	C	C	.	.			trans	-113	146.2	174.8	-167	-96.8	0	0	0	110.1	F220 S241 D242	F220-H239 PolarHBondContact O-CE1 3.03Å; F220-H239 VanDerWaalsContact O-CE1 3.31Å; H239-S241 WeakPolarHBondContact ND1-CB 3.46Å; H239-S241 PolarHBondContact ND1-N 3.2Å; H239-S241 PolarHBondContact ND1-OG 3.33Å; H239-S241 PolarHBondContact O-N 3.17Å; H239-D242 WeakPolarHBondContact CB-OD2 3.43Å; H239-D242 PolarHBondContact N-OD2 3.3Å; H239-D242 WeakPolarHBondContact O-CB 3.37Å; H239-D242 PolarHBondContact O-N 2.95Å
240	P	91.7	Very high	87.1	Confident	0 Å²	0	29 Å²	29	0%	0	17%	0.171	C	C	.	.	G	3₁₀ helix	trans	-53.3	-30.1	177.5	-30	36.7	0	0	0	114.1	I104 F220 I223 L231 M233 D242 L243	I104-P240 HydrophobicContact CD1-CB 4.36Å; F220-P240 HydrophobicContact CB-CB 4.02Å; F220-P240 HydrophobicContact CD1-CB 4.5Å; F220-P240 HydrophobicContact CD2-CB 4.15Å; F220-P240 WeakPolarHBondContact CD2-O 3.43Å; F220-P240 HydrophobicContact CG-CB 3.99Å; I223-P240 HydrophobicContact CD1-CB 3.96Å; I223-P240 HydrophobicContact CD1-CG 3.96Å; L231-P240 HydrophobicContact CD1-CG 4.03Å; M233-P240 HydrophobicContact SD-CG 3.97Å; P240-D242 PolarHBondContact O-N 3.2Å; P240-L243 WeakPolarHBondContact O-CB 3.37Å; P240-L243 WeakPolarHBondContact O-CG 3.25Å; P240-L243 PolarHBondContact O-N 2.89Å
241	S	91.5	Very high	87.3	Confident	11 Å²	11	29.5 Å²	29.5	8%	0.077	17%	0.174	C	C	.	.	G	3₁₀ helix	trans	-61.3	-29.3	175.7	57.4	0	0	0	0	113.7	H239 L243 I244	H239-S241 WeakPolarHBondContact ND1-CB 3.46Å; H239-S241 PolarHBondContact ND1-N 3.2Å; H239-S241 PolarHBondContact ND1-OG 3.33Å; H239-S241 PolarHBondContact O-N 3.17Å; S241-L243 PolarHBondContact O-N 3.44Å; S241-I244 PolarHBondContact O-N 2.88Å; S241-I244 VanDerWaalsContact O-N 3.15Å
242	D	90.6	Very high	87.4	Confident	29 Å²	29	29.6 Å²	29.6	16%	0.155	18%	0.175	C	C	.	.	G	3₁₀ helix	trans	-72.4	-13.6	-175.5	-52.2	-31.9	0	0	0	112	P22 H239 P240 I244	P22-D242 HydrophobicContact CB-CB 4.35Å; P22-D242 HydrophobicContact CG-CB 4.38Å; H239-D242 WeakPolarHBondContact CB-OD2 3.43Å; H239-D242 PolarHBondContact N-OD2 3.3Å; H239-D242 WeakPolarHBondContact O-CB 3.37Å; H239-D242 PolarHBondContact O-N 2.95Å; P240-D242 PolarHBondContact O-N 3.2Å; D242-I244 PolarHBondContact O-N 3.04Å
243	L	92.7	Very high	87.6	Confident	0 Å²	0	29.5 Å²	29.5	0%	0	17%	0.174	C	C	.	.	G	3₁₀ helix	trans	-74.3	-17.2	174.5	-56	168.4	0	0	0	112.4	H94 F97 I104 P240 S241 Y1338	H94-L243 WeakPolarHBondContact CB-O 3.36Å; F97-L243 HydrophobicContact CB-CB 4.24Å; F97-L243 HydrophobicContact CB-CD2 3.86Å; F97-L243 HydrophobicContact CD1-CD2 3.72Å; F97-L243 HydrophobicContact CD2-CD2 4.06Å; F97-L243 HydrophobicContact CE1-CD2 4.26Å; F97-L243 HydrophobicContact CG-CD2 3.61Å; I104-L243 HydrophobicContact CD1-CD1 3.43Å; I104-L243 VanDerWaalsContact CD1-CD1 3.43Å; P240-L243 WeakPolarHBondContact O-CB 3.37Å; P240-L243 WeakPolarHBondContact O-CG 3.25Å; P240-L243 PolarHBondContact O-N 2.89Å; S241-L243 PolarHBondContact O-N 3.44Å; L243-Y1338 HydrophobicContact CD1-CD2 4.03Å; L243-Y1338 HydrophobicContact CD1-CE2 3.81Å; L243-Y1338 HydrophobicContact CD2-CD2 3.82Å; L243-Y1338 HydrophobicContact CD2-CE2 4.44Å
244	I	94.1	Very high	87.6	Confident	4 Å²	4	30.5 Å²	30.5	2%	0.021	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	120.8	176.1	-60	-169	0	0	0	108.2	P91 F93 P213 A216 L217 F220 S241 D242 Q246	P91-I244 HydrophobicContact CB-CG2 3.77Å; F93-I244 HydrophobicContact CD1-CD1 4.26Å; F93-I244 HydrophobicContact CD1-CG1 4.36Å; F93-I244 HydrophobicContact CE1-CD1 4.03Å; P213-I244 HydrophobicContact CB-CG2 4.31Å; P213-I244 WeakPolarHBondContact O-CD1 3.48Å; A216-I244 HydrophobicContact CB-CD1 3.61Å; L217-I244 HydrophobicContact CB-CD1 4.06Å; L217-I244 HydrophobicContact CB-CG2 4.4Å; L217-I244 HydrophobicContact CD1-CB 4.38Å; F220-I244 HydrophobicContact CD2-CD1 4.05Å; F220-I244 HydrophobicContact CD2-CG1 4.27Å; F220-I244 HydrophobicContact CE2-CD1 4.09Å; F220-I244 HydrophobicContact CE2-CG1 4.24Å; S241-I244 PolarHBondContact O-N 2.88Å; S241-I244 VanDerWaalsContact O-N 3.15Å; D242-I244 PolarHBondContact O-N 3.04Å; I244-Q246 PolarHBondContact O-N 2.89Å
245	L	93.1	Very high	88.3	Confident	21 Å²	21	33 Å²	33	11%	0.11	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	122.1	-175.2	-77.2	158.4	0	0	0	110.3	L88 P91 I92 H94 R247 H308	L88-L245 HydrophobicContact CD1-CB 4.33Å; P91-L245 VanDerWaalsContact CA-O 3.29Å; P91-L245 WeakPolarHBondContact CA-O 3.4Å; I92-L245 HydrophobicContact CD1-CD1 4.42Å; I92-L245 HydrophobicContact CG1-CB 3.78Å; I92-L245 HydrophobicContact CG1-CD1 4.23Å; I92-L245 PolarHBondContact N-O 3.06Å; I92-L245 PolarHBondContact O-N 3.1Å; H94-L245 HydrophobicContact CB-CD1 3.81Å; H94-L245 HydrophobicContact CB-CG 4.19Å; L245-R247 WeakPolarHBondContact CD2-O 3.26Å; L245-H308 WeakPolarHBondContact CD1-CE1 3.49Å
246	Q	93	Very high	89.4	Confident	65 Å²	65	24.9 Å²	24.9	30%	0.304	16%	0.159	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	-18.7	166	-61.2	172.5	36	0	0	111.4	L88 P91 L217 I244	L88-Q246 WeakPolarHBondContact CB-O 3.33Å; L88-Q246 PolarHBondContact N-O 2.88Å; P91-Q246 HydrophobicContact CB-CG 4.35Å; L217-Q246 HydrophobicContact CD2-CG 4.23Å; I244-Q246 PolarHBondContact O-N 2.89Å
247	R	93.6	Very high	90.4	Very high	22 Å²	22	22.9 Å²	22.9	8%	0.083	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	135.4	-176.9	177.5	175.6	-77	130	7.7	108.9	H25 F85 L86 D87 L245	H25-R247 PolarHBondContact O-NH1 3.03Å; F85-R247 HydrophobicContact CB-CG 3.95Å; F85-R247 HydrophobicContact CD2-CG 3.95Å; F85-R247 HydrophobicContact CG-CG 4.37Å; L86-R247 CarbonylContact O-C 3.58Å; L86-R247 WeakPolarHBondContact O-CA 3.36Å; D87-R247 VanDerWaalsContact CG-NH2 3.27Å; D87-R247 IonicContact OD1-CZ 2.61Å; D87-R247 IonicContact OD1-NE 3.05Å; D87-R247 PolarHBondContact OD1-NE 2.82Å; D87-R247 IonicContact OD1-NH2 3.03Å; D87-R247 PolarHBondContact OD1-NH2 3.4Å; D87-R247 IonicContact OD2-NH2 2.75Å; D87-R247 PolarHBondContact OD2-NH2 3.35Å; L245-R247 WeakPolarHBondContact CD2-O 3.26Å
248	I	93.4	Very high	91.3	Very high	4 Å²	4	22.3 Å²	22.3	2%	0.021	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	123.7	177	-62.1	172.6	0	0	0	108.5	F85 L86 L88 I92 V250 I277	F85-I248 WeakPolarHBondContact CA-O 3.22Å; L86-I248 HydrophobicContact CB-CB 4.5Å; L86-I248 PolarHBondContact N-O 3.01Å; L86-I248 PolarHBondContact O-N 2.95Å; L88-I248 HydrophobicContact CD1-CD1 4.03Å; L88-I248 HydrophobicContact CD1-CG1 3.87Å; L88-I248 HydrophobicContact CD2-CD1 3.67Å; L88-I248 HydrophobicContact CD2-CG1 4.22Å; L88-I248 HydrophobicContact CG-CD1 4.18Å; L88-I248 HydrophobicContact CG-CG1 4.17Å; I92-I248 HydrophobicContact CD1-CD1 4.36Å; I248-V250 PolarHBondContact O-N 3.4Å; I248-I277 HydrophobicContact CD1-CG2 3.86Å
249	P	93.5	Very high	91.8	Very high	47 Å²	47	26.1 Å²	26.1	31%	0.305	15%	0.146	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	127.2	169.3	27.4	-30.1	0	0	0	110	L28 P251	L28-P249 HydrophobicContact CD2-CB 4Å; L28-P249 HydrophobicContact CD2-CG 4.23Å; P249-P251 WeakPolarHBondContact O-CD 3.25Å
250	V	94.7	Very high	91.4	Very high	1 Å²	1	30.6 Å²	30.6	1%	0.006	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	114.5	177.5	170.8	0	0	0	0	107.4	I36 M60 G84 L86 I248 I274	I36-V250 HydrophobicContact CG1-CB 4.27Å; I36-V250 HydrophobicContact CG1-CG1 4.15Å; I36-V250 HydrophobicContact CG1-CG2 3.95Å; M60-V250 HydrophobicContact CE-CG1 4.31Å; M60-V250 HydrophobicContact SD-CB 4.44Å; M60-V250 HydrophobicContact SD-CG1 3.66Å; G84-V250 PolarHBondContact N-O 2.51Å; G84-V250 PolarHBondContact O-N 3.35Å; L86-V250 HydrophobicContact CB-CG2 4.07Å; I248-V250 PolarHBondContact O-N 3.4Å; V250-I274 HydrophobicContact CG1-CD1 4.27Å; V250-I274 HydrophobicContact CG1-CG2 4.47Å; V250-I274 HydrophobicContact CG2-CG2 4.24Å
251	P	94.4	Very high	90.8	Very high	11 Å²	11	33.1 Å²	33.1	7%	0.071	19%	0.186	C	C	.	.			trans	-64.5	155.4	-175.9	17.9	-26.3	0	0	0	111.8	F83 P249 I255 R256 Y311	F83-P251 HydrophobicContact CE1-CB 4.45Å; P249-P251 WeakPolarHBondContact O-CD 3.25Å; P251-I255 HydrophobicContact CB-CD1 4.41Å; P251-R256 VanDerWaalsContact CG-NH1 3.26Å; P251-R256 PolarHBondContact O-NH1 3.46Å; P251-R256 PolarHBondContact O-NH2 3.39Å; P251-R256 VanDerWaalsContact O-NH2 3.07Å; P251-Y311 WeakPolarHBondContact CD-OH 3.25Å; P251-Y311 VanDerWaalsContact CG-OH 3.3Å; P251-Y311 WeakPolarHBondContact CG-OH 3.07Å
252	P	94.2	Very high	89.9	Confident	4 Å²	4	38.5 Å²	38.5	3%	0.026	23%	0.23	C	C	.	.			trans	-53.8	149.6	175.9	-25.8	31.7	0	0	0	113.6	H82 F83 T254 I255	H82-P252 WeakPolarHBondContact O-CA 3.34Å; F83-P252 HydrophobicContact CD2-CG 4.48Å; F83-P252 HydrophobicContact CE2-CG 4.49Å; P252-T254 PolarHBondContact O-N 2.93Å; P252-I255 HydrophobicContact CB-CG1 4.5Å; P252-I255 HydrophobicContact CG-CD1 4.41Å; P252-I255 PolarHBondContact O-N 3.25Å; P252-I255 VanDerWaalsContact O-N 3.09Å
253	A	91.2	Very high	89	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	27%	0.266	C	S	.	.	G	3₁₀ helix	trans	-61.8	-26.1	177.1	0	0	0	0	0	112.7	M60 N63 I255 R256	M60-A253 PolarHBondContact O-N 3.43Å; N63-A253 HydrophobicContact CB-CB 4.26Å; A253-I255 PolarHBondContact O-N 2.95Å; A253-R256 CarbonylContact O-C 3.53Å; A253-R256 VanDerWaalsContact O-C 3.25Å; A253-R256 PolarHBondContact O-N 3.35Å; A253-R256 VanDerWaalsContact O-N 3.14Å
254	T	89.4	Confident	88.2	Confident	28 Å²	28	42.4 Å²	42.4	17%	0.172	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	-64.6	-24.9	176.1	53.4	0	0	0	0	113.5	F76 P252	F76-T254 HydrophobicContact CD2-CG2 4.3Å; F76-T254 HydrophobicContact CE2-CG2 4.28Å; P252-T254 PolarHBondContact O-N 2.93Å
255	I	91.2	Very high	87.6	Confident	88 Å²	88	43.6 Å²	43.6	45%	0.451	29%	0.286	S	S	.	.	G	3₁₀ helix	trans	-80.2	-22.5	176.6	-60.6	-171.7	0	0	0	111.9	P251 P252 A253 P257	P251-I255 HydrophobicContact CB-CD1 4.41Å; P252-I255 HydrophobicContact CB-CG1 4.5Å; P252-I255 HydrophobicContact CG-CD1 4.41Å; P252-I255 PolarHBondContact O-N 3.25Å; P252-I255 VanDerWaalsContact O-N 3.09Å; A253-I255 PolarHBondContact O-N 2.95Å; I255-P257 VanDerWaalsContact C-CD 3.46Å
256	R	91.7	Very high	87.3	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	31%	0.309	C	S	.	.	S	Bend	trans	-130.1	62.2	-174.5	56.3	178.3	-165.3	-117.8	-10.7	111.4	P55 P251 A253 D268 T271	P55-R256 PolarHBondContact O-NH2 3.19Å; P251-R256 VanDerWaalsContact CG-NH1 3.26Å; P251-R256 PolarHBondContact O-NH1 3.46Å; P251-R256 PolarHBondContact O-NH2 3.39Å; P251-R256 VanDerWaalsContact O-NH2 3.07Å; A253-R256 CarbonylContact O-C 3.53Å; A253-R256 VanDerWaalsContact O-C 3.25Å; A253-R256 PolarHBondContact O-N 3.35Å; A253-R256 VanDerWaalsContact O-N 3.14Å; R256-D268 WeakPolarHBondContact CA-OD2 3.36Å; R256-D268 HydrophobicContact CB-CB 3.79Å; R256-T271 VanDerWaalsContact CD-OG1 3.27Å; R256-T271 WeakPolarHBondContact CD-OG1 3.45Å
257	P	89.6	Confident	87	Confident	52 Å²	52	46 Å²	46	34%	0.338	30%	0.3	S	S	.	.	P	Polyproline II helix	trans	-65.1	145.8	-172.7	27.7	-35.1	0	0	0	112.2	F76 I255	F76-P257 HydrophobicContact CE2-CB 4.31Å; F76-P257 HydrophobicContact CZ-CB 4.18Å; I255-P257 VanDerWaalsContact C-CD 3.46Å
258	S	89	Confident	87	Confident	20 Å²	20	46.1 Å²	46.1	14%	0.14	30%	0.303	C	S	.	.	P	Polyproline II helix	trans	-81.8	135.1	174.3	-50.9	0	0	0	0	110	N63 E267	N63-S258 PolarHBondContact ND2-OG 3.12Å; N63-S258 PolarHBondContact O-N 2.96Å; S258-E267 VanDerWaalsContact CB-OE2 3.28Å; S258-E267 WeakPolarHBondContact CB-OE2 3.47Å; S258-E267 PolarHBondContact OG-OE2 3.15Å
259	V	86.7	Confident	86.9	Confident	92 Å²	92	48.5 Å²	48.5	56%	0.558	32%	0.316	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.7	118.3	178	-176.3	0	0	0	0	109.2	A261 N266	V259-A261 PolarHBondContact O-N 2.89Å; V259-N266 PolarHBondContact N-O 3.1Å; V259-N266 PolarHBondContact O-N 3.05Å
260	K	79.4	Confident	86.9	Confident	144 Å²	144	46.3 Å²	46.3	63%	0.626	30%	0.302	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.2	127.4	171.8	-84.8	-171.8	171.2	-171.8	0	110.1
261	A	79.3	Confident	86.8	Confident	53 Å²	53	46.3 Å²	46.3	44%	0.438	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	163.9	168.7	0	0	0	0	0	109.3	V259 G263 G264	V259-A261 PolarHBondContact O-N 2.89Å; A261-G263 PolarHBondContact O-N 2.81Å; A261-G264 CarbonylContact C-O 3.14Å; A261-G264 PolarHBondContact N-O 3.39Å; A261-G264 PolarHBondContact O-N 3.22Å; A261-G264 VanDerWaalsContact O-N 3.17Å
262	A	73.5	Confident	86.7	Confident	123 Å²	123	48.7 Å²	48.7	100%	1.017	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-16.1	-171.1	0	0	0	0	0	115.4
263	G	72.5	Confident	86.6	Confident	87 Å²	87	49.3 Å²	49.3	90%	0.897	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-124	15.9	179	0	0	0	0	0	115.2	A261	A261-G263 PolarHBondContact O-N 2.81Å
264	G	75.7	Confident	86.7	Confident	25 Å²	25	49.4 Å²	49.4	26%	0.258	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	158	-169	-178.7	0	0	0	0	0	114	A261	A261-G264 CarbonylContact C-O 3.14Å; A261-G264 PolarHBondContact N-O 3.39Å; A261-G264 PolarHBondContact O-N 3.22Å; A261-G264 VanDerWaalsContact O-N 3.17Å
265	S	80.1	Confident	86.9	Confident	28 Å²	28	50.9 Å²	50.9	20%	0.196	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	128.2	169.5	64.3	0	0	0	0	110	Y42 E267	Y42-S265 PolarHBondContact OH-OG 3.26Å; S265-E267 VanDerWaalsContact CB-OE1 3.25Å; S265-E267 WeakPolarHBondContact CB-OE1 3.43Å; S265-E267 PolarHBondContact OG-OE1 3.06Å
266	N	86.5	Confident	87	Confident	109 Å²	109	49.4 Å²	49.4	58%	0.583	31%	0.312	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.2	116.8	165.9	-87.1	-26.5	0	0	0	108	V259	V259-N266 PolarHBondContact N-O 3.1Å; V259-N266 PolarHBondContact O-N 3.05Å
267	E	88.5	Confident	87.2	Confident	27 Å²	27	49.5 Å²	49.5	13%	0.126	31%	0.313	C	S	.	.	P	Polyproline II helix	trans	-84.1	153.7	176.2	-56.4	-51.3	143	0	0	111.4	L41 Y42 S258 S265 T271 I272	L41-E267 HydrophobicContact CD1-CG 4.05Å; Y42-E267 PolarHBondContact OH-OE1 3.07Å; S258-E267 VanDerWaalsContact CB-OE2 3.28Å; S258-E267 WeakPolarHBondContact CB-OE2 3.47Å; S258-E267 PolarHBondContact OG-OE2 3.15Å; S265-E267 VanDerWaalsContact CB-OE1 3.25Å; S265-E267 WeakPolarHBondContact CB-OE1 3.43Å; S265-E267 PolarHBondContact OG-OE1 3.06Å; E267-T271 HydrophobicContact CB-CG2 4.43Å; E267-I272 HydrophobicContact CB-CG1 4.38Å
268	D	92	Very high	87.4	Confident	25 Å²	25	47.2 Å²	47.2	13%	0.134	30%	0.298	C	S	.	.	P	Polyproline II helix	trans	-65.5	140.5	174.4	-173.7	-50.8	0	0	0	110.6	R256 L270 T271 I272 R335	R256-D268 WeakPolarHBondContact CA-OD2 3.36Å; R256-D268 HydrophobicContact CB-CB 3.79Å; D268-L270 PolarHBondContact O-N 3.01Å; D268-L270 PolarHBondContact OD1-N 3.34Å; D268-T271 WeakPolarHBondContact O-CA 3.42Å; D268-T271 VanDerWaalsContact O-CB 3.3Å; D268-T271 WeakPolarHBondContact O-CB 3.43Å; D268-T271 PolarHBondContact O-N 2.85Å; D268-I272 PolarHBondContact O-N 3.37Å; D268-R335 IonicContact OD1-CZ 3.71Å; D268-R335 IonicContact OD1-NH1 2.69Å; D268-R335 IonicContact OD1-NH2 3.78Å; D268-R335 PolarHBondContact OD1-NH2 3.27Å; D268-R335 IonicContact OD2-CZ 2.87Å; D268-R335 IonicContact OD2-NH1 3.37Å; D268-R335 PolarHBondContact OD2-NH1 2.8Å; D268-R335 IonicContact OD2-NH2 3.67Å; D268-R335 PolarHBondContact OD2-NH2 3.48Å
269	D	91.9	Very high	87.6	Confident	55 Å²	55	49.4 Å²	49.4	29%	0.294	31%	0.313	S	S	.	.	H	α-helix	trans	-42.5	-39.8	172.3	-73.6	-13.1	0	0	0	113.8	I272 K273 I329 R330	D269-I272 PolarHBondContact O-N 3.42Å; D269-K273 WeakPolarHBondContact O-CG 3.28Å; D269-K273 PolarHBondContact O-N 2.87Å; D269-I329 HydrophobicContact CB-CG2 3.86Å; D269-R330 PolarHBondContact OD2-N 2.85Å
270	L	93.8	Very high	88	Confident	1 Å²	1	46.7 Å²	46.7	1%	0.005	30%	0.295	C	S	.	.	H	α-helix	trans	-66.6	-40.1	178.6	-63.8	179.6	0	0	0	111.8	D268 I272 K273 I274 Y311 L332	D268-L270 PolarHBondContact O-N 3.01Å; D268-L270 PolarHBondContact OD1-N 3.34Å; L270-I272 VanDerWaalsContact C-N 3.33Å; L270-K273 PolarHBondContact O-N 2.86Å; L270-I274 WeakPolarHBondContact O-CD1 3.44Å; L270-I274 WeakPolarHBondContact O-CG1 3.06Å; L270-I274 PolarHBondContact O-N 3.31Å; L270-Y311 HydrophobicContact CB-CE2 4.15Å; L270-Y311 HydrophobicContact CD2-CD2 3.85Å; L270-Y311 HydrophobicContact CD2-CE2 3.65Å; L270-Y311 HydrophobicContact CG-CE2 4.41Å; L270-L332 HydrophobicContact CD1-CD2 3.82Å; L270-L332 HydrophobicContact CD2-CD2 4.32Å; L270-L332 HydrophobicContact CD2-CG 4.16Å
271	T	93.5	Very high	88.7	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-62.5	-44.1	177.4	-56.5	0	0	0	0	110.2	L41 P55 L56 R256 E267 D268 K273 I274 M275	L41-T271 HydrophobicContact CD2-CG2 3.72Å; P55-T271 HydrophobicContact CB-CG2 4.21Å; L56-T271 HydrophobicContact CD1-CG2 4.35Å; L56-T271 HydrophobicContact CD2-CG2 3.76Å; L56-T271 HydrophobicContact CG-CG2 3.92Å; R256-T271 VanDerWaalsContact CD-OG1 3.27Å; R256-T271 WeakPolarHBondContact CD-OG1 3.45Å; E267-T271 HydrophobicContact CB-CG2 4.43Å; D268-T271 WeakPolarHBondContact O-CA 3.42Å; D268-T271 VanDerWaalsContact O-CB 3.3Å; D268-T271 WeakPolarHBondContact O-CB 3.43Å; D268-T271 PolarHBondContact O-N 2.85Å; T271-K273 PolarHBondContact O-N 2.83Å; T271-I274 PolarHBondContact O-N 3.4Å; T271-M275 PolarHBondContact O-N 2.83Å
272	I	91.7	Very high	89.3	Confident	61 Å²	61	42.1 Å²	42.1	31%	0.313	27%	0.267	S	S	.	.	H	α-helix	trans	-62.1	-44.5	178	-60	175.7	0	0	0	110.5	E267 D268 D269 L270 I274 M275 E276	E267-I272 HydrophobicContact CB-CG1 4.38Å; D268-I272 PolarHBondContact O-N 3.37Å; D269-I272 PolarHBondContact O-N 3.42Å; L270-I272 VanDerWaalsContact C-N 3.33Å; I272-I274 PolarHBondContact O-N 2.82Å; I272-M275 HydrophobicContact CG2-CE 4.38Å; I272-M275 WeakPolarHBondContact O-CB 3.22Å; I272-M275 PolarHBondContact O-N 3.44Å; I272-E276 WeakPolarHBondContact O-CG 3.29Å; I272-E276 PolarHBondContact O-N 2.89Å
273	K	91.6	Very high	90.1	Very high	17 Å²	17	37.7 Å²	37.7	7%	0.074	23%	0.23	C	C	.	.	H	α-helix	trans	-67.7	-34.8	178.4	-68.1	-55.7	175.3	-155.7	0	113.9	D269 L270 T271 M275 E276 I277 Y311	D269-K273 WeakPolarHBondContact O-CG 3.28Å; D269-K273 PolarHBondContact O-N 2.87Å; L270-K273 PolarHBondContact O-N 2.86Å; T271-K273 PolarHBondContact O-N 2.83Å; K273-M275 VanDerWaalsContact C-N 3.33Å; K273-E276 WeakPolarHBondContact CD-OE2 3.42Å; K273-E276 IonicContact NZ-OE1 2.88Å; K273-E276 PolarHBondContact NZ-OE1 3.27Å; K273-E276 IonicContact NZ-OE2 2.72Å; K273-E276 PolarHBondContact NZ-OE2 3.18Å; K273-E276 PolarHBondContact O-N 2.85Å; K273-I277 WeakPolarHBondContact O-CB 3.29Å; K273-I277 WeakPolarHBondContact O-CD1 3.47Å; K273-I277 WeakPolarHBondContact O-CG1 3.45Å; K273-I277 PolarHBondContact O-N 3.06Å; K273-Y311 HydrophobicContact CB-CD2 4.1Å
274	I	94.3	Very high	91	Very high	3 Å²	3	33.5 Å²	33.5	2%	0.015	19%	0.187	C	C	.	.	H	α-helix	trans	-66.3	-39.7	174.3	-68.8	162.2	0	0	0	110.8	P55 V250 L270 T271 I272 I277 C278 Y311	P55-I274 HydrophobicContact CB-CG2 4.17Å; P55-I274 HydrophobicContact CG-CG2 4.29Å; V250-I274 HydrophobicContact CG1-CD1 4.27Å; V250-I274 HydrophobicContact CG1-CG2 4.47Å; V250-I274 HydrophobicContact CG2-CG2 4.24Å; L270-I274 WeakPolarHBondContact O-CD1 3.44Å; L270-I274 WeakPolarHBondContact O-CG1 3.06Å; L270-I274 PolarHBondContact O-N 3.31Å; T271-I274 PolarHBondContact O-N 3.4Å; I272-I274 PolarHBondContact O-N 2.82Å; I274-I277 PolarHBondContact O-N 3.17Å; I274-C278 WeakPolarHBondContact O-CB 3.4Å; I274-C278 PolarHBondContact O-N 3.01Å; I274-Y311 HydrophobicContact CD1-CE2 3.89Å; I274-Y311 HydrophobicContact CG1-CD2 4.33Å; I274-Y311 HydrophobicContact CG1-CE2 3.82Å
275	M	93.7	Very high	91.7	Very high	58 Å²	58	36.5 Å²	36.5	29%	0.286	19%	0.194	S	C	.	.	H	α-helix	trans	-60.2	-48.5	173.2	174	-173.6	78.6	0	0	111.7	T39 L41 P55 T271 I272 K273 C278 C279	T39-M275 WeakPolarHBondContact O-CG 3.49Å; L41-M275 HydrophobicContact CD1-SD 4.19Å; L41-M275 HydrophobicContact CD2-SD 4.49Å; L41-M275 HydrophobicContact CG-SD 4.11Å; P55-M275 HydrophobicContact CG-CB 4.47Å; T271-M275 PolarHBondContact O-N 2.83Å; I272-M275 HydrophobicContact CG2-CE 4.38Å; I272-M275 WeakPolarHBondContact O-CB 3.22Å; I272-M275 PolarHBondContact O-N 3.44Å; K273-M275 VanDerWaalsContact C-N 3.33Å; M275-C278 PolarHBondContact O-N 3.4Å; M275-C279 WeakPolarHBondContact O-CB 3.22Å; M275-C279 PolarHBondContact O-N 2.95Å
276	E	93	Very high	92.1	Very high	57 Å²	57	37.3 Å²	37.3	27%	0.266	20%	0.2	S	C	.	.	H	α-helix	trans	-60.7	-44.6	177.5	-71	173.5	-163.8	0	0	112	I272 K273 C278 C279 I280 L307	I272-E276 WeakPolarHBondContact O-CG 3.29Å; I272-E276 PolarHBondContact O-N 2.89Å; K273-E276 WeakPolarHBondContact CD-OE2 3.42Å; K273-E276 IonicContact NZ-OE1 2.88Å; K273-E276 PolarHBondContact NZ-OE1 3.27Å; K273-E276 IonicContact NZ-OE2 2.72Å; K273-E276 PolarHBondContact NZ-OE2 3.18Å; K273-E276 PolarHBondContact O-N 2.85Å; E276-C278 VanDerWaalsContact C-N 3.34Å; E276-C278 PolarHBondContact O-N 3.42Å; E276-C279 WeakPolarHBondContact O-CB 3.23Å; E276-C279 PolarHBondContact O-N 2.9Å; E276-I280 PolarHBondContact O-N 3.08Å; E276-L307 HydrophobicContact CB-CD1 4.2Å; E276-L307 VanDerWaalsContact OE2-CD2 3.28Å; E276-L307 WeakPolarHBondContact OE2-CD2 3.49Å
277	I	94.6	Very high	92.1	Very high	3 Å²	3	32.8 Å²	32.8	2%	0.015	18%	0.177	C	C	.	.	H	α-helix	trans	-59.5	-45.8	176.1	-72.1	166.5	0	0	0	110.5	L86 I248 K273 I274 C279 I280 N281 L304 L307 H308 Y311	L86-I277 HydrophobicContact CD1-CG2 4.46Å; L86-I277 HydrophobicContact CD2-CG2 4.18Å; I248-I277 HydrophobicContact CD1-CG2 3.86Å; K273-I277 WeakPolarHBondContact O-CB 3.29Å; K273-I277 WeakPolarHBondContact O-CD1 3.47Å; K273-I277 WeakPolarHBondContact O-CG1 3.45Å; K273-I277 PolarHBondContact O-N 3.06Å; I274-I277 PolarHBondContact O-N 3.17Å; I277-C279 VanDerWaalsContact C-N 3.29Å; I277-C279 PolarHBondContact O-N 2.88Å; I277-I280 PolarHBondContact O-N 3.4Å; I277-N281 VanDerWaalsContact O-CB 3.29Å; I277-N281 WeakPolarHBondContact O-CB 3.3Å; I277-N281 PolarHBondContact O-N 3.38Å; I277-L304 HydrophobicContact CG2-CD1 3.88Å; I277-L307 HydrophobicContact CG1-CB 3.91Å; I277-H308 HydrophobicContact CD1-CB 4.33Å; I277-Y311 HydrophobicContact CD1-CG 4.41Å
278	C	94.1	Very high	91.8	Very high	4 Å²	4	36.1 Å²	36.1	3%	0.027	19%	0.193	C	C	.	.	H	α-helix	trans	-62.2	-37.7	177.7	-164.9	0	0	0	0	112	T39 L86 I274 M275 E276 N281 Q282	T39-C278 HydrophobicContact CG2-CB 4.14Å; L86-C278 HydrophobicContact CD1-CB 3.67Å; I274-C278 WeakPolarHBondContact O-CB 3.4Å; I274-C278 PolarHBondContact O-N 3.01Å; M275-C278 PolarHBondContact O-N 3.4Å; E276-C278 VanDerWaalsContact C-N 3.34Å; E276-C278 PolarHBondContact O-N 3.42Å; C278-N281 PolarHBondContact O-N 3.02Å; C278-Q282 PolarHBondContact O-N 2.88Å
279	C	94.3	Very high	91.4	Very high	66 Å²	66	39.7 Å²	39.7	45%	0.446	22%	0.215	S	C	.	.	H	α-helix	trans	-66.3	-48.8	178.8	-167.2	0	0	0	0	111.9	T39 M275 E276 I277 N281 Q282 A283	T39-C279 HydrophobicContact CG2-CB 3.86Å; M275-C279 WeakPolarHBondContact O-CB 3.22Å; M275-C279 PolarHBondContact O-N 2.95Å; E276-C279 WeakPolarHBondContact O-CB 3.23Å; E276-C279 PolarHBondContact O-N 2.9Å; I277-C279 VanDerWaalsContact C-N 3.29Å; I277-C279 PolarHBondContact O-N 2.88Å; C279-N281 VanDerWaalsContact C-N 3.31Å; C279-N281 PolarHBondContact O-N 2.9Å; C279-Q282 PolarHBondContact O-N 2.84Å; C279-A283 PolarHBondContact O-N 3.19Å
280	I	93.9	Very high	91	Very high	34 Å²	34	45.1 Å²	45.1	17%	0.174	24%	0.236	C	C	.	.	H	α-helix	trans	-65.4	-36.7	176.7	-64.5	-61.4	0	0	0	111.3	E276 I277 A283 I284 N300 L304 L307	E276-I280 PolarHBondContact O-N 3.08Å; I277-I280 PolarHBondContact O-N 3.4Å; I280-A283 WeakPolarHBondContact O-CB 3.39Å; I280-A283 PolarHBondContact O-N 3.39Å; I280-A283 VanDerWaalsContact O-N 3.14Å; I280-I284 HydrophobicContact CG2-CD1 4.27Å; I280-I284 WeakPolarHBondContact O-CG1 3.49Å; I280-I284 PolarHBondContact O-N 3.08Å; I280-N300 WeakPolarHBondContact CG2-O 3.19Å; I280-L304 HydrophobicContact CG2-CB 3.9Å; I280-L304 HydrophobicContact CG2-CD1 4.33Å; I280-L307 HydrophobicContact CB-CD1 4.43Å; I280-L307 HydrophobicContact CG1-CD1 3.68Å
281	N	93.7	Very high	90.3	Very high	12 Å²	12	50.4 Å²	50.4	6%	0.064	27%	0.274	C	S	.	.	H	α-helix	trans	-64.3	-41.8	176.9	-164.3	66	0	0	0	112	D87 L88 E89 I277 C278 C279 A283 I284 H285 L304	D87-N281 PolarHBondContact O-ND2 2.63Å; L88-N281 WeakPolarHBondContact CA-OD1 3.5Å; E89-N281 PolarHBondContact N-OD1 3.11Å; I277-N281 VanDerWaalsContact O-CB 3.29Å; I277-N281 WeakPolarHBondContact O-CB 3.3Å; I277-N281 PolarHBondContact O-N 3.38Å; C278-N281 PolarHBondContact O-N 3.02Å; C279-N281 VanDerWaalsContact C-N 3.31Å; C279-N281 PolarHBondContact O-N 2.9Å; N281-A283 VanDerWaalsContact C-N 3.32Å; N281-A283 PolarHBondContact O-N 3.26Å; N281-I284 PolarHBondContact O-N 3.49Å; N281-H285 PolarHBondContact O-N 3.04Å; N281-L304 HydrophobicContact CB-CD1 4.48Å
282	Q	91.7	Very high	89.6	Confident	90 Å²	90	52.5 Å²	52.5	42%	0.421	29%	0.291	S	S	.	.	H	α-helix	trans	-62.8	-37.9	170.1	-89.3	-177.9	-26.5	0	0	112.5	V37 C278 C279 I284 H285 S286	V37-Q282 PolarHBondContact O-NE2 3.47Å; C278-Q282 PolarHBondContact O-N 2.88Å; C279-Q282 PolarHBondContact O-N 2.84Å; Q282-I284 VanDerWaalsContact C-N 3.34Å; Q282-I284 PolarHBondContact O-N 3.07Å; Q282-H285 PolarHBondContact O-N 3.38Å; Q282-S286 WeakPolarHBondContact O-CB 3.34Å; Q282-S286 PolarHBondContact O-N 3.42Å; Q282-S286 PolarHBondContact O-OG 2.56Å
283	A	91.5	Very high	89.3	Confident	29 Å²	29	52.4 Å²	52.4	24%	0.24	30%	0.296	C	S	.	.	H	α-helix	trans	-61.2	-43.1	175.9	0	0	0	0	0	111.3	C279 I280 N281 S286 S287	C279-A283 PolarHBondContact O-N 3.19Å; I280-A283 WeakPolarHBondContact O-CB 3.39Å; I280-A283 PolarHBondContact O-N 3.39Å; I280-A283 VanDerWaalsContact O-N 3.14Å; N281-A283 VanDerWaalsContact C-N 3.32Å; N281-A283 PolarHBondContact O-N 3.26Å; A283-S286 WeakPolarHBondContact CA-OG 3.3Å; A283-S286 PolarHBondContact O-N 3.48Å; A283-S286 PolarHBondContact O-OG 2.96Å; A283-S287 WeakPolarHBondContact O-CB 3.14Å; A283-S287 PolarHBondContact O-N 2.69Å; A283-S287 PolarHBondContact O-OG 2.96Å
284	I	91.3	Very high	89	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-61.1	-49.5	174.6	-66.3	168.1	0	0	0	110.8	E89 L90 I280 N281 Q282 S286 S287 E288 N300 L304	E89-I284 HydrophobicContact CB-CG2 4.05Å; L90-I284 HydrophobicContact CD1-CG2 3.91Å; L90-I284 HydrophobicContact CG-CG2 4.17Å; I280-I284 HydrophobicContact CG2-CD1 4.27Å; I280-I284 WeakPolarHBondContact O-CG1 3.49Å; I280-I284 PolarHBondContact O-N 3.08Å; N281-I284 PolarHBondContact O-N 3.49Å; Q282-I284 VanDerWaalsContact C-N 3.34Å; Q282-I284 PolarHBondContact O-N 3.07Å; I284-S286 VanDerWaalsContact C-N 3.29Å; I284-S286 PolarHBondContact O-N 2.82Å; I284-S287 WeakPolarHBondContact O-CA 3.44Å; I284-S287 WeakPolarHBondContact O-CB 3.12Å; I284-S287 PolarHBondContact O-N 3.2Å; I284-E288 PolarHBondContact O-N 3.24Å; I284-N300 HydrophobicContact CD1-CB 4.31Å; I284-N300 HydrophobicContact CG1-CB 3.7Å; I284-L304 HydrophobicContact CD1-CB 4.26Å; I284-L304 HydrophobicContact CD1-CD2 3.79Å
285	H	89.8	Confident	88.6	Confident	87 Å²	87	64.8 Å²	64.8	40%	0.403	36%	0.362	S	S	.	.	H	α-helix	trans	-56.4	-43.6	177.3	-169.4	74	0	0	0	112.3	E89 N281 Q282 S287 E288 T289	E89-H285 HydrophobicContact CG-CB 3.8Å; E89-H285 IonicContact OE1-CG 3.29Å; E89-H285 IonicContact OE1-ND1 2.72Å; E89-H285 PolarHBondContact OE1-ND1 2.9Å; E89-H285 IonicContact OE2-CE1 2.73Å; E89-H285 IonicContact OE2-CG 3.1Å; E89-H285 IonicContact OE2-ND1 3.33Å; E89-H285 PolarHBondContact OE2-ND1 3.37Å; N281-H285 PolarHBondContact O-N 3.04Å; Q282-H285 PolarHBondContact O-N 3.38Å; H285-S287 VanDerWaalsContact C-N 3.29Å; H285-S287 PolarHBondContact O-N 3.18Å; H285-E288 PolarHBondContact O-N 2.98Å; H285-T289 PolarHBondContact O-N 2.78Å; H285-T289 VanDerWaalsContact O-N 3.16Å; H285-T289 PolarHBondContact O-OG1 3.22Å
286	S	89	Confident	88.3	Confident	46 Å²	46	64.8 Å²	64.8	32%	0.322	37%	0.365	S	S	.	.	H	α-helix	trans	-70.3	-24.3	177.2	68.1	0	0	0	0	113.6	Q282 A283 I284 T289 K290	Q282-S286 WeakPolarHBondContact O-CB 3.34Å; Q282-S286 PolarHBondContact O-N 3.42Å; Q282-S286 PolarHBondContact O-OG 2.56Å; A283-S286 WeakPolarHBondContact CA-OG 3.3Å; A283-S286 PolarHBondContact O-N 3.48Å; A283-S286 PolarHBondContact O-OG 2.96Å; I284-S286 VanDerWaalsContact C-N 3.29Å; I284-S286 PolarHBondContact O-N 2.82Å; S286-T289 WeakPolarHBondContact CA-OG1 3.34Å; S286-T289 PolarHBondContact O-OG1 2.67Å; S286-K290 VanDerWaalsContact O-CB 3.31Å; S286-K290 WeakPolarHBondContact O-CB 3.09Å; S286-K290 VanDerWaalsContact O-CG 3.23Å; S286-K290 WeakPolarHBondContact O-CG 3.45Å; S286-K290 PolarHBondContact O-N 3.12Å
287	S	87	Confident	88.2	Confident	14 Å²	14	63.3 Å²	63.3	10%	0.098	36%	0.36	C	S	.	.	H	α-helix	trans	-77.9	-38.2	177	-56	0	0	0	0	111.3	A283 I284 H285 S291 A292	A283-S287 WeakPolarHBondContact O-CB 3.14Å; A283-S287 PolarHBondContact O-N 2.69Å; A283-S287 PolarHBondContact O-OG 2.96Å; I284-S287 WeakPolarHBondContact O-CA 3.44Å; I284-S287 WeakPolarHBondContact O-CB 3.12Å; I284-S287 PolarHBondContact O-N 3.2Å; H285-S287 VanDerWaalsContact C-N 3.29Å; H285-S287 PolarHBondContact O-N 3.18Å; S287-S291 PolarHBondContact O-N 3.48Å; S287-A292 PolarHBondContact O-N 3.45Å
288	E	82	Confident	87.9	Confident	96 Å²	96	65 Å²	65	45%	0.449	38%	0.375	S	S	.	.	H	α-helix	trans	-66.5	-44.7	174.3	-77.6	-170.9	155.6	0	0	111.8	I284 H285 K290 S291	I284-E288 PolarHBondContact O-N 3.24Å; H285-E288 PolarHBondContact O-N 2.98Å; E288-K290 VanDerWaalsContact C-N 3.28Å; E288-K290 PolarHBondContact O-N 3.25Å; E288-S291 PolarHBondContact O-N 2.87Å
289	T	83.9	Confident	87.6	Confident	100 Å²	100	71.2 Å²	71.2	61%	0.613	40%	0.404	S	S	*	.	H	α-helix	trans	-68	-25.4	178.6	43.4	0	0	0	0	113.6	H285 S286	H285-T289 PolarHBondContact O-N 2.78Å; H285-T289 VanDerWaalsContact O-N 3.16Å; H285-T289 PolarHBondContact O-OG1 3.22Å; S286-T289 WeakPolarHBondContact CA-OG1 3.34Å; S286-T289 PolarHBondContact O-OG1 2.67Å
290	K	83.6	Confident	87.5	Confident	169 Å²	169	69.8 Å²	69.8	74%	0.735	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.2	6.3	178.4	-67.9	179	-179.2	-179.6	0	114.2	S286 E288 A292	S286-K290 VanDerWaalsContact O-CB 3.31Å; S286-K290 WeakPolarHBondContact O-CB 3.09Å; S286-K290 VanDerWaalsContact O-CG 3.23Å; S286-K290 WeakPolarHBondContact O-CG 3.45Å; S286-K290 PolarHBondContact O-N 3.12Å; E288-K290 VanDerWaalsContact C-N 3.28Å; E288-K290 PolarHBondContact O-N 3.25Å; K290-A292 VanDerWaalsContact C-N 3.34Å; K290-A292 PolarHBondContact O-N 3.49Å
291	S	78.1	Confident	87.4	Confident	112 Å²	112	69.7 Å²	69.7	78%	0.783	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	51	47.9	-176.8	-60.4	0	0	0	0	113.5	S287 E288	S287-S291 PolarHBondContact O-N 3.48Å; E288-S291 PolarHBondContact O-N 2.87Å
292	A	78.3	Confident	87.3	Confident	44 Å²	44	71.7 Å²	71.7	36%	0.364	40%	0.4	S	S	.	.			trans	-65.3	166.2	176.2	0	0	0	0	0	112.4	S287 K290	S287-A292 PolarHBondContact O-N 3.45Å; K290-A292 VanDerWaalsContact C-N 3.34Å; K290-A292 PolarHBondContact O-N 3.49Å
293	S	86.1	Confident	87.2	Confident	60 Å²	60	68.7 Å²	68.7	42%	0.42	39%	0.388	S	S	.	.			trans	-62.6	146.4	177.1	81.9	0	0	0	0	111.5	E295 T296 V297	S293-E295 PolarHBondContact O-N 3.01Å; S293-T296 PolarHBondContact O-N 3.02Å; S293-T296 VanDerWaalsContact O-N 3.17Å; S293-T296 PolarHBondContact OG-N 3.24Å; S293-T296 PolarHBondContact OG-OG1 3.48Å; S293-V297 PolarHBondContact O-N 2.97Å
294	V	85.1	Confident	87.3	Confident	126 Å²	126	67.3 Å²	67.3	76%	0.764	38%	0.377	S	S	*	.	H	α-helix	trans	-58.8	-32	-179.7	-179.1	0	0	0	0	111.5	V297 A298	V294-V297 PolarHBondContact O-N 3.2Å; V294-A298 WeakPolarHBondContact O-CB 3.21Å; V294-A298 PolarHBondContact O-N 3.2Å
295	E	86.1	Confident	87.3	Confident	153 Å²	153	67.7 Å²	67.7	72%	0.715	38%	0.378	S	S	*	.	H	α-helix	trans	-64.4	-46.1	178.1	-68.2	169.4	165.6	0	0	111.8	S293 V297 A298 E299	S293-E295 PolarHBondContact O-N 3.01Å; E295-V297 VanDerWaalsContact C-N 3.34Å; E295-V297 PolarHBondContact O-N 2.91Å; E295-A298 PolarHBondContact O-N 3.2Å; E295-E299 PolarHBondContact O-N 3.07Å
296	T	87.9	Confident	87.3	Confident	58 Å²	58	64.2 Å²	64.2	36%	0.356	36%	0.363	S	S	.	.	H	α-helix	trans	-64.4	-40.4	179	-48.7	0	0	0	0	111.5	S293 E299 N300	S293-T296 PolarHBondContact O-N 3.02Å; S293-T296 VanDerWaalsContact O-N 3.17Å; S293-T296 PolarHBondContact OG-N 3.24Å; S293-T296 PolarHBondContact OG-OG1 3.48Å; T296-E299 PolarHBondContact O-N 2.94Å; T296-N300 WeakPolarHBondContact O-CB 3.46Å; T296-N300 PolarHBondContact O-N 3.09Å; T296-N300 PolarHBondContact O-ND2 2.92Å
297	V	89.4	Confident	87.4	Confident	26 Å²	26	62.7 Å²	62.7	16%	0.158	35%	0.351	C	S	.	.	H	α-helix	trans	-63.4	-43.6	174.8	178.4	0	0	0	0	110.5	L90 S293 V294 E295 N300 W301	L90-V297 HydrophobicContact CD1-CG1 4.03Å; S293-V297 PolarHBondContact O-N 2.97Å; V294-V297 PolarHBondContact O-N 3.2Å; E295-V297 VanDerWaalsContact C-N 3.34Å; E295-V297 PolarHBondContact O-N 2.91Å; V297-N300 PolarHBondContact O-N 2.78Å; V297-W301 VanDerWaalsContact O-CB 3.26Å; V297-W301 WeakPolarHBondContact O-CB 3.41Å; V297-W301 PolarHBondContact O-N 3.45Å
298	A	88.5	Confident	87.7	Confident	39 Å²	39	62.3 Å²	62.3	32%	0.322	35%	0.347	S	S	.	.	H	α-helix	trans	-66.2	-36.7	178.3	0	0	0	0	0	113.1	V294 E295 N302	V294-A298 WeakPolarHBondContact O-CB 3.21Å; V294-A298 PolarHBondContact O-N 3.2Å; E295-A298 PolarHBondContact O-N 3.2Å; A298-N302 PolarHBondContact O-N 3.34Å; A298-N302 PolarHBondContact O-ND2 2.77Å
299	E	88.9	Confident	88.2	Confident	135 Å²	135	57.8 Å²	57.8	63%	0.631	33%	0.326	S	S	*	.	H	α-helix	trans	-65.6	-50.1	173.4	-92.6	-178.4	154.3	0	0	111.8	E295 T296 W301 N302 C303	E295-E299 PolarHBondContact O-N 3.07Å; T296-E299 PolarHBondContact O-N 2.94Å; E299-W301 VanDerWaalsContact C-N 3.25Å; E299-W301 PolarHBondContact O-N 3.48Å; E299-N302 PolarHBondContact O-N 2.97Å; E299-C303 WeakPolarHBondContact O-CB 3.43Å; E299-C303 PolarHBondContact O-N 2.93Å
300	N	91.6	Very high	88.5	Confident	36 Å²	36	53.3 Å²	53.3	19%	0.193	30%	0.299	C	S	.	.	H	α-helix	trans	-60.4	-37.2	176.2	-75.8	-27.7	0	0	0	111.5	I280 I284 T296 V297 C303 L304	I280-N300 WeakPolarHBondContact CG2-O 3.19Å; I284-N300 HydrophobicContact CD1-CB 4.31Å; I284-N300 HydrophobicContact CG1-CB 3.7Å; T296-N300 WeakPolarHBondContact O-CB 3.46Å; T296-N300 PolarHBondContact O-N 3.09Å; T296-N300 PolarHBondContact O-ND2 2.92Å; V297-N300 PolarHBondContact O-N 2.78Å; N300-C303 WeakPolarHBondContact O-CB 3.45Å; N300-C303 PolarHBondContact O-N 3.27Å; N300-L304 WeakPolarHBondContact O-CB 3.44Å; N300-L304 PolarHBondContact O-N 3.02Å
301	W	92.7	Very high	89	Confident	32 Å²	32	45.7 Å²	45.7	12%	0.121	27%	0.265	C	S	.	.	H	α-helix	trans	-67.2	-41.8	176.3	-170.8	26.4	0	0	0	112.8	L90 P91 N212 P213 L214 V297 E299 C303 L304 Q305	L90-W301 HydrophobicContact CB-CD2 4.34Å; L90-W301 HydrophobicContact CB-CG 4.29Å; L90-W301 HydrophobicContact CB-CZ2 4.36Å; L90-W301 HydrophobicContact CD1-CB 4.21Å; L90-W301 HydrophobicContact CD1-CD2 4.01Å; L90-W301 HydrophobicContact CD1-CE3 4.41Å; L90-W301 HydrophobicContact CD1-CG 3.93Å; P91-W301 VanDerWaalsContact O-CZ2 3.28Å; P91-W301 WeakPolarHBondContact O-CZ2 3.4Å; P91-W301 PolarHBondContact O-NE1 3.13Å; N212-W301 HydrophobicContact CB-CH2 3.78Å; N212-W301 HydrophobicContact CB-CZ3 3.97Å; P213-W301 HydrophobicContact CB-CZ2 3.92Å; P213-W301 HydrophobicContact CG-CH2 4.34Å; P213-W301 HydrophobicContact CG-CZ2 3.7Å; L214-W301 HydrophobicContact CB-CH2 4.11Å; V297-W301 VanDerWaalsContact O-CB 3.26Å; V297-W301 WeakPolarHBondContact O-CB 3.41Å; V297-W301 PolarHBondContact O-N 3.45Å; E299-W301 VanDerWaalsContact C-N 3.25Å; E299-W301 PolarHBondContact O-N 3.48Å; W301-C303 VanDerWaalsContact C-N 3.33Å; W301-L304 PolarHBondContact O-N 3.41Å; W301-Q305 PolarHBondContact O-N 2.95Å; W301-Q305 VanDerWaalsContact O-N 3.09Å
302	N	89.9	Confident	89.6	Confident	54 Å²	54	40.9 Å²	40.9	29%	0.289	23%	0.231	S	C	.	.	H	α-helix	trans	-63.6	-40.3	172.4	-76.4	-47.5	0	0	0	111.4	A298 E299 Q305 M306	A298-N302 PolarHBondContact O-N 3.34Å; A298-N302 PolarHBondContact O-ND2 2.77Å; E299-N302 PolarHBondContact O-N 2.97Å; N302-Q305 WeakPolarHBondContact O-CB 3.39Å; N302-Q305 PolarHBondContact O-N 3.47Å; N302-M306 PolarHBondContact O-N 3.45Å
303	C	91	Very high	90.2	Very high	26 Å²	26	40.5 Å²	40.5	18%	0.176	22%	0.223	C	C	.	.	H	α-helix	trans	-60.6	-47.3	176.6	-169.2	0	0	0	0	111.3	E299 N300 W301 Q305 M306 L307 M323	E299-C303 WeakPolarHBondContact O-CB 3.43Å; E299-C303 PolarHBondContact O-N 2.93Å; N300-C303 WeakPolarHBondContact O-CB 3.45Å; N300-C303 PolarHBondContact O-N 3.27Å; W301-C303 VanDerWaalsContact C-N 3.33Å; C303-Q305 VanDerWaalsContact C-N 3.31Å; C303-Q305 PolarHBondContact O-N 3.29Å; C303-M306 PolarHBondContact O-N 3.01Å; C303-L307 WeakPolarHBondContact O-CG 3.44Å; C303-L307 PolarHBondContact O-N 3.39Å; C303-M323 WeakPolarHBondContact SG-CE 3.43Å
304	L	93.3	Very high	90.2	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-56.3	-45.1	174.6	-177.2	65.4	0	0	0	111.8	L88 I92 I277 I280 N281 I284 N300 W301 M306 L307 H308	L88-L304 HydrophobicContact CD2-CD1 4.22Å; L88-L304 HydrophobicContact CD2-CD2 4Å; L88-L304 HydrophobicContact CD2-CG 4.45Å; I92-L304 HydrophobicContact CG2-CD2 4.05Å; I92-L304 HydrophobicContact CG2-CG 4.25Å; I277-L304 HydrophobicContact CG2-CD1 3.88Å; I280-L304 HydrophobicContact CG2-CB 3.9Å; I280-L304 HydrophobicContact CG2-CD1 4.33Å; N281-L304 HydrophobicContact CB-CD1 4.48Å; I284-L304 HydrophobicContact CD1-CB 4.26Å; I284-L304 HydrophobicContact CD1-CD2 3.79Å; N300-L304 WeakPolarHBondContact O-CB 3.44Å; N300-L304 PolarHBondContact O-N 3.02Å; W301-L304 PolarHBondContact O-N 3.41Å; L304-M306 PolarHBondContact O-N 2.98Å; L304-L307 PolarHBondContact O-N 3.2Å; L304-H308 WeakPolarHBondContact O-CB 3.45Å; L304-H308 PolarHBondContact O-N 3.46Å
305	Q	91.7	Very high	90.2	Very high	8 Å²	8	37.5 Å²	37.5	4%	0.037	20%	0.196	C	C	.	.	H	α-helix	trans	-60.8	-43.6	177.2	-116.1	-171.6	19.6	0	0	112.6	I92 F173 W301 N302 C303 A309	I92-Q305 HydrophobicContact CB-CG 3.7Å; I92-Q305 HydrophobicContact CG2-CG 3.83Å; F173-Q305 HydrophobicContact CE1-CB 4.17Å; W301-Q305 PolarHBondContact O-N 2.95Å; W301-Q305 VanDerWaalsContact O-N 3.09Å; N302-Q305 WeakPolarHBondContact O-CB 3.39Å; N302-Q305 PolarHBondContact O-N 3.47Å; C303-Q305 VanDerWaalsContact C-N 3.31Å; C303-Q305 PolarHBondContact O-N 3.29Å; Q305-A309 WeakPolarHBondContact O-CB 3.34Å; Q305-A309 PolarHBondContact O-N 3.3Å
306	M	89.6	Confident	89.9	Confident	15 Å²	15	30.9 Å²	30.9	7%	0.074	17%	0.166	C	C	.	.	H	α-helix	trans	-67.3	-44.3	177.4	-84.5	174.2	57.2	0	0	112.6	F173 N302 C303 L304 H308 A309 L310 L319 P320 M323	F173-M306 HydrophobicContact CD1-CG 3.48Å; F173-M306 VanDerWaalsContact CD1-CG 3.48Å; F173-M306 HydrophobicContact CD1-SD 4.4Å; F173-M306 HydrophobicContact CD2-CG 4.22Å; F173-M306 HydrophobicContact CE1-CB 4.31Å; F173-M306 HydrophobicContact CE1-CG 3.5Å; F173-M306 HydrophobicContact CE2-CG 4.2Å; F173-M306 HydrophobicContact CG-CG 3.87Å; F173-M306 HydrophobicContact CZ-CB 4.46Å; F173-M306 HydrophobicContact CZ-CG 3.88Å; N302-M306 PolarHBondContact O-N 3.45Å; C303-M306 PolarHBondContact O-N 3.01Å; L304-M306 PolarHBondContact O-N 2.98Å; M306-H308 VanDerWaalsContact C-N 3.34Å; M306-H308 PolarHBondContact O-N 2.97Å; M306-A309 PolarHBondContact O-N 2.94Å; M306-L310 WeakPolarHBondContact O-CG 3.46Å; M306-L310 PolarHBondContact O-N 3.02Å; M306-L319 HydrophobicContact CB-CD2 4.26Å; M306-L319 HydrophobicContact CE-CD2 3.42Å; M306-L319 VanDerWaalsContact CE-CD2 3.42Å; M306-L319 HydrophobicContact CG-CD2 3.75Å; M306-L319 HydrophobicContact SD-CD2 4.11Å; M306-P320 HydrophobicContact CE-CG 3.53Å; M306-P320 HydrophobicContact SD-CG 3.89Å; M306-M323 HydrophobicContact CB-SD 4.25Å; M306-M323 HydrophobicContact CE-CB 3.35Å; M306-M323 HydrophobicContact CE-CG 3.61Å; M306-M323 HydrophobicContact CE-SD 3.13Å; M306-M323 WeakPolarHBondContact CE-SD 3.36Å; M306-M323 HydrophobicContact SD-SD 4.28Å
307	L	91.3	Very high	89.3	Confident	13 Å²	13	33.6 Å²	33.6	7%	0.068	19%	0.185	C	C	.	.	H	α-helix	trans	-61	-44	178.1	-72.1	176.3	0	0	0	111.6	E276 I277 I280 C303 L304 A309 L310 Y311	E276-L307 HydrophobicContact CB-CD1 4.2Å; E276-L307 VanDerWaalsContact OE2-CD2 3.28Å; E276-L307 WeakPolarHBondContact OE2-CD2 3.49Å; I277-L307 HydrophobicContact CG1-CB 3.91Å; I280-L307 HydrophobicContact CB-CD1 4.43Å; I280-L307 HydrophobicContact CG1-CD1 3.68Å; C303-L307 WeakPolarHBondContact O-CG 3.44Å; C303-L307 PolarHBondContact O-N 3.39Å; L304-L307 PolarHBondContact O-N 3.2Å; L307-A309 PolarHBondContact O-N 2.87Å; L307-L310 PolarHBondContact O-N 3.33Å; L307-Y311 WeakPolarHBondContact O-CB 3.47Å; L307-Y311 PolarHBondContact O-N 3.43Å
308	H	92.8	Very high	88.6	Confident	6 Å²	6	34.1 Å²	34.1	3%	0.028	20%	0.196	C	C	.	.	H	α-helix	trans	-65	-38.2	175	179.5	-101	0	0	0	112.4	I92 L245 I277 L304 M306 Y311 L312	I92-H308 HydrophobicContact CD1-CB 3.6Å; I92-H308 VanDerWaalsContact CD1-CG 3.49Å; L245-H308 WeakPolarHBondContact CD1-CE1 3.49Å; I277-H308 HydrophobicContact CD1-CB 4.33Å; L304-H308 WeakPolarHBondContact O-CB 3.45Å; L304-H308 PolarHBondContact O-N 3.46Å; M306-H308 VanDerWaalsContact C-N 3.34Å; M306-H308 PolarHBondContact O-N 2.97Å; H308-Y311 WeakPolarHBondContact O-CB 3.42Å; H308-Y311 PolarHBondContact O-N 3.42Å; H308-L312 PolarHBondContact O-N 2.86Å; H308-L312 VanDerWaalsContact O-N 3.15Å
309	A	92.1	Very high	88.1	Confident	1 Å²	1	33 Å²	33	1%	0.008	18%	0.184	C	C	.	.	H	α-helix	trans	-63.7	-42.4	173.8	0	0	0	0	0	112.7	L95 F173 Q305 M306 L307 Y311 L312 N313 V316	L95-A309 HydrophobicContact CD2-CB 4.3Å; F173-A309 HydrophobicContact CE2-CB 3.77Å; F173-A309 HydrophobicContact CZ-CB 3.39Å; Q305-A309 WeakPolarHBondContact O-CB 3.34Å; Q305-A309 PolarHBondContact O-N 3.3Å; M306-A309 PolarHBondContact O-N 2.94Å; L307-A309 PolarHBondContact O-N 2.87Å; A309-Y311 VanDerWaalsContact C-N 3.3Å; A309-Y311 PolarHBondContact O-N 3.44Å; A309-L312 PolarHBondContact O-N 3.36Å; A309-N313 PolarHBondContact O-N 3.02Å; A309-V316 HydrophobicContact CB-CG2 4.29Å
310	L	90.8	Very high	87.6	Confident	7 Å²	7	28.8 Å²	28.8	4%	0.037	17%	0.168	C	C	.	.	H	α-helix	trans	-63.2	-35.2	173.9	-73.4	172	0	0	0	112.2	M306 L307 L312 L319 S331	M306-L310 WeakPolarHBondContact O-CG 3.46Å; M306-L310 PolarHBondContact O-N 3.02Å; L307-L310 PolarHBondContact O-N 3.33Å; L310-L312 VanDerWaalsContact C-N 3.3Å; L310-L312 PolarHBondContact O-N 3.15Å; L310-L319 HydrophobicContact CD2-CD1 3.7Å; L310-L319 HydrophobicContact CG-CD1 4.42Å; L310-S331 WeakPolarHBondContact O-CB 3.17Å
311	Y	92.9	Very high	86.7	Confident	8 Å²	8	32.3 Å²	32.3	3%	0.031	19%	0.193	C	C	.	.	H	α-helix	trans	-61.6	-36.3	173.5	169.3	-101.3	0	0	0	112.5	P251 L270 K273 I274 I277 L307 H308 A309 S331 L332	P251-Y311 WeakPolarHBondContact CD-OH 3.25Å; P251-Y311 VanDerWaalsContact CG-OH 3.3Å; P251-Y311 WeakPolarHBondContact CG-OH 3.07Å; L270-Y311 HydrophobicContact CB-CE2 4.15Å; L270-Y311 HydrophobicContact CD2-CD2 3.85Å; L270-Y311 HydrophobicContact CD2-CE2 3.65Å; L270-Y311 HydrophobicContact CG-CE2 4.41Å; K273-Y311 HydrophobicContact CB-CD2 4.1Å; I274-Y311 HydrophobicContact CD1-CE2 3.89Å; I274-Y311 HydrophobicContact CG1-CD2 4.33Å; I274-Y311 HydrophobicContact CG1-CE2 3.82Å; I277-Y311 HydrophobicContact CD1-CG 4.41Å; L307-Y311 WeakPolarHBondContact O-CB 3.47Å; L307-Y311 PolarHBondContact O-N 3.43Å; H308-Y311 WeakPolarHBondContact O-CB 3.42Å; H308-Y311 PolarHBondContact O-N 3.42Å; A309-Y311 VanDerWaalsContact C-N 3.3Å; A309-Y311 PolarHBondContact O-N 3.44Å; Y311-S331 VanDerWaalsContact O-CB 3.24Å; Y311-S331 WeakPolarHBondContact O-CB 3.36Å; Y311-L332 HydrophobicContact CE1-CD1 3.84Å; Y311-L332 PolarHBondContact O-N 2.71Å
312	L	92.6	Very high	85.6	Confident	12 Å²	12	39.5 Å²	39.5	6%	0.063	23%	0.228	C	C	.	.	H	α-helix	trans	-79.7	-52	175.6	-66.6	179.3	0	0	0	112.4	L95 H308 A309 L310 S331 L332 A333	L95-L312 HydrophobicContact CB-CD1 4.02Å; H308-L312 PolarHBondContact O-N 2.86Å; H308-L312 VanDerWaalsContact O-N 3.15Å; A309-L312 PolarHBondContact O-N 3.36Å; L310-L312 VanDerWaalsContact C-N 3.3Å; L310-L312 PolarHBondContact O-N 3.15Å; L312-S331 PolarHBondContact O-OG 3.28Å; L312-L332 HydrophobicContact CD2-CD1 4.16Å; L312-L332 PolarHBondContact O-N 3.45Å; L312-A333 WeakPolarHBondContact O-CB 3.4Å; L312-A333 PolarHBondContact O-N 3.25Å
313	N	90.4	Very high	84.5	Confident	35 Å²	35	39.8 Å²	39.8	19%	0.187	23%	0.228	C	C	.	.			trans	-144.9	122.4	-176.8	-177.9	9.1	0	0	0	110.1	L95 A309 E315 V316 S331 A333 Q334	L95-N313 HydrophobicContact CD2-CB 3.79Å; A309-N313 PolarHBondContact O-N 3.02Å; N313-E315 VanDerWaalsContact C-N 3.31Å; N313-E315 PolarHBondContact O-N 3.18Å; N313-E315 PolarHBondContact OD1-N 3.03Å; N313-V316 WeakPolarHBondContact O-CG2 3.3Å; N313-S331 WeakPolarHBondContact CA-OG 3.36Å; N313-A333 HydrophobicContact CB-CB 3.93Å; N313-Q334 PolarHBondContact OD1-NE2 3.38Å; N313-Q334 PolarHBondContact OD1-OE1 2.83Å
314	S	86.3	Confident	83.2	Confident	21 Å²	21	45.3 Å²	45.3	15%	0.147	25%	0.249	C	C	.	.	S	Bend	trans	-76.5	-15.3	177.6	54.6	0	0	0	0	114.1	V316 I329 S331 Q334	S314-V316 PolarHBondContact O-N 3.46Å; S314-I329 WeakPolarHBondContact CB-O 3.06Å; S314-I329 PolarHBondContact OG-O 2.99Å; S314-S331 PolarHBondContact N-OG 3.49Å; S314-Q334 PolarHBondContact OG-NE2 3.49Å
315	E	83.8	Confident	81.6	Confident	103 Å²	103	48.6 Å²	48.6	48%	0.481	27%	0.27	S	S	.	.			trans	-98	54.9	179.3	-71.6	164.2	-135.7	0	0	111.4	N313 P317 F328 Q334 K337	N313-E315 VanDerWaalsContact C-N 3.31Å; N313-E315 PolarHBondContact O-N 3.18Å; N313-E315 PolarHBondContact OD1-N 3.03Å; E315-P317 WeakPolarHBondContact O-CD 3.35Å; E315-F328 HydrophobicContact CG-CE2 4.13Å; E315-Q334 PolarHBondContact OE1-NE2 2.71Å; E315-K337 IonicContact OE1-NZ 2.84Å; E315-K337 PolarHBondContact OE1-NZ 3.36Å; E315-K337 IonicContact OE2-NZ 2.9Å; E315-K337 PolarHBondContact OE2-NZ 3.46Å
316	V	80.4	Confident	80.2	Confident	14 Å²	14	58.4 Å²	58.4	9%	0.085	32%	0.315	C	S	.	.			trans	-86.3	122.8	177.6	-156.9	0	0	0	0	110.6	L95 F173 A309 N313 S314 L319	L95-V316 HydrophobicContact CD1-CG1 3.73Å; L95-V316 HydrophobicContact CD2-CG1 4.33Å; L95-V316 HydrophobicContact CD2-CG2 3.85Å; F173-V316 HydrophobicContact CD2-CG1 4.26Å; F173-V316 HydrophobicContact CE2-CB 4.41Å; F173-V316 HydrophobicContact CE2-CG1 3.83Å; A309-V316 HydrophobicContact CB-CG2 4.29Å; N313-V316 WeakPolarHBondContact O-CG2 3.3Å; S314-V316 PolarHBondContact O-N 3.46Å; V316-L319 HydrophobicContact CB-CD1 3.93Å; V316-L319 HydrophobicContact CB-CG 4.24Å; V316-L319 HydrophobicContact CG2-CD1 4.38Å
317	P	76	Confident	79.2	Confident	115 Å²	115	66.3 Å²	66.3	75%	0.747	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.1	141.3	173.3	26.4	-31	0	0	0	110.8	E315	E315-P317 WeakPolarHBondContact O-CD 3.35Å
318	G	74.9	Confident	78.4	Confident	37 Å²	37	71.8 Å²	71.8	38%	0.381	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	91.5	9.5	174.9	0	0	0	0	0	116.1
319	L	77.9	Confident	77.9	Confident	15 Å²	15	72.3 Å²	72.3	8%	0.079	38%	0.376	C	S	.	.			trans	-69.4	133.5	172.1	-73.4	162.6	0	0	0	111.2	F173 M306 L310 V316 K324	F173-L319 HydrophobicContact CD2-CD2 3.88Å; F173-L319 HydrophobicContact CD2-CG 4.29Å; F173-L319 HydrophobicContact CE2-CD2 4.01Å; M306-L319 HydrophobicContact CB-CD2 4.26Å; M306-L319 HydrophobicContact CE-CD2 3.42Å; M306-L319 VanDerWaalsContact CE-CD2 3.42Å; M306-L319 HydrophobicContact CG-CD2 3.75Å; M306-L319 HydrophobicContact SD-CD2 4.11Å; L310-L319 HydrophobicContact CD2-CD1 3.7Å; L310-L319 HydrophobicContact CG-CD1 4.42Å; V316-L319 HydrophobicContact CB-CD1 3.93Å; V316-L319 HydrophobicContact CB-CG 4.24Å; V316-L319 HydrophobicContact CG2-CD1 4.38Å; L319-K324 HydrophobicContact CB-CG 4.46Å
320	P	76.8	Confident	77.8	Confident	47 Å²	47	80.4 Å²	80.4	31%	0.305	41%	0.406	S	S	.	.			trans	-58.4	146.2	172.2	19.5	-31.6	0	0	0	112.2	M306 Q322 M323 K324	M306-P320 HydrophobicContact CE-CG 3.53Å; M306-P320 HydrophobicContact SD-CG 3.89Å; P320-Q322 VanDerWaalsContact C-N 3.27Å; P320-Q322 PolarHBondContact O-N 3.18Å; P320-M323 PolarHBondContact O-N 2.99Å; P320-M323 VanDerWaalsContact O-N 3.11Å; P320-K324 PolarHBondContact O-N 3.29Å
321	P	73	Confident	77.8	Confident	109 Å²	109	80.1 Å²	80.1	71%	0.708	40%	0.404	S	S	*	.	G	3₁₀ helix	trans	-59.9	-32.8	-171.5	20.3	-30.8	0	0	0	113.7	M323 K324	P321-M323 PolarHBondContact O-N 3.44Å; P321-K324 PolarHBondContact O-N 3.09Å
322	Q	70	Confident	77.8	Confident	184 Å²	184	82.1 Å²	82.1	86%	0.86	42%	0.416	S	S	*	.	G	3₁₀ helix	trans	-62.3	-27.3	179.2	-65.5	141.3	-23	0	0	113.3	P320	P320-Q322 VanDerWaalsContact C-N 3.27Å; P320-Q322 PolarHBondContact O-N 3.18Å
323	M	66.3	Low	77.8	Confident	60 Å²	60	81.8 Å²	81.8	30%	0.296	42%	0.415	S	S	.	.	G	3₁₀ helix	trans	-102.6	-0.6	-179.6	-85.1	-146.9	169.3	0	0	114	C303 M306 P320 P321 T325	C303-M323 WeakPolarHBondContact SG-CE 3.43Å; M306-M323 HydrophobicContact CB-SD 4.25Å; M306-M323 HydrophobicContact CE-CB 3.35Å; M306-M323 HydrophobicContact CE-CG 3.61Å; M306-M323 HydrophobicContact CE-SD 3.13Å; M306-M323 WeakPolarHBondContact CE-SD 3.36Å; M306-M323 HydrophobicContact SD-SD 4.28Å; P320-M323 PolarHBondContact O-N 2.99Å; P320-M323 VanDerWaalsContact O-N 3.11Å; P321-M323 PolarHBondContact O-N 3.44Å; M323-T325 VanDerWaalsContact C-N 3.31Å; M323-T325 PolarHBondContact O-N 3.37Å
324	K	65	Low	77.8	Confident	142 Å²	142	81.3 Å²	81.3	62%	0.617	41%	0.411	S	S	*	.	S	Bend	trans	-71.5	93.5	167	-81.3	-176.4	176.2	178	0	108.2	L319 P320 P321 Q326	L319-K324 HydrophobicContact CB-CG 4.46Å; P320-K324 PolarHBondContact O-N 3.29Å; P321-K324 PolarHBondContact O-N 3.09Å; K324-Q326 PolarHBondContact O-N 3.44Å
325	T	59.3	Low	78	Confident	69 Å²	69	82.4 Å²	82.4	42%	0.423	41%	0.412	S	S	.	.			trans	-56.2	128.3	175.2	48.6	0	0	0	0	110	M323 K327 I329	M323-T325 VanDerWaalsContact C-N 3.31Å; M323-T325 PolarHBondContact O-N 3.37Å; T325-K327 PolarHBondContact O-N 2.91Å; T325-K327 PolarHBondContact OG1-O 2.87Å; T325-I329 HydrophobicContact CG2-CD1 4.17Å
326	Q	62.6	Low	78.4	Confident	214 Å²	214	80.2 Å²	80.2	100%	1	40%	0.403	S	S	*	.	S	Bend	trans	-58.5	-29.8	175.1	-77.6	-162.8	-9.7	0	0	112.3	K324	K324-Q326 PolarHBondContact O-N 3.44Å
327	K	68.3	Low	78.8	Confident	180 Å²	180	82 Å²	82	78%	0.783	41%	0.41	S	S	*	.	S	Bend	trans	-90.2	127	178	-130	177.2	-176.8	179.8	0	110.5	T325 I329	T325-K327 PolarHBondContact O-N 2.91Å; T325-K327 PolarHBondContact OG1-O 2.87Å; K327-I329 PolarHBondContact O-N 3.21Å
328	F	75.2	Confident	79.2	Confident	128 Å²	128	78.7 Å²	78.7	56%	0.561	40%	0.396	S	S	*	.			trans	-71.3	115.5	177.8	-171	-92	0	0	0	110.8	E315 Q334	E315-F328 HydrophobicContact CG-CE2 4.13Å; F328-Q334 HydrophobicContact CE1-CG 3.73Å; F328-Q334 HydrophobicContact CZ-CG 3.66Å
329	I	82.5	Confident	79.7	Confident	18 Å²	18	84.2 Å²	84.2	9%	0.092	41%	0.41	C	S	.	.			trans	-86.1	135.9	-177.9	-61.4	160.9	0	0	0	110.3	D269 S314 T325 K327 S331	D269-I329 HydrophobicContact CB-CG2 3.86Å; S314-I329 WeakPolarHBondContact CB-O 3.06Å; S314-I329 PolarHBondContact OG-O 2.99Å; T325-I329 HydrophobicContact CG2-CD1 4.17Å; K327-I329 PolarHBondContact O-N 3.21Å; I329-S331 PolarHBondContact O-N 3.01Å; I329-S331 VanDerWaalsContact O-N 3.16Å
330	R	88.3	Confident	80.2	Confident	171 Å²	171	89.4 Å²	89.4	65%	0.645	43%	0.434	S	S	*	.			trans	-86.2	74.8	173.8	-70.3	-174	-178.9	175.9	2.6	112.1	D269 R335	D269-R330 PolarHBondContact OD2-N 2.85Å; R330-R335 PolarHBondContact O-NE 3.05Å; R330-R335 VanDerWaalsContact O-NE 3.1Å; R330-R335 PolarHBondContact O-NH2 2.8Å
331	S	91.3	Very high	80.8	Confident	0 Å²	0	87.1 Å²	87.1	0%	0	42%	0.419	C	S	.	.			trans	-69.2	173.6	172.4	58.9	0	0	0	0	112.8	L310 Y311 L312 N313 S314 I329 A333 Q334 R335	L310-S331 WeakPolarHBondContact O-CB 3.17Å; Y311-S331 VanDerWaalsContact O-CB 3.24Å; Y311-S331 WeakPolarHBondContact O-CB 3.36Å; L312-S331 PolarHBondContact O-OG 3.28Å; N313-S331 WeakPolarHBondContact CA-OG 3.36Å; S314-S331 PolarHBondContact N-OG 3.49Å; I329-S331 PolarHBondContact O-N 3.01Å; I329-S331 VanDerWaalsContact O-N 3.16Å; S331-A333 PolarHBondContact O-N 3.29Å; S331-Q334 PolarHBondContact O-N 3.28Å; S331-Q334 VanDerWaalsContact OG-CD 3.31Å; S331-Q334 PolarHBondContact OG-OE1 3.08Å; S331-R335 PolarHBondContact O-N 2.69Å
332	L	92.6	Very high	81.7	Confident	51 Å²	51	87.3 Å²	87.3	27%	0.267	41%	0.406	S	S	.	.	H	α-helix	trans	-58.2	-44.8	-174.9	-69.9	173.8	0	0	0	113.1	L270 Y311 L312 Q334 R335 L336	L270-L332 HydrophobicContact CD1-CD2 3.82Å; L270-L332 HydrophobicContact CD2-CD2 4.32Å; L270-L332 HydrophobicContact CD2-CG 4.16Å; Y311-L332 HydrophobicContact CE1-CD1 3.84Å; Y311-L332 PolarHBondContact O-N 2.71Å; L312-L332 HydrophobicContact CD2-CD1 4.16Å; L312-L332 PolarHBondContact O-N 3.45Å; L332-Q334 VanDerWaalsContact C-N 3.33Å; L332-Q334 PolarHBondContact O-N 3.36Å; L332-R335 PolarHBondContact O-N 3.23Å; L332-L336 WeakPolarHBondContact O-CG 3.47Å; L332-L336 PolarHBondContact O-N 3.36Å
333	A	92	Very high	82.6	Confident	5 Å²	5	79.5 Å²	79.5	4%	0.041	37%	0.369	C	S	.	.	H	α-helix	trans	-59.7	-41.5	178.1	0	0	0	0	0	112.4	L312 N313 S331 R335 L336 K337 T1330	L312-A333 WeakPolarHBondContact O-CB 3.4Å; L312-A333 PolarHBondContact O-N 3.25Å; N313-A333 HydrophobicContact CB-CB 3.93Å; S331-A333 PolarHBondContact O-N 3.29Å; A333-R335 VanDerWaalsContact C-N 3.3Å; A333-R335 PolarHBondContact O-N 3.09Å; A333-L336 PolarHBondContact O-N 3.45Å; A333-L336 VanDerWaalsContact O-N 3.11Å; A333-K337 WeakPolarHBondContact O-CB 3.39Å; A333-K337 VanDerWaalsContact O-CG 3.27Å; A333-K337 WeakPolarHBondContact O-CG 2.97Å; A333-K337 PolarHBondContact O-N 3.35Å; A333-T1330 HydrophobicContact CB-CG2 3.7Å
334	Q	90.5	Very high	83.7	Confident	24 Å²	24	81.1 Å²	81.1	11%	0.112	37%	0.372	C	S	.	.	H	α-helix	trans	-67.3	-31	-179.5	-84.9	62.9	7.1	0	0	111.4	N313 S314 E315 F328 S331 L332 L336 K337	N313-Q334 PolarHBondContact OD1-NE2 3.38Å; N313-Q334 PolarHBondContact OD1-OE1 2.83Å; S314-Q334 PolarHBondContact OG-NE2 3.49Å; E315-Q334 PolarHBondContact OE1-NE2 2.71Å; F328-Q334 HydrophobicContact CE1-CG 3.73Å; F328-Q334 HydrophobicContact CZ-CG 3.66Å; S331-Q334 PolarHBondContact O-N 3.28Å; S331-Q334 VanDerWaalsContact OG-CD 3.31Å; S331-Q334 PolarHBondContact OG-OE1 3.08Å; L332-Q334 VanDerWaalsContact C-N 3.33Å; L332-Q334 PolarHBondContact O-N 3.36Å; Q334-L336 VanDerWaalsContact C-N 3.34Å; Q334-K337 VanDerWaalsContact NE2-NZ 3.13Å
335	R	92.4	Very high	84.9	Confident	44 Å²	44	79.2 Å²	79.2	17%	0.166	36%	0.364	C	S	.	.	H	α-helix	trans	-72.2	-27.9	172.8	-64.6	177.3	-170.9	-136.3	-11.8	112.5	D268 R330 S331 L332 A333 G341 R342	D268-R335 IonicContact OD1-CZ 3.71Å; D268-R335 IonicContact OD1-NH1 2.69Å; D268-R335 IonicContact OD1-NH2 3.78Å; D268-R335 PolarHBondContact OD1-NH2 3.27Å; D268-R335 IonicContact OD2-CZ 2.87Å; D268-R335 IonicContact OD2-NH1 3.37Å; D268-R335 PolarHBondContact OD2-NH1 2.8Å; D268-R335 IonicContact OD2-NH2 3.67Å; D268-R335 PolarHBondContact OD2-NH2 3.48Å; R330-R335 PolarHBondContact O-NE 3.05Å; R330-R335 VanDerWaalsContact O-NE 3.1Å; R330-R335 PolarHBondContact O-NH2 2.8Å; S331-R335 PolarHBondContact O-N 2.69Å; L332-R335 PolarHBondContact O-N 3.23Å; A333-R335 VanDerWaalsContact C-N 3.3Å; A333-R335 PolarHBondContact O-N 3.09Å; R335-G341 CarbonylContact O-C 3.49Å; R335-G341 VanDerWaalsContact O-CA 3.25Å; R335-G341 WeakPolarHBondContact O-CA 3.32Å; R335-R342 WeakPolarHBondContact O-CG 3.23Å; R335-R342 PolarHBondContact O-N 3.39Å
336	L	92.1	Very high	86.5	Confident	57 Å²	57	79 Å²	79	30%	0.298	36%	0.36	S	S	.	.	H	α-helix	trans	-90.2	-42.4	-177.9	-65.3	174.7	0	0	0	112.9	L332 A333 Q334 R342 F343 T1329	L332-L336 WeakPolarHBondContact O-CG 3.47Å; L332-L336 PolarHBondContact O-N 3.36Å; A333-L336 PolarHBondContact O-N 3.45Å; A333-L336 VanDerWaalsContact O-N 3.11Å; Q334-L336 VanDerWaalsContact C-N 3.34Å; L336-R342 HydrophobicContact CD2-CB 4.25Å; L336-R342 HydrophobicContact CD2-CG 4.33Å; L336-F343 HydrophobicContact CD2-CE2 4.32Å; L336-T1329 HydrophobicContact CB-CG2 4.37Å
337	K	88.3	Confident	87.9	Confident	52 Å²	52	71.9 Å²	71.9	23%	0.226	33%	0.328	C	S	.	.	S	Bend	trans	-84.8	158.1	-172	80.7	-171.8	-175.6	177.6	0	113	E315 A333 Q334 G341	E315-K337 IonicContact OE1-NZ 2.84Å; E315-K337 PolarHBondContact OE1-NZ 3.36Å; E315-K337 IonicContact OE2-NZ 2.9Å; E315-K337 PolarHBondContact OE2-NZ 3.46Å; A333-K337 WeakPolarHBondContact O-CB 3.39Å; A333-K337 VanDerWaalsContact O-CG 3.27Å; A333-K337 WeakPolarHBondContact O-CG 2.97Å; A333-K337 PolarHBondContact O-N 3.35Å; Q334-K337 VanDerWaalsContact NE2-NZ 3.13Å; K337-G341 WeakPolarHBondContact O-CA 3.48Å; K337-G341 PolarHBondContact O-N 3.04Å
338	G	84.1	Confident	88.9	Confident	45 Å²	45	66 Å²	66	46%	0.464	31%	0.309	S	S	.	.	S	Bend	trans	85.4	-173.2	170.1	0	0	0	0	0	115	G341	G338-G341 PolarHBondContact O-N 3.02Å
339	K	85.1	Confident	89.5	Confident	154 Å²	154	61.5 Å²	61.5	67%	0.67	30%	0.299	S	S	*	.	S	Bend	trans	-69.4	-39.1	-177.7	-170	178.8	179.1	-176.9	0	112.2	G341 K345	K339-G341 VanDerWaalsContact C-N 3.29Å; K339-K345 WeakPolarHBondContact O-CB 3.49Å
340	E	88.4	Confident	89.9	Confident	123 Å²	123	68 Å²	68	58%	0.575	33%	0.327	S	S	*	.	S	Bend	trans	-82.7	-6.5	176.8	-63.8	-61.3	132.8	0	0	113.2	K345	E340-K345 WeakPolarHBondContact OE2-CD 3.29Å; E340-K345 WeakPolarHBondContact OE2-CE 3.47Å; E340-K345 IonicContact OE2-NZ 3.54Å; E340-K345 PolarHBondContact OE2-NZ 3.46Å
341	G	89.1	Confident	90.1	Very high	0 Å²	0	71.6 Å²	71.6	0%	0	34%	0.341	C	S	.	.	S	Bend	trans	-72.3	160.3	179.9	0	0	0	0	0	113	R335 K337 G338 K339 F343 R344 K345	R335-G341 CarbonylContact O-C 3.49Å; R335-G341 VanDerWaalsContact O-CA 3.25Å; R335-G341 WeakPolarHBondContact O-CA 3.32Å; K337-G341 WeakPolarHBondContact O-CA 3.48Å; K337-G341 PolarHBondContact O-N 3.04Å; G338-G341 PolarHBondContact O-N 3.02Å; K339-G341 VanDerWaalsContact C-N 3.29Å; G341-F343 PolarHBondContact O-N 3.22Å; G341-R344 PolarHBondContact O-N 3.44Å; G341-K345 WeakPolarHBondContact O-CB 3.47Å; G341-K345 PolarHBondContact O-N 3.38Å
342	R	91.4	Very high	90.2	Very high	112 Å²	112	74.9 Å²	74.9	42%	0.423	36%	0.361	S	S	.	.	H	α-helix	trans	-54.8	-46.3	-175.3	-68.2	-66.5	178.5	-107.4	0.9	113.5	R335 L336 R344 N346 L347	R335-R342 WeakPolarHBondContact O-CG 3.23Å; R335-R342 PolarHBondContact O-N 3.39Å; L336-R342 HydrophobicContact CD2-CB 4.25Å; L336-R342 HydrophobicContact CD2-CG 4.33Å; R342-R344 VanDerWaalsContact C-N 3.28Å; R342-R344 PolarHBondContact O-N 2.99Å; R342-N346 WeakPolarHBondContact CD-ND2 3.46Å; R342-N346 PolarHBondContact NH1-ND2 2.63Å; R342-N346 PolarHBondContact O-N 2.69Å; R342-N346 VanDerWaalsContact O-N 3.08Å; R342-L347 WeakPolarHBondContact O-CG 3.22Å; R342-L347 PolarHBondContact O-N 3.5Å
343	F	90.3	Very high	90.3	Very high	21 Å²	21	79 Å²	79	9%	0.092	38%	0.383	C	S	.	.	I	π-helix	trans	-58.4	-37.5	-177.2	-80.1	-88.2	0	0	0	113.4	L336 G341 L347 S348 I1321 A1324 T1329 L1333 I1353	L336-F343 HydrophobicContact CD2-CE2 4.32Å; G341-F343 PolarHBondContact O-N 3.22Å; F343-L347 HydrophobicContact CD1-CD1 4.26Å; F343-L347 HydrophobicContact CG-CD1 4.42Å; F343-S348 VanDerWaalsContact O-CB 3.29Å; F343-S348 WeakPolarHBondContact O-CB 3.32Å; F343-S348 PolarHBondContact O-N 3.03Å; F343-S348 PolarHBondContact O-OG 3.5Å; F343-I1321 HydrophobicContact CE1-CG2 4.47Å; F343-A1324 HydrophobicContact CE1-CB 4.09Å; F343-A1324 HydrophobicContact CZ-CB 4.12Å; F343-T1329 HydrophobicContact CD2-CG2 3.24Å; F343-T1329 HydrophobicContact CE2-CG2 3.28Å; F343-T1329 HydrophobicContact CG-CG2 4.06Å; F343-T1329 HydrophobicContact CZ-CG2 4.12Å; F343-L1333 HydrophobicContact CE2-CD1 4.12Å; F343-L1333 HydrophobicContact CZ-CD1 4.16Å; F343-I1353 HydrophobicContact CD1-CD1 4.41Å
344	R	88.5	Confident	90.4	Very high	93 Å²	93	82.4 Å²	82.4	35%	0.351	40%	0.395	S	S	.	.	I	π-helix	trans	-92.7	-47.5	-179	-69.6	-170.8	72.7	-179.7	3.8	113.4	G341 R342 G349	G341-R344 PolarHBondContact O-N 3.44Å; R342-R344 VanDerWaalsContact C-N 3.28Å; R342-R344 PolarHBondContact O-N 2.99Å; R344-G349 PolarHBondContact O-N 2.96Å
345	K	90.8	Very high	90.7	Very high	103 Å²	103	84 Å²	84	45%	0.448	41%	0.409	S	S	.	.	I	π-helix	trans	-87.3	-26	-170	-177.6	172.3	177.5	-178.8	0	114.9	K339 E340 G341 G349	K339-K345 WeakPolarHBondContact O-CB 3.49Å; E340-K345 WeakPolarHBondContact OE2-CD 3.29Å; E340-K345 WeakPolarHBondContact OE2-CE 3.47Å; E340-K345 IonicContact OE2-NZ 3.54Å; E340-K345 PolarHBondContact OE2-NZ 3.46Å; G341-K345 WeakPolarHBondContact O-CB 3.47Å; G341-K345 PolarHBondContact O-N 3.38Å; K345-G349 CarbonylContact C-O 3.57Å; K345-G349 CarbonylContact O-C 3.59Å
346	N	93	Very high	90.8	Very high	65 Å²	65	82.6 Å²	82.6	35%	0.348	41%	0.408	S	S	.	.	I	π-helix	trans	-115.8	-32.1	-173.1	-65.9	41.9	0	0	0	112.8	R342 G349	R342-N346 WeakPolarHBondContact CD-ND2 3.46Å; R342-N346 PolarHBondContact NH1-ND2 2.63Å; R342-N346 PolarHBondContact O-N 2.69Å; R342-N346 VanDerWaalsContact O-N 3.08Å; N346-G349 CarbonylContact C-O 3.4Å; N346-G349 VanDerWaalsContact CA-O 3.28Å; N346-G349 WeakPolarHBondContact CA-O 3.03Å; N346-G349 PolarHBondContact N-O 2.99Å; N346-G349 VanDerWaalsContact N-O 3.15Å
347	L	92.3	Very high	91	Very high	64 Å²	64	86 Å²	86	34%	0.335	42%	0.417	S	S	.	.	I	π-helix	trans	-97	-65	-176.8	-60.4	174.6	0	0	0	111.2	R342 F343 I1353	R342-L347 WeakPolarHBondContact O-CG 3.22Å; R342-L347 PolarHBondContact O-N 3.5Å; F343-L347 HydrophobicContact CD1-CD1 4.26Å; F343-L347 HydrophobicContact CG-CD1 4.42Å; L347-I1353 HydrophobicContact CB-CG1 4.12Å; L347-I1353 HydrophobicContact CB-CG2 4.37Å; L347-I1353 HydrophobicContact CD1-CG2 4.01Å; L347-I1353 HydrophobicContact CD2-CG2 4.43Å
348	S	88.6	Confident	91.4	Very high	55 Å²	55	84.9 Å²	84.9	39%	0.385	42%	0.415	S	S	.	.	I	π-helix	trans	-69	-41.6	-178.7	-55.9	0	0	0	0	112.9	F343	F343-S348 VanDerWaalsContact O-CB 3.29Å; F343-S348 WeakPolarHBondContact O-CB 3.32Å; F343-S348 PolarHBondContact O-N 3.03Å; F343-S348 PolarHBondContact O-OG 3.5Å
349	G	88.6	Confident	92	Very high	34 Å²	34	85.3 Å²	85.3	35%	0.351	41%	0.409	S	S	.	.	S	Bend	trans	-116	149.4	168.2	0	0	0	0	0	108.7	R344 K345 N346	R344-G349 PolarHBondContact O-N 2.96Å; K345-G349 CarbonylContact C-O 3.57Å; K345-G349 CarbonylContact O-C 3.59Å; N346-G349 CarbonylContact C-O 3.4Å; N346-G349 VanDerWaalsContact CA-O 3.28Å; N346-G349 WeakPolarHBondContact CA-O 3.03Å; N346-G349 PolarHBondContact N-O 2.99Å; N346-G349 VanDerWaalsContact N-O 3.15Å
350	K	90.3	Very high	92.6	Very high	156 Å²	156	78.3 Å²	78.3	68%	0.678	38%	0.378	S	S	*	.			trans	-150.9	157.4	171.9	60.1	-174	170.7	-171.9	0	109.9	V352	K350-V352 HydrophobicContact CG-CG1 4.27Å
351	R	91.3	Very high	93	Very high	245 Å²	245	73.3 Å²	73.3	93%	0.925	36%	0.357	S	S	*	.			trans	-69.8	137.3	165.9	-69.4	-177.1	177.4	-113.3	0.7	107.9
352	V	94	Very high	93.3	Very high	69 Å²	69	76 Å²	76	42%	0.418	37%	0.374	S	S	.	.			trans	-118.1	146.4	180	-63.4	0	0	0	0	109.1	K350 S355	K350-V352 HydrophobicContact CG-CG1 4.27Å; V352-S355 PolarHBondContact O-OG 3.49Å
353	D	94.2	Very high	93.5	Very high	139 Å²	139	71.8 Å²	71.8	74%	0.743	36%	0.36	S	S	*	.	S	Bend	trans	-81.6	176.3	172.9	-59.4	-26.3	0	0	0	110.2	S355	D353-S355 PolarHBondContact O-N 3.45Å
354	Y	95.7	Very high	93.6	Very high	75 Å²	75	72.1 Å²	72.1	29%	0.294	37%	0.365	S	S	.	.	S	Bend	trans	55.2	40.5	-179.5	-57.6	-83.7	0	0	0	113.4	F500 Q502	Y354-F500 PolarHBondContact O-N 3.13Å; Y354-Q502 HydrophobicContact CD2-CG 3.83Å; Y354-Q502 HydrophobicContact CE2-CG 4.26Å; Y354-Q502 HydrophobicContact CG-CG 4.03Å
355	S	96.2	Very high	93.7	Very high	57 Å²	57	72.1 Å²	72.1	40%	0.399	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	146.8	173.4	66.3	0	0	0	0	112	V352 D353 L498 H499	V352-S355 PolarHBondContact O-OG 3.49Å; D353-S355 PolarHBondContact O-N 3.45Å; S355-L498 CarbonylContact C-O 3.54Å; S355-L498 WeakPolarHBondContact CA-O 2.97Å; S355-L498 WeakPolarHBondContact CB-O 3.38Å; S355-H499 WeakPolarHBondContact CB-ND1 3.43Å
356	G	94.8	Very high	93.8	Very high	15 Å²	15	67.9 Å²	67.9	16%	0.155	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	157.1	171.7	0	0	0	0	0	111.3	N497 L498	G356-N497 CarbonylContact O-C 3.53Å; G356-N497 WeakPolarHBondContact O-CA 3.42Å; G356-L498 PolarHBondContact N-O 2.91Å; G356-L498 PolarHBondContact O-N 3.06Å
357	R	96.1	Very high	93.7	Very high	128 Å²	128	65 Å²	65	48%	0.483	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	133.5	174	-179.2	179.5	171.7	133.1	-0.7	109	E495 M496 N497	R357-E495 HydrophobicContact CG-CB 4.19Å; R357-E495 IonicContact CZ-OE2 2.77Å; R357-E495 VanDerWaalsContact CZ-OE2 3.24Å; R357-E495 IonicContact NE-OE2 3.81Å; R357-E495 PolarHBondContact NE-OE2 3.4Å; R357-E495 IonicContact NH2-OE2 3.9Å; R357-E495 PolarHBondContact NH2-OE2 2.82Å; R357-M496 WeakPolarHBondContact CA-O 3.24Å; R357-N497 WeakPolarHBondContact CD-OD1 3.4Å; R357-N497 WeakPolarHBondContact CG-OD1 3.35Å
358	T	96.4	Very high	93.8	Very high	30 Å²	30	62 Å²	62	18%	0.184	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161	156.6	-174.8	-69.2	0	0	0	0	109.4	R475 F477 E495 M496	T358-R475 WeakPolarHBondContact CG2-O 3.3Å; T358-F477 HydrophobicContact CG2-CD2 4.48Å; T358-E495 WeakPolarHBondContact O-CA 3.46Å; T358-M496 PolarHBondContact N-O 2.66Å; T358-M496 PolarHBondContact O-N 2.84Å; T358-M496 VanDerWaalsContact O-N 3.16Å
359	V	97.4	Very high	94	Very high	54 Å²	54	60 Å²	60	33%	0.327	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.5	139.9	172.8	179.6	0	0	0	0	111.2	T476 F477 D494 E495	V359-T476 HydrophobicContact CB-CG2 4.38Å; V359-T476 WeakPolarHBondContact O-CA 3.4Å; V359-T476 WeakPolarHBondContact O-CB 3.47Å; V359-F477 PolarHBondContact O-N 3.26Å; V359-D494 WeakPolarHBondContact CA-O 3.19Å; V359-E495 HydrophobicContact CG2-CG 3.96Å
360	I	97.1	Very high	94.3	Very high	6 Å²	6	59.1 Å²	59.1	3%	0.031	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	151.2	176.1	56.7	165.3	0	0	0	112.4	F453 F477 F479 A489 F491 D494 M496	I360-F453 HydrophobicContact CG2-CZ 3.9Å; I360-F477 CarbonylContact C-O 3.4Å; I360-F477 WeakPolarHBondContact CA-O 3.48Å; I360-F477 HydrophobicContact CG2-CB 4.23Å; I360-F479 HydrophobicContact CB-CE1 3.94Å; I360-F479 HydrophobicContact CD1-CE1 3.96Å; I360-F479 HydrophobicContact CD1-CZ 4.2Å; I360-F479 HydrophobicContact CG2-CE1 3.94Å; I360-A489 HydrophobicContact CD1-CB 3.68Å; I360-F491 HydrophobicContact CB-CD1 4.19Å; I360-F491 HydrophobicContact CB-CE1 4.25Å; I360-F491 HydrophobicContact CD1-CD1 3.76Å; I360-F491 HydrophobicContact CD1-CE1 3.98Å; I360-F491 HydrophobicContact CG1-CD1 3.84Å; I360-F491 HydrophobicContact CG1-CE1 4.27Å; I360-D494 HydrophobicContact CD1-CB 3.98Å; I360-D494 HydrophobicContact CG1-CB 4.02Å; I360-D494 WeakPolarHBondContact CG1-O 3.36Å; I360-D494 PolarHBondContact N-O 3.23Å; I360-M496 HydrophobicContact CD1-CG 4.49Å; I360-M496 HydrophobicContact CD1-SD 4.09Å; I360-M496 HydrophobicContact CG2-CB 3.7Å; I360-M496 HydrophobicContact CG2-CG 3.69Å; I360-M496 HydrophobicContact CG2-SD 3.8Å
361	S	96.9	Very high	94.6	Very high	18 Å²	18	51.7 Å²	51.7	13%	0.126	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	150.2	177	47.7	0	0	0	0	110.4	T476 F477 R478 F479	S361-T476 VanDerWaalsContact OG-CB 3.29Å; S361-T476 WeakPolarHBondContact OG-CB 3.35Å; S361-T476 PolarHBondContact OG-OG1 3.29Å; S361-F477 PolarHBondContact N-O 3.07Å; S361-F477 PolarHBondContact OG-O 3.44Å; S361-R478 VanDerWaalsContact O-CA 3.27Å; S361-R478 WeakPolarHBondContact O-CA 3.47Å; S361-R478 WeakPolarHBondContact OG-CG 3.35Å; S361-F479 PolarHBondContact O-N 2.94Å
362	P	95.8	Very high	94.9	Very high	56 Å²	56	40 Å²	40	36%	0.364	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	147.8	-180	28.2	-33.4	0	0	0	111.8	E481 F491	P362-E481 HydrophobicContact CB-CG 3.83Å; P362-E481 WeakPolarHBondContact CB-OE1 3.36Å; P362-F491 HydrophobicContact CB-CD2 4.18Å; P362-F491 HydrophobicContact CB-CE1 4.38Å; P362-F491 HydrophobicContact CB-CE2 3.8Å; P362-F491 HydrophobicContact CB-CZ 3.91Å; P362-F491 HydrophobicContact CG-CD2 4.39Å
363	D	94.4	Very high	95.1	Very high	24 Å²	24	36.8 Å²	36.8	13%	0.128	20%	0.198	C	C	.	.			trans	-150.5	100.7	164.4	-169.1	-18.1	0	0	0	110.7	N365 L366 R478 F479	D363-N365 PolarHBondContact O-N 3.1Å; D363-N365 WeakPolarHBondContact OD1-CB 3.22Å; D363-N365 PolarHBondContact OD1-N 3.02Å; D363-N365 PolarHBondContact OD1-ND2 3.08Å; D363-L366 HydrophobicContact CB-CD1 3.97Å; D363-L366 HydrophobicContact CB-CG 4.1Å; D363-L366 PolarHBondContact O-N 3.18Å; D363-R478 HydrophobicContact CB-CB 3.94Å; D363-R478 HydrophobicContact CB-CG 4.4Å; D363-F479 PolarHBondContact N-O 3.17Å; D363-F479 VanDerWaalsContact N-O 3.17Å
364	P	92.3	Very high	95.3	Very high	29 Å²	29	30.2 Å²	30.2	19%	0.188	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.1	-10.4	-177.3	29.8	-35.7	0	0	0	113.1	E481 F536	P364-E481 VanDerWaalsContact CA-OE2 3.31Å; P364-E481 WeakPolarHBondContact CA-OE2 3.39Å; P364-E481 WeakPolarHBondContact CD-OE1 3.47Å; P364-F536 HydrophobicContact CB-CE1 4.28Å; P364-F536 HydrophobicContact CB-CZ 4.01Å
365	N	91.1	Very high	95.3	Very high	93 Å²	93	29.2 Å²	29.2	50%	0.497	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.2	-24.4	179.6	-59.3	-64.6	0	0	0	112.4	D363 W670	D363-N365 PolarHBondContact O-N 3.1Å; D363-N365 WeakPolarHBondContact OD1-CB 3.22Å; D363-N365 PolarHBondContact OD1-N 3.02Å; D363-N365 PolarHBondContact OD1-ND2 3.08Å; N365-W670 PolarHBondContact O-NE1 2.72Å
366	L	92.6	Very high	95.3	Very high	13 Å²	13	31.7 Å²	31.7	7%	0.068	17%	0.17	C	C	.	.	S	Bend	trans	-67	147.1	173.6	-69.3	177.7	0	0	0	110.7	D363 E370 K470 R478 N480 W670	D363-L366 HydrophobicContact CB-CD1 3.97Å; D363-L366 HydrophobicContact CB-CG 4.1Å; D363-L366 PolarHBondContact O-N 3.18Å; L366-E370 HydrophobicContact CB-CB 4.44Å; L366-K470 HydrophobicContact CD2-CB 4.08Å; L366-K470 HydrophobicContact CD2-CG 4.01Å; L366-R478 HydrophobicContact CD1-CB 3.95Å; L366-R478 WeakPolarHBondContact CD1-O 3.49Å; L366-N480 PolarHBondContact O-ND2 3.37Å; L366-W670 PolarHBondContact O-NE1 3.45Å
367	Q	91.6	Very high	95.4	Very high	5 Å²	5	32 Å²	32	2%	0.023	17%	0.169	C	C	.	.			trans	-62.7	155.3	170.3	-62.1	-70.5	-25	0	0	110.3	F369 E370 N567	Q367-F369 HydrophobicContact CB-CD1 4.23Å; Q367-F369 HydrophobicContact CB-CD2 4.1Å; Q367-F369 HydrophobicContact CB-CE1 3.8Å; Q367-F369 HydrophobicContact CB-CE2 3.62Å; Q367-F369 HydrophobicContact CB-CG 4.39Å; Q367-F369 HydrophobicContact CB-CZ 3.46Å; Q367-F369 VanDerWaalsContact CB-CZ 3.46Å; Q367-F369 HydrophobicContact CG-CE1 4.3Å; Q367-F369 HydrophobicContact CG-CE2 4.06Å; Q367-F369 HydrophobicContact CG-CZ 3.68Å; Q367-F369 PolarHBondContact O-N 2.99Å; Q367-E370 HydrophobicContact CB-CB 4.15Å; Q367-E370 HydrophobicContact CB-CG 3.87Å; Q367-E370 WeakPolarHBondContact CB-OE2 3.39Å; Q367-E370 HydrophobicContact CG-CG 4.46Å; Q367-E370 WeakPolarHBondContact CG-OE2 3.49Å; Q367-E370 PolarHBondContact N-OE2 3.33Å; Q367-E370 VanDerWaalsContact N-OE2 3.16Å; Q367-E370 PolarHBondContact O-N 2.94Å; Q367-N567 PolarHBondContact NE2-OD1 2.99Å
368	I	93.5	Very high	95.4	Very high	1 Å²	1	25.9 Å²	25.9	1%	0.005	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-28.4	-175.4	-56.8	173.7	0	0	0	112.1	N480 C482 A483 V516 I530 V666 M669	I368-N480 HydrophobicContact CG1-CB 4.47Å; I368-C482 HydrophobicContact CD1-CB 4.21Å; I368-C482 HydrophobicContact CG1-CB 4.32Å; I368-C482 HydrophobicContact CG2-CB 4.28Å; I368-A483 HydrophobicContact CG2-CB 4.32Å; I368-V516 HydrophobicContact CG2-CG1 4.01Å; I368-I530 HydrophobicContact CG2-CG2 3.68Å; I368-V666 HydrophobicContact CB-CG1 4.28Å; I368-V666 HydrophobicContact CD1-CG1 4.31Å; I368-M669 HydrophobicContact CD1-CB 3.27Å; I368-M669 HydrophobicContact CD1-CE 4.22Å; I368-M669 HydrophobicContact CD1-CG 4.29Å; I368-M669 HydrophobicContact CD1-SD 4.2Å
369	F	93.8	Very high	95.3	Very high	12 Å²	12	27.2 Å²	27.2	5%	0.053	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.5	3.7	177	54.7	-101.9	0	0	0	113.7	Q367 H467 F468 V516 R517 V666	Q367-F369 HydrophobicContact CB-CD1 4.23Å; Q367-F369 HydrophobicContact CB-CD2 4.1Å; Q367-F369 HydrophobicContact CB-CE1 3.8Å; Q367-F369 HydrophobicContact CB-CE2 3.62Å; Q367-F369 HydrophobicContact CB-CG 4.39Å; Q367-F369 HydrophobicContact CB-CZ 3.46Å; Q367-F369 VanDerWaalsContact CB-CZ 3.46Å; Q367-F369 HydrophobicContact CG-CE1 4.3Å; Q367-F369 HydrophobicContact CG-CE2 4.06Å; Q367-F369 HydrophobicContact CG-CZ 3.68Å; Q367-F369 PolarHBondContact O-N 2.99Å; F369-H467 CarbonylContact O-C 3.6Å; F369-H467 WeakPolarHBondContact O-CA 3.4Å; F369-F468 HydrophobicContact CD2-CB 4.49Å; F369-F468 AromaticContact CD2-CD2 3.65Å; F369-F468 HydrophobicContact CD2-CD2 3.65Å; F369-F468 HydrophobicContact CD2-CE2 4.41Å; F369-F468 HydrophobicContact CE2-CD2 4.28Å; F369-F468 HydrophobicContact CG-CD2 4.42Å; F369-F468 PolarHBondContact O-N 3.17Å; F369-V516 HydrophobicContact CB-CB 4.01Å; F369-V516 HydrophobicContact CB-CG1 4.47Å; F369-R517 HydrophobicContact CB-CG 3.97Å; F369-R517 HydrophobicContact CD1-CG 3.61Å; F369-R517 HydrophobicContact CE1-CG 4.43Å; F369-R517 HydrophobicContact CG-CG 4Å; F369-R517 VanDerWaalsContact CG-NE 3.34Å; F369-V666 HydrophobicContact CD1-CG1 3.69Å; F369-V666 HydrophobicContact CE1-CG1 3.73Å
370	E	94.9	Very high	95.2	Very high	17 Å²	17	32.4 Å²	32.4	8%	0.079	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	145.1	179.1	-76.9	173.4	168.9	0	0	111.3	L366 Q367 F468 M566	L366-E370 HydrophobicContact CB-CB 4.44Å; Q367-E370 HydrophobicContact CB-CB 4.15Å; Q367-E370 HydrophobicContact CB-CG 3.87Å; Q367-E370 WeakPolarHBondContact CB-OE2 3.39Å; Q367-E370 HydrophobicContact CG-CG 4.46Å; Q367-E370 WeakPolarHBondContact CG-OE2 3.49Å; Q367-E370 PolarHBondContact N-OE2 3.33Å; Q367-E370 VanDerWaalsContact N-OE2 3.16Å; Q367-E370 PolarHBondContact O-N 2.94Å; E370-F468 CarbonylContact C-O 3.06Å; E370-F468 VanDerWaalsContact CA-O 3.25Å; E370-F468 WeakPolarHBondContact CA-O 3.34Å; E370-F468 HydrophobicContact CG-CB 4.27Å; E370-M566 VanDerWaalsContact OE1-CE 3.31Å; E370-M566 WeakPolarHBondContact OE1-CE 3.48Å
371	V	97.2	Very high	95.2	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	125	170.6	67	0	0	0	0	109.8	V373 V451 F453 H467 F468 K470 R478	V371-V373 HydrophobicContact CG1-CG2 4.21Å; V371-V373 PolarHBondContact O-N 3.31Å; V371-V451 HydrophobicContact CG1-CG2 3.62Å; V371-F453 HydrophobicContact CG2-CE1 4.48Å; V371-F453 HydrophobicContact CG2-CE2 4.42Å; V371-F453 HydrophobicContact CG2-CZ 4.39Å; V371-H467 HydrophobicContact CB-CB 3.91Å; V371-H467 HydrophobicContact CG1-CB 3.6Å; V371-F468 PolarHBondContact N-O 3.4Å; V371-K470 PolarHBondContact O-N 2.94Å; V371-R478 CarbonylContact C-O 3.53Å; V371-R478 WeakPolarHBondContact CA-O 3.43Å; V371-R478 WeakPolarHBondContact CG2-O 3.22Å
372	G	97.3	Very high	95.1	Very high	0 Å²	0	32 Å²	32	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	114.4	170.8	0	0	0	0	0	110.6	K470 F477 R478	G372-K470 CarbonylContact C-O 3.53Å; G372-K470 VanDerWaalsContact CA-O 3.25Å; G372-K470 WeakPolarHBondContact CA-O 3.26Å; G372-F477 WeakPolarHBondContact O-CA 3.25Å; G372-R478 PolarHBondContact N-O 3.13Å; G372-R478 PolarHBondContact O-N 2.92Å
373	V	98	Very high	95.2	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	130.7	178.6	177.2	0	0	0	0	110.1	V371 V377 A378 M445 V469 K470 V471 L472 F477 L498	V371-V373 HydrophobicContact CG1-CG2 4.21Å; V371-V373 PolarHBondContact O-N 3.31Å; V373-V377 HydrophobicContact CG1-CB 4.02Å; V373-V377 HydrophobicContact CG1-CG1 3.88Å; V373-A378 HydrophobicContact CG1-CB 4.45Å; V373-M445 HydrophobicContact CB-SD 4.45Å; V373-M445 HydrophobicContact CG1-SD 3.95Å; V373-M445 HydrophobicContact CG2-SD 4.32Å; V373-V469 HydrophobicContact CB-CG1 3.88Å; V373-V469 HydrophobicContact CG2-CB 4.42Å; V373-V469 HydrophobicContact CG2-CG1 3.72Å; V373-V469 HydrophobicContact CG2-CG2 4.12Å; V373-K470 PolarHBondContact N-O 3.35Å; V373-V471 WeakPolarHBondContact O-CA 3.33Å; V373-L472 PolarHBondContact O-N 3.42Å; V373-F477 HydrophobicContact CG1-CE1 4.3Å; V373-F477 HydrophobicContact CG2-CE1 4.43Å; V373-L498 HydrophobicContact CG2-CD1 3.63Å
374	P	97.5	Very high	95.2	Very high	2 Å²	2	30 Å²	30	1%	0.013	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-55.2	138.3	173.2	-31.9	39.5	0	0	0	113.7	L376 V377 A378 Y474 R475 T476	P374-L376 PolarHBondContact O-N 2.85Å; P374-L376 VanDerWaalsContact O-N 3.14Å; P374-V377 HydrophobicContact CB-CB 4.25Å; P374-V377 HydrophobicContact CB-CG2 4.03Å; P374-V377 HydrophobicContact CG-CG2 4.29Å; P374-V377 PolarHBondContact O-N 2.84Å; P374-A378 PolarHBondContact O-N 3Å; P374-Y474 WeakPolarHBondContact CA-O 3.21Å; P374-Y474 WeakPolarHBondContact CB-O 3.29Å; P374-R475 WeakPolarHBondContact CG-O 3.42Å; P374-T476 WeakPolarHBondContact CG-O 3.46Å
375	L	96.7	Very high	95.4	Very high	54 Å²	54	29.5 Å²	29.5	28%	0.283	15%	0.15	S	C	.	.	H	α-helix	trans	-53.3	-36.2	174.6	-176.3	66	0	0	0	113	A378 K379 Y406 V471 L472	L375-A378 PolarHBondContact O-N 2.63Å; L375-K379 WeakPolarHBondContact O-CG 3.44Å; L375-K379 PolarHBondContact O-N 3.16Å; L375-K379 VanDerWaalsContact O-N 3.09Å; L375-Y406 HydrophobicContact CD1-CD1 3.67Å; L375-Y406 HydrophobicContact CD1-CD2 4.08Å; L375-Y406 HydrophobicContact CD1-CE1 4.32Å; L375-Y406 HydrophobicContact CD1-CG 3.53Å; L375-V471 HydrophobicContact CB-CG1 4.3Å; L375-V471 HydrophobicContact CD1-CG1 3.8Å; L375-L472 PolarHBondContact N-O 3.2Å
376	L	95.8	Very high	95.6	Very high	108 Å²	108	27.6 Å²	27.6	57%	0.565	14%	0.143	S	C	*	.	H	α-helix	trans	-65	-41.3	178.3	-65.5	170.5	0	0	0	112	P374 Q380 R475	P374-L376 PolarHBondContact O-N 2.85Å; P374-L376 VanDerWaalsContact O-N 3.14Å; L376-Q380 PolarHBondContact O-N 3.37Å; L376-R475 HydrophobicContact CD1-CG 4.39Å
377	V	96.6	Very high	95.7	Very high	21 Å²	21	27.1 Å²	27.1	13%	0.127	14%	0.141	C	C	.	.	H	α-helix	trans	-69.9	-41.5	177.1	173.3	0	0	0	0	109.9	V373 P374 K379 Q380 L381 F477	V373-V377 HydrophobicContact CG1-CB 4.02Å; V373-V377 HydrophobicContact CG1-CG1 3.88Å; P374-V377 HydrophobicContact CB-CB 4.25Å; P374-V377 HydrophobicContact CB-CG2 4.03Å; P374-V377 HydrophobicContact CG-CG2 4.29Å; P374-V377 PolarHBondContact O-N 2.84Å; V377-K379 VanDerWaalsContact C-N 3.31Å; V377-K379 PolarHBondContact O-N 3.28Å; V377-Q380 PolarHBondContact O-N 2.93Å; V377-Q380 VanDerWaalsContact O-N 3.14Å; V377-L381 HydrophobicContact CG1-CD1 3.46Å; V377-L381 VanDerWaalsContact CG1-CD1 3.46Å; V377-L381 HydrophobicContact CG1-CG 4.24Å; V377-L381 PolarHBondContact O-N 3.47Å; V377-F477 HydrophobicContact CG1-CE1 4.46Å
378	A	96.6	Very high	95.9	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-63.1	-33.3	179.9	0	0	0	0	0	113.6	V373 P374 L375 H444 M445 V471	V373-A378 HydrophobicContact CG1-CB 4.45Å; P374-A378 PolarHBondContact O-N 3Å; L375-A378 PolarHBondContact O-N 2.63Å; A378-H444 WeakPolarHBondContact O-CB 3.46Å; A378-M445 HydrophobicContact CB-CB 4.25Å; A378-M445 PolarHBondContact O-N 3.13Å; A378-M445 VanDerWaalsContact O-N 3.11Å; A378-V471 HydrophobicContact CB-CG1 3.99Å; A378-V471 HydrophobicContact CB-CG2 3.93Å
379	K	95.1	Very high	96	Very high	59 Å²	59	36.7 Å²	36.7	26%	0.257	19%	0.189	S	C	.	.	H	α-helix	trans	-71.2	-32.3	174.1	-72.1	-179.3	-176.9	-174.7	0	113.2	L375 V377 N404 H444	L375-K379 WeakPolarHBondContact O-CG 3.44Å; L375-K379 PolarHBondContact O-N 3.16Å; L375-K379 VanDerWaalsContact O-N 3.09Å; V377-K379 VanDerWaalsContact C-N 3.31Å; V377-K379 PolarHBondContact O-N 3.28Å; K379-N404 WeakPolarHBondContact CE-O 3.32Å; K379-N404 PolarHBondContact NZ-O 3.36Å; K379-H444 PolarHBondContact O-CD2 3.31Å; K379-H444 VanDerWaalsContact O-CD2 3.28Å
380	Q	94.8	Very high	96.1	Very high	163 Å²	163	43.1 Å²	43.1	76%	0.762	22%	0.223	S	C	*	.	H	α-helix	trans	-83	-40.9	-178.9	-71.9	-175.3	-11.8	0	0	112.8	L376 V377 T382	L376-Q380 PolarHBondContact O-N 3.37Å; V377-Q380 PolarHBondContact O-N 2.93Å; V377-Q380 VanDerWaalsContact O-N 3.14Å; Q380-T382 PolarHBondContact O-N 3.04Å
381	L	96.2	Very high	96.1	Very high	12 Å²	12	42.9 Å²	42.9	6%	0.063	22%	0.222	C	C	.	.	S	Bend	trans	-80.5	113.3	178.8	-70.5	171.3	0	0	0	110.3	V377 M445 L498 F500	V377-L381 HydrophobicContact CG1-CD1 3.46Å; V377-L381 VanDerWaalsContact CG1-CD1 3.46Å; V377-L381 HydrophobicContact CG1-CG 4.24Å; V377-L381 PolarHBondContact O-N 3.47Å; L381-M445 HydrophobicContact CB-CE 3.89Å; L381-M445 HydrophobicContact CD1-CE 3.8Å; L381-M445 HydrophobicContact CG-CE 4.5Å; L381-M445 WeakPolarHBondContact O-CB 3.22Å; L381-M445 PolarHBondContact O-N 3.44Å; L381-M445 VanDerWaalsContact O-N 3.07Å; L381-L498 HydrophobicContact CD1-CD2 3.81Å; L381-F500 HydrophobicContact CB-CD1 4.18Å
382	T	96	Very high	95.9	Very high	4 Å²	4	45.8 Å²	45.8	3%	0.025	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	157.4	-178.6	59.6	0	0	0	0	113.2	Q380 T410 R443 F500 Q502	Q380-T382 PolarHBondContact O-N 3.04Å; T382-T410 VanDerWaalsContact CG2-OG1 3.27Å; T382-T410 WeakPolarHBondContact CG2-OG1 3.3Å; T382-R443 CarbonylContact C-O 2.9Å; T382-R443 WeakPolarHBondContact CA-O 3.15Å; T382-R443 VanDerWaalsContact CB-O 3.29Å; T382-R443 WeakPolarHBondContact CB-O 3.37Å; T382-F500 WeakPolarHBondContact O-CD1 3.48Å; T382-F500 WeakPolarHBondContact O-CE1 3.34Å; T382-Q502 PolarHBondContact O-NE2 2.98Å; T382-Q502 PolarHBondContact O-OE1 3.37Å
383	F	97.1	Very high	95.8	Very high	1 Å²	1	54.1 Å²	54.1	0%	0.004	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	126.6	170.4	-176.9	-104.5	0	0	0	110.2	E385 D442 R443 F500 H504 R507	F383-E385 HydrophobicContact CD1-CB 3.97Å; F383-E385 HydrophobicContact CD1-CG 4.43Å; F383-E385 HydrophobicContact CE1-CB 4.17Å; F383-E385 HydrophobicContact CE1-CG 4.25Å; F383-E385 PolarHBondContact O-N 3.43Å; F383-D442 WeakPolarHBondContact O-CA 3.4Å; F383-R443 PolarHBondContact N-O 3.32Å; F383-R443 PolarHBondContact O-N 2.9Å; F383-F500 HydrophobicContact CB-CE1 3.62Å; F383-F500 HydrophobicContact CB-CZ 3.59Å; F383-F500 HydrophobicContact CD2-CZ 4.26Å; F383-F500 HydrophobicContact CG-CZ 4.23Å; F383-H504 AromaticContact CE1-CE1 3.74Å; F383-H504 AromaticContact CE1-NE2 3.86Å; F383-H504 AromaticContact CZ-CE1 3.67Å; F383-H504 AromaticContact CZ-NE2 3.78Å; F383-R507 VanDerWaalsContact CE2-CD 3.43Å; F383-R507 HydrophobicContact CE2-CG 4.49Å
384	P	95.5	Very high	95.6	Very high	35 Å²	35	58.7 Å²	58.7	23%	0.227	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	95.6	176.3	30.2	-34.1	0	0	0	109.6	T440 Q502	P384-T440 HydrophobicContact CB-CG2 3.7Å; P384-Q502 WeakPolarHBondContact CG-O 3.47Å
385	E	95.4	Very high	95.5	Very high	19 Å²	19	58.7 Å²	58.7	9%	0.089	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	123	179	-158.9	171.2	157.6	0	0	111	F383 N391 R394 L395 V441 R443	F383-E385 HydrophobicContact CD1-CB 3.97Å; F383-E385 HydrophobicContact CD1-CG 4.43Å; F383-E385 HydrophobicContact CE1-CB 4.17Å; F383-E385 HydrophobicContact CE1-CG 4.25Å; F383-E385 PolarHBondContact O-N 3.43Å; E385-N391 PolarHBondContact OE1-ND2 3.19Å; E385-R394 IonicContact OE1-CZ 3.98Å; E385-R394 IonicContact OE1-NH2 2.63Å; E385-R394 PolarHBondContact OE1-NH2 2.82Å; E385-R394 IonicContact OE2-CZ 3.24Å; E385-R394 IonicContact OE2-NH1 2.71Å; E385-R394 IonicContact OE2-NH2 2.69Å; E385-R394 PolarHBondContact OE2-NH2 2.86Å; E385-L395 HydrophobicContact CB-CD1 4.34Å; E385-L395 HydrophobicContact CB-CD2 4.23Å; E385-L395 HydrophobicContact CG-CD1 4.33Å; E385-V441 PolarHBondContact N-O 3.47Å; E385-V441 PolarHBondContact O-N 3.38Å; E385-R443 HydrophobicContact CB-CG 4.42Å; E385-R443 WeakPolarHBondContact OE2-CD 3.46Å; E385-R443 IonicContact OE2-CZ 3.61Å; E385-R443 IonicContact OE2-NE 2.73Å; E385-R443 PolarHBondContact OE2-NE 3Å; E385-R443 IonicContact OE2-NH2 2.73Å
386	C	95	Very high	95.4	Very high	54 Å²	54	60 Å²	60	37%	0.365	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	133.3	175	-173.7	0	0	0	0	110.5	T388 N391	C386-T388 PolarHBondContact O-N 3.37Å; C386-N391 PolarHBondContact O-ND2 3.1Å
387	V	95.4	Very high	95.3	Very high	2 Å²	2	60.5 Å²	60.5	1%	0.012	29%	0.291	C	S	.	.	P	Polyproline II helix	trans	-75.2	117.8	-179.3	-178	0	0	0	0	109.7	F392 L395 L435 K436 F437 G438 D439 V441	V387-F392 HydrophobicContact CG1-CB 4.47Å; V387-F392 HydrophobicContact CG1-CD2 3.66Å; V387-F392 HydrophobicContact CG1-CE2 4.46Å; V387-L395 HydrophobicContact CB-CD1 4.35Å; V387-L395 HydrophobicContact CG2-CD1 3.76Å; V387-L435 HydrophobicContact CG1-CD2 4.12Å; V387-L435 HydrophobicContact CG1-CG 4.49Å; V387-L435 HydrophobicContact CG2-CD1 4.35Å; V387-L435 HydrophobicContact CG2-CD2 4.03Å; V387-L435 HydrophobicContact CG2-CG 4.16Å; V387-K436 WeakPolarHBondContact CB-O 2.93Å; V387-F437 HydrophobicContact CG1-CD1 4.26Å; V387-G438 PolarHBondContact O-N 3.36Å; V387-D439 WeakPolarHBondContact CB-O 3.47Å; V387-D439 HydrophobicContact CG2-CB 4.32Å; V387-D439 VanDerWaalsContact CG2-O 3.32Å; V387-D439 WeakPolarHBondContact CG2-O 3.27Å; V387-D439 PolarHBondContact N-O 3.49Å; V387-V441 HydrophobicContact CG2-CG2 3.87Å
388	T	95.5	Very high	95.3	Very high	54 Å²	54	60 Å²	60	33%	0.331	29%	0.289	S	S	.	.			trans	-123.9	172.5	178.1	67.1	0	0	0	0	110.2	C386 L390 N391 F392	C386-T388 PolarHBondContact O-N 3.37Å; T388-L390 PolarHBondContact O-N 3.1Å; T388-L390 PolarHBondContact OG1-N 3.37Å; T388-N391 PolarHBondContact N-OD1 2.95Å; T388-N391 PolarHBondContact O-N 2.9Å; T388-N391 PolarHBondContact O-OD1 3.05Å; T388-N391 VanDerWaalsContact O-OD1 3.07Å; T388-N391 PolarHBondContact OG1-OD1 3.49Å; T388-N391 VanDerWaalsContact OG1-OD1 3.12Å; T388-F392 WeakPolarHBondContact O-CB 3.13Å; T388-F392 PolarHBondContact O-N 2.89Å
389	H	95.6	Very high	95.2	Very high	153 Å²	153	60 Å²	60	71%	0.708	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-29.7	176.4	64.9	-81.5	0	0	0	113.1
390	L	95.3	Very high	95.1	Very high	147 Å²	147	61.3 Å²	61.3	77%	0.77	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.5	-33.9	-177.4	-61.2	174.3	0	0	0	113.2	T388	T388-L390 PolarHBondContact O-N 3.1Å; T388-L390 PolarHBondContact OG1-N 3.37Å
391	N	94.6	Very high	95.1	Very high	13 Å²	13	55.5 Å²	55.5	7%	0.07	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.2	-4.3	-173.3	65.6	11.4	0	0	0	113.8	E385 C386 T388 K393 R394 L395	E385-N391 PolarHBondContact OE1-ND2 3.19Å; C386-N391 PolarHBondContact O-ND2 3.1Å; T388-N391 PolarHBondContact N-OD1 2.95Å; T388-N391 PolarHBondContact O-N 2.9Å; T388-N391 PolarHBondContact O-OD1 3.05Å; T388-N391 VanDerWaalsContact O-OD1 3.07Å; T388-N391 PolarHBondContact OG1-OD1 3.49Å; T388-N391 VanDerWaalsContact OG1-OD1 3.12Å; N391-K393 VanDerWaalsContact C-N 3.35Å; N391-K393 PolarHBondContact O-N 2.85Å; N391-R394 PolarHBondContact O-N 3.46Å; N391-R394 VanDerWaalsContact O-N 3.1Å; N391-L395 HydrophobicContact CB-CD1 4.23Å; N391-L395 HydrophobicContact CB-CG 4.28Å; N391-L395 PolarHBondContact O-N 2.93Å
392	F	94.4	Very high	95	Very high	60 Å²	60	54.9 Å²	54.9	26%	0.263	27%	0.27	S	S	.	.	H	α-helix	trans	-49.1	-50.4	-176.3	-178.4	-100.2	0	0	0	113.4	V387 T388 R394 L395 K396 L435 F437	V387-F392 HydrophobicContact CG1-CB 4.47Å; V387-F392 HydrophobicContact CG1-CD2 3.66Å; V387-F392 HydrophobicContact CG1-CE2 4.46Å; T388-F392 WeakPolarHBondContact O-CB 3.13Å; T388-F392 PolarHBondContact O-N 2.89Å; F392-R394 PolarHBondContact O-N 3.3Å; F392-L395 PolarHBondContact O-N 3.46Å; F392-K396 HydrophobicContact CE1-CD 4.04Å; F392-K396 HydrophobicContact CZ-CD 4.2Å; F392-K396 WeakPolarHBondContact O-CB 3.32Å; F392-K396 PolarHBondContact O-N 3.21Å; F392-L435 HydrophobicContact CD2-CD2 4.22Å; F392-L435 HydrophobicContact CE2-CB 4.31Å; F392-L435 HydrophobicContact CE2-CD2 4.06Å; F392-L435 HydrophobicContact CE2-CG 4.49Å; F392-F437 HydrophobicContact CB-CE1 4.13Å; F392-F437 HydrophobicContact CD2-CD1 4.2Å; F392-F437 AromaticContact CD2-CE1 3.74Å; F392-F437 HydrophobicContact CD2-CE1 3.74Å; F392-F437 HydrophobicContact CE2-CE1 4.4Å; F392-F437 HydrophobicContact CG-CE1 4.03Å
393	K	94.3	Very high	94.9	Very high	176 Å²	176	55.6 Å²	55.6	77%	0.765	28%	0.275	S	S	*	.	H	α-helix	trans	-61.2	-46.5	-178.9	-170.2	178.2	179.5	-178.1	0	111.7	N391 K396 E397	N391-K393 VanDerWaalsContact C-N 3.35Å; N391-K393 PolarHBondContact O-N 2.85Å; K393-K396 PolarHBondContact O-N 3.18Å; K393-E397 PolarHBondContact O-N 2.54Å; K393-E397 VanDerWaalsContact O-N 3.15Å
394	R	94.9	Very high	94.7	Very high	96 Å²	96	61.5 Å²	61.5	36%	0.362	31%	0.306	S	S	.	.	H	α-helix	trans	-64.4	-45.1	179.8	-178.9	173.3	64.5	95.8	2.6	112	E385 N391 F392 E397 A398 M446	E385-R394 IonicContact OE1-CZ 3.98Å; E385-R394 IonicContact OE1-NH2 2.63Å; E385-R394 PolarHBondContact OE1-NH2 2.82Å; E385-R394 IonicContact OE2-CZ 3.24Å; E385-R394 IonicContact OE2-NH1 2.71Å; E385-R394 IonicContact OE2-NH2 2.69Å; E385-R394 PolarHBondContact OE2-NH2 2.86Å; N391-R394 PolarHBondContact O-N 3.46Å; N391-R394 VanDerWaalsContact O-N 3.1Å; F392-R394 PolarHBondContact O-N 3.3Å; R394-E397 PolarHBondContact O-N 2.63Å; R394-A398 PolarHBondContact O-N 3.48Å; R394-M446 PolarHBondContact NH1-SD 3.24Å
395	L	95.2	Very high	94.6	Very high	1 Å²	1	63.6 Å²	63.6	1%	0.005	32%	0.318	C	S	.	.	H	α-helix	trans	-70.2	-37.4	179.9	-67.1	179.6	0	0	0	111.8	E385 V387 N391 F392 E397 A398 V399 V441 R443	E385-L395 HydrophobicContact CB-CD1 4.34Å; E385-L395 HydrophobicContact CB-CD2 4.23Å; E385-L395 HydrophobicContact CG-CD1 4.33Å; V387-L395 HydrophobicContact CB-CD1 4.35Å; V387-L395 HydrophobicContact CG2-CD1 3.76Å; N391-L395 HydrophobicContact CB-CD1 4.23Å; N391-L395 HydrophobicContact CB-CG 4.28Å; N391-L395 PolarHBondContact O-N 2.93Å; F392-L395 PolarHBondContact O-N 3.46Å; L395-E397 VanDerWaalsContact C-N 3.28Å; L395-E397 PolarHBondContact O-N 3.23Å; L395-A398 PolarHBondContact O-N 3.27Å; L395-V399 VanDerWaalsContact O-CG2 3.29Å; L395-V399 WeakPolarHBondContact O-CG2 3.47Å; L395-V399 PolarHBondContact O-N 2.75Å; L395-V441 HydrophobicContact CD2-CB 4.47Å; L395-R443 HydrophobicContact CD2-CB 4.45Å
396	K	94.3	Very high	94.5	Very high	82 Å²	82	65.8 Å²	65.8	36%	0.357	33%	0.326	S	S	.	.	H	α-helix	trans	-59.3	-41.5	174.4	-171.6	173.3	-178.1	174	0	111.8	F392 K393 N400 V432 L435	F392-K396 HydrophobicContact CE1-CD 4.04Å; F392-K396 HydrophobicContact CZ-CD 4.2Å; F392-K396 WeakPolarHBondContact O-CB 3.32Å; F392-K396 PolarHBondContact O-N 3.21Å; K393-K396 PolarHBondContact O-N 3.18Å; K396-N400 PolarHBondContact O-N 2.59Å; K396-V432 HydrophobicContact CD-CG1 4.35Å; K396-V432 WeakPolarHBondContact CE-O 3.24Å; K396-V432 HydrophobicContact CG-CG1 3.84Å; K396-L435 HydrophobicContact CB-CD2 4.34Å
397	E	94.4	Very high	94.5	Very high	118 Å²	118	66.9 Å²	66.9	55%	0.551	33%	0.333	S	S	*	.	H	α-helix	trans	-66.9	-43	174.6	-169.1	172.9	-176.1	0	0	112.2	K393 R394 L395 V399 N400 N401	K393-E397 PolarHBondContact O-N 2.54Å; K393-E397 VanDerWaalsContact O-N 3.15Å; R394-E397 PolarHBondContact O-N 2.63Å; L395-E397 VanDerWaalsContact C-N 3.28Å; L395-E397 PolarHBondContact O-N 3.23Å; E397-V399 VanDerWaalsContact C-N 3.33Å; E397-V399 PolarHBondContact O-N 3.42Å; E397-N400 WeakPolarHBondContact O-CA 3.47Å; E397-N400 WeakPolarHBondContact O-CB 3.47Å; E397-N400 PolarHBondContact O-N 2.88Å; E397-N400 VanDerWaalsContact O-N 3.08Å; E397-N401 PolarHBondContact O-N 3.31Å
398	A	95	Very high	94.5	Very high	11 Å²	11	66.9 Å²	66.9	9%	0.091	33%	0.334	C	S	.	.	H	α-helix	trans	-60.7	-40.8	175.5	0	0	0	0	0	112.6	R394 L395 N400 N401 G402 G408 A409	R394-A398 PolarHBondContact O-N 3.48Å; L395-A398 PolarHBondContact O-N 3.27Å; A398-N400 VanDerWaalsContact C-N 3.33Å; A398-N401 PolarHBondContact O-N 2.84Å; A398-G402 PolarHBondContact O-N 3.12Å; A398-G402 VanDerWaalsContact O-N 3.08Å; A398-G408 CarbonylContact O-C 3.25Å; A398-G408 WeakPolarHBondContact O-CA 3.37Å; A398-A409 HydrophobicContact CB-CB 4.35Å; A398-A409 PolarHBondContact O-N 3.07Å
399	V	94.8	Very high	94.5	Very high	0 Å²	0	64.3 Å²	64.3	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-63.5	-40.6	173.7	176.6	0	0	0	0	110.4	L395 E397 N401 G402 L423 R428 A431 V432 L435 V441	L395-V399 VanDerWaalsContact O-CG2 3.29Å; L395-V399 WeakPolarHBondContact O-CG2 3.47Å; L395-V399 PolarHBondContact O-N 2.75Å; E397-V399 VanDerWaalsContact C-N 3.33Å; E397-V399 PolarHBondContact O-N 3.42Å; V399-N401 VanDerWaalsContact C-N 3.33Å; V399-N401 PolarHBondContact O-N 2.87Å; V399-G402 PolarHBondContact O-N 3.35Å; V399-L423 HydrophobicContact CG1-CD1 4.14Å; V399-L423 HydrophobicContact CG1-CD2 3.75Å; V399-L423 HydrophobicContact CG2-CD1 4.38Å; V399-R428 WeakPolarHBondContact O-CD 3.45Å; V399-R428 WeakPolarHBondContact O-CG 3.32Å; V399-A431 HydrophobicContact CG1-CB 3.88Å; V399-V432 HydrophobicContact CB-CG2 4.14Å; V399-V432 HydrophobicContact CG1-CG2 3.7Å; V399-L435 HydrophobicContact CG2-CD1 4.41Å; V399-V441 HydrophobicContact CG2-CB 4.5Å; V399-V441 HydrophobicContact CG2-CG1 3.67Å; V399-V441 HydrophobicContact CG2-CG2 3.93Å
400	N	93.8	Very high	94.5	Very high	87 Å²	87	57.9 Å²	57.9	47%	0.465	29%	0.289	S	S	.	.	H	α-helix	trans	-64.1	-35.9	177	-165.4	46.6	0	0	0	113.1	K396 E397 A398 R428 V432	K396-N400 PolarHBondContact O-N 2.59Å; E397-N400 WeakPolarHBondContact O-CA 3.47Å; E397-N400 WeakPolarHBondContact O-CB 3.47Å; E397-N400 PolarHBondContact O-N 2.88Å; E397-N400 VanDerWaalsContact O-N 3.08Å; A398-N400 VanDerWaalsContact C-N 3.33Å; N400-R428 WeakPolarHBondContact O-CD 3.43Å; N400-R428 PolarHBondContact O-NH1 3.14Å; N400-R428 VanDerWaalsContact O-NH1 3.09Å; N400-V432 HydrophobicContact CB-CG2 3.98Å
401	N	94	Very high	94.5	Very high	40 Å²	40	55 Å²	55	21%	0.214	27%	0.268	C	S	.	.	H	α-helix	trans	-70.3	-33.6	175.4	-69	-14.9	0	0	0	112.2	E397 A398 V399 V405 P407 R428	E397-N401 PolarHBondContact O-N 3.31Å; A398-N401 PolarHBondContact O-N 2.84Å; V399-N401 VanDerWaalsContact C-N 3.33Å; V399-N401 PolarHBondContact O-N 2.87Å; N401-V405 HydrophobicContact CB-CB 4.17Å; N401-V405 HydrophobicContact CB-CG1 4.33Å; N401-P407 WeakPolarHBondContact CB-O 3.46Å; N401-P407 PolarHBondContact ND2-O 3.07Å; N401-R428 PolarHBondContact O-NH1 2.94Å
402	G	93.5	Very high	94.3	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	69.8	-163.4	179.4	0	0	0	0	0	113.4	A398 V399 G408 A409	A398-G402 PolarHBondContact O-N 3.12Å; A398-G402 VanDerWaalsContact O-N 3.08Å; V399-G402 PolarHBondContact O-N 3.35Å; G402-G408 WeakPolarHBondContact O-CA 3.38Å; G402-A409 CarbonylContact C-O 3.58Å; G402-A409 PolarHBondContact O-N 2.84Å; G402-A409 VanDerWaalsContact O-N 3.15Å
403	P	94.5	Very high	94.3	Very high	19 Å²	19	52.7 Å²	52.7	12%	0.123	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.4	-21.5	-169.6	25.8	-33.4	0	0	0	114.8	A409 T410 F422 L423 H444	P403-A409 WeakPolarHBondContact CA-O 3.27Å; P403-A409 VanDerWaalsContact N-O 3.13Å; P403-T410 HydrophobicContact CB-CG2 4.44Å; P403-F422 HydrophobicContact CG-CE2 4.43Å; P403-F422 HydrophobicContact CG-CZ 4.1Å; P403-L423 WeakPolarHBondContact CD-O 3.29Å; P403-L423 WeakPolarHBondContact CG-O 3.2Å; P403-H444 PolarHBondContact O-CE1 3.19Å; P403-H444 PolarHBondContact O-NE2 3.49Å
404	N	92.7	Very high	94.1	Very high	124 Å²	124	47.3 Å²	47.3	66%	0.663	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.1	-29.4	-172.1	-66.5	-24.2	0	0	0	113.3	K379	K379-N404 WeakPolarHBondContact CE-O 3.32Å; K379-N404 PolarHBondContact NZ-O 3.36Å
405	V	93	Very high	93.8	Very high	79 Å²	79	52.2 Å²	52.2	48%	0.479	26%	0.255	S	S	.	.	S	Bend	trans	-99.3	132.3	-177.8	-179.1	0	0	0	0	109	N401 P407 G408	N401-V405 HydrophobicContact CB-CB 4.17Å; N401-V405 HydrophobicContact CB-CG1 4.33Å; V405-P407 CarbonylContact O-C 3.54Å; V405-G408 WeakPolarHBondContact O-CA 3.47Å; V405-G408 PolarHBondContact O-N 3.06Å
406	Y	94.5	Very high	93.2	Very high	65 Å²	65	56.2 Å²	56.2	26%	0.255	30%	0.297	S	S	.	.	S	Bend	trans	-102.8	136.1	176.3	174.4	-94.8	0	0	0	109.7	L375 H444 M445 M446 V471	L375-Y406 HydrophobicContact CD1-CD1 3.67Å; L375-Y406 HydrophobicContact CD1-CD2 4.08Å; L375-Y406 HydrophobicContact CD1-CE1 4.32Å; L375-Y406 HydrophobicContact CD1-CG 3.53Å; Y406-H444 HydrophobicContact CD2-CB 4.28Å; Y406-M445 VanDerWaalsContact CE2-O 3.26Å; Y406-M445 WeakPolarHBondContact CE2-O 3.36Å; Y406-M446 WeakPolarHBondContact OH-CA 3.28Å; Y406-V471 HydrophobicContact CE1-CB 4.47Å; Y406-V471 HydrophobicContact CE1-CG1 4.25Å; Y406-V471 HydrophobicContact CE2-CG2 4.39Å; Y406-V471 WeakPolarHBondContact OH-CG2 3.25Å
407	P	95	Very high	92.9	Very high	77 Å²	77	54.5 Å²	54.5	50%	0.5	30%	0.295	S	S	.	.	S	Bend	cis	-75.2	136.8	-5.4	30.1	-33.7	0	0	0	112.3	N401 V405	N401-P407 WeakPolarHBondContact CB-O 3.46Å; N401-P407 PolarHBondContact ND2-O 3.07Å; V405-P407 CarbonylContact O-C 3.54Å
408	G	95.4	Very high	92.3	Very high	3 Å²	3	55.5 Å²	55.5	3%	0.031	31%	0.31	C	S	.	.			trans	-149	-167.1	-172.1	0	0	0	0	0	113.1	A398 G402 V405 H444	A398-G408 CarbonylContact O-C 3.25Å; A398-G408 WeakPolarHBondContact O-CA 3.37Å; G402-G408 WeakPolarHBondContact O-CA 3.38Å; V405-G408 WeakPolarHBondContact O-CA 3.47Å; V405-G408 PolarHBondContact O-N 3.06Å; G408-H444 PolarHBondContact N-ND1 3.44Å; G408-H444 PolarHBondContact O-N 2.63Å
409	A	95.7	Very high	91.9	Very high	0 Å²	0	59.3 Å²	59.3	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	148.9	179.9	0	0	0	0	0	112.6	A398 G402 P403 L423 V441	A398-A409 HydrophobicContact CB-CB 4.35Å; A398-A409 PolarHBondContact O-N 3.07Å; G402-A409 CarbonylContact C-O 3.58Å; G402-A409 PolarHBondContact O-N 2.84Å; G402-A409 VanDerWaalsContact O-N 3.15Å; P403-A409 WeakPolarHBondContact CA-O 3.27Å; P403-A409 VanDerWaalsContact N-O 3.13Å; A409-L423 HydrophobicContact CB-CD1 3.83Å; A409-L423 WeakPolarHBondContact O-CD1 3.37Å; A409-V441 HydrophobicContact CB-CG1 3.64Å
410	T	95.1	Very high	91.7	Very high	18 Å²	18	63.9 Å²	63.9	11%	0.11	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	-43.1	-171.9	-47.3	0	0	0	0	112.6	T382 P403 F422 L423 D442 H444	T382-T410 VanDerWaalsContact CG2-OG1 3.27Å; T382-T410 WeakPolarHBondContact CG2-OG1 3.3Å; P403-T410 HydrophobicContact CB-CG2 4.44Å; T410-F422 HydrophobicContact CG2-CD2 4.01Å; T410-F422 HydrophobicContact CG2-CE2 3.66Å; T410-F422 WeakPolarHBondContact O-CD2 3.28Å; T410-L423 PolarHBondContact O-N 3.45Å; T410-D442 PolarHBondContact N-O 3.13Å; T410-H444 PolarHBondContact OG1-CD2 2.89Å; T410-H444 PolarHBondContact OG1-NE2 3.4Å
411	Y	94.4	Very high	91.5	Very high	85 Å²	85	63.1 Å²	63.1	33%	0.333	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	153.8	-179.5	-57.9	-84.7	0	0	0	111.8	K420 K421 F422 D442	Y411-K420 HydrophobicContact CD1-CB 4.21Å; Y411-K420 HydrophobicContact CG-CB 4.49Å; Y411-K421 CarbonylContact C-O 3.35Å; Y411-K421 VanDerWaalsContact CA-O 3.3Å; Y411-K421 WeakPolarHBondContact CA-O 3.45Å; Y411-F422 HydrophobicContact CD1-CB 4.02Å; Y411-F422 HydrophobicContact CD1-CD2 4.1Å; Y411-F422 HydrophobicContact CE1-CB 3.82Å; Y411-F422 AromaticContact CE1-CD2 3.64Å; Y411-F422 HydrophobicContact CE1-CD2 3.64Å; Y411-F422 HydrophobicContact CE1-CG 4.17Å; Y411-F422 AromaticContact CZ-CD2 3.96Å; Y411-D442 HydrophobicContact CD2-CB 4.34Å; Y411-D442 PolarHBondContact O-N 2.88Å
412	Y	92.2	Very high	91.5	Very high	8 Å²	8	65.5 Å²	65.5	3%	0.031	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	133.8	174.1	158.6	-108.8	0	0	0	109.5	E414 K421 A431 L435 D439 V441	Y412-E414 HydrophobicContact CE1-CG 3.73Å; Y412-E414 HydrophobicContact CE2-CG 4.46Å; Y412-E414 WeakPolarHBondContact OH-CG 3.4Å; Y412-K421 HydrophobicContact CD1-CD 4.28Å; Y412-K421 HydrophobicContact CE1-CD 4.46Å; Y412-K421 PolarHBondContact N-O 3.37Å; Y412-K421 WeakPolarHBondContact O-CB 3.47Å; Y412-K421 PolarHBondContact O-N 3.38Å; Y412-A431 HydrophobicContact CD1-CB 4.06Å; Y412-A431 HydrophobicContact CE1-CB 4.37Å; Y412-A431 HydrophobicContact CG-CB 4.31Å; Y412-L435 HydrophobicContact CD2-CD1 3.9Å; Y412-L435 HydrophobicContact CE2-CD1 3.74Å; Y412-D439 HydrophobicContact CE2-CB 3.94Å; Y412-D439 WeakPolarHBondContact CE2-OD2 3.33Å; Y412-D439 PolarHBondContact OH-OD2 3.15Å; Y412-D439 VanDerWaalsContact OH-OD2 3.05Å; Y412-V441 HydrophobicContact CD2-CG2 4.48Å
413	T	93.2	Very high	91.4	Very high	17 Å²	17	65.6 Å²	65.6	10%	0.104	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	124.7	179.4	-46.7	0	0	0	0	110	S417 T440	T413-S417 VanDerWaalsContact CG2-O 3.3Å; T413-S417 WeakPolarHBondContact CG2-O 3.47Å; T413-T440 PolarHBondContact N-O 3.32Å; T413-T440 PolarHBondContact O-N 3.08Å
414	E	90.7	Very high	91.1	Very high	64 Å²	64	67.6 Å²	67.6	30%	0.299	36%	0.363	S	S	.	.			trans	-73.6	144	176.3	-78.5	162	-169.6	0	0	111.2	Y412 G416 S417 K421	Y412-E414 HydrophobicContact CE1-CG 3.73Å; Y412-E414 HydrophobicContact CE2-CG 4.46Å; Y412-E414 WeakPolarHBondContact OH-CG 3.4Å; E414-G416 PolarHBondContact O-N 3.33Å; E414-S417 WeakPolarHBondContact O-CB 3.47Å; E414-S417 PolarHBondContact O-N 3.5Å; E414-K421 IonicContact OE1-NZ 3.8Å; E414-K421 PolarHBondContact OE1-NZ 2.92Å; E414-K421 IonicContact OE2-NZ 3.82Å; E414-K421 PolarHBondContact OE2-NZ 3.41Å
415	R	88.2	Confident	90.7	Very high	198 Å²	198	66.7 Å²	66.7	75%	0.747	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.8	123.5	176.5	-172.5	179.7	177.6	-175.3	-1.9	111.5	S417 D439	R415-S417 VanDerWaalsContact C-N 3.31Å; R415-D439 PolarHBondContact N-OD1 3.36Å
416	G	83.5	Confident	90.3	Very high	86 Å²	86	67.9 Å²	67.9	89%	0.887	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	86	-6.6	179.9	0	0	0	0	0	114.8	E414	E414-G416 PolarHBondContact O-N 3.33Å
417	S	86.9	Confident	90	Very high	45 Å²	45	67 Å²	67	32%	0.315	38%	0.375	S	S	.	.			trans	-92	142.7	170.7	-169.2	0	0	0	0	110.9	T413 E414 R415 V419	T413-S417 VanDerWaalsContact CG2-O 3.3Å; T413-S417 WeakPolarHBondContact CG2-O 3.47Å; E414-S417 WeakPolarHBondContact O-CB 3.47Å; E414-S417 PolarHBondContact O-N 3.5Å; R415-S417 VanDerWaalsContact C-N 3.31Å; S417-V419 PolarHBondContact OG-N 3.24Å
418	T	82.6	Confident	89.7	Confident	139 Å²	139	65.6 Å²	65.6	85%	0.853	36%	0.36	S	S	*	.			trans	-92	-7.1	169.6	46.6	0	0	0	0	112.7	K420	T418-K420 PolarHBondContact O-N 3.21Å
419	V	86.9	Confident	89.3	Confident	91 Å²	91	71.4 Å²	71.4	55%	0.552	39%	0.386	S	S	*	.			trans	-87.4	112.3	-175	-176.5	0	0	0	0	110.2	S417 K421	S417-V419 PolarHBondContact OG-N 3.24Å; V419-K421 PolarHBondContact O-N 2.86Å
420	K	89.3	Confident	89	Confident	96 Å²	96	79.8 Å²	79.8	42%	0.417	42%	0.418	S	S	.	.	P	Polyproline II helix	trans	-74.3	121.2	170.5	-63.4	-165.9	172.7	-161.3	0	110.3	Y411 T418 D442	Y411-K420 HydrophobicContact CD1-CB 4.21Å; Y411-K420 HydrophobicContact CG-CB 4.49Å; T418-K420 PolarHBondContact O-N 3.21Å; K420-D442 IonicContact NZ-OD2 2.89Å; K420-D442 PolarHBondContact NZ-OD2 3.28Å
421	K	90.4	Very high	88.6	Confident	71 Å²	71	79.1 Å²	79.1	31%	0.309	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	121.6	174.9	-60	176.7	-169.9	173.5	0	109	Y411 Y412 E414 V419	Y411-K421 CarbonylContact C-O 3.35Å; Y411-K421 VanDerWaalsContact CA-O 3.3Å; Y411-K421 WeakPolarHBondContact CA-O 3.45Å; Y412-K421 HydrophobicContact CD1-CD 4.28Å; Y412-K421 HydrophobicContact CE1-CD 4.46Å; Y412-K421 PolarHBondContact N-O 3.37Å; Y412-K421 WeakPolarHBondContact O-CB 3.47Å; Y412-K421 PolarHBondContact O-N 3.38Å; E414-K421 IonicContact OE1-NZ 3.8Å; E414-K421 PolarHBondContact OE1-NZ 2.92Å; E414-K421 IonicContact OE2-NZ 3.82Å; E414-K421 PolarHBondContact OE2-NZ 3.41Å; V419-K421 PolarHBondContact O-N 2.86Å
422	F	93.4	Very high	88.3	Confident	91 Å²	91	76.1 Å²	76.1	40%	0.399	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	140.1	173.4	-176.8	-120.1	0	0	0	110.1	P403 T410 Y411 N424 N427	P403-F422 HydrophobicContact CG-CE2 4.43Å; P403-F422 HydrophobicContact CG-CZ 4.1Å; T410-F422 HydrophobicContact CG2-CD2 4.01Å; T410-F422 HydrophobicContact CG2-CE2 3.66Å; T410-F422 WeakPolarHBondContact O-CD2 3.28Å; Y411-F422 HydrophobicContact CD1-CB 4.02Å; Y411-F422 HydrophobicContact CD1-CD2 4.1Å; Y411-F422 HydrophobicContact CE1-CB 3.82Å; Y411-F422 AromaticContact CE1-CD2 3.64Å; Y411-F422 HydrophobicContact CE1-CD2 3.64Å; Y411-F422 HydrophobicContact CE1-CG 4.17Å; Y411-F422 AromaticContact CZ-CD2 3.96Å; F422-N424 WeakPolarHBondContact CD1-OD1 3.47Å; F422-N424 PolarHBondContact O-N 3.34Å; F422-N424 PolarHBondContact O-OD1 3.48Å; F422-N427 PolarHBondContact O-ND2 3.17Å; F422-N427 PolarHBondContact O-OD1 3.46Å
423	L	91.8	Very high	88.2	Confident	2 Å²	2	85.1 Å²	85.1	1%	0.01	44%	0.439	C	S	.	.			trans	-86.3	87.3	-178	-78.9	165.9	0	0	0	111.7	V399 P403 A409 T410 A431	V399-L423 HydrophobicContact CG1-CD1 4.14Å; V399-L423 HydrophobicContact CG1-CD2 3.75Å; V399-L423 HydrophobicContact CG2-CD1 4.38Å; P403-L423 WeakPolarHBondContact CD-O 3.29Å; P403-L423 WeakPolarHBondContact CG-O 3.2Å; A409-L423 HydrophobicContact CB-CD1 3.83Å; A409-L423 WeakPolarHBondContact O-CD1 3.37Å; T410-L423 PolarHBondContact O-N 3.45Å; L423-A431 HydrophobicContact CD2-CB 3.95Å
424	N	88	Confident	88	Confident	61 Å²	61	86.9 Å²	86.9	33%	0.326	45%	0.449	S	S	.	.			trans	-85.6	158.3	176	-51.2	35.8	0	0	0	109.1	F422 S426 N427 R428	F422-N424 WeakPolarHBondContact CD1-OD1 3.47Å; F422-N424 PolarHBondContact O-N 3.34Å; F422-N424 PolarHBondContact O-OD1 3.48Å; N424-S426 PolarHBondContact O-N 2.84Å; N424-S426 VanDerWaalsContact O-N 3.08Å; N424-N427 PolarHBondContact N-OD1 2.88Å; N424-N427 PolarHBondContact O-N 3.45Å; N424-N427 PolarHBondContact O-OD1 2.64Å; N424-R428 WeakPolarHBondContact O-CB 3.39Å; N424-R428 PolarHBondContact O-N 2.99Å
425	P	84.4	Confident	88	Confident	105 Å²	105	84.4 Å²	84.4	68%	0.682	44%	0.438	S	S	*	.	H	α-helix	trans	-51	-35.7	174.2	-25.3	33.8	0	0	0	113.5
426	S	84.7	Confident	88.2	Confident	104 Å²	104	81.9 Å²	81.9	73%	0.727	43%	0.433	S	S	*	.	H	α-helix	trans	-73.4	-34.8	-176.8	52.3	0	0	0	0	115.3	N424	N424-S426 PolarHBondContact O-N 2.84Å; N424-S426 VanDerWaalsContact O-N 3.08Å
427	N	88.5	Confident	88.6	Confident	47 Å²	47	84 Å²	84	25%	0.251	42%	0.417	S	S	.	.	H	α-helix	trans	-99.5	-9.1	-176.3	66.9	10.7	0	0	0	113.3	F422 N424 R430 A431	F422-N427 PolarHBondContact O-ND2 3.17Å; F422-N427 PolarHBondContact O-OD1 3.46Å; N424-N427 PolarHBondContact N-OD1 2.88Å; N424-N427 PolarHBondContact O-N 3.45Å; N424-N427 PolarHBondContact O-OD1 2.64Å; N427-R430 WeakPolarHBondContact O-CB 3.45Å; N427-R430 PolarHBondContact O-N 3.38Å; N427-A431 PolarHBondContact O-N 2.9Å
428	R	87.9	Confident	88.9	Confident	46 Å²	46	83 Å²	83	17%	0.174	42%	0.415	C	S	.	.	H	α-helix	trans	-59.9	-51.9	-176.5	-163.6	-176.5	-47.8	-176.6	-0.6	112.9	V399 N400 N401 N424 R430 A431 V432	V399-R428 WeakPolarHBondContact O-CD 3.45Å; V399-R428 WeakPolarHBondContact O-CG 3.32Å; N400-R428 WeakPolarHBondContact O-CD 3.43Å; N400-R428 PolarHBondContact O-NH1 3.14Å; N400-R428 VanDerWaalsContact O-NH1 3.09Å; N401-R428 PolarHBondContact O-NH1 2.94Å; N424-R428 WeakPolarHBondContact O-CB 3.39Å; N424-R428 PolarHBondContact O-N 2.99Å; R428-R430 PolarHBondContact O-N 3.04Å; R428-A431 PolarHBondContact O-N 3.39Å; R428-A431 VanDerWaalsContact O-N 3.13Å; R428-V432 WeakPolarHBondContact O-CG2 3.13Å; R428-V432 PolarHBondContact O-N 2.72Å
429	E	87.7	Confident	89.4	Confident	125 Å²	125	76.6 Å²	76.6	58%	0.584	38%	0.375	S	S	*	.	H	α-helix	trans	-59.1	-39.2	179.2	-71.4	-168.8	162.4	0	0	111.8	V432 R433	E429-V432 PolarHBondContact O-N 2.73Å; E429-R433 WeakPolarHBondContact O-CG 3.32Å; E429-R433 PolarHBondContact O-N 3.18Å; E429-R433 VanDerWaalsContact O-N 3.07Å
430	R	88.4	Confident	89.8	Confident	176 Å²	176	74.3 Å²	74.3	66%	0.664	36%	0.362	S	S	*	.	H	α-helix	trans	-62.4	-50.5	175.6	-176.9	178.4	175.9	175.3	0.7	110.5	N427 R428 V432 R433 T434	N427-R430 WeakPolarHBondContact O-CB 3.45Å; N427-R430 PolarHBondContact O-N 3.38Å; R428-R430 PolarHBondContact O-N 3.04Å; R430-V432 VanDerWaalsContact C-N 3.3Å; R430-V432 PolarHBondContact O-N 3.33Å; R430-R433 PolarHBondContact O-N 3.49Å; R430-R433 VanDerWaalsContact O-N 3.1Å; R430-T434 HydrophobicContact CG-CG2 4.28Å; R430-T434 WeakPolarHBondContact O-CG2 3.18Å; R430-T434 PolarHBondContact O-N 2.94Å; R430-T434 PolarHBondContact O-OG1 3.19Å
431	A	87.7	Confident	90.1	Very high	5 Å²	5	69.8 Å²	69.8	4%	0.041	34%	0.342	C	S	.	.	H	α-helix	trans	-58.7	-41.2	178.9	0	0	0	0	0	112.1	V399 Y412 L423 N427 R428 R433 T434 L435	V399-A431 HydrophobicContact CG1-CB 3.88Å; Y412-A431 HydrophobicContact CD1-CB 4.06Å; Y412-A431 HydrophobicContact CE1-CB 4.37Å; Y412-A431 HydrophobicContact CG-CB 4.31Å; L423-A431 HydrophobicContact CD2-CB 3.95Å; N427-A431 PolarHBondContact O-N 2.9Å; R428-A431 PolarHBondContact O-N 3.39Å; R428-A431 VanDerWaalsContact O-N 3.13Å; A431-R433 VanDerWaalsContact C-N 3.33Å; A431-R433 PolarHBondContact O-N 2.48Å; A431-T434 PolarHBondContact O-N 3.45Å; A431-L435 WeakPolarHBondContact O-CB 3.44Å; A431-L435 PolarHBondContact O-N 3.48Å
432	V	89	Confident	90.3	Very high	21 Å²	21	66.4 Å²	66.4	13%	0.127	33%	0.327	C	S	.	.	H	α-helix	trans	-61.5	-39.3	175.7	172	0	0	0	0	111.9	K396 V399 N400 R428 E429 R430	K396-V432 HydrophobicContact CD-CG1 4.35Å; K396-V432 WeakPolarHBondContact CE-O 3.24Å; K396-V432 HydrophobicContact CG-CG1 3.84Å; V399-V432 HydrophobicContact CB-CG2 4.14Å; V399-V432 HydrophobicContact CG1-CG2 3.7Å; N400-V432 HydrophobicContact CB-CG2 3.98Å; R428-V432 WeakPolarHBondContact O-CG2 3.13Å; R428-V432 PolarHBondContact O-N 2.72Å; E429-V432 PolarHBondContact O-N 2.73Å; R430-V432 VanDerWaalsContact C-N 3.3Å; R430-V432 PolarHBondContact O-N 3.33Å
433	R	88.4	Confident	90.5	Very high	198 Å²	198	62.6 Å²	62.6	75%	0.747	31%	0.31	S	S	*	.	H	α-helix	trans	-75.5	-34.7	178.7	-70.4	179.5	-168.1	173.7	8.3	112.7	E429 R430 A431	E429-R433 WeakPolarHBondContact O-CG 3.32Å; E429-R433 PolarHBondContact O-N 3.18Å; E429-R433 VanDerWaalsContact O-N 3.07Å; R430-R433 PolarHBondContact O-N 3.49Å; R430-R433 VanDerWaalsContact O-N 3.1Å; A431-R433 VanDerWaalsContact C-N 3.33Å; A431-R433 PolarHBondContact O-N 2.48Å
434	T	89.7	Confident	90.7	Very high	53 Å²	53	62.7 Å²	62.7	33%	0.325	31%	0.311	S	S	.	.	H	α-helix	trans	-95.8	-2.5	-173.8	60	0	0	0	0	114.7	R430 A431 K436	R430-T434 HydrophobicContact CG-CG2 4.28Å; R430-T434 WeakPolarHBondContact O-CG2 3.18Å; R430-T434 PolarHBondContact O-N 2.94Å; R430-T434 PolarHBondContact O-OG1 3.19Å; A431-T434 PolarHBondContact O-N 3.45Å; T434-K436 WeakPolarHBondContact O-CG 3.13Å; T434-K436 PolarHBondContact O-N 3.33Å
435	L	90.8	Very high	91.1	Very high	12 Å²	12	59.8 Å²	59.8	6%	0.063	30%	0.295	C	S	.	.			trans	-56	122.4	-178	-155.8	82.4	0	0	0	111.3	V387 F392 K396 V399 Y412 A431 V441	V387-L435 HydrophobicContact CG1-CD2 4.12Å; V387-L435 HydrophobicContact CG1-CG 4.49Å; V387-L435 HydrophobicContact CG2-CD1 4.35Å; V387-L435 HydrophobicContact CG2-CD2 4.03Å; V387-L435 HydrophobicContact CG2-CG 4.16Å; F392-L435 HydrophobicContact CD2-CD2 4.22Å; F392-L435 HydrophobicContact CE2-CB 4.31Å; F392-L435 HydrophobicContact CE2-CD2 4.06Å; F392-L435 HydrophobicContact CE2-CG 4.49Å; K396-L435 HydrophobicContact CB-CD2 4.34Å; V399-L435 HydrophobicContact CG2-CD1 4.41Å; Y412-L435 HydrophobicContact CD2-CD1 3.9Å; Y412-L435 HydrophobicContact CE2-CD1 3.74Å; A431-L435 WeakPolarHBondContact O-CB 3.44Å; A431-L435 PolarHBondContact O-N 3.48Å; L435-V441 HydrophobicContact CD1-CG2 3.79Å
436	K	91.8	Very high	91.7	Very high	145 Å²	145	57.5 Å²	57.5	63%	0.63	28%	0.276	S	S	*	.			trans	-118.1	163.1	179.6	-72	173.5	-172.7	-178.4	0	111.9	V387 T434 G438 D439	V387-K436 WeakPolarHBondContact CB-O 2.93Å; T434-K436 WeakPolarHBondContact O-CG 3.13Å; T434-K436 PolarHBondContact O-N 3.33Å; K436-G438 PolarHBondContact O-N 3.35Å; K436-D439 PolarHBondContact N-OD2 3Å; K436-D439 WeakPolarHBondContact O-CB 3.44Å; K436-D439 PolarHBondContact O-N 3.18Å
437	F	93.3	Very high	92.2	Very high	130 Å²	130	55.6 Å²	55.6	57%	0.57	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	132.2	170.7	-54.9	-41.8	0	0	0	110.7	V387 F392	V387-F437 HydrophobicContact CG1-CD1 4.26Å; F392-F437 HydrophobicContact CB-CE1 4.13Å; F392-F437 HydrophobicContact CD2-CD1 4.2Å; F392-F437 AromaticContact CD2-CE1 3.74Å; F392-F437 HydrophobicContact CD2-CE1 3.74Å; F392-F437 HydrophobicContact CE2-CE1 4.4Å; F392-F437 HydrophobicContact CG-CE1 4.03Å
438	G	91.8	Very high	92.4	Very high	25 Å²	25	55.5 Å²	55.5	26%	0.258	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.6	-2.6	-174.3	0	0	0	0	0	115.2	V387 K436	V387-G438 PolarHBondContact O-N 3.36Å; K436-G438 PolarHBondContact O-N 3.35Å
439	D	93.9	Very high	92.8	Very high	5 Å²	5	53.4 Å²	53.4	3%	0.027	26%	0.26	C	S	.	.			trans	-70.3	157.1	163.4	-70.2	-11.9	0	0	0	109.7	V387 Y412 R415 K436	V387-D439 WeakPolarHBondContact CB-O 3.47Å; V387-D439 HydrophobicContact CG2-CB 4.32Å; V387-D439 VanDerWaalsContact CG2-O 3.32Å; V387-D439 WeakPolarHBondContact CG2-O 3.27Å; V387-D439 PolarHBondContact N-O 3.49Å; Y412-D439 HydrophobicContact CE2-CB 3.94Å; Y412-D439 WeakPolarHBondContact CE2-OD2 3.33Å; Y412-D439 PolarHBondContact OH-OD2 3.15Å; Y412-D439 VanDerWaalsContact OH-OD2 3.05Å; R415-D439 PolarHBondContact N-OD1 3.36Å; K436-D439 PolarHBondContact N-OD2 3Å; K436-D439 WeakPolarHBondContact O-CB 3.44Å; K436-D439 PolarHBondContact O-N 3.18Å
440	T	94.9	Very high	93.2	Very high	43 Å²	43	47.8 Å²	47.8	26%	0.264	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	129.3	178.3	-56.8	0	0	0	0	110.3	P384 T413	P384-T440 HydrophobicContact CB-CG2 3.7Å; T413-T440 PolarHBondContact N-O 3.32Å; T413-T440 PolarHBondContact O-N 3.08Å
441	V	95.4	Very high	93.7	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	120.9	176.8	177.9	0	0	0	0	109.1	E385 V387 L395 V399 A409 Y412 L435 R443	E385-V441 PolarHBondContact N-O 3.47Å; E385-V441 PolarHBondContact O-N 3.38Å; V387-V441 HydrophobicContact CG2-CG2 3.87Å; L395-V441 HydrophobicContact CD2-CB 4.47Å; V399-V441 HydrophobicContact CG2-CB 4.5Å; V399-V441 HydrophobicContact CG2-CG1 3.67Å; V399-V441 HydrophobicContact CG2-CG2 3.93Å; A409-V441 HydrophobicContact CB-CG1 3.64Å; Y412-V441 HydrophobicContact CD2-CG2 4.48Å; L435-V441 HydrophobicContact CD1-CG2 3.79Å; V441-R443 PolarHBondContact O-N 2.77Å
442	D	95.8	Very high	94.1	Very high	1 Å²	1	40.6 Å²	40.6	1%	0.005	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	84.1	175.5	-69.4	17.5	0	0	0	108.1	F383 T410 Y411 K420	F383-D442 WeakPolarHBondContact O-CA 3.4Å; T410-D442 PolarHBondContact N-O 3.13Å; Y411-D442 HydrophobicContact CD2-CB 4.34Å; Y411-D442 PolarHBondContact O-N 2.88Å; K420-D442 IonicContact NZ-OD2 2.89Å; K420-D442 PolarHBondContact NZ-OD2 3.28Å
443	R	96	Very high	94.5	Very high	11 Å²	11	39.6 Å²	39.6	4%	0.042	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	156.8	-179.9	63.3	160.1	-178	81.6	-5.4	111.9	T382 F383 E385 L395 V441 D449	T382-R443 CarbonylContact C-O 2.9Å; T382-R443 WeakPolarHBondContact CA-O 3.15Å; T382-R443 VanDerWaalsContact CB-O 3.29Å; T382-R443 WeakPolarHBondContact CB-O 3.37Å; F383-R443 PolarHBondContact N-O 3.32Å; F383-R443 PolarHBondContact O-N 2.9Å; E385-R443 HydrophobicContact CB-CG 4.42Å; E385-R443 WeakPolarHBondContact OE2-CD 3.46Å; E385-R443 IonicContact OE2-CZ 3.61Å; E385-R443 IonicContact OE2-NE 2.73Å; E385-R443 PolarHBondContact OE2-NE 3Å; E385-R443 IonicContact OE2-NH2 2.73Å; L395-R443 HydrophobicContact CD2-CB 4.45Å; V441-R443 PolarHBondContact O-N 2.77Å; R443-D449 IonicContact CZ-OD1 3.58Å; R443-D449 IonicContact CZ-OD2 2.7Å; R443-D449 IonicContact NH1-OD1 3.62Å; R443-D449 IonicContact NH1-OD2 2.66Å; R443-D449 PolarHBondContact NH1-OD2 3.3Å; R443-D449 IonicContact NH2-OD1 2.65Å; R443-D449 PolarHBondContact NH2-OD1 3.04Å; R443-D449 IonicContact NH2-OD2 2.69Å; R443-D449 PolarHBondContact NH2-OD2 3.14Å
444	H	97.3	Very high	94.9	Very high	4 Å²	4	30.8 Å²	30.8	2%	0.019	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.3	154.9	170.3	-61.1	162.5	0	0	0	111.5	A378 K379 P403 Y406 G408 T410	A378-H444 WeakPolarHBondContact O-CB 3.46Å; K379-H444 PolarHBondContact O-CD2 3.31Å; K379-H444 VanDerWaalsContact O-CD2 3.28Å; P403-H444 PolarHBondContact O-CE1 3.19Å; P403-H444 PolarHBondContact O-NE2 3.49Å; Y406-H444 HydrophobicContact CD2-CB 4.28Å; G408-H444 PolarHBondContact N-ND1 3.44Å; G408-H444 PolarHBondContact O-N 2.63Å; T410-H444 PolarHBondContact OG1-CD2 2.89Å; T410-H444 PolarHBondContact OG1-NE2 3.4Å
445	M	97	Very high	94.9	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	16%	0.161	C	C	.	.	P	Polyproline II helix	trans	-62.6	133.6	169.1	177.6	-177.4	-72	0	0	109.9	V373 A378 L381 Y406 D449 V451 V469 L498 F500	V373-M445 HydrophobicContact CB-SD 4.45Å; V373-M445 HydrophobicContact CG1-SD 3.95Å; V373-M445 HydrophobicContact CG2-SD 4.32Å; A378-M445 HydrophobicContact CB-CB 4.25Å; A378-M445 PolarHBondContact O-N 3.13Å; A378-M445 VanDerWaalsContact O-N 3.11Å; L381-M445 HydrophobicContact CB-CE 3.89Å; L381-M445 HydrophobicContact CD1-CE 3.8Å; L381-M445 HydrophobicContact CG-CE 4.5Å; L381-M445 WeakPolarHBondContact O-CB 3.22Å; L381-M445 PolarHBondContact O-N 3.44Å; L381-M445 VanDerWaalsContact O-N 3.07Å; Y406-M445 VanDerWaalsContact CE2-O 3.26Å; Y406-M445 WeakPolarHBondContact CE2-O 3.36Å; M445-D449 HydrophobicContact CG-CB 4.39Å; M445-V451 HydrophobicContact CE-CG1 3.6Å; M445-V451 HydrophobicContact SD-CG1 4.23Å; M445-V469 HydrophobicContact CG-CB 4.46Å; M445-V469 HydrophobicContact CG-CG1 4Å; M445-V469 HydrophobicContact CG-CG2 4.19Å; M445-V469 HydrophobicContact SD-CB 4.4Å; M445-V469 HydrophobicContact SD-CG1 3.87Å; M445-V469 HydrophobicContact SD-CG2 3.75Å; M445-L498 HydrophobicContact CE-CD2 4.03Å; M445-F500 HydrophobicContact CB-CE1 4.02Å; M445-F500 HydrophobicContact CB-CZ 4.3Å; M445-F500 HydrophobicContact CE-CB 3.84Å; M445-F500 HydrophobicContact CE-CD1 3.58Å; M445-F500 HydrophobicContact CE-CD2 3.84Å; M445-F500 HydrophobicContact CE-CE1 3.94Å; M445-F500 HydrophobicContact CE-CE2 4.22Å; M445-F500 HydrophobicContact CE-CG 3.5Å; M445-F500 VanDerWaalsContact CE-CG 3.5Å; M445-F500 HydrophobicContact CE-CZ 4.24Å; M445-F500 HydrophobicContact CG-CE1 4.38Å; M445-F500 HydrophobicContact CG-CZ 4.29Å
446	M	95.1	Very high	94.7	Very high	57 Å²	57	36 Å²	36	28%	0.281	19%	0.188	S	C	.	.			trans	-127.1	168	-175.5	65.1	-175.9	-77.8	0	0	112.6	R394 Y406 G448 D449	R394-M446 PolarHBondContact NH1-SD 3.24Å; Y406-M446 WeakPolarHBondContact OH-CA 3.28Å; M446-G448 PolarHBondContact O-N 3.35Å; M446-D449 WeakPolarHBondContact CG-OD2 3.3Å; M446-D449 PolarHBondContact N-OD2 2.87Å; M446-D449 WeakPolarHBondContact O-CB 3.31Å; M446-D449 PolarHBondContact O-N 3.15Å; M446-D449 VanDerWaalsContact O-N 3.1Å
447	D	95.3	Very high	94.3	Very high	63 Å²	63	33.3 Å²	33.3	34%	0.337	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.5	133	172.8	-74.1	7.4	0	0	0	111.1	D449 V469 K470 V471	D447-D449 VanDerWaalsContact C-N 3.32Å; D447-V469 WeakPolarHBondContact CA-O 3.2Å; D447-K470 WeakPolarHBondContact OD2-CE 3.18Å; D447-K470 IonicContact OD2-NZ 2.87Å; D447-K470 PolarHBondContact OD2-NZ 3.43Å; D447-V471 WeakPolarHBondContact OD1-CB 3.34Å; D447-V471 PolarHBondContact OD1-N 3.43Å
448	G	93.6	Very high	94	Very high	45 Å²	45	30.1 Å²	30.1	46%	0.464	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	83.4	-1.1	-178.5	0	0	0	0	0	115	M446 V469	M446-G448 PolarHBondContact O-N 3.35Å; G448-V469 PolarHBondContact N-O 3.12Å
449	D	96.3	Very high	93.6	Very high	3 Å²	3	31.2 Å²	31.2	2%	0.016	18%	0.179	C	C	.	.			trans	-65.4	157	165.6	-83.4	-34.7	0	0	0	111.3	R443 M445 M446 D447 F468 V469 F500 R507	R443-D449 IonicContact CZ-OD1 3.58Å; R443-D449 IonicContact CZ-OD2 2.7Å; R443-D449 IonicContact NH1-OD1 3.62Å; R443-D449 IonicContact NH1-OD2 2.66Å; R443-D449 PolarHBondContact NH1-OD2 3.3Å; R443-D449 IonicContact NH2-OD1 2.65Å; R443-D449 PolarHBondContact NH2-OD1 3.04Å; R443-D449 IonicContact NH2-OD2 2.69Å; R443-D449 PolarHBondContact NH2-OD2 3.14Å; M445-D449 HydrophobicContact CG-CB 4.39Å; M446-D449 WeakPolarHBondContact CG-OD2 3.3Å; M446-D449 PolarHBondContact N-OD2 2.87Å; M446-D449 WeakPolarHBondContact O-CB 3.31Å; M446-D449 PolarHBondContact O-N 3.15Å; M446-D449 VanDerWaalsContact O-N 3.1Å; D447-D449 VanDerWaalsContact C-N 3.32Å; D449-F468 CarbonylContact O-C 3.43Å; D449-F468 WeakPolarHBondContact O-CA 3.44Å; D449-V469 HydrophobicContact CB-CB 4.46Å; D449-V469 HydrophobicContact CB-CG2 4.38Å; D449-V469 PolarHBondContact O-N 3.5Å; D449-F500 HydrophobicContact CB-CE2 3.95Å; D449-F500 HydrophobicContact CB-CZ 4.14Å; D449-R507 IonicContact OD1-CZ 3.3Å; D449-R507 IonicContact OD1-NH1 3.65Å; D449-R507 PolarHBondContact OD1-NH1 3.16Å; D449-R507 IonicContact OD1-NH2 2.76Å; D449-R507 PolarHBondContact OD1-NH2 3.5Å
450	V	96.9	Very high	93.3	Very high	6 Å²	6	32.6 Å²	32.6	4%	0.036	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	131.5	-176.1	-179.8	0	0	0	0	108.2	H467 F468 P501 V510 V511	V450-H467 WeakPolarHBondContact CA-O 3.28Å; V450-F468 HydrophobicContact CG2-CD1 3.8Å; V450-F468 HydrophobicContact CG2-CE1 3.56Å; V450-F468 HydrophobicContact CG2-CZ 4.47Å; V450-P501 WeakPolarHBondContact O-CD 3.47Å; V450-V510 HydrophobicContact CG1-CB 3.97Å; V450-V510 HydrophobicContact CG1-CG1 3.41Å; V450-V510 VanDerWaalsContact CG1-CG1 3.41Å; V450-V511 HydrophobicContact CB-CG2 4.2Å; V450-V511 HydrophobicContact CG1-CG2 3.92Å; V450-V511 HydrophobicContact CG2-CG2 3.37Å
451	V	97.5	Very high	93.1	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	150.8	179.8	-67.9	0	0	0	0	110.2	V371 M445 G466 H467 V469 L498 F500	V371-V451 HydrophobicContact CG1-CG2 3.62Å; M445-V451 HydrophobicContact CE-CG1 3.6Å; M445-V451 HydrophobicContact SD-CG1 4.23Å; V451-G466 WeakPolarHBondContact O-CA 3.31Å; V451-H467 HydrophobicContact CG2-CB 4.34Å; V451-H467 PolarHBondContact N-O 2.93Å; V451-H467 PolarHBondContact O-N 3.09Å; V451-V469 HydrophobicContact CB-CG2 4.1Å; V451-V469 HydrophobicContact CG1-CG2 3.36Å; V451-V469 HydrophobicContact CG2-CG2 3.6Å; V451-L498 HydrophobicContact CB-CD1 4.25Å; V451-L498 HydrophobicContact CB-CD2 4.1Å; V451-L498 HydrophobicContact CB-CG 4.01Å; V451-L498 HydrophobicContact CG1-CD1 4.45Å; V451-L498 HydrophobicContact CG1-CD2 3.89Å; V451-L498 HydrophobicContact CG1-CG 4.31Å; V451-L498 HydrophobicContact CG2-CD1 3.95Å; V451-L498 HydrophobicContact CG2-CG 4.2Å; V451-F500 HydrophobicContact CG1-CD2 3.86Å; V451-F500 HydrophobicContact CG1-CE2 4.47Å; V451-F500 HydrophobicContact CG1-CG 4.47Å
452	L	97.4	Very high	93	Very high	30 Å²	30	36.2 Å²	36.2	16%	0.157	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	130.5	166.9	-73	170.3	0	0	0	108.8	M464 L498 H499 V510 M514	L452-M464 HydrophobicContact CD2-CG 4.34Å; L452-L498 CarbonylContact O-C 3.51Å; L452-L498 WeakPolarHBondContact O-CA 3.31Å; L452-H499 HydrophobicContact CB-CB 4.16Å; L452-H499 PolarHBondContact N-O 2.78Å; L452-H499 PolarHBondContact O-N 3.07Å; L452-V510 HydrophobicContact CD1-CG2 4.31Å; L452-V510 HydrophobicContact CD2-CG1 3.86Å; L452-V510 HydrophobicContact CD2-CG2 3.78Å; L452-V510 HydrophobicContact CG-CG1 4.37Å; L452-V510 HydrophobicContact CG-CG2 3.99Å; L452-M514 HydrophobicContact CD2-CE 3.46Å; L452-M514 VanDerWaalsContact CD2-CE 3.46Å; L452-M514 HydrophobicContact CD2-SD 3.77Å
453	F	97.2	Very high	92.8	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	127.9	177.1	-164	-129.2	0	0	0	109	I360 V371 M464 M465 F477 F479 Y487 M496 N497 L498	I360-F453 HydrophobicContact CG2-CZ 3.9Å; V371-F453 HydrophobicContact CG2-CE1 4.48Å; V371-F453 HydrophobicContact CG2-CE2 4.42Å; V371-F453 HydrophobicContact CG2-CZ 4.39Å; F453-M464 WeakPolarHBondContact O-CA 3.44Å; F453-M465 PolarHBondContact N-O 3.22Å; F453-M465 PolarHBondContact O-N 3.48Å; F453-F477 HydrophobicContact CE2-CB 4.3Å; F453-F477 AromaticContact CE2-CD2 3.85Å; F453-F477 HydrophobicContact CE2-CD2 3.85Å; F453-F477 HydrophobicContact CE2-CE2 4.42Å; F453-F477 HydrophobicContact CE2-CG 4.15Å; F453-F477 HydrophobicContact CZ-CB 4.23Å; F453-F477 HydrophobicContact CZ-CD2 4.45Å; F453-F479 AromaticContact CE1-CD1 3.75Å; F453-F479 HydrophobicContact CE1-CD1 3.75Å; F453-F479 AromaticContact CE1-CE1 3.89Å; F453-F479 HydrophobicContact CE1-CE1 3.89Å; F453-F479 HydrophobicContact CE1-CG 4.35Å; F453-F479 HydrophobicContact CZ-CD1 4.2Å; F453-F479 HydrophobicContact CZ-CE1 4.33Å; F453-Y487 AromaticContact CD1-CE2 3.95Å; F453-Y487 HydrophobicContact CD1-CE2 3.95Å; F453-Y487 AromaticContact CD1-CZ 3.87Å; F453-Y487 HydrophobicContact CE1-CE2 4.4Å; F453-Y487 PolarHBondContact O-OH 3.16Å; F453-M496 HydrophobicContact CD1-CE 3.34Å; F453-M496 HydrophobicContact CD1-SD 4.3Å; F453-M496 HydrophobicContact CD2-CB 4.42Å; F453-M496 HydrophobicContact CD2-CE 4.43Å; F453-M496 HydrophobicContact CE1-CB 4.21Å; F453-M496 HydrophobicContact CE1-CE 3.12Å; F453-M496 HydrophobicContact CE1-CG 4.47Å; F453-M496 HydrophobicContact CE1-SD 3.46Å; F453-M496 WeakPolarHBondContact CE1-SD 3.44Å; F453-M496 HydrophobicContact CE2-CB 3.56Å; F453-M496 HydrophobicContact CE2-CE 4.26Å; F453-M496 HydrophobicContact CG-CE 4.01Å; F453-M496 HydrophobicContact CZ-CB 3.44Å; F453-M496 VanDerWaalsContact CZ-CB 3.44Å; F453-M496 HydrophobicContact CZ-CE 3.63Å; F453-M496 HydrophobicContact CZ-CG 4.09Å; F453-M496 HydrophobicContact CZ-SD 3.61Å; F453-N497 WeakPolarHBondContact CD2-O 3.48Å; F453-L498 HydrophobicContact CD2-CB 4.31Å
454	N	95.4	Very high	92.8	Very high	14 Å²	14	39 Å²	39	8%	0.075	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	148.8	-177.3	100.6	39.5	0	0	0	112	S463 M464 M496 N497 H499	N454-S463 WeakPolarHBondContact CA-O 3.39Å; N454-M464 HydrophobicContact CB-CB 4.14Å; N454-M464 HydrophobicContact CB-CE 3.81Å; N454-M464 HydrophobicContact CB-CG 4.11Å; N454-M496 WeakPolarHBondContact O-CB 3.1Å; N454-N497 PolarHBondContact N-O 3.06Å; N454-N497 PolarHBondContact O-N 2.88Å; N454-N497 PolarHBondContact OD1-ND2 3.49Å; N454-H499 PolarHBondContact ND2-NE2 2.93Å
455	R	91	Very high	92.8	Very high	39 Å²	39	38.9 Å²	38.9	15%	0.147	21%	0.209	C	C	.	.			trans	-107.4	141.4	161.3	-159.3	-175.4	174.5	-123.7	0.5	110.3	P457 S458 S463 Y487 N488 D494 M496	R455-P457 CarbonylContact O-C 3.48Å; R455-S458 PolarHBondContact O-OG 3.43Å; R455-S463 PolarHBondContact N-O 2.96Å; R455-Y487 HydrophobicContact CB-CD1 4.24Å; R455-Y487 WeakPolarHBondContact CD-O 3.27Å; R455-Y487 PolarHBondContact NH1-O 3.23Å; R455-Y487 VanDerWaalsContact NH1-O 3.15Å; R455-N488 PolarHBondContact NH1-O 3.04Å; R455-N488 PolarHBondContact NH2-O 2.9Å; R455-D494 IonicContact CZ-OD2 2.63Å; R455-D494 IonicContact NE-OD2 3.29Å; R455-D494 PolarHBondContact NE-OD2 3.14Å; R455-D494 IonicContact NH2-OD1 3.79Å; R455-D494 PolarHBondContact NH2-OD1 2.7Å; R455-D494 IonicContact NH2-OD2 3.78Å; R455-D494 PolarHBondContact NH2-OD2 2.69Å; R455-M496 HydrophobicContact CB-CE 3.94Å; R455-M496 HydrophobicContact CB-CG 4.13Å; R455-M496 HydrophobicContact CB-SD 4.3Å; R455-M496 HydrophobicContact CG-CG 4.01Å; R455-M496 HydrophobicContact CG-SD 4.49Å
456	Q	85.3	Confident	92.8	Very high	135 Å²	135	38.9 Å²	38.9	63%	0.631	21%	0.209	S	C	*	.	S	Bend	trans	-108.2	128	172.5	-166.6	155.6	26.2	0	0	109.1
457	P	84.2	Confident	92.9	Very high	89 Å²	89	36.1 Å²	36.1	58%	0.578	20%	0.195	S	C	*	.	S	Bend	cis	-78	147.2	4	32.4	-35.3	0	0	0	114.2	R455	R455-P457 CarbonylContact O-C 3.48Å
458	S	87.7	Confident	93	Very high	63 Å²	63	35 Å²	35	44%	0.441	19%	0.188	S	C	.	.			trans	-95.5	115.5	176.3	-46.8	0	0	0	0	110.4	R455	R455-S458 PolarHBondContact O-OG 3.43Å
459	L	82.8	Confident	93.1	Very high	47 Å²	47	33 Å²	33	25%	0.246	17%	0.166	C	C	.	.			trans	-99.2	-25.6	-176.5	-62.8	177.3	0	0	0	112.8	S463 Q861 E1047 T1050	L459-S463 PolarHBondContact N-OG 2.81Å; L459-Q861 PolarHBondContact O-NE2 2.94Å; L459-Q861 PolarHBondContact O-OE1 3Å; L459-E1047 HydrophobicContact CB-CG 4.31Å; L459-T1050 HydrophobicContact CD1-CG2 4.21Å; L459-T1050 HydrophobicContact CD2-CG2 4.01Å
460	H	87.7	Confident	93.1	Very high	35 Å²	35	36.1 Å²	36.1	16%	0.162	18%	0.18	C	C	.	.	S	Bend	trans	-146.2	173	-179.5	57	75.4	0	0	0	110.8	L462 S463 P486 E1047	H460-L462 VanDerWaalsContact C-N 3.33Å; H460-L462 WeakPolarHBondContact ND1-CA 3.32Å; H460-L462 WeakPolarHBondContact ND1-CB 3.39Å; H460-L462 PolarHBondContact ND1-N 3.16Å; H460-L462 VanDerWaalsContact ND1-N 3.14Å; H460-L462 PolarHBondContact O-N 3.14Å; H460-S463 PolarHBondContact CE1-N 3.47Å; H460-S463 PolarHBondContact CE1-OG 3.18Å; H460-S463 PolarHBondContact N-OG 3.17Å; H460-S463 PolarHBondContact ND1-N 3.16Å; H460-S463 WeakPolarHBondContact O-CB 3.48Å; H460-S463 PolarHBondContact O-N 3.46Å; H460-S463 PolarHBondContact O-OG 3.02Å; H460-P486 PolarHBondContact CE1-O 3.45Å; H460-P486 PolarHBondContact NE2-O 2.89Å; H460-P486 VanDerWaalsContact NE2-O 3.11Å; H460-E1047 HydrophobicContact CB-CB 4.27Å; H460-E1047 HydrophobicContact CB-CG 4.1Å
461	R	90.1	Very high	93.1	Very high	117 Å²	117	36.8 Å²	36.8	44%	0.442	18%	0.184	S	C	.	.	G	3₁₀ helix	trans	-53.5	-47.2	-179.1	-171.5	-179.8	86.5	-174.2	5	112.6	S463 M464 N519	R461-S463 PolarHBondContact O-N 2.95Å; R461-S463 VanDerWaalsContact O-N 3.07Å; R461-M464 PolarHBondContact O-N 3.01Å; R461-N519 PolarHBondContact NH2-OD1 2.62Å
462	L	93	Very high	93.1	Very high	1 Å²	1	38.1 Å²	38.1	1%	0.005	19%	0.191	C	C	.	.	G	3₁₀ helix	trans	-67.7	-3.9	-178.7	-62.5	80.5	0	0	0	114.8	H460 M464 M465 P486 N519 P523 L529	H460-L462 VanDerWaalsContact C-N 3.33Å; H460-L462 WeakPolarHBondContact ND1-CA 3.32Å; H460-L462 WeakPolarHBondContact ND1-CB 3.39Å; H460-L462 PolarHBondContact ND1-N 3.16Å; H460-L462 VanDerWaalsContact ND1-N 3.14Å; H460-L462 PolarHBondContact O-N 3.14Å; L462-M464 PolarHBondContact O-N 2.85Å; L462-M465 HydrophobicContact CB-SD 4.19Å; L462-M465 WeakPolarHBondContact O-CG 3.2Å; L462-P486 HydrophobicContact CB-CB 3.91Å; L462-P486 HydrophobicContact CD2-CB 4.46Å; L462-N519 HydrophobicContact CD2-CB 4.36Å; L462-N519 WeakPolarHBondContact CD2-O 3.37Å; L462-N519 HydrophobicContact CG-CB 4.41Å; L462-P523 VanDerWaalsContact CD1-CD 3.47Å; L462-P523 HydrophobicContact CD1-CG 4.36Å; L462-L529 HydrophobicContact CD2-CD2 4.03Å
463	S	92.8	Very high	93	Very high	6 Å²	6	41.7 Å²	41.7	4%	0.042	22%	0.215	C	C	.	.	G	3₁₀ helix	trans	-70.9	-8.7	171	-51.8	0	0	0	0	112.6	N454 R455 L459 H460 R461 Y487	N454-S463 WeakPolarHBondContact CA-O 3.39Å; R455-S463 PolarHBondContact N-O 2.96Å; L459-S463 PolarHBondContact N-OG 2.81Å; H460-S463 PolarHBondContact CE1-N 3.47Å; H460-S463 PolarHBondContact CE1-OG 3.18Å; H460-S463 PolarHBondContact N-OG 3.17Å; H460-S463 PolarHBondContact ND1-N 3.16Å; H460-S463 WeakPolarHBondContact O-CB 3.48Å; H460-S463 PolarHBondContact O-N 3.46Å; H460-S463 PolarHBondContact O-OG 3.02Å; R461-S463 PolarHBondContact O-N 2.95Å; R461-S463 VanDerWaalsContact O-N 3.07Å; S463-Y487 WeakPolarHBondContact O-CD1 3.42Å; S463-Y487 WeakPolarHBondContact O-CE1 3.3Å
464	M	95	Very high	92.8	Very high	65 Å²	65	47.5 Å²	47.5	32%	0.32	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	115.8	170.8	-177.9	179.9	-72	0	0	109.4	L452 F453 N454 R461 L462 M514	L452-M464 HydrophobicContact CD2-CG 4.34Å; F453-M464 WeakPolarHBondContact O-CA 3.44Å; N454-M464 HydrophobicContact CB-CB 4.14Å; N454-M464 HydrophobicContact CB-CE 3.81Å; N454-M464 HydrophobicContact CB-CG 4.11Å; R461-M464 PolarHBondContact O-N 3.01Å; L462-M464 PolarHBondContact O-N 2.85Å; M464-M514 HydrophobicContact CG-CE 3.97Å; M464-M514 HydrophobicContact SD-CE 4.16Å
465	M	96.6	Very high	92.8	Very high	1 Å²	1	56.3 Å²	56.3	1%	0.005	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	158.2	-179.4	-61.4	-177.6	-73.5	0	0	111.7	F453 L462 P486 Y487 V516 N519 I530	F453-M465 PolarHBondContact N-O 3.22Å; F453-M465 PolarHBondContact O-N 3.48Å; L462-M465 HydrophobicContact CB-SD 4.19Å; L462-M465 WeakPolarHBondContact O-CG 3.2Å; M465-P486 HydrophobicContact CE-CB 3.85Å; M465-P486 HydrophobicContact CE-CG 4.1Å; M465-Y487 HydrophobicContact CE-CD2 4.31Å; M465-Y487 HydrophobicContact CE-CE1 3.97Å; M465-Y487 HydrophobicContact CE-CE2 3.57Å; M465-Y487 WeakPolarHBondContact CE-OH 3.47Å; M465-V516 HydrophobicContact CB-CG2 4.07Å; M465-V516 HydrophobicContact CE-CG2 4.32Å; M465-V516 HydrophobicContact SD-CG2 4.14Å; M465-N519 HydrophobicContact SD-CB 4.36Å; M465-I530 HydrophobicContact CE-CD1 4.25Å; M465-I530 HydrophobicContact SD-CD1 4.11Å
466	G	96.9	Very high	93.1	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	127.8	172.4	0	0	0	0	0	111.7	V451 V510 M514 N515 V516	V451-G466 WeakPolarHBondContact O-CA 3.31Å; G466-V510 VanDerWaalsContact CA-CG1 3.5Å; G466-M514 PolarHBondContact N-O 2.91Å; G466-N515 WeakPolarHBondContact O-CA 3.46Å; G466-V516 PolarHBondContact O-N 3.15Å
467	H	97.4	Very high	93.7	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	153.3	175.7	-74.1	-106	0	0	0	110.7	F369 V371 V450 V451 Y487 V516	F369-H467 CarbonylContact O-C 3.6Å; F369-H467 WeakPolarHBondContact O-CA 3.4Å; V371-H467 HydrophobicContact CB-CB 3.91Å; V371-H467 HydrophobicContact CG1-CB 3.6Å; V450-H467 WeakPolarHBondContact CA-O 3.28Å; V451-H467 HydrophobicContact CG2-CB 4.34Å; V451-H467 PolarHBondContact N-O 2.93Å; V451-H467 PolarHBondContact O-N 3.09Å; H467-Y487 AromaticContact NE2-CZ 3.95Å; H467-Y487 PolarHBondContact NE2-OH 3.05Å; H467-V516 WeakPolarHBondContact CE1-CG2 3.24Å; H467-V516 WeakPolarHBondContact NE2-CG2 3.44Å
468	F	97.2	Very high	94.3	Very high	39 Å²	39	48.3 Å²	48.3	17%	0.171	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	135.5	167.9	-70.3	-75.5	0	0	0	110.1	F369 E370 V371 D449 V450 V511 N515	F369-F468 HydrophobicContact CD2-CB 4.49Å; F369-F468 AromaticContact CD2-CD2 3.65Å; F369-F468 HydrophobicContact CD2-CD2 3.65Å; F369-F468 HydrophobicContact CD2-CE2 4.41Å; F369-F468 HydrophobicContact CE2-CD2 4.28Å; F369-F468 HydrophobicContact CG-CD2 4.42Å; F369-F468 PolarHBondContact O-N 3.17Å; E370-F468 CarbonylContact C-O 3.06Å; E370-F468 VanDerWaalsContact CA-O 3.25Å; E370-F468 WeakPolarHBondContact CA-O 3.34Å; E370-F468 HydrophobicContact CG-CB 4.27Å; V371-F468 PolarHBondContact N-O 3.4Å; D449-F468 CarbonylContact O-C 3.43Å; D449-F468 WeakPolarHBondContact O-CA 3.44Å; V450-F468 HydrophobicContact CG2-CD1 3.8Å; V450-F468 HydrophobicContact CG2-CE1 3.56Å; V450-F468 HydrophobicContact CG2-CZ 4.47Å; F468-V511 HydrophobicContact CE1-CG2 4.44Å; F468-V511 HydrophobicContact CZ-CG1 4.4Å; F468-V511 HydrophobicContact CZ-CG2 4.4Å; F468-N515 WeakPolarHBondContact CE2-ND2 3.47Å
469	V	97.3	Very high	94.7	Very high	2 Å²	2	45.3 Å²	45.3	1%	0.012	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	136	-178.5	174.6	0	0	0	0	110.3	V373 M445 D447 G448 D449 V451 V471	V373-V469 HydrophobicContact CB-CG1 3.88Å; V373-V469 HydrophobicContact CG2-CB 4.42Å; V373-V469 HydrophobicContact CG2-CG1 3.72Å; V373-V469 HydrophobicContact CG2-CG2 4.12Å; M445-V469 HydrophobicContact CG-CB 4.46Å; M445-V469 HydrophobicContact CG-CG1 4Å; M445-V469 HydrophobicContact CG-CG2 4.19Å; M445-V469 HydrophobicContact SD-CB 4.4Å; M445-V469 HydrophobicContact SD-CG1 3.87Å; M445-V469 HydrophobicContact SD-CG2 3.75Å; D447-V469 WeakPolarHBondContact CA-O 3.2Å; G448-V469 PolarHBondContact N-O 3.12Å; D449-V469 HydrophobicContact CB-CB 4.46Å; D449-V469 HydrophobicContact CB-CG2 4.38Å; D449-V469 PolarHBondContact O-N 3.5Å; V451-V469 HydrophobicContact CB-CG2 4.1Å; V451-V469 HydrophobicContact CG1-CG2 3.36Å; V451-V469 HydrophobicContact CG2-CG2 3.6Å; V469-V471 HydrophobicContact CG1-CG2 3.97Å
470	K	96.3	Very high	95.3	Very high	69 Å²	69	43.1 Å²	43.1	30%	0.3	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	117.4	160.9	-171.7	67.8	-179.6	168.4	0	108.9	L366 V371 G372 V373 D447 L472	L366-K470 HydrophobicContact CD2-CB 4.08Å; L366-K470 HydrophobicContact CD2-CG 4.01Å; V371-K470 PolarHBondContact O-N 2.94Å; G372-K470 CarbonylContact C-O 3.53Å; G372-K470 VanDerWaalsContact CA-O 3.25Å; G372-K470 WeakPolarHBondContact CA-O 3.26Å; V373-K470 PolarHBondContact N-O 3.35Å; D447-K470 WeakPolarHBondContact OD2-CE 3.18Å; D447-K470 IonicContact OD2-NZ 2.87Å; D447-K470 PolarHBondContact OD2-NZ 3.43Å; K470-L472 HydrophobicContact CG-CD2 4.28Å; K470-L472 PolarHBondContact O-N 3.29Å
471	V	97.1	Very high	95.7	Very high	20 Å²	20	43 Å²	43	12%	0.121	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	125.2	-178.9	-177.9	0	0	0	0	109.7	V373 L375 A378 Y406 D447 V469	V373-V471 WeakPolarHBondContact O-CA 3.33Å; L375-V471 HydrophobicContact CB-CG1 4.3Å; L375-V471 HydrophobicContact CD1-CG1 3.8Å; A378-V471 HydrophobicContact CB-CG1 3.99Å; A378-V471 HydrophobicContact CB-CG2 3.93Å; Y406-V471 HydrophobicContact CE1-CB 4.47Å; Y406-V471 HydrophobicContact CE1-CG1 4.25Å; Y406-V471 HydrophobicContact CE2-CG2 4.39Å; Y406-V471 WeakPolarHBondContact OH-CG2 3.25Å; D447-V471 WeakPolarHBondContact OD1-CB 3.34Å; D447-V471 PolarHBondContact OD1-N 3.43Å; V469-V471 HydrophobicContact CG1-CG2 3.97Å
472	L	96	Very high	95.9	Very high	29 Å²	29	37.5 Å²	37.5	15%	0.152	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	151.1	-177.8	-63.4	177.8	0	0	0	111	V373 L375 K470 Y474 R478	V373-L472 PolarHBondContact O-N 3.42Å; L375-L472 PolarHBondContact N-O 3.2Å; K470-L472 HydrophobicContact CG-CD2 4.28Å; K470-L472 PolarHBondContact O-N 3.29Å; L472-Y474 HydrophobicContact CB-CD2 4Å; L472-Y474 HydrophobicContact CD1-CD2 4.4Å; L472-Y474 PolarHBondContact O-N 3.29Å; L472-R478 HydrophobicContact CD1-CB 4.21Å
473	P	95.2	Very high	96	Very high	104 Å²	104	37.4 Å²	37.4	68%	0.675	17%	0.173	S	C	*	.	S	Bend	trans	-73.3	-4.3	-178.4	30.8	-36.2	0	0	0	113.9
474	Y	94.4	Very high	96	Very high	123 Å²	123	37.7 Å²	37.7	48%	0.482	18%	0.175	S	C	.	.	S	Bend	trans	-82.3	-177	-178.2	-51.1	-62.5	0	0	0	112.8	P374 L472	P374-Y474 WeakPolarHBondContact CA-O 3.21Å; P374-Y474 WeakPolarHBondContact CB-O 3.29Å; L472-Y474 HydrophobicContact CB-CD2 4Å; L472-Y474 HydrophobicContact CD1-CD2 4.4Å; L472-Y474 PolarHBondContact O-N 3.29Å
475	R	95.8	Very high	95.9	Very high	199 Å²	199	37 Å²	37	75%	0.751	18%	0.175	S	C	*	.	S	Bend	trans	-111	-9.3	-179	-64.6	-175.9	-178.1	178.8	0.9	114.9	T358 P374 L376	T358-R475 WeakPolarHBondContact CG2-O 3.3Å; P374-R475 WeakPolarHBondContact CG-O 3.42Å; L376-R475 HydrophobicContact CD1-CG 4.39Å
476	T	96.9	Very high	95.7	Very high	38 Å²	38	37 Å²	37	23%	0.233	17%	0.174	C	C	.	.	S	Bend	trans	-101.2	154.3	-178.8	51.6	0	0	0	0	111.6	V359 S361 P374	V359-T476 HydrophobicContact CB-CG2 4.38Å; V359-T476 WeakPolarHBondContact O-CA 3.4Å; V359-T476 WeakPolarHBondContact O-CB 3.47Å; S361-T476 VanDerWaalsContact OG-CB 3.29Å; S361-T476 WeakPolarHBondContact OG-CB 3.35Å; S361-T476 PolarHBondContact OG-OG1 3.29Å; P374-T476 WeakPolarHBondContact CG-O 3.46Å
477	F	97.8	Very high	95.6	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	137.4	164.8	-68.3	-43.7	0	0	0	109.3	T358 V359 I360 S361 G372 V373 V377 F453 L498	T358-F477 HydrophobicContact CG2-CD2 4.48Å; V359-F477 PolarHBondContact O-N 3.26Å; I360-F477 CarbonylContact C-O 3.4Å; I360-F477 WeakPolarHBondContact CA-O 3.48Å; I360-F477 HydrophobicContact CG2-CB 4.23Å; S361-F477 PolarHBondContact N-O 3.07Å; S361-F477 PolarHBondContact OG-O 3.44Å; G372-F477 WeakPolarHBondContact O-CA 3.25Å; V373-F477 HydrophobicContact CG1-CE1 4.3Å; V373-F477 HydrophobicContact CG2-CE1 4.43Å; V377-F477 HydrophobicContact CG1-CE1 4.46Å; F453-F477 HydrophobicContact CE2-CB 4.3Å; F453-F477 AromaticContact CE2-CD2 3.85Å; F453-F477 HydrophobicContact CE2-CD2 3.85Å; F453-F477 HydrophobicContact CE2-CE2 4.42Å; F453-F477 HydrophobicContact CE2-CG 4.15Å; F453-F477 HydrophobicContact CZ-CB 4.23Å; F453-F477 HydrophobicContact CZ-CD2 4.45Å; F477-L498 HydrophobicContact CD1-CD1 4.37Å; F477-L498 HydrophobicContact CE1-CB 4.34Å; F477-L498 HydrophobicContact CE1-CD1 3.8Å; F477-L498 HydrophobicContact CE2-CB 4.04Å; F477-L498 HydrophobicContact CZ-CB 3.7Å; F477-L498 HydrophobicContact CZ-CD1 4.04Å; F477-L498 HydrophobicContact CZ-CG 4.45Å
478	R	97.2	Very high	95.2	Very high	57 Å²	57	42.6 Å²	42.6	22%	0.215	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	136.8	179.8	-73.5	172.3	-168.9	-103.1	2.7	110.6	S361 D363 L366 V371 G372 L472	S361-R478 VanDerWaalsContact O-CA 3.27Å; S361-R478 WeakPolarHBondContact O-CA 3.47Å; S361-R478 WeakPolarHBondContact OG-CG 3.35Å; D363-R478 HydrophobicContact CB-CB 3.94Å; D363-R478 HydrophobicContact CB-CG 4.4Å; L366-R478 HydrophobicContact CD1-CB 3.95Å; L366-R478 WeakPolarHBondContact CD1-O 3.49Å; V371-R478 CarbonylContact C-O 3.53Å; V371-R478 WeakPolarHBondContact CA-O 3.43Å; V371-R478 WeakPolarHBondContact CG2-O 3.22Å; G372-R478 PolarHBondContact N-O 3.13Å; G372-R478 PolarHBondContact O-N 2.92Å; L472-R478 HydrophobicContact CD1-CB 4.21Å
479	F	96.1	Very high	94.9	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.6	164.4	172.5	67	-84.2	0	0	0	110.1	I360 S361 D363 F453 A483 C484 Y487 A489 F491 M496	I360-F479 HydrophobicContact CB-CE1 3.94Å; I360-F479 HydrophobicContact CD1-CE1 3.96Å; I360-F479 HydrophobicContact CD1-CZ 4.2Å; I360-F479 HydrophobicContact CG2-CE1 3.94Å; S361-F479 PolarHBondContact O-N 2.94Å; D363-F479 PolarHBondContact N-O 3.17Å; D363-F479 VanDerWaalsContact N-O 3.17Å; F453-F479 AromaticContact CE1-CD1 3.75Å; F453-F479 HydrophobicContact CE1-CD1 3.75Å; F453-F479 AromaticContact CE1-CE1 3.89Å; F453-F479 HydrophobicContact CE1-CE1 3.89Å; F453-F479 HydrophobicContact CE1-CG 4.35Å; F453-F479 HydrophobicContact CZ-CD1 4.2Å; F453-F479 HydrophobicContact CZ-CE1 4.33Å; F479-A483 HydrophobicContact CD2-CB 4.21Å; F479-A483 HydrophobicContact CE2-CB 4.5Å; F479-C484 HydrophobicContact CE2-CB 4.47Å; F479-C484 WeakPolarHBondContact CE2-SG 3.24Å; F479-Y487 HydrophobicContact CE2-CD2 4.26Å; F479-Y487 HydrophobicContact CZ-CD2 4.41Å; F479-A489 HydrophobicContact CZ-CB 4.47Å; F479-F491 HydrophobicContact CD1-CE1 4.42Å; F479-F491 AromaticContact CE1-CE1 3.79Å; F479-F491 HydrophobicContact CE1-CE1 3.79Å; F479-F491 HydrophobicContact CE1-CZ 4.25Å; F479-F491 HydrophobicContact CE2-CZ 4.29Å; F479-F491 AromaticContact CZ-CE1 3.9Å; F479-F491 HydrophobicContact CZ-CE1 3.9Å; F479-F491 AromaticContact CZ-CZ 3.97Å; F479-F491 HydrophobicContact CZ-CZ 3.97Å; F479-M496 HydrophobicContact CE1-SD 4.09Å; F479-M496 HydrophobicContact CZ-SD 4.31Å
480	N	95.6	Very high	94.5	Very high	0 Å²	0	46 Å²	46	0%	0	23%	0.226	C	C	.	.			trans	-71.2	137.5	-177.1	-167.2	-58.7	0	0	0	111.7	L366 I368 C482 A483	L366-N480 PolarHBondContact O-ND2 3.37Å; I368-N480 HydrophobicContact CG1-CB 4.47Å; N480-C482 PolarHBondContact O-N 3.43Å; N480-C482 VanDerWaalsContact O-N 3.17Å; N480-C482 WeakPolarHBondContact OD1-CB 3.28Å; N480-C482 PolarHBondContact OD1-N 2.85Å; N480-C482 PolarHBondContact OD1-SG 2.91Å; N480-A483 PolarHBondContact O-N 2.91Å
481	E	95.3	Very high	94.4	Very high	33 Å²	33	45.3 Å²	45.3	15%	0.154	22%	0.223	C	C	.	.	G	3₁₀ helix	trans	-65.2	-20.8	-175.3	-56.1	92.2	143.3	0	0	113.3	P362 P364 A483 C484 F491 T533 F536	P362-E481 HydrophobicContact CB-CG 3.83Å; P362-E481 WeakPolarHBondContact CB-OE1 3.36Å; P364-E481 VanDerWaalsContact CA-OE2 3.31Å; P364-E481 WeakPolarHBondContact CA-OE2 3.39Å; P364-E481 WeakPolarHBondContact CD-OE1 3.47Å; E481-A483 PolarHBondContact O-N 3.21Å; E481-C484 WeakPolarHBondContact O-CB 3.49Å; E481-C484 PolarHBondContact O-N 2.89Å; E481-F491 HydrophobicContact CG-CE2 3.92Å; E481-F491 HydrophobicContact CG-CZ 4.4Å; E481-T533 WeakPolarHBondContact O-CG2 3.25Å; E481-T533 PolarHBondContact O-OG1 2.7Å; E481-F536 HydrophobicContact CB-CE2 3.88Å; E481-F536 HydrophobicContact CB-CZ 4.06Å; E481-F536 HydrophobicContact CG-CZ 4.41Å; E481-F536 WeakPolarHBondContact OE2-CZ 3.42Å
482	C	95	Very high	94.2	Very high	1 Å²	1	49.9 Å²	49.9	1%	0.007	25%	0.247	C	C	.	.	G	3₁₀ helix	trans	-60.4	-28.2	171.5	-69	0	0	0	0	112.5	I368 N480 I530 A531	I368-C482 HydrophobicContact CD1-CB 4.21Å; I368-C482 HydrophobicContact CG1-CB 4.32Å; I368-C482 HydrophobicContact CG2-CB 4.28Å; N480-C482 PolarHBondContact O-N 3.43Å; N480-C482 VanDerWaalsContact O-N 3.17Å; N480-C482 WeakPolarHBondContact OD1-CB 3.28Å; N480-C482 PolarHBondContact OD1-N 2.85Å; N480-C482 PolarHBondContact OD1-SG 2.91Å; C482-I530 HydrophobicContact CB-CG2 4.41Å; C482-I530 WeakPolarHBondContact O-CG2 3.35Å; C482-A531 VanDerWaalsContact CA-O 3.32Å; C482-A531 WeakPolarHBondContact CA-O 3.4Å; C482-A531 WeakPolarHBondContact CB-O 3.36Å
483	A	94.4	Very high	94.1	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	26%	0.262	C	S	.	.	G	3₁₀ helix	trans	-93.3	5.7	-179.5	0	0	0	0	0	113.7	I368 F479 N480 E481 P486 Y487	I368-A483 HydrophobicContact CG2-CB 4.32Å; F479-A483 HydrophobicContact CD2-CB 4.21Å; F479-A483 HydrophobicContact CE2-CB 4.5Å; N480-A483 PolarHBondContact O-N 2.91Å; E481-A483 PolarHBondContact O-N 3.21Å; A483-P486 WeakPolarHBondContact O-CD 3.29Å; A483-Y487 VanDerWaalsContact O-CD2 3.24Å; A483-Y487 WeakPolarHBondContact O-CD2 3.45Å
484	C	93.6	Very high	93.9	Very high	11 Å²	11	47.4 Å²	47.4	7%	0.074	24%	0.239	C	C	.	.	H	α-helix	trans	-70.2	-36.9	179.7	-74	0	0	0	0	113.6	F479 E481 Y487 N488 A489 F491	F479-C484 HydrophobicContact CE2-CB 4.47Å; F479-C484 WeakPolarHBondContact CE2-SG 3.24Å; E481-C484 WeakPolarHBondContact O-CB 3.49Å; E481-C484 PolarHBondContact O-N 2.89Å; C484-Y487 CarbonylContact O-C 3.6Å; C484-Y487 PolarHBondContact O-N 3.47Å; C484-Y487 VanDerWaalsContact O-N 3.07Å; C484-N488 PolarHBondContact O-N 2.9Å; C484-A489 WeakPolarHBondContact CB-O 3.49Å; C484-A489 PolarHBondContact O-N 2.94Å; C484-F491 WeakPolarHBondContact SG-CE2 3.21Å; C484-F491 WeakPolarHBondContact SG-CZ 3.47Å
485	T	92.3	Very high	93.9	Very high	51 Å²	51	45.4 Å²	45.4	31%	0.313	23%	0.234	S	C	.	.	H	α-helix	trans	-59.6	-45.5	-173.8	-54	0	0	0	0	113.4	Y487 N488 L529	T485-Y487 VanDerWaalsContact C-N 3.26Å; T485-Y487 PolarHBondContact O-N 3.1Å; T485-N488 PolarHBondContact O-N 3.48Å; T485-L529 HydrophobicContact CG2-CD1 3.98Å; T485-L529 HydrophobicContact CG2-CG 4.18Å
486	P	92.8	Very high	94	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-61	-29.5	173.4	-19.8	26.6	0	0	0	115.2	H460 L462 M465 A483 N488 L529 I530	H460-P486 PolarHBondContact CE1-O 3.45Å; H460-P486 PolarHBondContact NE2-O 2.89Å; H460-P486 VanDerWaalsContact NE2-O 3.11Å; L462-P486 HydrophobicContact CB-CB 3.91Å; L462-P486 HydrophobicContact CD2-CB 4.46Å; M465-P486 HydrophobicContact CE-CB 3.85Å; M465-P486 HydrophobicContact CE-CG 4.1Å; A483-P486 WeakPolarHBondContact O-CD 3.29Å; P486-N488 VanDerWaalsContact C-N 3.34Å; P486-L529 HydrophobicContact CB-CD2 3.83Å; P486-L529 HydrophobicContact CG-CD2 3.87Å; P486-L529 HydrophobicContact CG-CG 4.1Å; P486-I530 HydrophobicContact CG-CD1 3.94Å; P486-I530 HydrophobicContact CG-CG1 3.39Å
487	Y	93.7	Very high	94	Very high	4 Å²	4	35.1 Å²	35.1	2%	0.016	19%	0.192	C	C	.	.	H	α-helix	trans	-85.8	-12.2	175.2	-62.7	-57.6	0	0	0	111.9	F453 R455 S463 M465 H467 F479 A483 C484 T485 A489 M496	F453-Y487 AromaticContact CD1-CE2 3.95Å; F453-Y487 HydrophobicContact CD1-CE2 3.95Å; F453-Y487 AromaticContact CD1-CZ 3.87Å; F453-Y487 HydrophobicContact CE1-CE2 4.4Å; F453-Y487 PolarHBondContact O-OH 3.16Å; R455-Y487 HydrophobicContact CB-CD1 4.24Å; R455-Y487 WeakPolarHBondContact CD-O 3.27Å; R455-Y487 PolarHBondContact NH1-O 3.23Å; R455-Y487 VanDerWaalsContact NH1-O 3.15Å; S463-Y487 WeakPolarHBondContact O-CD1 3.42Å; S463-Y487 WeakPolarHBondContact O-CE1 3.3Å; M465-Y487 HydrophobicContact CE-CD2 4.31Å; M465-Y487 HydrophobicContact CE-CE1 3.97Å; M465-Y487 HydrophobicContact CE-CE2 3.57Å; M465-Y487 WeakPolarHBondContact CE-OH 3.47Å; H467-Y487 AromaticContact NE2-CZ 3.95Å; H467-Y487 PolarHBondContact NE2-OH 3.05Å; F479-Y487 HydrophobicContact CE2-CD2 4.26Å; F479-Y487 HydrophobicContact CZ-CD2 4.41Å; A483-Y487 VanDerWaalsContact O-CD2 3.24Å; A483-Y487 WeakPolarHBondContact O-CD2 3.45Å; C484-Y487 CarbonylContact O-C 3.6Å; C484-Y487 PolarHBondContact O-N 3.47Å; C484-Y487 VanDerWaalsContact O-N 3.07Å; T485-Y487 VanDerWaalsContact C-N 3.26Å; T485-Y487 PolarHBondContact O-N 3.1Å; Y487-A489 PolarHBondContact O-N 2.92Å; Y487-M496 HydrophobicContact CD1-CE 3.48Å; Y487-M496 VanDerWaalsContact CD1-CE 3.48Å; Y487-M496 HydrophobicContact CD2-CE 3.76Å; Y487-M496 HydrophobicContact CD2-SD 4.46Å; Y487-M496 HydrophobicContact CE1-CE 3.69Å; Y487-M496 HydrophobicContact CE2-CE 3.94Å; Y487-M496 HydrophobicContact CG-CE 3.51Å; Y487-M496 HydrophobicContact CG-SD 4.31Å
488	N	89.1	Confident	93.9	Very high	115 Å²	115	35.1 Å²	35.1	62%	0.615	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.9	41.7	-168.7	-165.9	34.3	0	0	0	111.6	R455 C484 T485 P486	R455-N488 PolarHBondContact NH1-O 3.04Å; R455-N488 PolarHBondContact NH2-O 2.9Å; C484-N488 PolarHBondContact O-N 2.9Å; T485-N488 PolarHBondContact O-N 3.48Å; P486-N488 VanDerWaalsContact C-N 3.34Å
489	A	90.5	Very high	94	Very high	10 Å²	10	34.3 Å²	34.3	8%	0.083	19%	0.191	C	C	.	.			trans	-101	143	-178.3	0	0	0	0	0	110.8	I360 F479 C484 Y487	I360-A489 HydrophobicContact CD1-CB 3.68Å; F479-A489 HydrophobicContact CZ-CB 4.47Å; C484-A489 WeakPolarHBondContact CB-O 3.49Å; C484-A489 PolarHBondContact O-N 2.94Å; Y487-A489 PolarHBondContact O-N 2.92Å
490	D	89.9	Confident	94	Very high	102 Å²	102	34.6 Å²	34.6	55%	0.545	19%	0.192	S	C	.	.			trans	-133.2	8.8	-175.1	61.3	-5.7	0	0	0	114.6	D492	D490-D492 VanDerWaalsContact C-N 3.34Å; D490-D492 PolarHBondContact O-N 2.83Å; D490-D492 VanDerWaalsContact OD1-CG 3.27Å
491	F	94	Very high	94.1	Very high	55 Å²	55	35.3 Å²	35.3	24%	0.241	20%	0.197	C	C	.	.	S	Bend	trans	60.6	33.7	176.7	-52.2	-70.1	0	0	0	114.9	I360 P362 F479 E481 C484 G493	I360-F491 HydrophobicContact CB-CD1 4.19Å; I360-F491 HydrophobicContact CB-CE1 4.25Å; I360-F491 HydrophobicContact CD1-CD1 3.76Å; I360-F491 HydrophobicContact CD1-CE1 3.98Å; I360-F491 HydrophobicContact CG1-CD1 3.84Å; I360-F491 HydrophobicContact CG1-CE1 4.27Å; P362-F491 HydrophobicContact CB-CD2 4.18Å; P362-F491 HydrophobicContact CB-CE1 4.38Å; P362-F491 HydrophobicContact CB-CE2 3.8Å; P362-F491 HydrophobicContact CB-CZ 3.91Å; P362-F491 HydrophobicContact CG-CD2 4.39Å; F479-F491 HydrophobicContact CD1-CE1 4.42Å; F479-F491 AromaticContact CE1-CE1 3.79Å; F479-F491 HydrophobicContact CE1-CE1 3.79Å; F479-F491 HydrophobicContact CE1-CZ 4.25Å; F479-F491 HydrophobicContact CE2-CZ 4.29Å; F479-F491 AromaticContact CZ-CE1 3.9Å; F479-F491 HydrophobicContact CZ-CE1 3.9Å; F479-F491 AromaticContact CZ-CZ 3.97Å; F479-F491 HydrophobicContact CZ-CZ 3.97Å; E481-F491 HydrophobicContact CG-CE2 3.92Å; E481-F491 HydrophobicContact CG-CZ 4.4Å; C484-F491 WeakPolarHBondContact SG-CE2 3.21Å; C484-F491 WeakPolarHBondContact SG-CZ 3.47Å; F491-G493 VanDerWaalsContact C-N 3.31Å; F491-G493 PolarHBondContact O-N 3.46Å
492	D	93.6	Very high	94.2	Very high	116 Å²	116	36 Å²	36	62%	0.62	20%	0.2	S	C	*	.	S	Bend	trans	-84.9	5	179.2	72.5	-15.6	0	0	0	115	D490 D494	D490-D492 VanDerWaalsContact C-N 3.34Å; D490-D492 PolarHBondContact O-N 2.83Å; D490-D492 VanDerWaalsContact OD1-CG 3.27Å; D492-D494 PolarHBondContact OD1-N 2.89Å; D492-D494 VanDerWaalsContact OD1-N 3.09Å
493	G	92.1	Very high	94.2	Very high	47 Å²	47	39.5 Å²	39.5	49%	0.485	22%	0.222	S	C	.	.	S	Bend	trans	116.2	-0.3	-168	0	0	0	0	0	113.3	F491	F491-G493 VanDerWaalsContact C-N 3.31Å; F491-G493 PolarHBondContact O-N 3.46Å
494	D	91.2	Very high	94.2	Very high	33 Å²	33	45 Å²	45	18%	0.176	25%	0.247	C	C	.	.			trans	-46.1	142.8	170.1	-99.1	-13.9	0	0	0	114.2	V359 I360 R455 D492	V359-D494 WeakPolarHBondContact CA-O 3.19Å; I360-D494 HydrophobicContact CD1-CB 3.98Å; I360-D494 HydrophobicContact CG1-CB 4.02Å; I360-D494 WeakPolarHBondContact CG1-O 3.36Å; I360-D494 PolarHBondContact N-O 3.23Å; R455-D494 IonicContact CZ-OD2 2.63Å; R455-D494 IonicContact NE-OD2 3.29Å; R455-D494 PolarHBondContact NE-OD2 3.14Å; R455-D494 IonicContact NH2-OD1 3.79Å; R455-D494 PolarHBondContact NH2-OD1 2.7Å; R455-D494 IonicContact NH2-OD2 3.78Å; R455-D494 PolarHBondContact NH2-OD2 2.69Å; D492-D494 PolarHBondContact OD1-N 2.89Å; D492-D494 VanDerWaalsContact OD1-N 3.09Å
495	E	95.7	Very high	94.3	Very high	81 Å²	81	51.9 Å²	51.9	38%	0.379	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	139.8	174.3	-63.2	179.2	152.3	0	0	110.5	R357 T358 V359	R357-E495 HydrophobicContact CG-CB 4.19Å; R357-E495 IonicContact CZ-OE2 2.77Å; R357-E495 VanDerWaalsContact CZ-OE2 3.24Å; R357-E495 IonicContact NE-OE2 3.81Å; R357-E495 PolarHBondContact NE-OE2 3.4Å; R357-E495 IonicContact NH2-OE2 3.9Å; R357-E495 PolarHBondContact NH2-OE2 2.82Å; T358-E495 WeakPolarHBondContact O-CA 3.46Å; V359-E495 HydrophobicContact CG2-CG 3.96Å
496	M	97.1	Very high	94.4	Very high	0 Å²	0	51 Å²	51	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	153.1	177	-73	-175.8	65.9	0	0	111.5	R357 T358 I360 F453 N454 R455 F479 Y487	R357-M496 WeakPolarHBondContact CA-O 3.24Å; T358-M496 PolarHBondContact N-O 2.66Å; T358-M496 PolarHBondContact O-N 2.84Å; T358-M496 VanDerWaalsContact O-N 3.16Å; I360-M496 HydrophobicContact CD1-CG 4.49Å; I360-M496 HydrophobicContact CD1-SD 4.09Å; I360-M496 HydrophobicContact CG2-CB 3.7Å; I360-M496 HydrophobicContact CG2-CG 3.69Å; I360-M496 HydrophobicContact CG2-SD 3.8Å; F453-M496 HydrophobicContact CD1-CE 3.34Å; F453-M496 HydrophobicContact CD1-SD 4.3Å; F453-M496 HydrophobicContact CD2-CB 4.42Å; F453-M496 HydrophobicContact CD2-CE 4.43Å; F453-M496 HydrophobicContact CE1-CB 4.21Å; F453-M496 HydrophobicContact CE1-CE 3.12Å; F453-M496 HydrophobicContact CE1-CG 4.47Å; F453-M496 HydrophobicContact CE1-SD 3.46Å; F453-M496 WeakPolarHBondContact CE1-SD 3.44Å; F453-M496 HydrophobicContact CE2-CB 3.56Å; F453-M496 HydrophobicContact CE2-CE 4.26Å; F453-M496 HydrophobicContact CG-CE 4.01Å; F453-M496 HydrophobicContact CZ-CB 3.44Å; F453-M496 VanDerWaalsContact CZ-CB 3.44Å; F453-M496 HydrophobicContact CZ-CE 3.63Å; F453-M496 HydrophobicContact CZ-CG 4.09Å; F453-M496 HydrophobicContact CZ-SD 3.61Å; N454-M496 WeakPolarHBondContact O-CB 3.1Å; R455-M496 HydrophobicContact CB-CE 3.94Å; R455-M496 HydrophobicContact CB-CG 4.13Å; R455-M496 HydrophobicContact CB-SD 4.3Å; R455-M496 HydrophobicContact CG-CG 4.01Å; R455-M496 HydrophobicContact CG-SD 4.49Å; F479-M496 HydrophobicContact CE1-SD 4.09Å; F479-M496 HydrophobicContact CZ-SD 4.31Å; Y487-M496 HydrophobicContact CD1-CE 3.48Å; Y487-M496 VanDerWaalsContact CD1-CE 3.48Å; Y487-M496 HydrophobicContact CD2-CE 3.76Å; Y487-M496 HydrophobicContact CD2-SD 4.46Å; Y487-M496 HydrophobicContact CE1-CE 3.69Å; Y487-M496 HydrophobicContact CE2-CE 3.94Å; Y487-M496 HydrophobicContact CG-CE 3.51Å; Y487-M496 HydrophobicContact CG-SD 4.31Å
497	N	96.6	Very high	94.6	Very high	21 Å²	21	52.9 Å²	52.9	11%	0.112	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	141.5	179.7	-53.6	-54.3	0	0	0	109.9	G356 R357 F453 N454	G356-N497 CarbonylContact O-C 3.53Å; G356-N497 WeakPolarHBondContact O-CA 3.42Å; R357-N497 WeakPolarHBondContact CD-OD1 3.4Å; R357-N497 WeakPolarHBondContact CG-OD1 3.35Å; F453-N497 WeakPolarHBondContact CD2-O 3.48Å; N454-N497 PolarHBondContact N-O 3.06Å; N454-N497 PolarHBondContact O-N 2.88Å; N454-N497 PolarHBondContact OD1-ND2 3.49Å
498	L	97.1	Very high	94.7	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	132.3	173.7	-175.1	148.7	0	0	0	108.5	S355 G356 V373 L381 M445 V451 L452 F453 F477	S355-L498 CarbonylContact C-O 3.54Å; S355-L498 WeakPolarHBondContact CA-O 2.97Å; S355-L498 WeakPolarHBondContact CB-O 3.38Å; G356-L498 PolarHBondContact N-O 2.91Å; G356-L498 PolarHBondContact O-N 3.06Å; V373-L498 HydrophobicContact CG2-CD1 3.63Å; L381-L498 HydrophobicContact CD1-CD2 3.81Å; M445-L498 HydrophobicContact CE-CD2 4.03Å; V451-L498 HydrophobicContact CB-CD1 4.25Å; V451-L498 HydrophobicContact CB-CD2 4.1Å; V451-L498 HydrophobicContact CB-CG 4.01Å; V451-L498 HydrophobicContact CG1-CD1 4.45Å; V451-L498 HydrophobicContact CG1-CD2 3.89Å; V451-L498 HydrophobicContact CG1-CG 4.31Å; V451-L498 HydrophobicContact CG2-CD1 3.95Å; V451-L498 HydrophobicContact CG2-CG 4.2Å; L452-L498 CarbonylContact O-C 3.51Å; L452-L498 WeakPolarHBondContact O-CA 3.31Å; F453-L498 HydrophobicContact CD2-CB 4.31Å; F477-L498 HydrophobicContact CD1-CD1 4.37Å; F477-L498 HydrophobicContact CE1-CB 4.34Å; F477-L498 HydrophobicContact CE1-CD1 3.8Å; F477-L498 HydrophobicContact CE2-CB 4.04Å; F477-L498 HydrophobicContact CZ-CB 3.7Å; F477-L498 HydrophobicContact CZ-CD1 4.04Å; F477-L498 HydrophobicContact CZ-CG 4.45Å
499	H	97.5	Very high	95	Very high	41 Å²	41	53.8 Å²	53.8	19%	0.19	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	134.6	175.2	-51.7	-89.5	0	0	0	109.6	S355 L452 N454 P501	S355-H499 WeakPolarHBondContact CB-ND1 3.43Å; L452-H499 HydrophobicContact CB-CB 4.16Å; L452-H499 PolarHBondContact N-O 2.78Å; L452-H499 PolarHBondContact O-N 3.07Å; N454-H499 PolarHBondContact ND2-NE2 2.93Å; H499-P501 WeakPolarHBondContact O-CD 3.4Å
500	F	97.3	Very high	95.3	Very high	6 Å²	6	53.7 Å²	53.7	3%	0.026	29%	0.291	C	S	.	.			trans	-105.7	105.7	-177.4	-170.2	-157.4	0	0	0	111.6	Y354 L381 T382 F383 M445 D449 V451 Q502	Y354-F500 PolarHBondContact O-N 3.13Å; L381-F500 HydrophobicContact CB-CD1 4.18Å; T382-F500 WeakPolarHBondContact O-CD1 3.48Å; T382-F500 WeakPolarHBondContact O-CE1 3.34Å; F383-F500 HydrophobicContact CB-CE1 3.62Å; F383-F500 HydrophobicContact CB-CZ 3.59Å; F383-F500 HydrophobicContact CD2-CZ 4.26Å; F383-F500 HydrophobicContact CG-CZ 4.23Å; M445-F500 HydrophobicContact CB-CE1 4.02Å; M445-F500 HydrophobicContact CB-CZ 4.3Å; M445-F500 HydrophobicContact CE-CB 3.84Å; M445-F500 HydrophobicContact CE-CD1 3.58Å; M445-F500 HydrophobicContact CE-CD2 3.84Å; M445-F500 HydrophobicContact CE-CE1 3.94Å; M445-F500 HydrophobicContact CE-CE2 4.22Å; M445-F500 HydrophobicContact CE-CG 3.5Å; M445-F500 VanDerWaalsContact CE-CG 3.5Å; M445-F500 HydrophobicContact CE-CZ 4.24Å; M445-F500 HydrophobicContact CG-CE1 4.38Å; M445-F500 HydrophobicContact CG-CZ 4.29Å; D449-F500 HydrophobicContact CB-CE2 3.95Å; D449-F500 HydrophobicContact CB-CZ 4.14Å; V451-F500 HydrophobicContact CG1-CD2 3.86Å; V451-F500 HydrophobicContact CG1-CE2 4.47Å; V451-F500 HydrophobicContact CG1-CG 4.47Å; F500-Q502 PolarHBondContact O-N 3.35Å; F500-Q502 PolarHBondContact O-NE2 2.63Å
501	P	97.3	Very high	95.5	Very high	15 Å²	15	51.3 Å²	51.3	10%	0.097	28%	0.281	C	S	.	.			trans	-59.3	129	-179.2	-22.9	34.2	0	0	0	112.1	V450 H499 A506 R507 V510	V450-P501 WeakPolarHBondContact O-CD 3.47Å; H499-P501 WeakPolarHBondContact O-CD 3.4Å; P501-A506 HydrophobicContact CB-CB 4.1Å; P501-R507 HydrophobicContact CB-CG 3.93Å; P501-V510 HydrophobicContact CG-CG2 4.3Å
502	Q	96.3	Very high	95.5	Very high	47 Å²	47	52.3 Å²	52.3	22%	0.22	29%	0.294	C	S	.	.			trans	-93.2	-10.7	-172	-63.9	-63.6	-63.6	0	0	114	Y354 T382 P384 F500	Y354-Q502 HydrophobicContact CD2-CG 3.83Å; Y354-Q502 HydrophobicContact CE2-CG 4.26Å; Y354-Q502 HydrophobicContact CG-CG 4.03Å; T382-Q502 PolarHBondContact O-NE2 2.98Å; T382-Q502 PolarHBondContact O-OE1 3.37Å; P384-Q502 WeakPolarHBondContact CG-O 3.47Å; F500-Q502 PolarHBondContact O-N 3.35Å; F500-Q502 PolarHBondContact O-NE2 2.63Å
503	T	95.9	Very high	95.6	Very high	75 Å²	75	51.5 Å²	51.5	46%	0.46	29%	0.29	S	S	.	.	S	Bend	trans	-117.9	151.9	-179.5	61.6	0	0	0	0	111.5	E505 A506 R507	T503-E505 VanDerWaalsContact C-N 3.35Å; T503-A506 VanDerWaalsContact OG1-CB 3.29Å; T503-A506 WeakPolarHBondContact OG1-CB 3.31Å; T503-A506 PolarHBondContact OG1-N 3.34Å; T503-R507 WeakPolarHBondContact O-CG 3.49Å; T503-R507 PolarHBondContact O-N 2.97Å; T503-R507 VanDerWaalsContact O-N 3.1Å
504	H	94.9	Very high	95.8	Very high	114 Å²	114	52.1 Å²	52.1	53%	0.528	28%	0.28	S	S	.	.	H	α-helix	trans	-66.1	-35.8	177.9	-74.2	-73.8	0	0	0	112.7	F383 R507 A508	F383-H504 AromaticContact CE1-CE1 3.74Å; F383-H504 AromaticContact CE1-NE2 3.86Å; F383-H504 AromaticContact CZ-CE1 3.67Å; F383-H504 AromaticContact CZ-NE2 3.78Å; H504-R507 PolarHBondContact O-N 3.1Å; H504-A508 PolarHBondContact O-N 3.35Å
505	E	94.4	Very high	96	Very high	156 Å²	156	50.8 Å²	50.8	73%	0.729	27%	0.273	S	S	*	.	H	α-helix	trans	-59.9	-51.9	175.5	-66.5	170.1	176.5	0	0	111.1	T503 R507 A508 E509	T503-E505 VanDerWaalsContact C-N 3.35Å; E505-R507 VanDerWaalsContact C-N 3.31Å; E505-R507 PolarHBondContact O-N 3.26Å; E505-A508 WeakPolarHBondContact O-CB 3.5Å; E505-A508 PolarHBondContact O-N 2.85Å; E505-A508 VanDerWaalsContact O-N 3.1Å; E505-E509 PolarHBondContact O-N 3.06Å
506	A	95.2	Very high	95.9	Very high	33 Å²	33	46.9 Å²	46.9	27%	0.273	26%	0.255	S	S	.	.	H	α-helix	trans	-61.8	-38.8	177.9	0	0	0	0	0	111.9	P501 T503 A508 E509 V510	P501-A506 HydrophobicContact CB-CB 4.1Å; T503-A506 VanDerWaalsContact OG1-CB 3.29Å; T503-A506 WeakPolarHBondContact OG1-CB 3.31Å; T503-A506 PolarHBondContact OG1-N 3.34Å; A506-A508 VanDerWaalsContact C-N 3.33Å; A506-A508 PolarHBondContact O-N 2.97Å; A506-E509 PolarHBondContact O-N 3.44Å; A506-V510 VanDerWaalsContact O-CG2 3.24Å; A506-V510 WeakPolarHBondContact O-CG2 3.44Å; A506-V510 PolarHBondContact O-N 3.09Å
507	R	96.4	Very high	95.7	Very high	39 Å²	39	50.1 Å²	50.1	15%	0.147	27%	0.267	C	S	.	.	H	α-helix	trans	-61.3	-41.8	174.6	-73.4	175.4	63.7	157.8	12	112	F383 D449 P501 T503 H504 E505 V510 V511	F383-R507 VanDerWaalsContact CE2-CD 3.43Å; F383-R507 HydrophobicContact CE2-CG 4.49Å; D449-R507 IonicContact OD1-CZ 3.3Å; D449-R507 IonicContact OD1-NH1 3.65Å; D449-R507 PolarHBondContact OD1-NH1 3.16Å; D449-R507 IonicContact OD1-NH2 2.76Å; D449-R507 PolarHBondContact OD1-NH2 3.5Å; P501-R507 HydrophobicContact CB-CG 3.93Å; T503-R507 WeakPolarHBondContact O-CG 3.49Å; T503-R507 PolarHBondContact O-N 2.97Å; T503-R507 VanDerWaalsContact O-N 3.1Å; H504-R507 PolarHBondContact O-N 3.1Å; E505-R507 VanDerWaalsContact C-N 3.31Å; E505-R507 PolarHBondContact O-N 3.26Å; R507-V510 PolarHBondContact O-N 3.35Å; R507-V511 WeakPolarHBondContact O-CG2 3.38Å; R507-V511 PolarHBondContact O-N 3.1Å; R507-V511 VanDerWaalsContact O-N 3.09Å
508	A	96.1	Very high	95.5	Very high	55 Å²	55	53.2 Å²	53.2	46%	0.455	28%	0.284	S	S	.	.	H	α-helix	trans	-64.9	-44.4	179.2	0	0	0	0	0	111.6	H504 E505 A506 V510 V511 S512	H504-A508 PolarHBondContact O-N 3.35Å; E505-A508 WeakPolarHBondContact O-CB 3.5Å; E505-A508 PolarHBondContact O-N 2.85Å; E505-A508 VanDerWaalsContact O-N 3.1Å; A506-A508 VanDerWaalsContact C-N 3.33Å; A506-A508 PolarHBondContact O-N 2.97Å; A508-V510 VanDerWaalsContact C-N 3.33Å; A508-V510 PolarHBondContact O-N 3.2Å; A508-V511 PolarHBondContact O-N 3.27Å; A508-S512 WeakPolarHBondContact O-CB 3.49Å; A508-S512 PolarHBondContact O-N 3.42Å; A508-S512 PolarHBondContact O-OG 3.41Å
509	E	95.5	Very high	95.4	Very high	84 Å²	84	53.5 Å²	53.5	39%	0.393	29%	0.285	S	S	.	.	H	α-helix	trans	-59.7	-42.8	175.4	-68.9	-172	158.8	0	0	112.1	E505 A506 V511 S512 L513 T1362	E505-E509 PolarHBondContact O-N 3.06Å; A506-E509 PolarHBondContact O-N 3.44Å; E509-V511 PolarHBondContact O-N 3.15Å; E509-S512 PolarHBondContact O-N 3.04Å; E509-L513 WeakPolarHBondContact O-CB 3.39Å; E509-L513 PolarHBondContact O-N 3.46Å; E509-T1362 HydrophobicContact CG-CG2 4.34Å; E509-T1362 VanDerWaalsContact OE1-CB 3.27Å; E509-T1362 WeakPolarHBondContact OE1-CB 3.33Å; E509-T1362 WeakPolarHBondContact OE1-CG2 3.47Å; E509-T1362 PolarHBondContact OE1-OG1 3.1Å
510	V	96.3	Very high	95.3	Very high	7 Å²	7	51.8 Å²	51.8	4%	0.042	28%	0.278	C	S	.	.	I	π-helix	trans	-63.9	-40.8	178.8	175.9	0	0	0	0	111.5	V450 L452 G466 P501 A506 R507 A508 M514 N515	V450-V510 HydrophobicContact CG1-CB 3.97Å; V450-V510 HydrophobicContact CG1-CG1 3.41Å; V450-V510 VanDerWaalsContact CG1-CG1 3.41Å; L452-V510 HydrophobicContact CD1-CG2 4.31Å; L452-V510 HydrophobicContact CD2-CG1 3.86Å; L452-V510 HydrophobicContact CD2-CG2 3.78Å; L452-V510 HydrophobicContact CG-CG1 4.37Å; L452-V510 HydrophobicContact CG-CG2 3.99Å; G466-V510 VanDerWaalsContact CA-CG1 3.5Å; P501-V510 HydrophobicContact CG-CG2 4.3Å; A506-V510 VanDerWaalsContact O-CG2 3.24Å; A506-V510 WeakPolarHBondContact O-CG2 3.44Å; A506-V510 PolarHBondContact O-N 3.09Å; R507-V510 PolarHBondContact O-N 3.35Å; A508-V510 VanDerWaalsContact C-N 3.33Å; A508-V510 PolarHBondContact O-N 3.2Å; V510-M514 HydrophobicContact CG1-CB 4.32Å; V510-M514 HydrophobicContact CG2-SD 4.18Å; V510-M514 CarbonylContact O-C 3.5Å; V510-M514 WeakPolarHBondContact O-CA 3.32Å; V510-M514 PolarHBondContact O-N 3.01Å; V510-M514 VanDerWaalsContact O-N 3.14Å; V510-N515 PolarHBondContact O-N 3.32Å
511	V	95.7	Very high	95.2	Very high	53 Å²	53	52.3 Å²	52.3	32%	0.321	28%	0.281	S	S	.	.	I	π-helix	trans	-68.6	-42.9	178.4	174.2	0	0	0	0	111.8	V450 F468 R507 A508 E509 N515	V450-V511 HydrophobicContact CB-CG2 4.2Å; V450-V511 HydrophobicContact CG1-CG2 3.92Å; V450-V511 HydrophobicContact CG2-CG2 3.37Å; F468-V511 HydrophobicContact CE1-CG2 4.44Å; F468-V511 HydrophobicContact CZ-CG1 4.4Å; F468-V511 HydrophobicContact CZ-CG2 4.4Å; R507-V511 WeakPolarHBondContact O-CG2 3.38Å; R507-V511 PolarHBondContact O-N 3.1Å; R507-V511 VanDerWaalsContact O-N 3.09Å; A508-V511 PolarHBondContact O-N 3.27Å; E509-V511 PolarHBondContact O-N 3.15Å; V511-N515 WeakPolarHBondContact O-CB 3.23Å
512	S	94.3	Very high	95	Very high	75 Å²	75	52.2 Å²	52.2	52%	0.524	28%	0.28	S	S	.	.	I	π-helix	trans	-78.9	-42.3	-174.4	-61.3	0	0	0	0	112.5	A508 E509 N518	A508-S512 WeakPolarHBondContact O-CB 3.49Å; A508-S512 PolarHBondContact O-N 3.42Å; A508-S512 PolarHBondContact O-OG 3.41Å; E509-S512 PolarHBondContact O-N 3.04Å; S512-N518 PolarHBondContact O-ND2 3.2Å
513	L	94.7	Very high	94.8	Very high	100 Å²	100	50.2 Å²	50.2	52%	0.524	27%	0.272	S	S	.	.	I	π-helix	trans	-104.6	-41.5	-170.2	-56.6	177.4	0	0	0	113	E509 N519 T1362	E509-L513 WeakPolarHBondContact O-CB 3.39Å; E509-L513 PolarHBondContact O-N 3.46Å; L513-N519 PolarHBondContact O-ND2 3.06Å; L513-T1362 HydrophobicContact CD1-CG2 3.96Å
514	M	95.8	Very high	94.5	Very high	59 Å²	59	48.2 Å²	48.2	29%	0.291	26%	0.255	S	S	.	.	I	π-helix	trans	-99	-5.5	-169.3	-57.7	-176.9	69.4	0	0	113.9	L452 M464 G466 V510 N519	L452-M514 HydrophobicContact CD2-CE 3.46Å; L452-M514 VanDerWaalsContact CD2-CE 3.46Å; L452-M514 HydrophobicContact CD2-SD 3.77Å; M464-M514 HydrophobicContact CG-CE 3.97Å; M464-M514 HydrophobicContact SD-CE 4.16Å; G466-M514 PolarHBondContact N-O 2.91Å; V510-M514 HydrophobicContact CG1-CB 4.32Å; V510-M514 HydrophobicContact CG2-SD 4.18Å; V510-M514 CarbonylContact O-C 3.5Å; V510-M514 WeakPolarHBondContact O-CA 3.32Å; V510-M514 PolarHBondContact O-N 3.01Å; V510-M514 VanDerWaalsContact O-N 3.14Å; M514-N519 VanDerWaalsContact C-ND2 3.28Å; M514-N519 PolarHBondContact O-ND2 3.08Å
515	N	95.4	Very high	94.2	Very high	5 Å²	5	43.2 Å²	43.2	3%	0.027	23%	0.233	C	C	.	.	B	Isolated β-bridge	trans	-61.8	140.6	-177.6	-167.2	-56.4	0	0	0	111.2	G466 F468 V510 V511 R517 N518 N519	G466-N515 WeakPolarHBondContact O-CA 3.46Å; F468-N515 WeakPolarHBondContact CE2-ND2 3.47Å; V510-N515 PolarHBondContact O-N 3.32Å; V511-N515 WeakPolarHBondContact O-CB 3.23Å; N515-R517 PolarHBondContact O-N 3.11Å; N515-R517 WeakPolarHBondContact OD1-CG 3.42Å; N515-R517 PolarHBondContact OD1-N 3.43Å; N515-N518 PolarHBondContact O-N 3.25Å; N515-N519 PolarHBondContact O-N 2.9Å; N515-N519 PolarHBondContact O-ND2 2.93Å
516	V	95.2	Very high	94.1	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	20%	0.198	C	C	.	.	G	3₁₀ helix	trans	-49.5	-40.5	174.4	174.2	0	0	0	0	112.7	I368 F369 M465 G466 H467 N518 N519 L520 I530	I368-V516 HydrophobicContact CG2-CG1 4.01Å; F369-V516 HydrophobicContact CB-CB 4.01Å; F369-V516 HydrophobicContact CB-CG1 4.47Å; M465-V516 HydrophobicContact CB-CG2 4.07Å; M465-V516 HydrophobicContact CE-CG2 4.32Å; M465-V516 HydrophobicContact SD-CG2 4.14Å; G466-V516 PolarHBondContact O-N 3.15Å; H467-V516 WeakPolarHBondContact CE1-CG2 3.24Å; H467-V516 WeakPolarHBondContact NE2-CG2 3.44Å; V516-N518 PolarHBondContact O-N 3.18Å; V516-N519 CarbonylContact O-C 3.54Å; V516-N519 PolarHBondContact O-N 3.25Å; V516-L520 WeakPolarHBondContact O-CD2 3.37Å; V516-I530 HydrophobicContact CG1-CD1 3.6Å
517	R	92.7	Very high	93.9	Very high	68 Å²	68	36.5 Å²	36.5	26%	0.257	20%	0.196	S	C	.	.	G	3₁₀ helix	trans	-57.4	-36	179.6	-62.6	-179.5	-168.2	166.5	4	112.4	F369 N515 L520 P662 V666	F369-R517 HydrophobicContact CB-CG 3.97Å; F369-R517 HydrophobicContact CD1-CG 3.61Å; F369-R517 HydrophobicContact CE1-CG 4.43Å; F369-R517 HydrophobicContact CG-CG 4Å; F369-R517 VanDerWaalsContact CG-NE 3.34Å; N515-R517 PolarHBondContact O-N 3.11Å; N515-R517 WeakPolarHBondContact OD1-CG 3.42Å; N515-R517 PolarHBondContact OD1-N 3.43Å; R517-L520 WeakPolarHBondContact O-CG 3.32Å; R517-P662 WeakPolarHBondContact O-CB 3.3Å; R517-V666 HydrophobicContact CG-CG2 4.4Å
518	N	92.2	Very high	93.8	Very high	86 Å²	86	35.1 Å²	35.1	46%	0.46	19%	0.192	S	C	.	.	G	3₁₀ helix	trans	-91.8	-9.8	-178.2	-61.7	-14	0	0	0	112.2	S512 N515 V516	S512-N518 PolarHBondContact O-ND2 3.2Å; N515-N518 PolarHBondContact O-N 3.25Å; V516-N518 PolarHBondContact O-N 3.18Å
519	N	95.2	Very high	93.6	Very high	6 Å²	6	34.2 Å²	34.2	3%	0.032	18%	0.179	C	C	.	.			trans	-117	43.3	-176.5	-69.1	-77	0	0	0	112	R461 L462 M465 L513 M514 N515 V516	R461-N519 PolarHBondContact NH2-OD1 2.62Å; L462-N519 HydrophobicContact CD2-CB 4.36Å; L462-N519 WeakPolarHBondContact CD2-O 3.37Å; L462-N519 HydrophobicContact CG-CB 4.41Å; M465-N519 HydrophobicContact SD-CB 4.36Å; L513-N519 PolarHBondContact O-ND2 3.06Å; M514-N519 VanDerWaalsContact C-ND2 3.28Å; M514-N519 PolarHBondContact O-ND2 3.08Å; N515-N519 PolarHBondContact O-N 2.9Å; N515-N519 PolarHBondContact O-ND2 2.93Å; V516-N519 CarbonylContact O-C 3.54Å; V516-N519 PolarHBondContact O-N 3.25Å
520	L	94.8	Very high	93.6	Very high	5 Å²	5	30.3 Å²	30.3	3%	0.026	16%	0.161	C	C	.	.	S	Bend	trans	-74.8	-28	176.9	-59	177.4	0	0	0	112.7	V516 R517 L529 I530 M657 P662 A665 V666 M669	V516-L520 WeakPolarHBondContact O-CD2 3.37Å; R517-L520 WeakPolarHBondContact O-CG 3.32Å; L520-L529 PolarHBondContact O-N 2.74Å; L520-I530 HydrophobicContact CD2-CB 4.01Å; L520-I530 HydrophobicContact CD2-CD1 4.29Å; L520-I530 HydrophobicContact CD2-CG2 4Å; L520-I530 PolarHBondContact O-N 3.21Å; L520-M657 HydrophobicContact CB-SD 3.94Å; L520-M657 HydrophobicContact CD1-CG 4.31Å; L520-M657 HydrophobicContact CD1-SD 3.96Å; L520-M657 HydrophobicContact CG-SD 4.49Å; L520-P662 HydrophobicContact CD1-CB 4.11Å; L520-A665 HydrophobicContact CD1-CB 4.24Å; L520-V666 HydrophobicContact CD1-CG2 4.05Å; L520-V666 HydrophobicContact CD2-CG2 4.01Å; L520-M669 HydrophobicContact CD1-CE 4.17Å; L520-M669 HydrophobicContact CD2-CE 4.07Å
521	V	94.4	Very high	93.5	Very high	16 Å²	16	30.1 Å²	30.1	10%	0.097	16%	0.16	C	C	.	.	B	Isolated β-bridge	trans	-103.8	148.3	-178	-64.6	0	0	0	0	112	E527 Y654 M657	V521-E527 CarbonylContact C-O 3.53Å; V521-E527 VanDerWaalsContact CA-O 3.24Å; V521-E527 WeakPolarHBondContact CA-O 3.27Å; V521-Y654 HydrophobicContact CG1-CD2 4.22Å; V521-Y654 HydrophobicContact CG1-CE2 3.97Å; V521-M657 HydrophobicContact CG1-CE 3.35Å; V521-M657 HydrophobicContact CG1-SD 3.93Å
522	T	92.9	Very high	93.4	Very high	14 Å²	14	27.9 Å²	27.9	9%	0.086	15%	0.147	C	C	.	.			trans	-78	138.3	171.4	176.5	0	0	0	0	110.7	R524 N525 G526 E527	T522-R524 HydrophobicContact CG2-CB 4.3Å; T522-R524 PolarHBondContact O-N 2.93Å; T522-R524 WeakPolarHBondContact OG1-CB 2.94Å; T522-R524 PolarHBondContact OG1-N 3.01Å; T522-N525 WeakPolarHBondContact CG2-OD1 3.43Å; T522-G526 WeakPolarHBondContact O-CA 3.27Å; T522-G526 PolarHBondContact O-N 3.24Å; T522-E527 HydrophobicContact CG2-CB 4.26Å; T522-E527 WeakPolarHBondContact CG2-O 3.48Å; T522-E527 PolarHBondContact N-O 2.97Å
523	P	92	Very high	93.3	Very high	5 Å²	5	25.7 Å²	25.7	3%	0.032	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-9.3	174.4	30.8	-37.3	0	0	0	113.5	L462 T899 I1040 H1291	L462-P523 VanDerWaalsContact CD1-CD 3.47Å; L462-P523 HydrophobicContact CD1-CG 4.36Å; P523-T899 HydrophobicContact CB-CG2 3.83Å; P523-I1040 HydrophobicContact CB-CG2 3.67Å; P523-I1040 HydrophobicContact CG-CG2 4.19Å; P523-H1291 PolarHBondContact O-NE2 3.13Å
524	R	90.3	Very high	93.1	Very high	32 Å²	32	25.3 Å²	25.3	12%	0.121	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-45.6	-178.5	-173.7	-176.6	71.7	-162.4	3	113.1	T522 S1044 E1047 G1286 L1287 D1288 H1291	T522-R524 HydrophobicContact CG2-CB 4.3Å; T522-R524 PolarHBondContact O-N 2.93Å; T522-R524 WeakPolarHBondContact OG1-CB 2.94Å; T522-R524 PolarHBondContact OG1-N 3.01Å; R524-S1044 WeakPolarHBondContact CA-OG 3.27Å; R524-E1047 IonicContact NH1-OE2 3.18Å; R524-E1047 PolarHBondContact NH1-OE2 2.85Å; R524-G1286 PolarHBondContact NE-O 3.38Å; R524-L1287 HydrophobicContact CG-CD1 3.65Å; R524-D1288 VanDerWaalsContact O-CB 3.3Å; R524-D1288 WeakPolarHBondContact O-CB 3.41Å; R524-D1288 PolarHBondContact O-N 2.88Å; R524-H1291 PolarHBondContact O-CD2 3.28Å
525	N	89.2	Confident	93.1	Very high	10 Å²	10	27.2 Å²	27.2	5%	0.053	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	-148.3	1.9	-172.7	60.8	2.1	0	0	0	113	T522 E527 K649 G1286	T522-N525 WeakPolarHBondContact CG2-OD1 3.43Å; N525-E527 VanDerWaalsContact C-N 3.32Å; N525-E527 PolarHBondContact ND2-OE1 2.93Å; N525-E527 PolarHBondContact ND2-OE2 3.42Å; N525-E527 PolarHBondContact O-N 3.11Å; N525-E527 WeakPolarHBondContact OD1-CB 3.41Å; N525-E527 PolarHBondContact OD1-N 2.87Å; N525-E527 VanDerWaalsContact OD1-N 3.1Å; N525-K649 WeakPolarHBondContact O-CE 3.44Å; N525-K649 PolarHBondContact O-NZ 3.2Å; N525-G1286 PolarHBondContact ND2-O 3.26Å
526	G	91.1	Very high	93.1	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	14%	0.138	C	C	.	.	S	Bend	trans	74.4	16.4	-178.4	0	0	0	0	0	114.5	T522 Y654	T522-G526 WeakPolarHBondContact O-CA 3.27Å; T522-G526 PolarHBondContact O-N 3.24Å; G526-Y654 WeakPolarHBondContact O-CE2 3.42Å
527	E	91.8	Very high	93.1	Very high	47 Å²	47	27.5 Å²	27.5	22%	0.22	14%	0.139	C	C	.	.			trans	-79.3	150.2	174.3	-74.3	169.8	-177.7	0	0	112.2	V521 T522 N525 L529 K649	V521-E527 CarbonylContact C-O 3.53Å; V521-E527 VanDerWaalsContact CA-O 3.24Å; V521-E527 WeakPolarHBondContact CA-O 3.27Å; T522-E527 HydrophobicContact CG2-CB 4.26Å; T522-E527 WeakPolarHBondContact CG2-O 3.48Å; T522-E527 PolarHBondContact N-O 2.97Å; N525-E527 VanDerWaalsContact C-N 3.32Å; N525-E527 PolarHBondContact ND2-OE1 2.93Å; N525-E527 PolarHBondContact ND2-OE2 3.42Å; N525-E527 PolarHBondContact O-N 3.11Å; N525-E527 WeakPolarHBondContact OD1-CB 3.41Å; N525-E527 PolarHBondContact OD1-N 2.87Å; N525-E527 VanDerWaalsContact OD1-N 3.1Å; E527-L529 PolarHBondContact O-N 2.86Å; E527-K649 HydrophobicContact CG-CG 4.02Å
528	P	93.6	Very high	93.3	Very high	11 Å²	11	24.3 Å²	24.3	7%	0.071	13%	0.127	C	C	.	.	B	Isolated β-bridge	trans	-68.2	126.7	173.8	29.2	-33.5	0	0	0	110.5	S646 G647 S648 Y654	P528-S646 WeakPolarHBondContact O-CA 3.42Å; P528-S646 WeakPolarHBondContact O-CB 3.33Å; P528-G647 PolarHBondContact O-N 2.74Å; P528-S648 VanDerWaalsContact CD-O 3.3Å; P528-S648 WeakPolarHBondContact CD-O 3.49Å; P528-S648 VanDerWaalsContact CG-O 3.25Å; P528-S648 WeakPolarHBondContact CG-O 3.28Å; P528-Y654 HydrophobicContact CB-CD2 4.39Å; P528-Y654 HydrophobicContact CG-CD2 4.19Å
529	L	92.4	Very high	93.4	Very high	36 Å²	36	20.2 Å²	20.2	19%	0.188	11%	0.105	C	C	.	.			trans	-101.8	-37.8	175.3	-161.6	70	0	0	0	111.3	L462 T485 P486 L520 E527	L462-L529 HydrophobicContact CD2-CD2 4.03Å; T485-L529 HydrophobicContact CG2-CD1 3.98Å; T485-L529 HydrophobicContact CG2-CG 4.18Å; P486-L529 HydrophobicContact CB-CD2 3.83Å; P486-L529 HydrophobicContact CG-CD2 3.87Å; P486-L529 HydrophobicContact CG-CG 4.1Å; L520-L529 PolarHBondContact O-N 2.74Å; E527-L529 PolarHBondContact O-N 2.86Å
530	I	95.2	Very high	93.5	Very high	2 Å²	2	20 Å²	20	1%	0.01	10%	0.103	C	C	.	.	S	Bend	trans	-89.1	110.3	173.7	-60.1	-177	0	0	0	107.9	I368 M465 C482 P486 V516 L520	I368-I530 HydrophobicContact CG2-CG2 3.68Å; M465-I530 HydrophobicContact CE-CD1 4.25Å; M465-I530 HydrophobicContact SD-CD1 4.11Å; C482-I530 HydrophobicContact CB-CG2 4.41Å; C482-I530 WeakPolarHBondContact O-CG2 3.35Å; P486-I530 HydrophobicContact CG-CD1 3.94Å; P486-I530 HydrophobicContact CG-CG1 3.39Å; V516-I530 HydrophobicContact CG1-CD1 3.6Å; L520-I530 HydrophobicContact CD2-CB 4.01Å; L520-I530 HydrophobicContact CD2-CD1 4.29Å; L520-I530 HydrophobicContact CD2-CG2 4Å; L520-I530 PolarHBondContact O-N 3.21Å
531	A	94.6	Very high	93.5	Very high	3 Å²	3	20.8 Å²	20.8	3%	0.025	11%	0.107	C	C	.	.			trans	-157	178.5	-175.2	0	0	0	0	0	110	C482 T533	C482-A531 VanDerWaalsContact CA-O 3.32Å; C482-A531 WeakPolarHBondContact CA-O 3.4Å; C482-A531 WeakPolarHBondContact CB-O 3.36Å; A531-T533 PolarHBondContact O-N 2.87Å
532	A	93.8	Very high	93.6	Very high	6 Å²	6	20 Å²	20	5%	0.05	10%	0.102	C	C	.	.			trans	-62.1	138	175.7	0	0	0	0	0	110.8	F536 I537 V644 F653 L672	A532-F536 HydrophobicContact CB-CB 3.94Å; A532-I537 HydrophobicContact CB-CG1 4.21Å; A532-I537 WeakPolarHBondContact O-CD1 3.38Å; A532-V644 HydrophobicContact CB-CB 4.36Å; A532-V644 HydrophobicContact CB-CG2 4.49Å; A532-V644 WeakPolarHBondContact CB-O 3.22Å; A532-V644 PolarHBondContact N-O 2.74Å; A532-V644 VanDerWaalsContact N-O 3.1Å; A532-F653 HydrophobicContact CB-CE2 4.21Å; A532-L672 HydrophobicContact CB-CD2 4.02Å
533	T	91.3	Very high	93.7	Very high	28 Å²	28	19.4 Å²	19.4	17%	0.172	10%	0.098	C	C	.	.			trans	-117.9	151.6	-178.1	61.9	0	0	0	0	111	E481 A531 D535 F536	E481-T533 WeakPolarHBondContact O-CG2 3.25Å; E481-T533 PolarHBondContact O-OG1 2.7Å; A531-T533 PolarHBondContact O-N 2.87Å; T533-D535 PolarHBondContact O-N 3Å; T533-F536 WeakPolarHBondContact O-CB 3.2Å; T533-F536 PolarHBondContact O-N 3.14Å
534	Q	91.6	Very high	93.9	Very high	93 Å²	93	19.2 Å²	19.2	44%	0.435	10%	0.097	S	C	.	.	H	α-helix	trans	32.8	-100.6	169.5	-57.5	-179.2	26.1	0	0	115.1	F536 I537 T538 S774	Q534-F536 VanDerWaalsContact C-N 3.3Å; Q534-F536 PolarHBondContact O-N 3.35Å; Q534-I537 WeakPolarHBondContact O-CB 3.47Å; Q534-I537 PolarHBondContact O-N 2.7Å; Q534-T538 PolarHBondContact O-N 2.84Å; Q534-T538 PolarHBondContact O-OG1 3.26Å; Q534-S774 WeakPolarHBondContact O-CB 3.4Å
535	D	94.8	Very high	94	Very high	98 Å²	98	19 Å²	19	52%	0.524	10%	0.096	S	C	.	.	H	α-helix	trans	-63.2	-32.4	-174.7	-67.9	-17.9	0	0	0	113.4	T533 I537 T538 G539 L680	T533-D535 PolarHBondContact O-N 3Å; D535-I537 VanDerWaalsContact C-N 3.3Å; D535-I537 PolarHBondContact O-N 3.26Å; D535-T538 PolarHBondContact O-N 2.77Å; D535-G539 PolarHBondContact O-N 3.27Å; D535-L680 HydrophobicContact CB-CD2 4.3Å
536	F	96	Very high	94.1	Very high	7 Å²	7	27.5 Å²	27.5	3%	0.031	13%	0.128	C	C	.	.	H	α-helix	trans	-64.9	-37.8	174.7	-56	-26.5	0	0	0	111.3	P364 E481 A532 T533 Q534 A540 A673 S676 S677	P364-F536 HydrophobicContact CB-CE1 4.28Å; P364-F536 HydrophobicContact CB-CZ 4.01Å; E481-F536 HydrophobicContact CB-CE2 3.88Å; E481-F536 HydrophobicContact CB-CZ 4.06Å; E481-F536 HydrophobicContact CG-CZ 4.41Å; E481-F536 WeakPolarHBondContact OE2-CZ 3.42Å; A532-F536 HydrophobicContact CB-CB 3.94Å; T533-F536 WeakPolarHBondContact O-CB 3.2Å; T533-F536 PolarHBondContact O-N 3.14Å; Q534-F536 VanDerWaalsContact C-N 3.3Å; Q534-F536 PolarHBondContact O-N 3.35Å; F536-A540 VanDerWaalsContact O-CB 3.24Å; F536-A540 WeakPolarHBondContact O-CB 3.48Å; F536-A540 PolarHBondContact O-N 2.85Å; F536-A673 HydrophobicContact CD1-CB 4.35Å; F536-A673 HydrophobicContact CD2-CB 4.21Å; F536-A673 HydrophobicContact CE1-CB 4Å; F536-A673 HydrophobicContact CE2-CB 3.83Å; F536-A673 HydrophobicContact CG-CB 4.47Å; F536-A673 HydrophobicContact CZ-CB 3.73Å; F536-S676 WeakPolarHBondContact CA-OG 3.36Å; F536-S676 WeakPolarHBondContact CD1-OG 3.37Å; F536-S677 WeakPolarHBondContact CE1-OG 3.48Å
537	I	95.8	Very high	94	Very high	5 Å²	5	31.4 Å²	31.4	3%	0.026	15%	0.149	C	C	.	.	H	α-helix	trans	-69	-46.1	175.7	-56.7	174.6	0	0	0	109.9	A532 Q534 D535 G539 A540 Y541 K641 V644 C772	A532-I537 HydrophobicContact CB-CG1 4.21Å; A532-I537 WeakPolarHBondContact O-CD1 3.38Å; Q534-I537 WeakPolarHBondContact O-CB 3.47Å; Q534-I537 PolarHBondContact O-N 2.7Å; D535-I537 VanDerWaalsContact C-N 3.3Å; D535-I537 PolarHBondContact O-N 3.26Å; I537-G539 PolarHBondContact O-N 2.81Å; I537-A540 PolarHBondContact O-N 3.15Å; I537-Y541 VanDerWaalsContact O-CB 3.31Å; I537-Y541 WeakPolarHBondContact O-CB 3.37Å; I537-Y541 PolarHBondContact O-N 3.18Å; I537-K641 HydrophobicContact CD1-CB 4.09Å; I537-K641 HydrophobicContact CD1-CG 4.17Å; I537-K641 HydrophobicContact CG2-CB 4.39Å; I537-V644 HydrophobicContact CG1-CG2 4.32Å; I537-V644 HydrophobicContact CG2-CG2 4.44Å; I537-C772 HydrophobicContact CG2-CB 4.31Å
538	T	95.9	Very high	94.1	Very high	1 Å²	1	30 Å²	30	1%	0.006	14%	0.143	C	C	.	.	H	α-helix	trans	-59.7	-47.2	177.7	-55.7	0	0	0	0	110.8	Q534 D535 Y541 L542 L680 F685 S774	Q534-T538 PolarHBondContact O-N 2.84Å; Q534-T538 PolarHBondContact O-OG1 3.26Å; D535-T538 PolarHBondContact O-N 2.77Å; T538-Y541 PolarHBondContact O-N 3.36Å; T538-L542 HydrophobicContact CG2-CD1 3.94Å; T538-L542 HydrophobicContact CG2-CG 4.31Å; T538-L542 WeakPolarHBondContact O-CB 3.39Å; T538-L542 VanDerWaalsContact O-CG 3.27Å; T538-L542 WeakPolarHBondContact O-CG 3.29Å; T538-L542 PolarHBondContact O-N 3.42Å; T538-L680 HydrophobicContact CG2-CD1 4.4Å; T538-F685 HydrophobicContact CG2-CD1 4Å; T538-F685 HydrophobicContact CG2-CE1 3.79Å; T538-F685 HydrophobicContact CG2-CG 4.45Å; T538-F685 HydrophobicContact CG2-CZ 4.06Å; T538-S774 WeakPolarHBondContact OG1-CB 3.14Å; T538-S774 PolarHBondContact OG1-OG 3.22Å
539	G	95.4	Very high	94.2	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-61.1	-44.3	176.9	0	0	0	0	0	112.4	D535 I537 L542 L543	D535-G539 PolarHBondContact O-N 3.27Å; I537-G539 PolarHBondContact O-N 2.81Å; G539-L542 PolarHBondContact O-N 3.16Å; G539-L543 WeakPolarHBondContact O-CB 2.97Å; G539-L543 PolarHBondContact O-N 3.21Å
540	A	95.8	Very high	94.4	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-62.9	-45	176.4	0	0	0	0	0	112.5	F536 I537 L543 T544 F592 M639 L672	F536-A540 VanDerWaalsContact O-CB 3.24Å; F536-A540 WeakPolarHBondContact O-CB 3.48Å; F536-A540 PolarHBondContact O-N 2.85Å; I537-A540 PolarHBondContact O-N 3.15Å; A540-L543 PolarHBondContact O-N 3.37Å; A540-T544 WeakPolarHBondContact O-CB 3.36Å; A540-T544 WeakPolarHBondContact O-CG2 3.5Å; A540-T544 PolarHBondContact O-N 3.36Å; A540-T544 PolarHBondContact O-OG1 3.37Å; A540-F592 HydrophobicContact CB-CE2 4.45Å; A540-M639 HydrophobicContact CB-CB 4.04Å; A540-L672 HydrophobicContact CB-CD1 4.05Å; A540-L672 HydrophobicContact CB-CD2 4.41Å
541	Y	95.4	Very high	94.3	Very high	23 Å²	23	36.6 Å²	36.6	9%	0.09	17%	0.173	C	C	.	.	H	α-helix	trans	-61.7	-48.9	178.1	178.7	-99.6	0	0	0	111.2	I537 T538 L543 T544 K545 V638 M639 I768 C772	I537-Y541 VanDerWaalsContact O-CB 3.31Å; I537-Y541 WeakPolarHBondContact O-CB 3.37Å; I537-Y541 PolarHBondContact O-N 3.18Å; T538-Y541 PolarHBondContact O-N 3.36Å; Y541-L543 PolarHBondContact O-N 3.34Å; Y541-T544 PolarHBondContact O-N 3.05Å; Y541-T544 PolarHBondContact O-OG1 3.42Å; Y541-K545 PolarHBondContact O-N 2.79Å; Y541-V638 HydrophobicContact CD2-CB 4.12Å; Y541-V638 HydrophobicContact CD2-CG2 3.93Å; Y541-V638 HydrophobicContact CE2-CB 4.12Å; Y541-V638 HydrophobicContact CE2-CG2 3.58Å; Y541-M639 WeakPolarHBondContact CA-O 3.47Å; Y541-M639 VanDerWaalsContact CB-O 3.23Å; Y541-M639 WeakPolarHBondContact CB-O 3.4Å; Y541-M639 PolarHBondContact N-O 3.07Å; Y541-I768 HydrophobicContact CD1-CG2 3.91Å; Y541-I768 HydrophobicContact CE1-CG2 3.94Å; Y541-C772 HydrophobicContact CD1-CB 3.87Å; Y541-C772 HydrophobicContact CD2-CB 3.68Å; Y541-C772 HydrophobicContact CE1-CB 4.46Å; Y541-C772 HydrophobicContact CE2-CB 4.29Å; Y541-C772 HydrophobicContact CG-CB 3.45Å; Y541-C772 VanDerWaalsContact CG-CB 3.45Å
542	L	95.6	Very high	94.3	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-65.5	-37	180	-78.7	-173.8	0	0	0	112.7	T538 G539 V548 F679 L680 R683 F685 I768	T538-L542 HydrophobicContact CG2-CD1 3.94Å; T538-L542 HydrophobicContact CG2-CG 4.31Å; T538-L542 WeakPolarHBondContact O-CB 3.39Å; T538-L542 VanDerWaalsContact O-CG 3.27Å; T538-L542 WeakPolarHBondContact O-CG 3.29Å; T538-L542 PolarHBondContact O-N 3.42Å; G539-L542 PolarHBondContact O-N 3.16Å; L542-V548 VanDerWaalsContact O-CG2 3.25Å; L542-V548 WeakPolarHBondContact O-CG2 2.95Å; L542-F679 HydrophobicContact CB-CE1 3.93Å; L542-L680 HydrophobicContact CD1-CD1 4.09Å; L542-R683 VanDerWaalsContact CB-NH1 3.34Å; L542-R683 PolarHBondContact O-NH1 3.4Å; L542-R683 VanDerWaalsContact O-NH1 3.1Å; L542-F685 HydrophobicContact CD1-CD2 3.69Å; L542-F685 HydrophobicContact CD1-CE2 4.09Å; L542-F685 HydrophobicContact CD1-CG 4.19Å; L542-I768 HydrophobicContact CD2-CD1 4.2Å; L542-I768 HydrophobicContact CD2-CG2 3.98Å; L542-I768 HydrophobicContact CG-CG2 4.4Å
543	L	95.8	Very high	94.2	Very high	1 Å²	1	46 Å²	46	1%	0.005	22%	0.221	C	C	.	.	H	α-helix	trans	-68.1	-37.8	176.5	178.7	64.1	0	0	0	111.7	G539 A540 Y541 L558 G588 V591 V675 F679	G539-L543 WeakPolarHBondContact O-CB 2.97Å; G539-L543 PolarHBondContact O-N 3.21Å; A540-L543 PolarHBondContact O-N 3.37Å; Y541-L543 PolarHBondContact O-N 3.34Å; L543-L558 HydrophobicContact CD1-CD1 4.34Å; L543-G588 CarbonylContact O-C 3.51Å; L543-G588 VanDerWaalsContact O-CA 3.26Å; L543-G588 WeakPolarHBondContact O-CA 3.45Å; L543-V591 HydrophobicContact CD2-CB 4.36Å; L543-V591 HydrophobicContact CD2-CG1 4.12Å; L543-V675 HydrophobicContact CD2-CG1 4.04Å; L543-F679 HydrophobicContact CB-CD1 4.04Å; L543-F679 HydrophobicContact CB-CE1 3.84Å; L543-F679 HydrophobicContact CB-CZ 4.17Å; L543-F679 HydrophobicContact CD1-CD2 3.93Å; L543-F679 HydrophobicContact CD1-CE1 4.47Å; L543-F679 HydrophobicContact CD1-CE2 3.85Å; L543-F679 HydrophobicContact CD1-CG 4.26Å; L543-F679 HydrophobicContact CD1-CZ 4.12Å
544	T	95.8	Very high	94.3	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-88.4	-0	-172.6	53.1	0	0	0	0	114.8	A540 Y541 K589 F592 L634 M639	A540-T544 WeakPolarHBondContact O-CB 3.36Å; A540-T544 WeakPolarHBondContact O-CG2 3.5Å; A540-T544 PolarHBondContact O-N 3.36Å; A540-T544 PolarHBondContact O-OG1 3.37Å; Y541-T544 PolarHBondContact O-N 3.05Å; Y541-T544 PolarHBondContact O-OG1 3.42Å; T544-K589 WeakPolarHBondContact O-CE 3.46Å; T544-K589 PolarHBondContact O-NZ 3.24Å; T544-F592 HydrophobicContact CG2-CB 3.83Å; T544-F592 HydrophobicContact CG2-CD2 4.06Å; T544-F592 HydrophobicContact CG2-CG 3.94Å; T544-L634 HydrophobicContact CG2-CD2 3.79Å; T544-M639 HydrophobicContact CG2-CB 4.31Å; T544-M639 HydrophobicContact CG2-CG 3.81Å; T544-M639 PolarHBondContact OG1-N 3.43Å
545	K	92.7	Very high	94.5	Very high	27 Å²	27	43 Å²	43	12%	0.117	21%	0.207	C	C	.	.	S	Bend	trans	-62.3	151.8	172.4	-71.7	-160.4	172.4	-173.6	0	112.5	Y541 D547 V548 V638	Y541-K545 PolarHBondContact O-N 2.79Å; K545-D547 VanDerWaalsContact C-N 3.25Å; K545-D547 WeakPolarHBondContact CB-OD1 3.4Å; K545-D547 PolarHBondContact O-N 3.49Å; K545-V548 HydrophobicContact CB-CG2 4.46Å; K545-V548 PolarHBondContact O-N 2.92Å; K545-V638 HydrophobicContact CG-CG1 4.45Å
546	R	90.7	Very high	94.3	Very high	189 Å²	189	44.6 Å²	44.6	71%	0.713	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63	-26	-179.2	-159.1	177.1	80.1	173.6	5.8	114.9	V548 E624	R546-V548 VanDerWaalsContact C-N 3.31Å; R546-E624 WeakPolarHBondContact CB-OE1 3.2Å; R546-E624 WeakPolarHBondContact CB-OE2 3.01Å; R546-E624 PolarHBondContact N-OE2 3.41Å
547	D	90.7	Very high	94.2	Very high	83 Å²	83	49.5 Å²	49.5	44%	0.444	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-1	-175.6	59.2	-22	0	0	0	113.9	K545 F549 H763	K545-D547 VanDerWaalsContact C-N 3.25Å; K545-D547 WeakPolarHBondContact CB-OD1 3.4Å; K545-D547 PolarHBondContact O-N 3.49Å; D547-F549 PolarHBondContact O-N 2.96Å; D547-H763 IonicContact OD2-CE1 3.05Å
548	V	94.1	Very high	94	Very high	16 Å²	16	49.4 Å²	49.4	10%	0.097	23%	0.226	C	C	.	.			trans	-90.7	106.5	178.9	-178.5	0	0	0	0	111.1	L542 K545 R546 L550 T587 G588	L542-V548 VanDerWaalsContact O-CG2 3.25Å; L542-V548 WeakPolarHBondContact O-CG2 2.95Å; K545-V548 HydrophobicContact CB-CG2 4.46Å; K545-V548 PolarHBondContact O-N 2.92Å; R546-V548 VanDerWaalsContact C-N 3.31Å; V548-L550 HydrophobicContact CG1-CD2 4.23Å; V548-L550 HydrophobicContact CG1-CG 4.31Å; V548-T587 WeakPolarHBondContact O-CA 3.48Å; V548-G588 PolarHBondContact O-N 2.91Å
549	F	95.5	Very high	93.7	Very high	103 Å²	103	49.7 Å²	49.7	45%	0.452	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	130.7	170.8	-63.4	-78.5	0	0	0	110.2	D547 I579 V585 W586 T587	D547-F549 PolarHBondContact O-N 2.96Å; F549-I579 HydrophobicContact CD1-CD1 4.15Å; F549-I579 HydrophobicContact CE1-CD1 3.64Å; F549-I579 HydrophobicContact CE1-CG1 4.49Å; F549-I579 HydrophobicContact CZ-CD1 4.24Å; F549-V585 HydrophobicContact CB-CB 4.22Å; F549-V585 HydrophobicContact CB-CG2 4.24Å; F549-V585 HydrophobicContact CD1-CG2 3.82Å; F549-V585 HydrophobicContact CG-CG2 4.33Å; F549-W586 CarbonylContact C-O 3.58Å; F549-W586 WeakPolarHBondContact CA-O 3.16Å; F549-T587 HydrophobicContact CD1-CG2 4.22Å; F549-T587 HydrophobicContact CE1-CG2 3.96Å
550	L	95.2	Very high	93.4	Very high	14 Å²	14	51.4 Å²	51.4	7%	0.073	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	132.2	-177.1	-59.9	170.8	0	0	0	109.1	V548 D554 F555 L558 V585 W586 V591	V548-L550 HydrophobicContact CG1-CD2 4.23Å; V548-L550 HydrophobicContact CG1-CG 4.31Å; L550-D554 HydrophobicContact CB-CB 4.35Å; L550-D554 HydrophobicContact CD2-CB 4.17Å; L550-F555 HydrophobicContact CB-CB 4.24Å; L550-F555 HydrophobicContact CD1-CD2 4.49Å; L550-L558 HydrophobicContact CD1-CD1 3.8Å; L550-L558 HydrophobicContact CD2-CD1 4.42Å; L550-V585 WeakPolarHBondContact O-CA 3.47Å; L550-W586 PolarHBondContact N-O 2.99Å; L550-W586 PolarHBondContact O-N 3.33Å; L550-V591 HydrophobicContact CD1-CG2 3.44Å; L550-V591 VanDerWaalsContact CD1-CG2 3.44Å
551	N	94.4	Very high	93	Very high	71 Å²	71	52.1 Å²	52.1	38%	0.38	25%	0.251	S	S	.	.			trans	-70.3	173.6	169.2	72.9	38.3	0	0	0	109.7	V553 D554 F555	N551-V553 VanDerWaalsContact C-N 3.29Å; N551-V553 PolarHBondContact O-N 2.94Å; N551-V553 WeakPolarHBondContact OD1-CA 3.44Å; N551-V553 WeakPolarHBondContact OD1-CB 3.18Å; N551-V553 PolarHBondContact OD1-N 3.36Å; N551-D554 PolarHBondContact ND2-OD2 3.28Å; N551-D554 PolarHBondContact O-N 3.01Å; N551-D554 VanDerWaalsContact OD1-CG 3.24Å; N551-D554 PolarHBondContact OD1-N 2.79Å; N551-D554 PolarHBondContact OD1-OD2 3.36Å; N551-F555 VanDerWaalsContact O-CB 3.27Å; N551-F555 WeakPolarHBondContact O-CB 3.43Å; N551-F555 PolarHBondContact O-N 3.04Å
552	K	93.5	Very high	92.5	Very high	106 Å²	106	51 Å²	51	46%	0.461	25%	0.247	S	C	.	.	H	α-helix	trans	-57.9	-39.6	-179	-173.8	179.4	175.8	-175.8	0	113	W556 W586	K552-W556 HydrophobicContact CD-CZ2 4.38Å; K552-W556 HydrophobicContact CG-CD2 4.29Å; K552-W556 HydrophobicContact CG-CZ2 4.38Å; K552-W556 WeakPolarHBondContact O-CB 3.48Å; K552-W556 VanDerWaalsContact O-CG 3.23Å; K552-W556 PolarHBondContact O-N 3.49Å; K552-W586 HydrophobicContact CB-CH2 4.34Å; K552-W586 HydrophobicContact CB-CZ3 3.87Å; K552-W586 HydrophobicContact CG-CH2 4.27Å; K552-W586 HydrophobicContact CG-CZ3 4.27Å
553	V	93.4	Very high	91.7	Very high	102 Å²	102	55.3 Å²	55.3	62%	0.618	27%	0.266	S	S	*	.	H	α-helix	trans	-70.5	-49	-176.6	180	0	0	0	0	110.4	N551 F555 W556 K557	N551-V553 VanDerWaalsContact C-N 3.29Å; N551-V553 PolarHBondContact O-N 2.94Å; N551-V553 WeakPolarHBondContact OD1-CA 3.44Å; N551-V553 WeakPolarHBondContact OD1-CB 3.18Å; N551-V553 PolarHBondContact OD1-N 3.36Å; V553-F555 VanDerWaalsContact C-N 3.32Å; V553-F555 PolarHBondContact O-N 3.48Å; V553-W556 PolarHBondContact O-N 3.48Å; V553-K557 WeakPolarHBondContact O-CB 3.35Å; V553-K557 PolarHBondContact O-N 3.41Å
554	D	93.3	Very high	90.4	Very high	56 Å²	56	56.9 Å²	56.9	30%	0.299	28%	0.277	S	S	.	.	H	α-helix	trans	-62.9	-42.6	179.7	-55	-25.2	0	0	0	110.5	L550 N551 W556 K557 L558	L550-D554 HydrophobicContact CB-CB 4.35Å; L550-D554 HydrophobicContact CD2-CB 4.17Å; N551-D554 PolarHBondContact ND2-OD2 3.28Å; N551-D554 PolarHBondContact O-N 3.01Å; N551-D554 VanDerWaalsContact OD1-CG 3.24Å; N551-D554 PolarHBondContact OD1-N 2.79Å; N551-D554 PolarHBondContact OD1-OD2 3.36Å; D554-W556 PolarHBondContact O-N 3.36Å; D554-K557 PolarHBondContact O-N 2.99Å; D554-L558 WeakPolarHBondContact O-CG 3.44Å; D554-L558 PolarHBondContact O-N 2.87Å
555	F	94.3	Very high	88.7	Confident	0 Å²	0	66.4 Å²	66.4	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-60.9	-45.8	175.3	-178.2	-92.8	0	0	0	111.6	L550 N551 V553 K557 L558 A559 I574 P575 W586 Q590 V591 L594	L550-F555 HydrophobicContact CB-CB 4.24Å; L550-F555 HydrophobicContact CD1-CD2 4.49Å; N551-F555 VanDerWaalsContact O-CB 3.27Å; N551-F555 WeakPolarHBondContact O-CB 3.43Å; N551-F555 PolarHBondContact O-N 3.04Å; V553-F555 VanDerWaalsContact C-N 3.32Å; V553-F555 PolarHBondContact O-N 3.48Å; F555-K557 VanDerWaalsContact C-N 3.34Å; F555-K557 PolarHBondContact O-N 2.96Å; F555-L558 PolarHBondContact O-N 3.07Å; F555-A559 WeakPolarHBondContact O-CB 3.27Å; F555-A559 PolarHBondContact O-N 3.32Å; F555-I574 HydrophobicContact CE1-CG2 3.87Å; F555-P575 HydrophobicContact CZ-CG 3.95Å; F555-W586 HydrophobicContact CB-CB 4.47Å; F555-W586 HydrophobicContact CB-CD2 4.5Å; F555-W586 HydrophobicContact CB-CE3 4.44Å; F555-W586 HydrophobicContact CD1-CD2 4.33Å; F555-W586 HydrophobicContact CD1-CG 4.34Å; F555-W586 HydrophobicContact CD2-CB 3.5Å; F555-W586 AromaticContact CD2-CD1 3.98Å; F555-W586 HydrophobicContact CD2-CD2 4.38Å; F555-W586 AromaticContact CD2-CG 3.67Å; F555-W586 HydrophobicContact CD2-CG 3.67Å; F555-W586 HydrophobicContact CE2-CB 3.95Å; F555-W586 AromaticContact CE2-CD1 3.73Å; F555-W586 AromaticContact CE2-CG 3.91Å; F555-W586 HydrophobicContact CE2-CG 3.91Å; F555-W586 HydrophobicContact CG-CB 4.06Å; F555-W586 HydrophobicContact CG-CD2 4.14Å; F555-W586 AromaticContact CG-CG 3.92Å; F555-W586 HydrophobicContact CG-CG 3.92Å; F555-W586 AromaticContact CZ-CD1 3.9Å; F555-W586 HydrophobicContact CZ-CG 4.38Å; F555-Q590 HydrophobicContact CE2-CB 4.35Å; F555-V591 HydrophobicContact CD2-CG2 3.41Å; F555-V591 VanDerWaalsContact CD2-CG2 3.41Å; F555-V591 HydrophobicContact CE2-CB 4.46Å; F555-V591 HydrophobicContact CE2-CG2 3.5Å; F555-L594 HydrophobicContact CE1-CD1 4.11Å; F555-L594 HydrophobicContact CE2-CD1 4.28Å; F555-L594 HydrophobicContact CZ-CD1 3.48Å; F555-L594 VanDerWaalsContact CZ-CD1 3.48Å
556	W	92	Very high	86.9	Confident	132 Å²	132	70.6 Å²	70.6	50%	0.5	34%	0.342	S	S	.	.	H	α-helix	trans	-65.5	-36	177.1	-76.1	5.2	0	0	0	112.8	K552 V553 D554 A559 G560	K552-W556 HydrophobicContact CD-CZ2 4.38Å; K552-W556 HydrophobicContact CG-CD2 4.29Å; K552-W556 HydrophobicContact CG-CZ2 4.38Å; K552-W556 WeakPolarHBondContact O-CB 3.48Å; K552-W556 VanDerWaalsContact O-CG 3.23Å; K552-W556 PolarHBondContact O-N 3.49Å; V553-W556 PolarHBondContact O-N 3.48Å; D554-W556 PolarHBondContact O-N 3.36Å; W556-A559 PolarHBondContact O-N 2.9Å; W556-G560 PolarHBondContact O-N 3.11Å
557	K	92.4	Very high	85.3	Confident	111 Å²	111	61.9 Å²	61.9	48%	0.483	31%	0.31	S	S	.	.	H	α-helix	trans	-62.9	-49.7	176.6	-167.5	178.9	-173.7	-167.8	0	111.2	V553 D554 F555 A559 G560 C561 E682	V553-K557 WeakPolarHBondContact O-CB 3.35Å; V553-K557 PolarHBondContact O-N 3.41Å; D554-K557 PolarHBondContact O-N 2.99Å; F555-K557 VanDerWaalsContact C-N 3.34Å; F555-K557 PolarHBondContact O-N 2.96Å; K557-A559 PolarHBondContact O-N 3.43Å; K557-G560 WeakPolarHBondContact O-CA 3.29Å; K557-G560 PolarHBondContact O-N 3.38Å; K557-G560 VanDerWaalsContact O-N 3.13Å; K557-C561 PolarHBondContact O-N 3.04Å; K557-C561 PolarHBondContact O-SG 3.05Å; K557-E682 WeakPolarHBondContact CD-OE1 3.04Å; K557-E682 WeakPolarHBondContact CE-OE1 3.47Å; K557-E682 IonicContact NZ-OE1 3.62Å; K557-E682 PolarHBondContact NZ-OE1 3.45Å; K557-E682 IonicContact NZ-OE2 2.69Å
558	L	92.6	Very high	83.7	Confident	3 Å²	3	60.8 Å²	60.8	2%	0.016	32%	0.318	C	S	.	.	H	α-helix	trans	-64.8	-39.3	177	-67.1	177.6	0	0	0	112.5	L543 L550 D554 F555 G560 C561 V591 F679	L543-L558 HydrophobicContact CD1-CD1 4.34Å; L550-L558 HydrophobicContact CD1-CD1 3.8Å; L550-L558 HydrophobicContact CD2-CD1 4.42Å; D554-L558 WeakPolarHBondContact O-CG 3.44Å; D554-L558 PolarHBondContact O-N 2.87Å; F555-L558 PolarHBondContact O-N 3.07Å; L558-G560 VanDerWaalsContact C-N 3.3Å; L558-G560 PolarHBondContact O-N 2.98Å; L558-C561 WeakPolarHBondContact O-CB 3.12Å; L558-C561 PolarHBondContact O-N 3.35Å; L558-V591 HydrophobicContact CB-CG1 4.1Å; L558-V591 HydrophobicContact CD1-CG1 4.39Å; L558-V591 HydrophobicContact CD1-CG2 4.43Å; L558-F679 HydrophobicContact CD1-CD2 4.13Å; L558-F679 HydrophobicContact CD2-CB 3.95Å
559	A	90.2	Very high	82.4	Confident	6 Å²	6	60.7 Å²	60.7	5%	0.05	32%	0.318	C	S	.	.	H	α-helix	trans	-63.2	-38.5	172.4	0	0	0	0	0	111.6	F555 W556 K557 C561 M562 M572 L594	F555-A559 WeakPolarHBondContact O-CB 3.27Å; F555-A559 PolarHBondContact O-N 3.32Å; W556-A559 PolarHBondContact O-N 2.9Å; K557-A559 PolarHBondContact O-N 3.43Å; A559-C561 VanDerWaalsContact C-N 3.27Å; A559-C561 PolarHBondContact O-N 3.25Å; A559-M562 WeakPolarHBondContact O-CB 3.41Å; A559-M562 PolarHBondContact O-N 3.4Å; A559-M572 HydrophobicContact CB-SD 3.93Å; A559-L594 HydrophobicContact CB-CD1 4.38Å
560	G	88.8	Confident	81.2	Confident	36 Å²	36	67.2 Å²	67.2	37%	0.371	34%	0.339	S	S	.	.	H	α-helix	trans	-54.5	-40	174.4	0	0	0	0	0	113.2	W556 K557 L558 M562 F563	W556-G560 PolarHBondContact O-N 3.11Å; K557-G560 WeakPolarHBondContact O-CA 3.29Å; K557-G560 PolarHBondContact O-N 3.38Å; K557-G560 VanDerWaalsContact O-N 3.13Å; L558-G560 VanDerWaalsContact C-N 3.3Å; L558-G560 PolarHBondContact O-N 2.98Å; G560-M562 PolarHBondContact O-N 3.44Å; G560-M562 VanDerWaalsContact O-N 3.1Å; G560-F563 PolarHBondContact O-N 2.82Å; G560-F563 VanDerWaalsContact O-N 3.12Å
561	C	86.9	Confident	80.5	Confident	15 Å²	15	73.7 Å²	73.7	10%	0.101	37%	0.367	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-18.1	177.3	-59.3	0	0	0	0	113.8	K557 L558 A559 R674 V675 N678	K557-C561 PolarHBondContact O-N 3.04Å; K557-C561 PolarHBondContact O-SG 3.05Å; L558-C561 WeakPolarHBondContact O-CB 3.12Å; L558-C561 PolarHBondContact O-N 3.35Å; A559-C561 VanDerWaalsContact C-N 3.27Å; A559-C561 PolarHBondContact O-N 3.25Å; C561-R674 PolarHBondContact O-NE 3.37Å; C561-R674 PolarHBondContact O-NH1 3.02Å; C561-V675 HydrophobicContact CB-CG2 4.47Å; C561-N678 VanDerWaalsContact SG-CG 3.58Å
562	M	85.8	Confident	80.1	Confident	1 Å²	1	71.4 Å²	71.4	1%	0.005	35%	0.354	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.8	-18.8	179.7	-54.4	-179.6	-156.3	0	0	112.6	A559 G560 M572 V591 L594 V595 R671 V675	A559-M562 WeakPolarHBondContact O-CB 3.41Å; A559-M562 PolarHBondContact O-N 3.4Å; G560-M562 PolarHBondContact O-N 3.44Å; G560-M562 VanDerWaalsContact O-N 3.1Å; M562-M572 HydrophobicContact CB-CE 3.87Å; M562-M572 HydrophobicContact CG-CE 4.28Å; M562-M572 HydrophobicContact SD-CE 3.55Å; M562-M572 VanDerWaalsContact SD-CE 3.55Å; M562-V591 HydrophobicContact CE-CG1 3.8Å; M562-L594 HydrophobicContact CE-CB 3.96Å; M562-L594 HydrophobicContact SD-CB 3.97Å; M562-V595 HydrophobicContact CE-CG2 3.73Å; M562-V595 HydrophobicContact SD-CG2 4.15Å; M562-R671 HydrophobicContact CB-CG 4.47Å; M562-V675 HydrophobicContact CE-CG1 4.47Å; M562-V675 HydrophobicContact CE-CG2 3.52Å; M562-V675 HydrophobicContact CG-CG2 3.49Å; M562-V675 VanDerWaalsContact CG-CG2 3.49Å; M562-V675 HydrophobicContact SD-CG2 4.19Å
563	F	78.6	Confident	79.9	Confident	90 Å²	90	68.9 Å²	68.9	40%	0.395	35%	0.346	S	S	.	.			trans	-71.5	133.6	179	-75.9	-76.1	0	0	0	111.4	G560 V569 M572 R674	G560-F563 PolarHBondContact O-N 2.82Å; G560-F563 VanDerWaalsContact O-N 3.12Å; F563-V569 WeakPolarHBondContact CD1-O 3.41Å; F563-V569 HydrophobicContact CE1-CG1 4.35Å; F563-M572 HydrophobicContact CZ-CB 3.85Å; F563-R674 PolarHBondContact O-NH1 3.34Å
564	S	68.1	Low	79.7	Confident	34 Å²	34	68.2 Å²	68.2	24%	0.238	34%	0.338	C	S	.	.			trans	-158.2	145.4	167.3	165.7	0	0	0	0	109.3	M566 N567 W670	S564-M566 PolarHBondContact O-N 2.81Å; S564-M566 PolarHBondContact OG-N 2.8Å; S564-M566 VanDerWaalsContact OG-N 3.11Å; S564-N567 PolarHBondContact O-N 2.9Å; S564-W670 VanDerWaalsContact CB-CH2 3.47Å
565	H	60	Low	79.6	Confident	199 Å²	199	67.4 Å²	67.4	92%	0.921	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.6	-23.2	173	-54.9	-64.8	0	0	0	112.6
566	M	53.9	Low	79.6	Confident	115 Å²	115	76.2 Å²	76.2	57%	0.567	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.5	-13	-173.2	-57.9	-166.8	74.1	0	0	114.8	E370 S564	E370-M566 VanDerWaalsContact OE1-CE 3.31Å; E370-M566 WeakPolarHBondContact OE1-CE 3.48Å; S564-M566 PolarHBondContact O-N 2.81Å; S564-M566 PolarHBondContact OG-N 2.8Å; S564-M566 VanDerWaalsContact OG-N 3.11Å
567	N	57.9	Low	79.8	Confident	6 Å²	6	71.2 Å²	71.2	3%	0.032	36%	0.358	C	S	.	.	S	Bend	trans	-99.3	2	-170.9	-81	23.6	0	0	0	114.9	Q367 S564 V569 W670	Q367-N567 PolarHBondContact NE2-OD1 2.99Å; S564-N567 PolarHBondContact O-N 2.9Å; N567-V569 HydrophobicContact CB-CG2 4.38Å; N567-V569 PolarHBondContact O-N 3.19Å; N567-W670 WeakPolarHBondContact ND2-CZ3 3.08Å
568	G	57.3	Low	79.9	Confident	61 Å²	61	68.5 Å²	68.5	63%	0.629	36%	0.357	S	S	*	.			trans	66.6	-10.6	-175.1	0	0	0	0	0	115.3	R570	G568-R570 VanDerWaalsContact C-N 3.29Å; G568-R570 PolarHBondContact O-N 3.35Å
569	V	66.4	Low	80	Confident	13 Å²	13	71.2 Å²	71.2	8%	0.079	37%	0.371	C	S	.	.			trans	-73	82.9	176.2	-173.3	0	0	0	0	109.4	F563 N567 P598	F563-V569 WeakPolarHBondContact CD1-O 3.41Å; F563-V569 HydrophobicContact CE1-CG1 4.35Å; N567-V569 HydrophobicContact CB-CG2 4.38Å; N567-V569 PolarHBondContact O-N 3.19Å; V569-P598 HydrophobicContact CG1-CB 3.87Å; V569-P598 HydrophobicContact CG1-CG 4.24Å; V569-P598 HydrophobicContact CG2-CB 4.23Å; V569-P598 HydrophobicContact CG2-CG 3.73Å
570	R	69.6	Low	80.1	Confident	240 Å²	240	76.7 Å²	76.7	91%	0.906	40%	0.398	S	S	*	.			trans	-82.8	-24.5	172.7	-65.6	-174.5	179.5	-170.6	0.2	112.4	G568	G568-R570 VanDerWaalsContact C-N 3.29Å; G568-R570 PolarHBondContact O-N 3.35Å
571	K	82.1	Confident	80.3	Confident	150 Å²	150	83.9 Å²	83.9	65%	0.652	42%	0.42	S	S	*	.			trans	-136.5	141.5	-177.8	-175.1	177.7	176.6	-179	0	109.2
572	M	85	Confident	80.6	Confident	23 Å²	23	89.3 Å²	89.3	11%	0.113	46%	0.455	C	S	.	.			trans	-126.3	134.5	176.4	-174	177.9	-91.4	0	0	109.5	A559 M562 F563 I574 L594 P598	A559-M572 HydrophobicContact CB-SD 3.93Å; M562-M572 HydrophobicContact CB-CE 3.87Å; M562-M572 HydrophobicContact CG-CE 4.28Å; M562-M572 HydrophobicContact SD-CE 3.55Å; M562-M572 VanDerWaalsContact SD-CE 3.55Å; F563-M572 HydrophobicContact CZ-CB 3.85Å; M572-I574 PolarHBondContact O-N 2.94Å; M572-L594 HydrophobicContact CE-CB 4.35Å; M572-L594 HydrophobicContact CG-CD2 3.88Å; M572-L594 HydrophobicContact SD-CB 4.49Å; M572-L594 HydrophobicContact SD-CD1 3.81Å; M572-L594 HydrophobicContact SD-CD2 4.13Å; M572-L594 HydrophobicContact SD-CG 4.38Å; M572-P598 CarbonylContact C-O 3.57Å; M572-P598 VanDerWaalsContact CA-O 3.28Å; M572-P598 WeakPolarHBondContact CA-O 3.39Å; M572-P598 HydrophobicContact CE-CB 3.79Å; M572-P598 HydrophobicContact CG-CB 4.39Å; M572-P598 VanDerWaalsContact CG-O 3.3Å; M572-P598 WeakPolarHBondContact CG-O 3.47Å
573	D	88.8	Confident	80.9	Confident	54 Å²	54	93.6 Å²	93.6	29%	0.289	48%	0.48	S	S	.	.			trans	-94	96.9	179.8	-67.8	-43.5	0	0	0	109.5	P598 K600	D573-P598 PolarHBondContact N-O 2.71Å; D573-K600 WeakPolarHBondContact OD2-CG 3.38Å; D573-K600 PolarHBondContact OD2-N 3.02Å
574	I	89.8	Confident	81.7	Confident	87 Å²	87	92.9 Å²	92.9	45%	0.446	48%	0.484	S	S	.	.	P	Polyproline II helix	trans	-66.9	126.3	-177.4	-64.3	-179.5	0	0	0	110.3	F555 M572	F555-I574 HydrophobicContact CE1-CG2 3.87Å; M572-I574 PolarHBondContact O-N 2.94Å
575	P	92	Very high	83	Confident	40 Å²	40	92.1 Å²	92.1	26%	0.26	48%	0.478	S	S	.	.	P	Polyproline II helix	trans	-70.6	155	178.2	29.2	-35.2	0	0	0	111.5	F555 W586 Q590	F555-P575 HydrophobicContact CZ-CG 3.95Å; P575-W586 PolarHBondContact O-NE1 3.29Å; P575-Q590 HydrophobicContact CG-CB 4.19Å
576	K	93.7	Very high	84.7	Confident	184 Å²	184	83.5 Å²	83.5	80%	0.8	44%	0.437	S	S	*	.	P	Polyproline II helix	trans	-60	141	169.7	-66.8	-176.6	-179.7	-179.5	0	109.9	Q590	K576-Q590 PolarHBondContact O-NE2 2.63Å
577	P	95.3	Very high	86.8	Confident	27 Å²	27	79.5 Å²	79.5	18%	0.175	42%	0.419	C	S	.	.	P	Polyproline II helix	trans	-56	143.9	175.4	-4.2	6.4	0	0	0	111.1	I579 L580 W586	P577-I579 VanDerWaalsContact C-N 3.34Å; P577-L580 HydrophobicContact CG-CD2 4.26Å; P577-W586 HydrophobicContact CB-CD2 3.97Å; P577-W586 HydrophobicContact CB-CE3 4.27Å; P577-W586 HydrophobicContact CB-CH2 4.18Å; P577-W586 HydrophobicContact CB-CZ2 3.89Å; P577-W586 HydrophobicContact CB-CZ3 4.35Å; P577-W586 HydrophobicContact CG-CD2 4.47Å; P577-W586 HydrophobicContact CG-CH2 3.77Å; P577-W586 HydrophobicContact CG-CZ2 3.46Å; P577-W586 VanDerWaalsContact CG-CZ2 3.46Å; P577-W586 HydrophobicContact CG-CZ3 4.38Å
578	A	94.3	Very high	88.5	Confident	54 Å²	54	79.2 Å²	79.2	45%	0.446	42%	0.418	S	S	.	.	S	Bend	trans	-68.8	-35.6	178.3	0	0	0	0	0	112	V585 T587	A578-V585 PolarHBondContact N-O 2.79Å; A578-V585 VanDerWaalsContact N-O 3.13Å; A578-T587 HydrophobicContact CB-CG2 3.74Å
579	I	94.8	Very high	90.4	Very high	60 Å²	60	77.2 Å²	77.2	31%	0.308	39%	0.392	S	S	.	.	B	Isolated β-bridge	trans	-120.2	126.1	175.2	-55.8	176.9	0	0	0	107.7	F549 P577 K581 V583 T584 V585	F549-I579 HydrophobicContact CD1-CD1 4.15Å; F549-I579 HydrophobicContact CE1-CD1 3.64Å; F549-I579 HydrophobicContact CE1-CG1 4.49Å; F549-I579 HydrophobicContact CZ-CD1 4.24Å; P577-I579 VanDerWaalsContact C-N 3.34Å; I579-K581 VanDerWaalsContact CG2-O 3.31Å; I579-K581 WeakPolarHBondContact CG2-O 3.4Å; I579-V583 WeakPolarHBondContact CG2-O 3.4Å; I579-T584 VanDerWaalsContact O-CA 3.32Å; I579-T584 WeakPolarHBondContact O-CA 3.18Å; I579-V585 HydrophobicContact CB-CG2 3.74Å; I579-V585 HydrophobicContact CD1-CG2 3.91Å; I579-V585 HydrophobicContact CG1-CG2 4.13Å; I579-V585 HydrophobicContact CG2-CG2 4.49Å; I579-V585 PolarHBondContact N-O 3.2Å; I579-V585 PolarHBondContact O-N 2.88Å; I579-V585 VanDerWaalsContact O-N 3.12Å
580	L	93.5	Very high	91.8	Very high	121 Å²	121	78 Å²	78	63%	0.634	40%	0.395	S	S	*	.			trans	-98.1	-38.8	179.4	-76.7	151.7	0	0	0	112.2	P577	P577-L580 HydrophobicContact CG-CD2 4.26Å
581	K	92.4	Very high	93	Very high	188 Å²	188	66.7 Å²	66.7	82%	0.817	35%	0.352	S	S	*	.	S	Bend	trans	-134.6	141	175.9	-68.5	-170.8	176.5	-175.7	0	108.6	I579	I579-K581 VanDerWaalsContact CG2-O 3.31Å; I579-K581 WeakPolarHBondContact CG2-O 3.4Å
582	P	92.8	Very high	93.6	Very high	129 Å²	129	59.5 Å²	59.5	84%	0.838	32%	0.321	S	S	*	.	S	Bend	cis	-77.1	-27.8	7.2	30	-34.6	0	0	0	114.3
583	V	92.7	Very high	94.1	Very high	90 Å²	90	59 Å²	59	55%	0.545	32%	0.319	S	S	.	.	S	Bend	trans	-122.3	142.5	179.6	-70.9	0	0	0	0	110.9	I579 V585	I579-V583 WeakPolarHBondContact CG2-O 3.4Å; V583-V585 HydrophobicContact CB-CG1 4.42Å; V583-V585 HydrophobicContact CG2-CG1 4Å; V583-V585 HydrophobicContact CG2-CG2 4.44Å; V583-V585 PolarHBondContact O-N 3.03Å
584	T	94.9	Very high	94.2	Very high	76 Å²	76	56.7 Å²	56.7	47%	0.466	31%	0.307	S	S	.	.			trans	-80	101.4	176.8	54.7	0	0	0	0	110.2	I579	I579-T584 VanDerWaalsContact O-CA 3.32Å; I579-T584 WeakPolarHBondContact O-CA 3.18Å
585	V	96.2	Very high	94.3	Very high	18 Å²	18	52.6 Å²	52.6	11%	0.109	29%	0.286	C	S	.	.	B	Isolated β-bridge	trans	-131.7	147.5	-178.9	-66.2	0	0	0	0	111.9	F549 L550 A578 I579 V583	F549-V585 HydrophobicContact CB-CB 4.22Å; F549-V585 HydrophobicContact CB-CG2 4.24Å; F549-V585 HydrophobicContact CD1-CG2 3.82Å; F549-V585 HydrophobicContact CG-CG2 4.33Å; L550-V585 WeakPolarHBondContact O-CA 3.47Å; A578-V585 PolarHBondContact N-O 2.79Å; A578-V585 VanDerWaalsContact N-O 3.13Å; I579-V585 HydrophobicContact CB-CG2 3.74Å; I579-V585 HydrophobicContact CD1-CG2 3.91Å; I579-V585 HydrophobicContact CG1-CG2 4.13Å; I579-V585 HydrophobicContact CG2-CG2 4.49Å; I579-V585 PolarHBondContact N-O 3.2Å; I579-V585 PolarHBondContact O-N 2.88Å; I579-V585 VanDerWaalsContact O-N 3.12Å; V583-V585 HydrophobicContact CB-CG1 4.42Å; V583-V585 HydrophobicContact CG2-CG1 4Å; V583-V585 HydrophobicContact CG2-CG2 4.44Å; V583-V585 PolarHBondContact O-N 3.03Å
586	W	96.3	Very high	94.3	Very high	18 Å²	18	50.9 Å²	50.9	7%	0.068	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	152	173.6	-72.9	-101.9	0	0	0	109.9	F549 L550 K552 F555 P575 P577 Q590	F549-W586 CarbonylContact C-O 3.58Å; F549-W586 WeakPolarHBondContact CA-O 3.16Å; L550-W586 PolarHBondContact N-O 2.99Å; L550-W586 PolarHBondContact O-N 3.33Å; K552-W586 HydrophobicContact CB-CH2 4.34Å; K552-W586 HydrophobicContact CB-CZ3 3.87Å; K552-W586 HydrophobicContact CG-CH2 4.27Å; K552-W586 HydrophobicContact CG-CZ3 4.27Å; F555-W586 HydrophobicContact CB-CB 4.47Å; F555-W586 HydrophobicContact CB-CD2 4.5Å; F555-W586 HydrophobicContact CB-CE3 4.44Å; F555-W586 HydrophobicContact CD1-CD2 4.33Å; F555-W586 HydrophobicContact CD1-CG 4.34Å; F555-W586 HydrophobicContact CD2-CB 3.5Å; F555-W586 AromaticContact CD2-CD1 3.98Å; F555-W586 HydrophobicContact CD2-CD2 4.38Å; F555-W586 AromaticContact CD2-CG 3.67Å; F555-W586 HydrophobicContact CD2-CG 3.67Å; F555-W586 HydrophobicContact CE2-CB 3.95Å; F555-W586 AromaticContact CE2-CD1 3.73Å; F555-W586 AromaticContact CE2-CG 3.91Å; F555-W586 HydrophobicContact CE2-CG 3.91Å; F555-W586 HydrophobicContact CG-CB 4.06Å; F555-W586 HydrophobicContact CG-CD2 4.14Å; F555-W586 AromaticContact CG-CG 3.92Å; F555-W586 HydrophobicContact CG-CG 3.92Å; F555-W586 AromaticContact CZ-CD1 3.9Å; F555-W586 HydrophobicContact CZ-CG 4.38Å; P575-W586 PolarHBondContact O-NE1 3.29Å; P577-W586 HydrophobicContact CB-CD2 3.97Å; P577-W586 HydrophobicContact CB-CE3 4.27Å; P577-W586 HydrophobicContact CB-CH2 4.18Å; P577-W586 HydrophobicContact CB-CZ2 3.89Å; P577-W586 HydrophobicContact CB-CZ3 4.35Å; P577-W586 HydrophobicContact CG-CD2 4.47Å; P577-W586 HydrophobicContact CG-CH2 3.77Å; P577-W586 HydrophobicContact CG-CZ2 3.46Å; P577-W586 VanDerWaalsContact CG-CZ2 3.46Å; P577-W586 HydrophobicContact CG-CZ3 4.38Å; W586-Q590 VanDerWaalsContact CB-OE1 3.31Å; W586-Q590 VanDerWaalsContact CD1-OE1 3.22Å
587	T	96.5	Very high	94.2	Very high	31 Å²	31	45.5 Å²	45.5	19%	0.19	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	154.2	171.6	64.4	0	0	0	0	110.6	V548 F549 A578 K589 Q590	V548-T587 WeakPolarHBondContact O-CA 3.48Å; F549-T587 HydrophobicContact CD1-CG2 4.22Å; F549-T587 HydrophobicContact CE1-CG2 3.96Å; A578-T587 HydrophobicContact CB-CG2 3.74Å; T587-K589 PolarHBondContact O-N 3.48Å; T587-Q590 WeakPolarHBondContact O-CB 3.36Å; T587-Q590 PolarHBondContact O-N 2.95Å; T587-Q590 WeakPolarHBondContact OG1-CG 3.44Å; T587-Q590 PolarHBondContact OG1-N 3.22Å
588	G	95.3	Very high	93.9	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-62.8	-23.8	173.6	0	0	0	0	0	113.7	L543 V548 Q590 V591 F592	L543-G588 CarbonylContact O-C 3.51Å; L543-G588 VanDerWaalsContact O-CA 3.26Å; L543-G588 WeakPolarHBondContact O-CA 3.45Å; V548-G588 PolarHBondContact O-N 2.91Å; G588-Q590 VanDerWaalsContact C-N 3.29Å; G588-Q590 PolarHBondContact O-N 3.25Å; G588-V591 WeakPolarHBondContact O-CB 3.34Å; G588-V591 PolarHBondContact O-N 3.27Å; G588-F592 PolarHBondContact O-N 2.99Å
589	K	95.8	Very high	93.6	Very high	19 Å²	19	42.1 Å²	42.1	8%	0.083	22%	0.224	C	C	.	.	H	α-helix	trans	-62.8	-33.2	170.3	-65.4	-177.9	170.4	71.9	0	112.5	T544 T587 F592 S593 E624 L634 G637	T544-K589 WeakPolarHBondContact O-CE 3.46Å; T544-K589 PolarHBondContact O-NZ 3.24Å; T587-K589 PolarHBondContact O-N 3.48Å; K589-F592 PolarHBondContact O-N 3.07Å; K589-S593 PolarHBondContact O-N 3.49Å; K589-S593 PolarHBondContact O-OG 3.35Å; K589-E624 IonicContact NZ-OE1 3.7Å; K589-E624 PolarHBondContact NZ-OE1 3.22Å; K589-L634 HydrophobicContact CB-CD2 4Å; K589-L634 HydrophobicContact CB-CG 4.24Å; K589-L634 HydrophobicContact CD-CD2 4.47Å; K589-L634 HydrophobicContact CD-CG 4.42Å; K589-L634 HydrophobicContact CG-CD2 3.89Å; K589-L634 HydrophobicContact CG-CG 4.29Å; K589-G637 WeakPolarHBondContact CE-O 3.36Å
590	Q	95.5	Very high	93	Very high	30 Å²	30	46.8 Å²	46.8	14%	0.14	24%	0.242	C	C	.	.	H	α-helix	trans	-69	-36	174.5	-67.9	177.2	-52	0	0	112	F555 P575 K576 W586 T587 G588 S593 L594	F555-Q590 HydrophobicContact CE2-CB 4.35Å; P575-Q590 HydrophobicContact CG-CB 4.19Å; K576-Q590 PolarHBondContact O-NE2 2.63Å; W586-Q590 VanDerWaalsContact CB-OE1 3.31Å; W586-Q590 VanDerWaalsContact CD1-OE1 3.22Å; T587-Q590 WeakPolarHBondContact O-CB 3.36Å; T587-Q590 PolarHBondContact O-N 2.95Å; T587-Q590 WeakPolarHBondContact OG1-CG 3.44Å; T587-Q590 PolarHBondContact OG1-N 3.22Å; G588-Q590 VanDerWaalsContact C-N 3.29Å; G588-Q590 PolarHBondContact O-N 3.25Å; Q590-S593 WeakPolarHBondContact O-CB 3.35Å; Q590-S593 PolarHBondContact O-N 3.47Å; Q590-L594 PolarHBondContact O-N 3.31Å
591	V	94.8	Very high	92.6	Very high	1 Å²	1	47.5 Å²	47.5	1%	0.006	25%	0.251	C	S	.	.	H	α-helix	trans	-63.9	-45.9	172.1	179.1	0	0	0	0	110.5	L543 L550 F555 L558 M562 G588 S593 L594 V595 V675	L543-V591 HydrophobicContact CD2-CB 4.36Å; L543-V591 HydrophobicContact CD2-CG1 4.12Å; L550-V591 HydrophobicContact CD1-CG2 3.44Å; L550-V591 VanDerWaalsContact CD1-CG2 3.44Å; F555-V591 HydrophobicContact CD2-CG2 3.41Å; F555-V591 VanDerWaalsContact CD2-CG2 3.41Å; F555-V591 HydrophobicContact CE2-CB 4.46Å; F555-V591 HydrophobicContact CE2-CG2 3.5Å; L558-V591 HydrophobicContact CB-CG1 4.1Å; L558-V591 HydrophobicContact CD1-CG1 4.39Å; L558-V591 HydrophobicContact CD1-CG2 4.43Å; M562-V591 HydrophobicContact CE-CG1 3.8Å; G588-V591 WeakPolarHBondContact O-CB 3.34Å; G588-V591 PolarHBondContact O-N 3.27Å; V591-S593 PolarHBondContact O-N 3.03Å; V591-L594 WeakPolarHBondContact O-CB 3.47Å; V591-L594 PolarHBondContact O-N 3.28Å; V591-V595 PolarHBondContact O-N 2.84Å; V591-V675 HydrophobicContact CG1-CG1 3.97Å
592	F	94.8	Very high	92.2	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-62.4	-33.7	176.7	-167.4	-89.1	0	0	0	112.3	A540 T544 G588 K589 L594 V595 L596 L634 M639 V644 L672	A540-F592 HydrophobicContact CB-CE2 4.45Å; T544-F592 HydrophobicContact CG2-CB 3.83Å; T544-F592 HydrophobicContact CG2-CD2 4.06Å; T544-F592 HydrophobicContact CG2-CG 3.94Å; G588-F592 PolarHBondContact O-N 2.99Å; K589-F592 PolarHBondContact O-N 3.07Å; F592-L594 VanDerWaalsContact C-N 3.28Å; F592-L594 PolarHBondContact O-N 3.38Å; F592-V595 VanDerWaalsContact O-CB 3.29Å; F592-V595 WeakPolarHBondContact O-CB 3.34Å; F592-V595 PolarHBondContact O-N 3.46Å; F592-V595 VanDerWaalsContact O-N 3.09Å; F592-L596 HydrophobicContact CD1-CD1 4.21Å; F592-L596 HydrophobicContact CD1-CG 4.24Å; F592-L596 HydrophobicContact CE1-CD1 3.93Å; F592-L596 HydrophobicContact CE1-CD2 3.99Å; F592-L596 HydrophobicContact CE1-CG 3.98Å; F592-L596 HydrophobicContact CZ-CD2 4.44Å; F592-L596 PolarHBondContact O-N 3.43Å; F592-L634 HydrophobicContact CB-CD2 4.28Å; F592-L634 HydrophobicContact CD1-CB 4.5Å; F592-L634 HydrophobicContact CD1-CD2 3.9Å; F592-L634 HydrophobicContact CG-CD2 4.3Å; F592-M639 HydrophobicContact CD1-CE 4.36Å; F592-M639 HydrophobicContact CD1-CG 4.18Å; F592-M639 HydrophobicContact CD1-SD 4.46Å; F592-M639 HydrophobicContact CD2-CG 4.1Å; F592-M639 HydrophobicContact CE1-CE 3.92Å; F592-M639 HydrophobicContact CE1-CG 3.77Å; F592-M639 HydrophobicContact CE1-SD 3.64Å; F592-M639 HydrophobicContact CE2-CB 4.32Å; F592-M639 HydrophobicContact CE2-CG 3.69Å; F592-M639 HydrophobicContact CE2-SD 4.37Å; F592-M639 HydrophobicContact CG-CG 4.33Å; F592-M639 HydrophobicContact CZ-CB 4.43Å; F592-M639 HydrophobicContact CZ-CE 4.47Å; F592-M639 HydrophobicContact CZ-CG 3.52Å; F592-M639 HydrophobicContact CZ-SD 3.6Å; F592-M639 VanDerWaalsContact CZ-SD 3.6Å; F592-V644 HydrophobicContact CE2-CG1 4.42Å; F592-V644 HydrophobicContact CZ-CG1 4Å; F592-L672 HydrophobicContact CD2-CD1 4.11Å; F592-L672 HydrophobicContact CE2-CD1 3.71Å; F592-L672 HydrophobicContact CE2-CD2 4.4Å
593	S	95	Very high	91.8	Very high	11 Å²	11	35.7 Å²	35.7	8%	0.077	20%	0.195	C	C	.	.	H	α-helix	trans	-61.1	-36.5	173.8	-56.4	0	0	0	0	112.2	K589 Q590 V591 V595 L596 R597 L634	K589-S593 PolarHBondContact O-N 3.49Å; K589-S593 PolarHBondContact O-OG 3.35Å; Q590-S593 WeakPolarHBondContact O-CB 3.35Å; Q590-S593 PolarHBondContact O-N 3.47Å; V591-S593 PolarHBondContact O-N 3.03Å; S593-V595 VanDerWaalsContact C-N 3.34Å; S593-L596 PolarHBondContact O-N 2.98Å; S593-R597 PolarHBondContact O-N 3.45Å; S593-L634 PolarHBondContact OG-N 2.89Å
594	L	92.4	Very high	91.6	Very high	6 Å²	6	32.4 Å²	32.4	3%	0.031	18%	0.176	C	C	.	.	H	α-helix	trans	-68.9	-29.2	173.9	-70.4	176.1	0	0	0	113.3	F555 A559 M562 M572 Q590 V591 F592 L596 R597 P598	F555-L594 HydrophobicContact CE1-CD1 4.11Å; F555-L594 HydrophobicContact CE2-CD1 4.28Å; F555-L594 HydrophobicContact CZ-CD1 3.48Å; F555-L594 VanDerWaalsContact CZ-CD1 3.48Å; A559-L594 HydrophobicContact CB-CD1 4.38Å; M562-L594 HydrophobicContact CE-CB 3.96Å; M562-L594 HydrophobicContact SD-CB 3.97Å; M572-L594 HydrophobicContact CE-CB 4.35Å; M572-L594 HydrophobicContact CG-CD2 3.88Å; M572-L594 HydrophobicContact SD-CB 4.49Å; M572-L594 HydrophobicContact SD-CD1 3.81Å; M572-L594 HydrophobicContact SD-CD2 4.13Å; M572-L594 HydrophobicContact SD-CG 4.38Å; Q590-L594 PolarHBondContact O-N 3.31Å; V591-L594 WeakPolarHBondContact O-CB 3.47Å; V591-L594 PolarHBondContact O-N 3.28Å; F592-L594 VanDerWaalsContact C-N 3.28Å; F592-L594 PolarHBondContact O-N 3.38Å; L594-L596 VanDerWaalsContact C-N 3.31Å; L594-R597 CarbonylContact O-C 3.53Å; L594-P598 WeakPolarHBondContact O-CA 3.47Å; L594-P598 WeakPolarHBondContact O-CD 3.21Å
595	V	92.4	Very high	91.5	Very high	1 Å²	1	28.8 Å²	28.8	1%	0.006	15%	0.154	C	C	.	.	H	α-helix	trans	-61.3	-44.2	172.7	174.9	0	0	0	0	110.1	M562 V591 F592 S593 A668 R671 L672 V675	M562-V595 HydrophobicContact CE-CG2 3.73Å; M562-V595 HydrophobicContact SD-CG2 4.15Å; V591-V595 PolarHBondContact O-N 2.84Å; F592-V595 VanDerWaalsContact O-CB 3.29Å; F592-V595 WeakPolarHBondContact O-CB 3.34Å; F592-V595 PolarHBondContact O-N 3.46Å; F592-V595 VanDerWaalsContact O-N 3.09Å; S593-V595 VanDerWaalsContact C-N 3.34Å; V595-A668 WeakPolarHBondContact CG1-O 3.5Å; V595-R671 HydrophobicContact CG1-CB 3.9Å; V595-R671 WeakPolarHBondContact O-CD 3.34Å; V595-R671 PolarHBondContact O-NH1 3.29Å; V595-L672 HydrophobicContact CG1-CB 3.96Å; V595-V675 HydrophobicContact CG2-CB 4.42Å; V595-V675 HydrophobicContact CG2-CG2 4.14Å
596	L	91.8	Very high	91.3	Very high	5 Å²	5	28 Å²	28	3%	0.026	15%	0.15	C	C	.	.	H	α-helix	trans	-72	-51.3	178.3	-56.6	-177.6	0	0	0	111.7	F592 S593 L594 I629 V652 L656	F592-L596 HydrophobicContact CD1-CD1 4.21Å; F592-L596 HydrophobicContact CD1-CG 4.24Å; F592-L596 HydrophobicContact CE1-CD1 3.93Å; F592-L596 HydrophobicContact CE1-CD2 3.99Å; F592-L596 HydrophobicContact CE1-CG 3.98Å; F592-L596 HydrophobicContact CZ-CD2 4.44Å; F592-L596 PolarHBondContact O-N 3.43Å; S593-L596 PolarHBondContact O-N 2.98Å; L594-L596 VanDerWaalsContact C-N 3.31Å; L596-I629 HydrophobicContact CD1-CD1 3.96Å; L596-I629 HydrophobicContact CD1-CG2 4.12Å; L596-V652 HydrophobicContact CD1-CG1 4.31Å; L596-V652 HydrophobicContact CD2-CG1 3.45Å; L596-V652 VanDerWaalsContact CD2-CG1 3.45Å; L596-L656 HydrophobicContact CD2-CD1 4.25Å
597	R	91.1	Very high	91.1	Very high	70 Å²	70	27.4 Å²	27.4	26%	0.264	15%	0.148	S	C	.	.			trans	-133.6	86.5	-173.3	-169.6	178.5	-174.7	-174	1.4	110.9	S593 L594 A599 K600 S602 N631	S593-R597 PolarHBondContact O-N 3.45Å; L594-R597 CarbonylContact O-C 3.53Å; R597-A599 VanDerWaalsContact CG-O 3.29Å; R597-A599 WeakPolarHBondContact CG-O 3.38Å; R597-K600 PolarHBondContact NH2-O 2.88Å; R597-S602 PolarHBondContact NE-O 3.28Å; R597-N631 WeakPolarHBondContact CD-O 3.49Å; R597-N631 PolarHBondContact NH1-O 2.92Å
598	P	89.3	Confident	90.8	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	15%	0.148	C	C	.	.	S	Bend	trans	-72	-32.9	-179	26.4	-33.9	0	0	0	112.8	V569 M572 D573 L594	V569-P598 HydrophobicContact CG1-CB 3.87Å; V569-P598 HydrophobicContact CG1-CG 4.24Å; V569-P598 HydrophobicContact CG2-CB 4.23Å; V569-P598 HydrophobicContact CG2-CG 3.73Å; M572-P598 CarbonylContact C-O 3.57Å; M572-P598 VanDerWaalsContact CA-O 3.28Å; M572-P598 WeakPolarHBondContact CA-O 3.39Å; M572-P598 HydrophobicContact CE-CB 3.79Å; M572-P598 HydrophobicContact CG-CB 4.39Å; M572-P598 VanDerWaalsContact CG-O 3.3Å; M572-P598 WeakPolarHBondContact CG-O 3.47Å; D573-P598 PolarHBondContact N-O 2.71Å; L594-P598 WeakPolarHBondContact O-CA 3.47Å; L594-P598 WeakPolarHBondContact O-CD 3.21Å
599	A	86.7	Confident	90.6	Very high	11 Å²	11	28.3 Å²	28.3	9%	0.091	15%	0.152	C	C	.	.	S	Bend	trans	-129.1	157.3	176.6	0	0	0	0	0	110.7	R597 T601 S602	R597-A599 VanDerWaalsContact CG-O 3.29Å; R597-A599 WeakPolarHBondContact CG-O 3.38Å; A599-T601 PolarHBondContact O-N 2.88Å; A599-T601 VanDerWaalsContact O-N 3.16Å; A599-S602 PolarHBondContact N-OG 2.91Å; A599-S602 WeakPolarHBondContact O-CB 3.29Å; A599-S602 PolarHBondContact O-N 3.46Å; A599-S602 PolarHBondContact O-OG 2.95Å
600	K	83.8	Confident	90.4	Very high	158 Å²	158	33.7 Å²	33.7	69%	0.687	18%	0.175	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-27	174.1	-74.8	176.8	-175.9	-175.8	0	113.1	D573 R597 S602	D573-K600 WeakPolarHBondContact OD2-CG 3.38Å; D573-K600 PolarHBondContact OD2-N 3.02Å; R597-K600 PolarHBondContact NH2-O 2.88Å; K600-S602 VanDerWaalsContact C-N 3.27Å
601	T	83.7	Confident	90	Very high	135 Å²	135	32.8 Å²	32.8	83%	0.828	17%	0.174	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.6	-15.8	174.1	55.8	0	0	0	0	113.3	A599	A599-T601 PolarHBondContact O-N 2.88Å; A599-T601 VanDerWaalsContact O-N 3.16Å
602	S	85.1	Confident	89.5	Confident	23 Å²	23	39.3 Å²	39.3	16%	0.161	20%	0.202	C	C	.	.	S	Bend	trans	-77.3	156.6	177.2	-55.2	0	0	0	0	111.5	R597 A599 K600	R597-S602 PolarHBondContact NE-O 3.28Å; A599-S602 PolarHBondContact N-OG 2.91Å; A599-S602 WeakPolarHBondContact O-CB 3.29Å; A599-S602 PolarHBondContact O-N 3.46Å; A599-S602 PolarHBondContact O-OG 2.95Å; K600-S602 VanDerWaalsContact C-N 3.27Å
603	P	84.2	Confident	89	Confident	47 Å²	47	41 Å²	41	31%	0.305	21%	0.214	S	C	.	.			trans	-51	137	179.9	-30.3	37.3	0	0	0	114.4	F660 A664	P603-F660 HydrophobicContact CB-CB 4.12Å; P603-F660 HydrophobicContact CB-CD1 3.74Å; P603-F660 HydrophobicContact CB-CD2 3.68Å; P603-F660 HydrophobicContact CB-CE1 3.99Å; P603-F660 HydrophobicContact CB-CE2 3.93Å; P603-F660 HydrophobicContact CB-CG 3.57Å; P603-F660 HydrophobicContact CB-CZ 4.07Å; P603-F660 HydrophobicContact CG-CB 4.15Å; P603-F660 HydrophobicContact CG-CD1 4.29Å; P603-F660 HydrophobicContact CG-CG 4.1Å; P603-A664 HydrophobicContact CG-CB 4.12Å
604	A	88.7	Confident	88.8	Confident	20 Å²	20	43.5 Å²	43.5	17%	0.165	22%	0.222	C	C	.	.			trans	-107	88.1	-178.1	0	0	0	0	0	110.4
605	L	92.1	Very high	88.6	Confident	1 Å²	1	46.6 Å²	46.6	1%	0.005	24%	0.242	C	C	.	.			trans	-68.8	141.1	178.7	-177.6	68.9	0	0	0	111.8	I629 N631 G632 V652 M655 L656 F660	L605-I629 HydrophobicContact CD2-CD1 4.33Å; L605-I629 WeakPolarHBondContact O-CG2 3.47Å; L605-N631 PolarHBondContact O-N 2.88Å; L605-G632 PolarHBondContact O-N 3.5Å; L605-V652 HydrophobicContact CD2-CG1 3.73Å; L605-M655 HydrophobicContact CD1-CB 3.71Å; L605-L656 HydrophobicContact CB-CD2 3.95Å; L605-L656 HydrophobicContact CD1-CD2 4.43Å; L605-L656 HydrophobicContact CD2-CD2 4.37Å; L605-L656 HydrophobicContact CD2-CG 4.16Å; L605-L656 HydrophobicContact CG-CD2 4.47Å; L605-F660 HydrophobicContact CD1-CE2 4.49Å
606	N	92.4	Very high	88.5	Confident	1 Å²	1	50.9 Å²	50.9	1%	0.005	26%	0.264	C	S	.	.			trans	-122	128.7	168.4	-69.2	-58	0	0	0	108	I629 R630 N631 H912 H916 S919 S920	N606-I629 CarbonylContact C-O 3.53Å; N606-I629 WeakPolarHBondContact CA-O 3.42Å; N606-R630 VanDerWaalsContact OD1-CA 3.31Å; N606-R630 WeakPolarHBondContact OD1-CA 3.48Å; N606-N631 PolarHBondContact ND2-OD1 2.92Å; N606-N631 PolarHBondContact OD1-N 3.17Å; N606-N631 PolarHBondContact OD1-OD1 2.89Å; N606-H912 PolarHBondContact O-CE1 3.44Å; N606-H916 HydrophobicContact CB-CB 4.49Å; N606-S919 VanDerWaalsContact CG-CB 3.46Å; N606-S919 WeakPolarHBondContact ND2-CB 3.38Å; N606-S919 WeakPolarHBondContact OD1-CB 3.47Å; N606-S920 PolarHBondContact ND2-OG 3.47Å
607	L	91.5	Very high	88.4	Confident	5 Å²	5	55.9 Å²	55.9	3%	0.026	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.1	131.9	-179.2	177.5	61.8	0	0	0	111.1	T609 I629 V652 M655	L607-T609 HydrophobicContact CD1-CG2 4.38Å; L607-T609 HydrophobicContact CD2-CG2 3.98Å; L607-T609 HydrophobicContact CG-CG2 3.98Å; L607-I629 HydrophobicContact CB-CB 4.37Å; L607-I629 PolarHBondContact N-O 3.38Å; L607-I629 PolarHBondContact O-N 3.08Å; L607-V652 HydrophobicContact CD2-CG2 4.16Å; L607-M655 HydrophobicContact CD1-CG 4.13Å; L607-M655 HydrophobicContact CD2-CG 4.44Å
608	N	91.5	Very high	88.3	Confident	38 Å²	38	60.3 Å²	60.3	20%	0.203	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	121	168.6	-74.1	-9	0	0	0	109.7	V627 R630 E915	N608-V627 WeakPolarHBondContact CA-O 3.41Å; N608-R630 PolarHBondContact ND2-NH2 2.9Å; N608-R630 PolarHBondContact OD1-NH1 3.21Å; N608-E915 WeakPolarHBondContact CB-OE2 3.47Å; N608-E915 VanDerWaalsContact ND2-CD 3.27Å; N608-E915 PolarHBondContact ND2-OE1 2.8Å; N608-E915 PolarHBondContact ND2-OE2 2.89Å
609	T	91.1	Very high	88.2	Confident	12 Å²	12	64.7 Å²	64.7	7%	0.074	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.8	157.1	-176.2	-175.2	0	0	0	0	113.2	L607 V627 L643	L607-T609 HydrophobicContact CD1-CG2 4.38Å; L607-T609 HydrophobicContact CD2-CG2 3.98Å; L607-T609 HydrophobicContact CG-CG2 3.98Å; T609-V627 HydrophobicContact CG2-CB 4.19Å; T609-V627 PolarHBondContact N-O 2.88Å; T609-V627 PolarHBondContact O-N 3.36Å; T609-L643 HydrophobicContact CG2-CD2 3.25Å
610	K	90.9	Very high	88.4	Confident	132 Å²	132	72 Å²	72	57%	0.574	36%	0.359	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.6	135.5	177.7	-60.1	170.8	-174.7	171.9	0	109.2	Y614 Y626	K610-Y614 HydrophobicContact CB-CD1 4.44Å; K610-Y614 HydrophobicContact CB-CG 4.24Å; K610-Y614 HydrophobicContact CD-CD1 4Å; K610-Y614 HydrophobicContact CD-CE1 4.12Å; K610-Y614 HydrophobicContact CG-CD1 4.14Å; K610-Y614 HydrophobicContact CG-CE1 4.38Å; K610-Y614 HydrophobicContact CG-CG 4.24Å; K610-Y626 HydrophobicContact CG-CD2 3.89Å; K610-Y626 HydrophobicContact CG-CE2 3.89Å
611	G	87.1	Confident	88.7	Confident	11 Å²	11	64.9 Å²	64.9	11%	0.113	33%	0.328	C	S	.	.			trans	-84.7	179.4	165.4	0	0	0	0	0	112.2	Y614 S625 E640	G611-Y614 VanDerWaalsContact O-CB 3.3Å; G611-Y614 WeakPolarHBondContact O-CB 3.29Å; G611-Y614 PolarHBondContact O-N 3.37Å; G611-S625 VanDerWaalsContact C-OG 3.27Å; G611-S625 WeakPolarHBondContact CA-O 3.39Å; G611-S625 VanDerWaalsContact CA-OG 3.29Å; G611-S625 WeakPolarHBondContact CA-OG 3.17Å; G611-S625 PolarHBondContact N-O 3.12Å; G611-E640 VanDerWaalsContact CA-OE1 3.24Å; G611-E640 WeakPolarHBondContact CA-OE1 3.32Å
612	K	84.4	Confident	88.8	Confident	139 Å²	139	69.5 Å²	69.5	60%	0.604	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.7	-34.4	-174.6	-175.9	-175.4	177.9	-170.2	0	112.3	Y614 E640	K612-Y614 VanDerWaalsContact C-N 3.33Å; K612-E640 VanDerWaalsContact CB-OE1 3.27Å; K612-E640 WeakPolarHBondContact CB-OE1 3.19Å; K612-E640 VanDerWaalsContact N-CD 3.29Å; K612-E640 PolarHBondContact N-OE1 3.33Å; K612-E640 PolarHBondContact N-OE2 2.94Å
613	S	85.1	Confident	88.8	Confident	35 Å²	35	72.1 Å²	72.1	25%	0.245	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95	17.7	-179.8	-61.7	0	0	0	0	113.2	N623 S625	S613-N623 PolarHBondContact O-ND2 2.79Å; S613-S625 VanDerWaalsContact C-CB 3.42Å; S613-S625 PolarHBondContact N-OG 3.08Å; S613-S625 VanDerWaalsContact N-OG 3.13Å
614	Y	89.7	Confident	89.1	Confident	63 Å²	63	72.4 Å²	72.4	25%	0.247	34%	0.34	C	S	.	.			trans	-64.2	133.2	178.7	178.3	-103.1	0	0	0	111.5	K610 G611 K612 N616 R618 C621 S625 Y626	K610-Y614 HydrophobicContact CB-CD1 4.44Å; K610-Y614 HydrophobicContact CB-CG 4.24Å; K610-Y614 HydrophobicContact CD-CD1 4Å; K610-Y614 HydrophobicContact CD-CE1 4.12Å; K610-Y614 HydrophobicContact CG-CD1 4.14Å; K610-Y614 HydrophobicContact CG-CE1 4.38Å; K610-Y614 HydrophobicContact CG-CG 4.24Å; G611-Y614 VanDerWaalsContact O-CB 3.3Å; G611-Y614 WeakPolarHBondContact O-CB 3.29Å; G611-Y614 PolarHBondContact O-N 3.37Å; K612-Y614 VanDerWaalsContact C-N 3.33Å; Y614-N616 WeakPolarHBondContact OH-CA 3.25Å; Y614-R618 PolarHBondContact OH-N 3.19Å; Y614-C621 HydrophobicContact CD2-CB 4.12Å; Y614-C621 HydrophobicContact CE2-CB 4.15Å; Y614-S625 PolarHBondContact N-OG 3.24Å; Y614-Y626 HydrophobicContact CD2-CD2 4.13Å; Y614-Y626 AromaticContact CE2-CD2 3.85Å; Y614-Y626 HydrophobicContact CE2-CD2 3.85Å; Y614-Y626 HydrophobicContact CE2-CG 4.28Å
615	T	88	Confident	89.1	Confident	72 Å²	72	71.5 Å²	71.5	44%	0.442	33%	0.333	S	S	.	.			trans	-104.4	-73.4	176.9	58.6	0	0	0	0	111	C621	T615-C621 PolarHBondContact N-SG 3.05Å; T615-C621 PolarHBondContact OG1-SG 3.46Å
616	N	90.4	Very high	89.2	Confident	90 Å²	90	72.7 Å²	72.7	48%	0.481	34%	0.337	S	S	.	.	S	Bend	trans	-165.6	178.9	-173.6	57.4	-5.3	0	0	0	109.7	Y614 R618 C621	Y614-N616 WeakPolarHBondContact OH-CA 3.25Å; N616-R618 VanDerWaalsContact C-N 3.34Å; N616-R618 PolarHBondContact O-N 2.78Å; N616-C621 WeakPolarHBondContact O-CA 3.29Å; N616-C621 WeakPolarHBondContact O-CB 3.11Å
617	N	89.6	Confident	89.3	Confident	111 Å²	111	72.7 Å²	72.7	59%	0.594	34%	0.337	S	S	*	.	S	Bend	trans	62.2	28	175.7	-63.4	-6.1	0	0	0	116.3	E619 F620	N617-E619 PolarHBondContact O-N 3.07Å; N617-F620 HydrophobicContact CB-CB 4.3Å; N617-F620 PolarHBondContact O-N 2.69Å
618	R	89.4	Confident	89.4	Confident	163 Å²	163	73.4 Å²	73.4	62%	0.615	34%	0.341	S	S	*	.	G	3₁₀ helix	trans	47	-121.3	174	-61.3	-176.2	178.8	-172.5	-1.4	111.1	Y614 N616 F620 C621 Y626	Y614-R618 PolarHBondContact OH-N 3.19Å; N616-R618 VanDerWaalsContact C-N 3.34Å; N616-R618 PolarHBondContact O-N 2.78Å; R618-F620 PolarHBondContact O-N 3.08Å; R618-C621 VanDerWaalsContact O-CB 3.29Å; R618-C621 WeakPolarHBondContact O-CB 3.22Å; R618-C621 PolarHBondContact O-N 3.42Å; R618-C621 VanDerWaalsContact O-N 3.14Å; R618-Y626 VanDerWaalsContact C-CB 3.46Å; R618-Y626 VanDerWaalsContact C-CD1 3.48Å; R618-Y626 VanDerWaalsContact C-CG 3.42Å; R618-Y626 HydrophobicContact CB-CD1 4.13Å; R618-Y626 HydrophobicContact CB-CE1 4.01Å; R618-Y626 HydrophobicContact CB-CE2 4.48Å; R618-Y626 HydrophobicContact CB-CG 4.41Å; R618-Y626 WeakPolarHBondContact O-CB 3.36Å
619	E	87.9	Confident	89.5	Confident	92 Å²	92	71.6 Å²	71.6	43%	0.43	33%	0.332	S	S	.	.	G	3₁₀ helix	trans	-62.5	-21.7	-178.3	63.7	-86.9	-161.8	0	0	114.7	N617 C621 Y626 V628 A636	N617-E619 PolarHBondContact O-N 3.07Å; E619-C621 VanDerWaalsContact C-N 3.28Å; E619-C621 PolarHBondContact O-N 3.15Å; E619-Y626 HydrophobicContact CB-CD1 4.23Å; E619-V628 HydrophobicContact CB-CG2 4.41Å; E619-A636 HydrophobicContact CB-CB 4.32Å
620	F	90.6	Very high	89.6	Confident	165 Å²	165	74.2 Å²	74.2	72%	0.724	34%	0.34	S	S	*	.	G	3₁₀ helix	trans	-91.6	18.1	176.7	-60.2	-74.9	0	0	0	113.2	N617 R618 R622	N617-F620 HydrophobicContact CB-CB 4.3Å; N617-F620 PolarHBondContact O-N 2.69Å; R618-F620 PolarHBondContact O-N 3.08Å; F620-R622 PolarHBondContact O-N 3.09Å
621	C	88.8	Confident	89.5	Confident	7 Å²	7	70.6 Å²	70.6	5%	0.047	33%	0.327	C	S	.	.			trans	-57.3	131.7	175.7	176.4	0	0	0	0	111.3	Y614 T615 N616 R618 E619 N623 E624	Y614-C621 HydrophobicContact CD2-CB 4.12Å; Y614-C621 HydrophobicContact CE2-CB 4.15Å; T615-C621 PolarHBondContact N-SG 3.05Å; T615-C621 PolarHBondContact OG1-SG 3.46Å; N616-C621 WeakPolarHBondContact O-CA 3.29Å; N616-C621 WeakPolarHBondContact O-CB 3.11Å; R618-C621 VanDerWaalsContact O-CB 3.29Å; R618-C621 WeakPolarHBondContact O-CB 3.22Å; R618-C621 PolarHBondContact O-N 3.42Å; R618-C621 VanDerWaalsContact O-N 3.14Å; E619-C621 VanDerWaalsContact C-N 3.28Å; E619-C621 PolarHBondContact O-N 3.15Å; C621-N623 PolarHBondContact O-N 3.4Å; C621-N623 VanDerWaalsContact O-N 3.08Å; C621-E624 PolarHBondContact O-N 3.34Å
622	R	87.6	Confident	89.7	Confident	232 Å²	232	70.1 Å²	70.1	88%	0.875	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.1	-33.7	-179.7	-177.6	177.5	178.8	-179.4	0.2	113.6	F620	F620-R622 PolarHBondContact O-N 3.09Å
623	N	85.2	Confident	90.1	Very high	78 Å²	78	66.7 Å²	66.7	42%	0.417	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.9	6.4	-175.6	-62.9	-19.5	0	0	0	113.5	S613 C621 S625	S613-N623 PolarHBondContact O-ND2 2.79Å; C621-N623 PolarHBondContact O-N 3.4Å; C621-N623 VanDerWaalsContact O-N 3.08Å; N623-S625 PolarHBondContact O-N 2.93Å
624	E	88.5	Confident	90.6	Very high	53 Å²	53	65.4 Å²	65.4	25%	0.248	30%	0.303	C	S	.	.			trans	52.2	34.7	-172.9	-62.7	-170.7	100.2	0	0	113.4	R546 K589 C621 G637 V638	R546-E624 WeakPolarHBondContact CB-OE1 3.2Å; R546-E624 WeakPolarHBondContact CB-OE2 3.01Å; R546-E624 PolarHBondContact N-OE2 3.41Å; K589-E624 IonicContact NZ-OE1 3.7Å; K589-E624 PolarHBondContact NZ-OE1 3.22Å; C621-E624 PolarHBondContact O-N 3.34Å; E624-G637 CarbonylContact O-C 3.56Å; E624-G637 WeakPolarHBondContact O-CA 3.27Å; E624-V638 HydrophobicContact CB-CG1 4.13Å; E624-V638 PolarHBondContact O-N 3.49Å
625	S	90.4	Very high	90.8	Very high	2 Å²	2	67.4 Å²	67.4	1%	0.014	32%	0.318	C	S	.	.			trans	-102.6	29.7	-176.1	-164.3	0	0	0	0	112.2	G611 S613 Y614 N623 E640	G611-S625 VanDerWaalsContact C-OG 3.27Å; G611-S625 WeakPolarHBondContact CA-O 3.39Å; G611-S625 VanDerWaalsContact CA-OG 3.29Å; G611-S625 WeakPolarHBondContact CA-OG 3.17Å; G611-S625 PolarHBondContact N-O 3.12Å; S613-S625 VanDerWaalsContact C-CB 3.42Å; S613-S625 PolarHBondContact N-OG 3.08Å; S613-S625 VanDerWaalsContact N-OG 3.13Å; Y614-S625 PolarHBondContact N-OG 3.24Å; N623-S625 PolarHBondContact O-N 2.93Å; S625-E640 PolarHBondContact OG-OE2 2.79Å
626	Y	93.7	Very high	91.1	Very high	26 Å²	26	65 Å²	65	10%	0.102	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	118.5	168	-168.6	-98.8	0	0	0	108.2	K610 Y614 R618 E619 V628 A636 G637	K610-Y626 HydrophobicContact CG-CD2 3.89Å; K610-Y626 HydrophobicContact CG-CE2 3.89Å; Y614-Y626 HydrophobicContact CD2-CD2 4.13Å; Y614-Y626 AromaticContact CE2-CD2 3.85Å; Y614-Y626 HydrophobicContact CE2-CD2 3.85Å; Y614-Y626 HydrophobicContact CE2-CG 4.28Å; R618-Y626 VanDerWaalsContact C-CB 3.46Å; R618-Y626 VanDerWaalsContact C-CD1 3.48Å; R618-Y626 VanDerWaalsContact C-CG 3.42Å; R618-Y626 HydrophobicContact CB-CD1 4.13Å; R618-Y626 HydrophobicContact CB-CE1 4.01Å; R618-Y626 HydrophobicContact CB-CE2 4.48Å; R618-Y626 HydrophobicContact CB-CG 4.41Å; R618-Y626 WeakPolarHBondContact O-CB 3.36Å; E619-Y626 HydrophobicContact CB-CD1 4.23Å; Y626-V628 HydrophobicContact CD1-CG2 3.78Å; Y626-V628 HydrophobicContact CE1-CG2 3.72Å; Y626-A636 CarbonylContact O-C 3.51Å; Y626-G637 VanDerWaalsContact O-CA 3.3Å; Y626-G637 WeakPolarHBondContact O-CA 3.44Å; Y626-G637 PolarHBondContact O-N 3.4Å
627	V	93.7	Very high	91.2	Very high	0 Å²	0	60.8 Å²	60.8	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	128.3	-172.6	167.5	0	0	0	0	110.6	N608 T609 I629 L634 A636 M639 L643	N608-V627 WeakPolarHBondContact CA-O 3.41Å; T609-V627 HydrophobicContact CG2-CB 4.19Å; T609-V627 PolarHBondContact N-O 2.88Å; T609-V627 PolarHBondContact O-N 3.36Å; V627-I629 HydrophobicContact CG1-CD1 4.12Å; V627-I629 HydrophobicContact CG1-CG1 3.94Å; V627-L634 HydrophobicContact CG1-CD1 3.98Å; V627-A636 WeakPolarHBondContact CA-O 3.49Å; V627-M639 HydrophobicContact CG1-CE 3.68Å; V627-M639 HydrophobicContact CG2-CE 4.13Å; V627-L643 HydrophobicContact CB-CD1 4.01Å; V627-L643 HydrophobicContact CG1-CD1 4.4Å; V627-L643 HydrophobicContact CG2-CD1 3.36Å
628	V	94.3	Very high	91.4	Very high	20 Å²	20	55.8 Å²	55.8	12%	0.121	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	112	177.3	179.1	0	0	0	0	107.9	E619 Y626 R630 L635 A636	E619-V628 HydrophobicContact CB-CG2 4.41Å; Y626-V628 HydrophobicContact CD1-CG2 3.78Å; Y626-V628 HydrophobicContact CE1-CG2 3.72Å; V628-R630 HydrophobicContact CG1-CG 4.17Å; V628-L635 HydrophobicContact CB-CB 4.48Å; V628-L635 HydrophobicContact CG1-CB 4.34Å; V628-L635 HydrophobicContact CG1-CD1 4.15Å; V628-L635 PolarHBondContact O-N 3.06Å; V628-A636 HydrophobicContact CB-CB 4.26Å; V628-A636 HydrophobicContact CG2-CB 4.36Å; V628-A636 PolarHBondContact N-O 3.42Å; V628-A636 VanDerWaalsContact N-O 3.12Å; V628-A636 PolarHBondContact O-N 3.37Å
629	I	94.4	Very high	91.6	Very high	0 Å²	0	48 Å²	48	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	124.5	173.2	-59	171.2	0	0	0	107.4	L596 L605 N606 L607 V627 V633 L634 M639 V652	L596-I629 HydrophobicContact CD1-CD1 3.96Å; L596-I629 HydrophobicContact CD1-CG2 4.12Å; L605-I629 HydrophobicContact CD2-CD1 4.33Å; L605-I629 WeakPolarHBondContact O-CG2 3.47Å; N606-I629 CarbonylContact C-O 3.53Å; N606-I629 WeakPolarHBondContact CA-O 3.42Å; L607-I629 HydrophobicContact CB-CB 4.37Å; L607-I629 PolarHBondContact N-O 3.38Å; L607-I629 PolarHBondContact O-N 3.08Å; V627-I629 HydrophobicContact CG1-CD1 4.12Å; V627-I629 HydrophobicContact CG1-CG1 3.94Å; I629-V633 WeakPolarHBondContact CA-O 3.4Å; I629-L634 HydrophobicContact CG1-CD1 3.87Å; I629-M639 HydrophobicContact CD1-CE 4.33Å; I629-V652 HydrophobicContact CD1-CG1 4.4Å; I629-V652 HydrophobicContact CD1-CG2 3.82Å
630	R	91.7	Very high	91.8	Very high	67 Å²	67	43.8 Å²	43.8	25%	0.253	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	125.8	175.2	-66.4	-62.8	-168.3	-145	6.8	110	N606 N608 V628 G632 V633 L635 E915	N606-R630 VanDerWaalsContact OD1-CA 3.31Å; N606-R630 WeakPolarHBondContact OD1-CA 3.48Å; N608-R630 PolarHBondContact ND2-NH2 2.9Å; N608-R630 PolarHBondContact OD1-NH1 3.21Å; V628-R630 HydrophobicContact CG1-CG 4.17Å; R630-G632 PolarHBondContact O-N 3.1Å; R630-V633 PolarHBondContact N-O 2.7Å; R630-V633 WeakPolarHBondContact O-CB 3.39Å; R630-V633 PolarHBondContact O-N 3.23Å; R630-L635 HydrophobicContact CB-CD1 4Å; R630-L635 HydrophobicContact CG-CD1 3.89Å; R630-E915 IonicContact CZ-OE2 3.84Å; R630-E915 IonicContact NH1-OE2 2.99Å; R630-E915 PolarHBondContact NH1-OE2 3.01Å; R630-E915 IonicContact NH2-OE2 2.89Å; R630-E915 PolarHBondContact NH2-OE2 3.14Å
631	N	90	Very high	91.9	Very high	57 Å²	57	40.3 Å²	40.3	31%	0.305	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.1	37.3	179.4	-67	-32.9	0	0	0	114.1	R597 L605 N606 V633 S919	R597-N631 WeakPolarHBondContact CD-O 3.49Å; R597-N631 PolarHBondContact NH1-O 2.92Å; L605-N631 PolarHBondContact O-N 2.88Å; N606-N631 PolarHBondContact ND2-OD1 2.92Å; N606-N631 PolarHBondContact OD1-N 3.17Å; N606-N631 PolarHBondContact OD1-OD1 2.89Å; N631-V633 VanDerWaalsContact C-N 3.34Å; N631-S919 PolarHBondContact ND2-O 2.96Å; N631-S919 PolarHBondContact OD1-O 3.45Å
632	G	90.3	Very high	92	Very high	1 Å²	1	41.6 Å²	41.6	1%	0.01	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	81.4	4.6	-177.4	0	0	0	0	0	115.1	L605 R630	L605-G632 PolarHBondContact O-N 3.5Å; R630-G632 PolarHBondContact O-N 3.1Å
633	V	93.4	Very high	92.3	Very high	67 Å²	67	30.6 Å²	30.6	41%	0.406	16%	0.16	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	125.5	178.6	-175	0	0	0	0	110.3	I629 R630 N631 L635	I629-V633 WeakPolarHBondContact CA-O 3.4Å; R630-V633 PolarHBondContact N-O 2.7Å; R630-V633 WeakPolarHBondContact O-CB 3.39Å; R630-V633 PolarHBondContact O-N 3.23Å; N631-V633 VanDerWaalsContact C-N 3.34Å; V633-L635 HydrophobicContact CG1-CD2 4.01Å; V633-L635 PolarHBondContact O-N 2.9Å
634	L	95.3	Very high	92.7	Very high	7 Å²	7	26.9 Å²	26.9	4%	0.037	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	104.8	174.4	178.2	61.1	0	0	0	110.1	T544 K589 F592 S593 V627 I629 A636 M639	T544-L634 HydrophobicContact CG2-CD2 3.79Å; K589-L634 HydrophobicContact CB-CD2 4Å; K589-L634 HydrophobicContact CB-CG 4.24Å; K589-L634 HydrophobicContact CD-CD2 4.47Å; K589-L634 HydrophobicContact CD-CG 4.42Å; K589-L634 HydrophobicContact CG-CD2 3.89Å; K589-L634 HydrophobicContact CG-CG 4.29Å; F592-L634 HydrophobicContact CB-CD2 4.28Å; F592-L634 HydrophobicContact CD1-CB 4.5Å; F592-L634 HydrophobicContact CD1-CD2 3.9Å; F592-L634 HydrophobicContact CG-CD2 4.3Å; S593-L634 PolarHBondContact OG-N 2.89Å; V627-L634 HydrophobicContact CG1-CD1 3.98Å; I629-L634 HydrophobicContact CG1-CD1 3.87Å; L634-A636 WeakPolarHBondContact CD1-O 3.48Å; L634-M639 HydrophobicContact CD1-CE 3.3Å; L634-M639 HydrophobicContact CD2-CE 3.62Å; L634-M639 HydrophobicContact CD2-CG 4.46Å; L634-M639 HydrophobicContact CG-CE 4.07Å
635	L	93.7	Very high	92.8	Very high	105 Å²	105	24.6 Å²	24.6	55%	0.55	13%	0.13	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	-46.5	-177.5	-61.6	179.4	0	0	0	112	V628 R630 V633	V628-L635 HydrophobicContact CB-CB 4.48Å; V628-L635 HydrophobicContact CG1-CB 4.34Å; V628-L635 HydrophobicContact CG1-CD1 4.15Å; V628-L635 PolarHBondContact O-N 3.06Å; R630-L635 HydrophobicContact CB-CD1 4Å; R630-L635 HydrophobicContact CG-CD1 3.89Å; V633-L635 HydrophobicContact CG1-CD2 4.01Å; V633-L635 PolarHBondContact O-N 2.9Å
636	A	93.5	Very high	92.7	Very high	21 Å²	21	26 Å²	26	17%	0.174	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	153.6	-176.2	0	0	0	0	0	111.5	E619 Y626 V627 V628 L634	E619-A636 HydrophobicContact CB-CB 4.32Å; Y626-A636 CarbonylContact O-C 3.51Å; V627-A636 WeakPolarHBondContact CA-O 3.49Å; V628-A636 HydrophobicContact CB-CB 4.26Å; V628-A636 HydrophobicContact CG2-CB 4.36Å; V628-A636 PolarHBondContact N-O 3.42Å; V628-A636 VanDerWaalsContact N-O 3.12Å; V628-A636 PolarHBondContact O-N 3.37Å; L634-A636 WeakPolarHBondContact CD1-O 3.48Å
637	G	93.2	Very high	92.3	Very high	2 Å²	2	26.6 Å²	26.6	2%	0.021	16%	0.155	C	C	.	.			trans	89.1	164.8	172.9	0	0	0	0	0	116.3	K589 E624 Y626	K589-G637 WeakPolarHBondContact CE-O 3.36Å; E624-G637 CarbonylContact O-C 3.56Å; E624-G637 WeakPolarHBondContact O-CA 3.27Å; Y626-G637 VanDerWaalsContact O-CA 3.3Å; Y626-G637 WeakPolarHBondContact O-CA 3.44Å; Y626-G637 PolarHBondContact O-N 3.4Å
638	V	93.7	Very high	92	Very high	6 Å²	6	27.9 Å²	27.9	4%	0.036	16%	0.164	C	C	.	.			trans	-104	149.7	-179.7	-63.1	0	0	0	0	112.1	Y541 K545 E624 L643	Y541-V638 HydrophobicContact CD2-CB 4.12Å; Y541-V638 HydrophobicContact CD2-CG2 3.93Å; Y541-V638 HydrophobicContact CE2-CB 4.12Å; Y541-V638 HydrophobicContact CE2-CG2 3.58Å; K545-V638 HydrophobicContact CG-CG1 4.45Å; E624-V638 HydrophobicContact CB-CG1 4.13Å; E624-V638 PolarHBondContact O-N 3.49Å; V638-L643 WeakPolarHBondContact O-CD1 3.3Å
639	M	94.3	Very high	91.7	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	16%	0.163	C	C	.	.			trans	-86.2	113.4	178.9	-66.1	-65.7	140.5	0	0	110.8	A540 Y541 T544 F592 V627 I629 L634 L643 V644 V652	A540-M639 HydrophobicContact CB-CB 4.04Å; Y541-M639 WeakPolarHBondContact CA-O 3.47Å; Y541-M639 VanDerWaalsContact CB-O 3.23Å; Y541-M639 WeakPolarHBondContact CB-O 3.4Å; Y541-M639 PolarHBondContact N-O 3.07Å; T544-M639 HydrophobicContact CG2-CB 4.31Å; T544-M639 HydrophobicContact CG2-CG 3.81Å; T544-M639 PolarHBondContact OG1-N 3.43Å; F592-M639 HydrophobicContact CD1-CE 4.36Å; F592-M639 HydrophobicContact CD1-CG 4.18Å; F592-M639 HydrophobicContact CD1-SD 4.46Å; F592-M639 HydrophobicContact CD2-CG 4.1Å; F592-M639 HydrophobicContact CE1-CE 3.92Å; F592-M639 HydrophobicContact CE1-CG 3.77Å; F592-M639 HydrophobicContact CE1-SD 3.64Å; F592-M639 HydrophobicContact CE2-CB 4.32Å; F592-M639 HydrophobicContact CE2-CG 3.69Å; F592-M639 HydrophobicContact CE2-SD 4.37Å; F592-M639 HydrophobicContact CG-CG 4.33Å; F592-M639 HydrophobicContact CZ-CB 4.43Å; F592-M639 HydrophobicContact CZ-CE 4.47Å; F592-M639 HydrophobicContact CZ-CG 3.52Å; F592-M639 HydrophobicContact CZ-SD 3.6Å; F592-M639 VanDerWaalsContact CZ-SD 3.6Å; V627-M639 HydrophobicContact CG1-CE 3.68Å; V627-M639 HydrophobicContact CG2-CE 4.13Å; I629-M639 HydrophobicContact CD1-CE 4.33Å; L634-M639 HydrophobicContact CD1-CE 3.3Å; L634-M639 HydrophobicContact CD2-CE 3.62Å; L634-M639 HydrophobicContact CD2-CG 4.46Å; L634-M639 HydrophobicContact CG-CE 4.07Å; M639-L643 HydrophobicContact SD-CB 4.32Å; M639-L643 HydrophobicContact SD-CD1 4.23Å; M639-V644 HydrophobicContact CB-CG1 4.19Å; M639-V644 HydrophobicContact CG-CG1 4.43Å; M639-V644 HydrophobicContact SD-CG1 4Å; M639-V652 HydrophobicContact SD-CG2 4.21Å
640	E	92.6	Very high	91.4	Very high	4 Å²	4	31.5 Å²	31.5	2%	0.019	18%	0.181	C	C	.	.			trans	-124.1	175.1	-179.2	48.6	161.3	-111.1	0	0	110.9	G611 K612 S625 S642 L643 V644	G611-E640 VanDerWaalsContact CA-OE1 3.24Å; G611-E640 WeakPolarHBondContact CA-OE1 3.32Å; K612-E640 VanDerWaalsContact CB-OE1 3.27Å; K612-E640 WeakPolarHBondContact CB-OE1 3.19Å; K612-E640 VanDerWaalsContact N-CD 3.29Å; K612-E640 PolarHBondContact N-OE1 3.33Å; K612-E640 PolarHBondContact N-OE2 2.94Å; S625-E640 PolarHBondContact OG-OE2 2.79Å; E640-S642 PolarHBondContact O-N 2.98Å; E640-S642 VanDerWaalsContact O-N 3.13Å; E640-S642 WeakPolarHBondContact OE1-CB 3.26Å; E640-S642 PolarHBondContact OE1-OG 3.29Å; E640-L643 HydrophobicContact CG-CD1 4.01Å; E640-L643 HydrophobicContact CG-CG 4.23Å; E640-L643 PolarHBondContact O-N 3.4Å; E640-V644 WeakPolarHBondContact O-CG2 3.32Å; E640-V644 PolarHBondContact O-N 3.33Å; E640-V644 VanDerWaalsContact O-N 3.09Å
641	K	92.9	Very high	91.3	Very high	91 Å²	91	28.4 Å²	28.4	40%	0.396	17%	0.17	S	C	.	.	H	α-helix	trans	-53.2	-36.3	-176.5	177.2	170.3	173.9	177.8	0	113.8	I537 L643 G645 C772 G773	I537-K641 HydrophobicContact CD1-CB 4.09Å; I537-K641 HydrophobicContact CD1-CG 4.17Å; I537-K641 HydrophobicContact CG2-CB 4.39Å; K641-L643 PolarHBondContact O-N 2.62Å; K641-G645 CarbonylContact O-C 3.57Å; K641-G645 WeakPolarHBondContact O-CA 3.46Å; K641-G645 PolarHBondContact O-N 3.16Å; K641-C772 VanDerWaalsContact CB-O 3.32Å; K641-C772 WeakPolarHBondContact CB-O 3.49Å; K641-C772 PolarHBondContact N-O 2.83Å; K641-G773 WeakPolarHBondContact CD-O 3.48Å
642	S	90.8	Very high	91.5	Very high	34 Å²	34	25.7 Å²	25.7	24%	0.238	16%	0.155	C	C	.	.	H	α-helix	trans	-64.4	-19.9	-179.9	69	0	0	0	0	113.5	E640 S648	E640-S642 PolarHBondContact O-N 2.98Å; E640-S642 VanDerWaalsContact O-N 3.13Å; E640-S642 WeakPolarHBondContact OE1-CB 3.26Å; E640-S642 PolarHBondContact OE1-OG 3.29Å; S642-S648 WeakPolarHBondContact O-CB 3.09Å; S642-S648 PolarHBondContact O-OG 2.94Å
643	L	92.3	Very high	91.6	Very high	1 Å²	1	26.1 Å²	26.1	1%	0.005	16%	0.157	C	C	.	.	H	α-helix	trans	-106.7	-42.8	-173.7	-59	173.4	0	0	0	112.8	T609 V627 V638 M639 E640 K641 G651 V652	T609-L643 HydrophobicContact CG2-CD2 3.25Å; V627-L643 HydrophobicContact CB-CD1 4.01Å; V627-L643 HydrophobicContact CG1-CD1 4.4Å; V627-L643 HydrophobicContact CG2-CD1 3.36Å; V638-L643 WeakPolarHBondContact O-CD1 3.3Å; M639-L643 HydrophobicContact SD-CB 4.32Å; M639-L643 HydrophobicContact SD-CD1 4.23Å; E640-L643 HydrophobicContact CG-CD1 4.01Å; E640-L643 HydrophobicContact CG-CG 4.23Å; E640-L643 PolarHBondContact O-N 3.4Å; K641-L643 PolarHBondContact O-N 2.62Å; L643-G651 CarbonylContact O-C 3.55Å; L643-G651 WeakPolarHBondContact O-CA 3.49Å; L643-V652 HydrophobicContact CB-CG2 4.43Å; L643-V652 PolarHBondContact O-N 3.5Å
644	V	93.8	Very high	91.7	Very high	1 Å²	1	23 Å²	23	1%	0.006	14%	0.138	C	C	.	.	H	α-helix	trans	-110.5	-12.2	-177.5	-65.9	0	0	0	0	113.6	A532 I537 F592 M639 E640 F653 L672	A532-V644 HydrophobicContact CB-CB 4.36Å; A532-V644 HydrophobicContact CB-CG2 4.49Å; A532-V644 WeakPolarHBondContact CB-O 3.22Å; A532-V644 PolarHBondContact N-O 2.74Å; A532-V644 VanDerWaalsContact N-O 3.1Å; I537-V644 HydrophobicContact CG1-CG2 4.32Å; I537-V644 HydrophobicContact CG2-CG2 4.44Å; F592-V644 HydrophobicContact CE2-CG1 4.42Å; F592-V644 HydrophobicContact CZ-CG1 4Å; M639-V644 HydrophobicContact CB-CG1 4.19Å; M639-V644 HydrophobicContact CG-CG1 4.43Å; M639-V644 HydrophobicContact SD-CG1 4Å; E640-V644 WeakPolarHBondContact O-CG2 3.32Å; E640-V644 PolarHBondContact O-N 3.33Å; E640-V644 VanDerWaalsContact O-N 3.09Å; V644-F653 HydrophobicContact CB-CD2 4.48Å; V644-F653 HydrophobicContact CB-CE2 3.88Å; V644-F653 HydrophobicContact CG1-CE2 4.24Å; V644-F653 WeakPolarHBondContact O-CD2 3.35Å; V644-F653 VanDerWaalsContact O-CE2 3.31Å; V644-F653 WeakPolarHBondContact O-CE2 3.29Å; V644-L672 HydrophobicContact CB-CD2 4.27Å; V644-L672 HydrophobicContact CG1-CD2 4.27Å
645	G	90.9	Very high	91.5	Very high	4 Å²	4	22.8 Å²	22.8	4%	0.041	14%	0.137	C	C	.	.	S	Bend	trans	-97.5	-176.7	-178.1	0	0	0	0	0	113.9	K641	K641-G645 CarbonylContact O-C 3.57Å; K641-G645 WeakPolarHBondContact O-CA 3.46Å; K641-G645 PolarHBondContact O-N 3.16Å
646	S	89.5	Confident	91.5	Very high	31 Å²	31	17.9 Å²	17.9	22%	0.217	11%	0.111	C	C	.	.	S	Bend	trans	-79.4	152.3	-178.8	62.9	0	0	0	0	112.8	P528	P528-S646 WeakPolarHBondContact O-CA 3.42Å; P528-S646 WeakPolarHBondContact O-CB 3.33Å
647	G	84.4	Confident	91.5	Very high	40 Å²	40	18 Å²	18	41%	0.412	11%	0.108	S	C	.	.	S	Bend	trans	91.3	13.2	169	0	0	0	0	0	116.1	P528	P528-G647 PolarHBondContact O-N 2.74Å
648	S	86.8	Confident	91.4	Very high	27 Å²	27	19.8 Å²	19.8	19%	0.189	11%	0.114	C	C	.	.			trans	-133.1	129.3	175.4	172.3	0	0	0	0	110.5	P528 S642 N650	P528-S648 VanDerWaalsContact CD-O 3.3Å; P528-S648 WeakPolarHBondContact CD-O 3.49Å; P528-S648 VanDerWaalsContact CG-O 3.25Å; P528-S648 WeakPolarHBondContact CG-O 3.28Å; S642-S648 WeakPolarHBondContact O-CB 3.09Å; S642-S648 PolarHBondContact O-OG 2.94Å; S648-N650 VanDerWaalsContact C-N 3.3Å; S648-N650 PolarHBondContact OG-N 3.45Å
649	K	89.1	Confident	91.3	Very high	24 Å²	24	21.2 Å²	21.2	10%	0.104	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.5	-21.3	174.1	-58.1	-169.3	-174.8	-167.9	0	112.3	N525 E527 G651 Y654 M655 M901 E902 C903	N525-K649 WeakPolarHBondContact O-CE 3.44Å; N525-K649 PolarHBondContact O-NZ 3.2Å; E527-K649 HydrophobicContact CG-CG 4.02Å; K649-G651 PolarHBondContact O-N 3.39Å; K649-G651 VanDerWaalsContact O-N 3.15Å; K649-Y654 HydrophobicContact CB-CD1 4.34Å; K649-Y654 HydrophobicContact CB-CE1 4.04Å; K649-Y654 WeakPolarHBondContact O-CD1 3.33Å; K649-M655 VanDerWaalsContact O-CE 3.28Å; K649-M655 WeakPolarHBondContact O-CE 3.44Å; K649-M901 PolarHBondContact NZ-O 2.95Å; K649-E902 WeakPolarHBondContact CB-O 3.47Å; K649-E902 WeakPolarHBondContact CD-O 3.32Å; K649-C903 PolarHBondContact NZ-O 3.32Å
650	N	87.5	Confident	91.1	Very high	71 Å²	71	25 Å²	25	38%	0.38	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.7	17.8	178.7	-63.4	-25	0	0	0	113.3	S648	S648-N650 VanDerWaalsContact C-N 3.3Å; S648-N650 PolarHBondContact OG-N 3.45Å
651	G	89.6	Confident	91.1	Very high	2 Å²	2	25.9 Å²	25.9	2%	0.021	15%	0.149	C	C	.	.			trans	-78.9	150.3	-178.4	0	0	0	0	0	113.5	L643 K649 F653 Y654 M655	L643-G651 CarbonylContact O-C 3.55Å; L643-G651 WeakPolarHBondContact O-CA 3.49Å; K649-G651 PolarHBondContact O-N 3.39Å; K649-G651 VanDerWaalsContact O-N 3.15Å; G651-F653 PolarHBondContact O-N 3.23Å; G651-Y654 WeakPolarHBondContact O-CB 3.23Å; G651-Y654 PolarHBondContact O-N 3.46Å; G651-M655 WeakPolarHBondContact O-CG 3.26Å; G651-M655 PolarHBondContact O-N 2.95Å
652	V	93.4	Very high	91.1	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-59	-45.8	178.5	177.5	0	0	0	0	111.2	L596 L605 L607 I629 M639 L643 Y654 M655 L656	L596-V652 HydrophobicContact CD1-CG1 4.31Å; L596-V652 HydrophobicContact CD2-CG1 3.45Å; L596-V652 VanDerWaalsContact CD2-CG1 3.45Å; L605-V652 HydrophobicContact CD2-CG1 3.73Å; L607-V652 HydrophobicContact CD2-CG2 4.16Å; I629-V652 HydrophobicContact CD1-CG1 4.4Å; I629-V652 HydrophobicContact CD1-CG2 3.82Å; M639-V652 HydrophobicContact SD-CG2 4.21Å; L643-V652 HydrophobicContact CB-CG2 4.43Å; L643-V652 PolarHBondContact O-N 3.5Å; V652-Y654 VanDerWaalsContact C-N 3.35Å; V652-M655 PolarHBondContact O-N 3.14Å; V652-L656 HydrophobicContact CG1-CD1 4.34Å; V652-L656 WeakPolarHBondContact O-CG 3.43Å; V652-L656 PolarHBondContact O-N 2.84Å
653	F	94.1	Very high	91.1	Very high	10 Å²	10	25.6 Å²	25.6	4%	0.044	15%	0.149	C	C	.	.	H	α-helix	trans	-69.5	-33.3	178.8	-59.7	-49.1	0	0	0	112.8	A532 V644 G651 L656 M657 A665 A668 M669 L672	A532-F653 HydrophobicContact CB-CE2 4.21Å; V644-F653 HydrophobicContact CB-CD2 4.48Å; V644-F653 HydrophobicContact CB-CE2 3.88Å; V644-F653 HydrophobicContact CG1-CE2 4.24Å; V644-F653 WeakPolarHBondContact O-CD2 3.35Å; V644-F653 VanDerWaalsContact O-CE2 3.31Å; V644-F653 WeakPolarHBondContact O-CE2 3.29Å; G651-F653 PolarHBondContact O-N 3.23Å; F653-L656 HydrophobicContact CD1-CD1 4.37Å; F653-M657 WeakPolarHBondContact O-CB 3.22Å; F653-M657 PolarHBondContact O-N 3.48Å; F653-A665 WeakPolarHBondContact O-CB 3.35Å; F653-A668 HydrophobicContact CD1-CB 4.17Å; F653-A668 HydrophobicContact CE1-CB 3.91Å; F653-M669 HydrophobicContact CB-CG 4.16Å; F653-M669 HydrophobicContact CB-SD 4.34Å; F653-M669 HydrophobicContact CD1-CB 4.46Å; F653-M669 HydrophobicContact CD1-CG 3.43Å; F653-M669 VanDerWaalsContact CD1-CG 3.43Å; F653-M669 HydrophobicContact CD2-CG 3.5Å; F653-M669 HydrophobicContact CD2-SD 4.1Å; F653-M669 HydrophobicContact CE1-CB 4.21Å; F653-M669 HydrophobicContact CE1-CG 3.55Å; F653-M669 HydrophobicContact CE2-CG 3.6Å; F653-M669 HydrophobicContact CG-CG 3.42Å; F653-M669 VanDerWaalsContact CG-CG 3.42Å; F653-M669 HydrophobicContact CG-SD 4.13Å; F653-M669 HydrophobicContact CZ-CB 4.25Å; F653-M669 HydrophobicContact CZ-CG 3.61Å; F653-L672 HydrophobicContact CE2-CD2 3.97Å; F653-L672 HydrophobicContact CZ-CB 4.16Å; F653-L672 HydrophobicContact CZ-CD2 3.56Å; F653-L672 HydrophobicContact CZ-CG 4.5Å
654	Y	94.2	Very high	91	Very high	3 Å²	3	26.2 Å²	26.2	1%	0.012	15%	0.154	C	C	.	.	H	α-helix	trans	-65.1	-47.4	175	-174.8	-93.9	0	0	0	111.1	V521 G526 P528 K649 G651 V652 L656 M657 R658 M901	V521-Y654 HydrophobicContact CG1-CD2 4.22Å; V521-Y654 HydrophobicContact CG1-CE2 3.97Å; G526-Y654 WeakPolarHBondContact O-CE2 3.42Å; P528-Y654 HydrophobicContact CB-CD2 4.39Å; P528-Y654 HydrophobicContact CG-CD2 4.19Å; K649-Y654 HydrophobicContact CB-CD1 4.34Å; K649-Y654 HydrophobicContact CB-CE1 4.04Å; K649-Y654 WeakPolarHBondContact O-CD1 3.33Å; G651-Y654 WeakPolarHBondContact O-CB 3.23Å; G651-Y654 PolarHBondContact O-N 3.46Å; V652-Y654 VanDerWaalsContact C-N 3.35Å; Y654-L656 PolarHBondContact O-N 3.48Å; Y654-M657 HydrophobicContact CD2-CE 3.82Å; Y654-M657 HydrophobicContact CE2-CE 3.85Å; Y654-M657 WeakPolarHBondContact O-CB 3.16Å; Y654-M657 PolarHBondContact O-N 3.36Å; Y654-M657 VanDerWaalsContact O-N 3.17Å; Y654-R658 HydrophobicContact CD1-CG 3.98Å; Y654-R658 HydrophobicContact CE1-CG 3.65Å; Y654-R658 VanDerWaalsContact CZ-NE 3.3Å; Y654-R658 WeakPolarHBondContact O-CG 3.49Å; Y654-R658 PolarHBondContact O-N 3.4Å; Y654-R658 PolarHBondContact OH-NE 3.12Å; Y654-R658 VanDerWaalsContact OH-NE 3.09Å; Y654-R658 PolarHBondContact OH-NH2 2.9Å; Y654-M901 PolarHBondContact OH-O 3.21Å
655	M	92.6	Very high	91	Very high	1 Å²	1	26.2 Å²	26.2	1%	0.005	16%	0.155	C	C	.	.	H	α-helix	trans	-65.9	-38.4	178.4	-64.8	-58.2	172.3	0	0	112.2	L605 L607 K649 G651 V652 M657 R658 D659	L605-M655 HydrophobicContact CD1-CB 3.71Å; L607-M655 HydrophobicContact CD1-CG 4.13Å; L607-M655 HydrophobicContact CD2-CG 4.44Å; K649-M655 VanDerWaalsContact O-CE 3.28Å; K649-M655 WeakPolarHBondContact O-CE 3.44Å; G651-M655 WeakPolarHBondContact O-CG 3.26Å; G651-M655 PolarHBondContact O-N 2.95Å; V652-M655 PolarHBondContact O-N 3.14Å; M655-M657 VanDerWaalsContact C-N 3.31Å; M655-M657 PolarHBondContact O-N 3.16Å; M655-R658 PolarHBondContact O-N 2.79Å; M655-D659 WeakPolarHBondContact O-CB 3.45Å; M655-D659 PolarHBondContact O-N 3.15Å
656	L	92.7	Very high	91.1	Very high	3 Å²	3	26 Å²	26	2%	0.016	15%	0.153	C	C	.	.	H	α-helix	trans	-58.7	-43.4	171.7	-77.3	171.9	0	0	0	112.2	L596 L605 V652 F653 Y654 F660 G661 A665 A668	L596-L656 HydrophobicContact CD2-CD1 4.25Å; L605-L656 HydrophobicContact CB-CD2 3.95Å; L605-L656 HydrophobicContact CD1-CD2 4.43Å; L605-L656 HydrophobicContact CD2-CD2 4.37Å; L605-L656 HydrophobicContact CD2-CG 4.16Å; L605-L656 HydrophobicContact CG-CD2 4.47Å; V652-L656 HydrophobicContact CG1-CD1 4.34Å; V652-L656 WeakPolarHBondContact O-CG 3.43Å; V652-L656 PolarHBondContact O-N 2.84Å; F653-L656 HydrophobicContact CD1-CD1 4.37Å; Y654-L656 PolarHBondContact O-N 3.48Å; L656-F660 HydrophobicContact CD2-CD2 3.95Å; L656-F660 HydrophobicContact CD2-CE2 4.28Å; L656-F660 WeakPolarHBondContact O-CB 3.47Å; L656-F660 PolarHBondContact O-N 3.1Å; L656-G661 PolarHBondContact O-N 3.05Å; L656-A665 HydrophobicContact CB-CB 4.24Å; L656-A668 HydrophobicContact CD1-CB 3.66Å
657	M	93.4	Very high	91.1	Very high	22 Å²	22	26.6 Å²	26.6	11%	0.108	15%	0.152	C	C	.	.	H	α-helix	trans	-63.3	-43.5	177.8	179.8	-169.6	71	0	0	111.5	L520 V521 F653 Y654 M655 G661 P662 A665	L520-M657 HydrophobicContact CB-SD 3.94Å; L520-M657 HydrophobicContact CD1-CG 4.31Å; L520-M657 HydrophobicContact CD1-SD 3.96Å; L520-M657 HydrophobicContact CG-SD 4.49Å; V521-M657 HydrophobicContact CG1-CE 3.35Å; V521-M657 HydrophobicContact CG1-SD 3.93Å; F653-M657 WeakPolarHBondContact O-CB 3.22Å; F653-M657 PolarHBondContact O-N 3.48Å; Y654-M657 HydrophobicContact CD2-CE 3.82Å; Y654-M657 HydrophobicContact CE2-CE 3.85Å; Y654-M657 WeakPolarHBondContact O-CB 3.16Å; Y654-M657 PolarHBondContact O-N 3.36Å; Y654-M657 VanDerWaalsContact O-N 3.17Å; M655-M657 VanDerWaalsContact C-N 3.31Å; M655-M657 PolarHBondContact O-N 3.16Å; M657-G661 WeakPolarHBondContact CA-O 3.33Å; M657-G661 CarbonylContact O-C 3.54Å; M657-G661 WeakPolarHBondContact O-CA 3.37Å; M657-G661 PolarHBondContact O-N 3.42Å; M657-P662 HydrophobicContact CG-CB 4.41Å; M657-A665 HydrophobicContact CB-CB 3.84Å
658	R	91.5	Very high	91.5	Very high	40 Å²	40	24.7 Å²	24.7	15%	0.151	13%	0.132	C	C	.	.	H	α-helix	trans	-71.3	-42.5	-178	-70.3	-64.9	179.4	-152.3	-3.6	113.5	Y654 M655 T899 E902	Y654-R658 HydrophobicContact CD1-CG 3.98Å; Y654-R658 HydrophobicContact CE1-CG 3.65Å; Y654-R658 VanDerWaalsContact CZ-NE 3.3Å; Y654-R658 WeakPolarHBondContact O-CG 3.49Å; Y654-R658 PolarHBondContact O-N 3.4Å; Y654-R658 PolarHBondContact OH-NE 3.12Å; Y654-R658 VanDerWaalsContact OH-NE 3.09Å; Y654-R658 PolarHBondContact OH-NH2 2.9Å; M655-R658 PolarHBondContact O-N 2.79Å; R658-T899 PolarHBondContact NH2-O 2.9Å; R658-E902 HydrophobicContact CG-CG 4.46Å
659	D	90.4	Very high	91.8	Very high	37 Å²	37	23.6 Å²	23.6	20%	0.198	12%	0.124	C	C	.	.	H	α-helix	trans	-84.5	-35	-173.2	-64.7	-18.2	0	0	0	111.8	M655 H912 H916 K1025	M655-D659 WeakPolarHBondContact O-CB 3.45Å; M655-D659 PolarHBondContact O-N 3.15Å; D659-H912 IonicContact OD1-NE2 3.25Å; D659-H912 IonicContact OD2-CD2 2.62Å; D659-H912 IonicContact OD2-CE1 3.41Å; D659-H912 IonicContact OD2-NE2 3.5Å; D659-H912 PolarHBondContact OD2-NE2 3.07Å; D659-H916 IonicContact OD2-ND1 2.77Å; D659-K1025 WeakPolarHBondContact OD1-CE 3.28Å; D659-K1025 IonicContact OD1-NZ 2.65Å; D659-K1025 PolarHBondContact OD1-NZ 3.27Å
660	F	91.1	Very high	92	Very high	79 Å²	79	22.7 Å²	22.7	35%	0.346	12%	0.12	S	C	.	.	H	α-helix	trans	-124.4	-2.6	-171.8	-53.5	-75.8	0	0	0	114.7	P603 L605 L656 A664 H916	P603-F660 HydrophobicContact CB-CB 4.12Å; P603-F660 HydrophobicContact CB-CD1 3.74Å; P603-F660 HydrophobicContact CB-CD2 3.68Å; P603-F660 HydrophobicContact CB-CE1 3.99Å; P603-F660 HydrophobicContact CB-CE2 3.93Å; P603-F660 HydrophobicContact CB-CG 3.57Å; P603-F660 HydrophobicContact CB-CZ 4.07Å; P603-F660 HydrophobicContact CG-CB 4.15Å; P603-F660 HydrophobicContact CG-CD1 4.29Å; P603-F660 HydrophobicContact CG-CG 4.1Å; L605-F660 HydrophobicContact CD1-CE2 4.49Å; L656-F660 HydrophobicContact CD2-CD2 3.95Å; L656-F660 HydrophobicContact CD2-CE2 4.28Å; L656-F660 WeakPolarHBondContact O-CB 3.47Å; L656-F660 PolarHBondContact O-N 3.1Å; F660-A664 HydrophobicContact CB-CB 3.93Å; F660-H916 AromaticContact CZ-CE1 3.92Å
661	G	91.7	Very high	92.2	Very high	23 Å²	23	19.8 Å²	19.8	24%	0.237	10%	0.104	C	C	.	.			trans	94.7	166.3	179.6	0	0	0	0	0	114.4	L656 M657 Q663 A664	L656-G661 PolarHBondContact O-N 3.05Å; M657-G661 WeakPolarHBondContact CA-O 3.33Å; M657-G661 CarbonylContact O-C 3.54Å; M657-G661 WeakPolarHBondContact O-CA 3.37Å; M657-G661 PolarHBondContact O-N 3.42Å; G661-Q663 VanDerWaalsContact C-N 3.31Å; G661-Q663 PolarHBondContact O-N 3.29Å; G661-A664 PolarHBondContact O-N 3.38Å
662	P	92.6	Very high	92.4	Very high	45 Å²	45	19.8 Å²	19.8	29%	0.292	10%	0.103	S	C	.	.	H	α-helix	trans	-63.6	-32.5	-171.3	21.7	-32.1	0	0	0	114.3	R517 L520 M657 A664 A665 V666	R517-P662 WeakPolarHBondContact O-CB 3.3Å; L520-P662 HydrophobicContact CD1-CB 4.11Å; M657-P662 HydrophobicContact CG-CB 4.41Å; P662-A664 VanDerWaalsContact C-N 3.31Å; P662-A664 PolarHBondContact O-N 2.91Å; P662-A665 PolarHBondContact O-N 3.36Å; P662-V666 WeakPolarHBondContact O-CG2 3.33Å; P662-V666 PolarHBondContact O-N 2.88Å
663	Q	91.1	Very high	92.4	Very high	73 Å²	73	19.8 Å²	19.8	34%	0.341	10%	0.104	S	C	.	.	H	α-helix	trans	-60.4	-41.9	-179.6	-176	63.1	25.8	0	0	111.6	G661 A665 V666 E667	G661-Q663 VanDerWaalsContact C-N 3.31Å; G661-Q663 PolarHBondContact O-N 3.29Å; Q663-A665 VanDerWaalsContact C-N 3.33Å; Q663-A665 PolarHBondContact O-N 3.2Å; Q663-V666 PolarHBondContact O-N 2.54Å; Q663-E667 WeakPolarHBondContact CG-OE1 3.27Å; Q663-E667 PolarHBondContact NE2-OE1 2.87Å; Q663-E667 WeakPolarHBondContact O-CG 3.49Å; Q663-E667 PolarHBondContact O-N 2.78Å
664	A	90.9	Very high	92.3	Very high	15 Å²	15	21.7 Å²	21.7	12%	0.124	11%	0.11	C	C	.	.	H	α-helix	trans	-63.1	-40.6	178.8	0	0	0	0	0	111.9	P603 F660 G661 P662 A668	P603-A664 HydrophobicContact CG-CB 4.12Å; F660-A664 HydrophobicContact CB-CB 3.93Å; G661-A664 PolarHBondContact O-N 3.38Å; P662-A664 VanDerWaalsContact C-N 3.31Å; P662-A664 PolarHBondContact O-N 2.91Å; A664-A668 WeakPolarHBondContact O-CB 3.4Å; A664-A668 PolarHBondContact O-N 2.63Å; A664-A668 VanDerWaalsContact O-N 3.12Å
665	A	93.6	Very high	92.3	Very high	1 Å²	1	21.5 Å²	21.5	1%	0.008	11%	0.11	C	C	.	.	H	α-helix	trans	-66.6	-45.1	177.7	0	0	0	0	0	112.1	L520 F653 L656 M657 P662 Q663 E667 A668 M669	L520-A665 HydrophobicContact CD1-CB 4.24Å; F653-A665 WeakPolarHBondContact O-CB 3.35Å; L656-A665 HydrophobicContact CB-CB 4.24Å; M657-A665 HydrophobicContact CB-CB 3.84Å; P662-A665 PolarHBondContact O-N 3.36Å; Q663-A665 VanDerWaalsContact C-N 3.33Å; Q663-A665 PolarHBondContact O-N 3.2Å; A665-E667 PolarHBondContact O-N 3.29Å; A665-A668 PolarHBondContact O-N 3.02Å; A665-M669 HydrophobicContact CB-CE 4.26Å; A665-M669 WeakPolarHBondContact O-CB 3.48Å; A665-M669 WeakPolarHBondContact O-CG 3.36Å; A665-M669 PolarHBondContact O-N 2.76Å
666	V	92.5	Very high	92.3	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-61.1	-45.7	178.7	167.8	0	0	0	0	111.8	I368 F369 R517 L520 P662 Q663 M669 W670	I368-V666 HydrophobicContact CB-CG1 4.28Å; I368-V666 HydrophobicContact CD1-CG1 4.31Å; F369-V666 HydrophobicContact CD1-CG1 3.69Å; F369-V666 HydrophobicContact CE1-CG1 3.73Å; R517-V666 HydrophobicContact CG-CG2 4.4Å; L520-V666 HydrophobicContact CD1-CG2 4.05Å; L520-V666 HydrophobicContact CD2-CG2 4.01Å; P662-V666 WeakPolarHBondContact O-CG2 3.33Å; P662-V666 PolarHBondContact O-N 2.88Å; Q663-V666 PolarHBondContact O-N 2.54Å; V666-M669 HydrophobicContact CG2-CE 4.29Å; V666-M669 PolarHBondContact O-N 3.03Å; V666-W670 WeakPolarHBondContact O-CB 3.4Å; V666-W670 PolarHBondContact O-N 2.86Å
667	E	90.4	Very high	92.4	Very high	42 Å²	42	23.3 Å²	23.3	20%	0.196	12%	0.123	C	C	.	.	H	α-helix	trans	-64.2	-42.3	178.6	-72.7	176	-167.7	0	0	112	Q663 A665 W670 R671	Q663-E667 WeakPolarHBondContact CG-OE1 3.27Å; Q663-E667 PolarHBondContact NE2-OE1 2.87Å; Q663-E667 WeakPolarHBondContact O-CG 3.49Å; Q663-E667 PolarHBondContact O-N 2.78Å; A665-E667 PolarHBondContact O-N 3.29Å; E667-W670 PolarHBondContact O-N 3.05Å; E667-R671 VanDerWaalsContact O-CG 3.27Å; E667-R671 WeakPolarHBondContact O-CG 3.26Å; E667-R671 PolarHBondContact O-N 3.25Å; E667-R671 IonicContact OE2-CZ 3.65Å; E667-R671 IonicContact OE2-NH2 3.39Å; E667-R671 PolarHBondContact OE2-NH2 3.33Å
668	A	91.8	Very high	92.3	Very high	1 Å²	1	24.3 Å²	24.3	1%	0.008	13%	0.128	C	C	.	.	H	α-helix	trans	-64.3	-42	176.7	0	0	0	0	0	111.6	V595 F653 L656 A664 A665 R671 L672	V595-A668 WeakPolarHBondContact CG1-O 3.5Å; F653-A668 HydrophobicContact CD1-CB 4.17Å; F653-A668 HydrophobicContact CE1-CB 3.91Å; L656-A668 HydrophobicContact CD1-CB 3.66Å; A664-A668 WeakPolarHBondContact O-CB 3.4Å; A664-A668 PolarHBondContact O-N 2.63Å; A664-A668 VanDerWaalsContact O-N 3.12Å; A665-A668 PolarHBondContact O-N 3.02Å; A668-R671 PolarHBondContact O-N 3.35Å; A668-L672 PolarHBondContact O-N 2.93Å
669	M	93.7	Very high	92.5	Very high	4 Å²	4	23.1 Å²	23.1	2%	0.02	12%	0.124	C	C	.	.	H	α-helix	trans	-61.5	-44	175.1	-78.1	-172.1	-81.3	0	0	111.8	I368 L520 F653 A665 V666 L672 A673	I368-M669 HydrophobicContact CD1-CB 3.27Å; I368-M669 HydrophobicContact CD1-CE 4.22Å; I368-M669 HydrophobicContact CD1-CG 4.29Å; I368-M669 HydrophobicContact CD1-SD 4.2Å; L520-M669 HydrophobicContact CD1-CE 4.17Å; L520-M669 HydrophobicContact CD2-CE 4.07Å; F653-M669 HydrophobicContact CB-CG 4.16Å; F653-M669 HydrophobicContact CB-SD 4.34Å; F653-M669 HydrophobicContact CD1-CB 4.46Å; F653-M669 HydrophobicContact CD1-CG 3.43Å; F653-M669 VanDerWaalsContact CD1-CG 3.43Å; F653-M669 HydrophobicContact CD2-CG 3.5Å; F653-M669 HydrophobicContact CD2-SD 4.1Å; F653-M669 HydrophobicContact CE1-CB 4.21Å; F653-M669 HydrophobicContact CE1-CG 3.55Å; F653-M669 HydrophobicContact CE2-CG 3.6Å; F653-M669 HydrophobicContact CG-CG 3.42Å; F653-M669 VanDerWaalsContact CG-CG 3.42Å; F653-M669 HydrophobicContact CG-SD 4.13Å; F653-M669 HydrophobicContact CZ-CB 4.25Å; F653-M669 HydrophobicContact CZ-CG 3.61Å; A665-M669 HydrophobicContact CB-CE 4.26Å; A665-M669 WeakPolarHBondContact O-CB 3.48Å; A665-M669 WeakPolarHBondContact O-CG 3.36Å; A665-M669 PolarHBondContact O-N 2.76Å; V666-M669 HydrophobicContact CG2-CE 4.29Å; V666-M669 PolarHBondContact O-N 3.03Å; M669-L672 WeakPolarHBondContact O-CB 3.33Å; M669-L672 PolarHBondContact O-N 3.06Å; M669-A673 PolarHBondContact O-N 3.33Å
670	W	92.6	Very high	92.7	Very high	5 Å²	5	22.7 Å²	22.7	2%	0.019	12%	0.122	C	C	.	.	H	α-helix	trans	-65.8	-42.1	178.4	-178.4	85.3	0	0	0	112.4	N365 L366 S564 N567 V666 E667 L672 A673 R674	N365-W670 PolarHBondContact O-NE1 2.72Å; L366-W670 PolarHBondContact O-NE1 3.45Å; S564-W670 VanDerWaalsContact CB-CH2 3.47Å; N567-W670 WeakPolarHBondContact ND2-CZ3 3.08Å; V666-W670 WeakPolarHBondContact O-CB 3.4Å; V666-W670 PolarHBondContact O-N 2.86Å; E667-W670 PolarHBondContact O-N 3.05Å; W670-L672 VanDerWaalsContact C-N 3.28Å; W670-L672 PolarHBondContact O-N 3.37Å; W670-A673 PolarHBondContact O-N 3.46Å; W670-R674 HydrophobicContact CZ2-CG 4.45Å; W670-R674 PolarHBondContact O-N 3.19Å; W670-R674 VanDerWaalsContact O-N 3.16Å
671	R	91.9	Very high	92.8	Very high	9 Å²	9	25.8 Å²	25.8	3%	0.034	14%	0.139	C	C	.	.	H	α-helix	trans	-59.7	-42	173.5	-71.7	172	-158.4	138.6	9.6	110.5	M562 V595 E667 A668 R674 V675	M562-R671 HydrophobicContact CB-CG 4.47Å; V595-R671 HydrophobicContact CG1-CB 3.9Å; V595-R671 WeakPolarHBondContact O-CD 3.34Å; V595-R671 PolarHBondContact O-NH1 3.29Å; E667-R671 VanDerWaalsContact O-CG 3.27Å; E667-R671 WeakPolarHBondContact O-CG 3.26Å; E667-R671 PolarHBondContact O-N 3.25Å; E667-R671 IonicContact OE2-CZ 3.65Å; E667-R671 IonicContact OE2-NH2 3.39Å; E667-R671 PolarHBondContact OE2-NH2 3.33Å; A668-R671 PolarHBondContact O-N 3.35Å; R671-R674 PolarHBondContact O-N 2.86Å; R671-V675 WeakPolarHBondContact O-CB 3.35Å; R671-V675 WeakPolarHBondContact O-CG2 3.45Å; R671-V675 PolarHBondContact O-N 2.94Å
672	L	94.2	Very high	92.8	Very high	2 Å²	2	28.5 Å²	28.5	1%	0.01	15%	0.146	C	C	.	.	H	α-helix	trans	-61.9	-46.3	176.5	-177.1	61.1	0	0	0	111.6	A532 A540 F592 V595 V644 F653 A668 M669 W670 R674 V675 S676	A532-L672 HydrophobicContact CB-CD2 4.02Å; A540-L672 HydrophobicContact CB-CD1 4.05Å; A540-L672 HydrophobicContact CB-CD2 4.41Å; F592-L672 HydrophobicContact CD2-CD1 4.11Å; F592-L672 HydrophobicContact CE2-CD1 3.71Å; F592-L672 HydrophobicContact CE2-CD2 4.4Å; V595-L672 HydrophobicContact CG1-CB 3.96Å; V644-L672 HydrophobicContact CB-CD2 4.27Å; V644-L672 HydrophobicContact CG1-CD2 4.27Å; F653-L672 HydrophobicContact CE2-CD2 3.97Å; F653-L672 HydrophobicContact CZ-CB 4.16Å; F653-L672 HydrophobicContact CZ-CD2 3.56Å; F653-L672 HydrophobicContact CZ-CG 4.5Å; A668-L672 PolarHBondContact O-N 2.93Å; M669-L672 WeakPolarHBondContact O-CB 3.33Å; M669-L672 PolarHBondContact O-N 3.06Å; W670-L672 VanDerWaalsContact C-N 3.28Å; W670-L672 PolarHBondContact O-N 3.37Å; L672-R674 VanDerWaalsContact C-N 3.34Å; L672-R674 PolarHBondContact O-N 2.91Å; L672-V675 PolarHBondContact O-N 3.3Å; L672-S676 VanDerWaalsContact O-CB 3.24Å; L672-S676 WeakPolarHBondContact O-CB 3.17Å; L672-S676 PolarHBondContact O-N 2.97Å; L672-S676 PolarHBondContact O-OG 3.26Å
673	A	93.5	Very high	92.8	Very high	1 Å²	1	31 Å²	31	1%	0.008	15%	0.149	C	C	.	.	H	α-helix	trans	-54.5	-50.8	179.1	0	0	0	0	0	110.8	F536 M669 W670 V675 S676 S677	F536-A673 HydrophobicContact CD1-CB 4.35Å; F536-A673 HydrophobicContact CD2-CB 4.21Å; F536-A673 HydrophobicContact CE1-CB 4Å; F536-A673 HydrophobicContact CE2-CB 3.83Å; F536-A673 HydrophobicContact CG-CB 4.47Å; F536-A673 HydrophobicContact CZ-CB 3.73Å; M669-A673 PolarHBondContact O-N 3.33Å; W670-A673 PolarHBondContact O-N 3.46Å; A673-V675 PolarHBondContact O-N 3.35Å; A673-S676 PolarHBondContact O-OG 3.46Å; A673-S676 VanDerWaalsContact O-OG 3.06Å; A673-S677 WeakPolarHBondContact O-CB 3.35Å; A673-S677 PolarHBondContact O-N 2.87Å; A673-S677 PolarHBondContact O-OG 2.94Å; A673-S677 VanDerWaalsContact O-OG 3.05Å
674	R	92	Very high	92.9	Very high	49 Å²	49	29.8 Å²	29.8	19%	0.185	16%	0.157	C	C	.	.	H	α-helix	trans	-64.4	-44.9	179.6	-66.3	-172.3	71.6	-156.6	1.1	113.3	C561 F563 W670 R671 L672 N678	C561-R674 PolarHBondContact O-NE 3.37Å; C561-R674 PolarHBondContact O-NH1 3.02Å; F563-R674 PolarHBondContact O-NH1 3.34Å; W670-R674 HydrophobicContact CZ2-CG 4.45Å; W670-R674 PolarHBondContact O-N 3.19Å; W670-R674 VanDerWaalsContact O-N 3.16Å; R671-R674 PolarHBondContact O-N 2.86Å; L672-R674 VanDerWaalsContact C-N 3.34Å; L672-R674 PolarHBondContact O-N 2.91Å; R674-N678 PolarHBondContact O-N 3.5Å; R674-N678 VanDerWaalsContact O-N 3.15Å; R674-N678 PolarHBondContact O-ND2 3.48Å
675	V	93.8	Very high	93.1	Very high	0 Å²	0	32 Å²	32	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-67.1	-45.2	-177.9	171.4	0	0	0	0	110.8	L543 C561 M562 V591 V595 R671 L672 A673 N678 F679	L543-V675 HydrophobicContact CD2-CG1 4.04Å; C561-V675 HydrophobicContact CB-CG2 4.47Å; M562-V675 HydrophobicContact CE-CG1 4.47Å; M562-V675 HydrophobicContact CE-CG2 3.52Å; M562-V675 HydrophobicContact CG-CG2 3.49Å; M562-V675 VanDerWaalsContact CG-CG2 3.49Å; M562-V675 HydrophobicContact SD-CG2 4.19Å; V591-V675 HydrophobicContact CG1-CG1 3.97Å; V595-V675 HydrophobicContact CG2-CB 4.42Å; V595-V675 HydrophobicContact CG2-CG2 4.14Å; R671-V675 WeakPolarHBondContact O-CB 3.35Å; R671-V675 WeakPolarHBondContact O-CG2 3.45Å; R671-V675 PolarHBondContact O-N 2.94Å; L672-V675 PolarHBondContact O-N 3.3Å; A673-V675 PolarHBondContact O-N 3.35Å; V675-N678 PolarHBondContact O-N 2.85Å; V675-F679 WeakPolarHBondContact O-CB 3.39Å; V675-F679 PolarHBondContact O-N 2.83Å
676	S	94.2	Very high	93.2	Very high	1 Å²	1	36.6 Å²	36.6	1%	0.007	20%	0.196	C	C	.	.	H	α-helix	trans	-65.2	-44	-179.7	59.1	0	0	0	0	111.9	F536 L672 A673 F679 L680	F536-S676 WeakPolarHBondContact CA-OG 3.36Å; F536-S676 WeakPolarHBondContact CD1-OG 3.37Å; L672-S676 VanDerWaalsContact O-CB 3.24Å; L672-S676 WeakPolarHBondContact O-CB 3.17Å; L672-S676 PolarHBondContact O-N 2.97Å; L672-S676 PolarHBondContact O-OG 3.26Å; A673-S676 PolarHBondContact O-OG 3.46Å; A673-S676 VanDerWaalsContact O-OG 3.06Å; S676-F679 PolarHBondContact O-N 3.39Å; S676-L680 WeakPolarHBondContact O-CB 3.48Å; S676-L680 PolarHBondContact O-N 3.45Å
677	S	93.2	Very high	93.3	Very high	40 Å²	40	40.9 Å²	40.9	28%	0.28	22%	0.218	S	C	.	.	H	α-helix	trans	-60.4	-47.8	175.8	-64.1	0	0	0	0	112.6	F536 A673 L680 M681	F536-S677 WeakPolarHBondContact CE1-OG 3.48Å; A673-S677 WeakPolarHBondContact O-CB 3.35Å; A673-S677 PolarHBondContact O-N 2.87Å; A673-S677 PolarHBondContact O-OG 2.94Å; A673-S677 VanDerWaalsContact O-OG 3.05Å; S677-L680 PolarHBondContact O-N 2.96Å; S677-M681 WeakPolarHBondContact O-CB 3.44Å; S677-M681 PolarHBondContact O-N 3.27Å
678	N	92.9	Very high	93.5	Very high	43 Å²	43	40.7 Å²	40.7	23%	0.23	23%	0.227	C	C	.	.	H	α-helix	trans	-67.2	-41.3	179.9	-77.2	-83.4	0	0	0	111.6	C561 R674 V675 L680 M681 E682	C561-N678 VanDerWaalsContact SG-CG 3.58Å; R674-N678 PolarHBondContact O-N 3.5Å; R674-N678 VanDerWaalsContact O-N 3.15Å; R674-N678 PolarHBondContact O-ND2 3.48Å; V675-N678 PolarHBondContact O-N 2.85Å; N678-L680 PolarHBondContact O-N 3.43Å; N678-M681 PolarHBondContact O-N 2.99Å; N678-E682 PolarHBondContact O-N 3.31Å; N678-E682 VanDerWaalsContact O-N 3.15Å
679	F	95.1	Very high	93.6	Very high	15 Å²	15	46.5 Å²	46.5	7%	0.066	26%	0.257	C	S	.	.	H	α-helix	trans	-60.4	-44.5	175.7	174.8	-108	0	0	0	112.2	L542 L543 L558 V675 S676 M681 E682 R683	L542-F679 HydrophobicContact CB-CE1 3.93Å; L543-F679 HydrophobicContact CB-CD1 4.04Å; L543-F679 HydrophobicContact CB-CE1 3.84Å; L543-F679 HydrophobicContact CB-CZ 4.17Å; L543-F679 HydrophobicContact CD1-CD2 3.93Å; L543-F679 HydrophobicContact CD1-CE1 4.47Å; L543-F679 HydrophobicContact CD1-CE2 3.85Å; L543-F679 HydrophobicContact CD1-CG 4.26Å; L543-F679 HydrophobicContact CD1-CZ 4.12Å; L558-F679 HydrophobicContact CD1-CD2 4.13Å; L558-F679 HydrophobicContact CD2-CB 3.95Å; V675-F679 WeakPolarHBondContact O-CB 3.39Å; V675-F679 PolarHBondContact O-N 2.83Å; S676-F679 PolarHBondContact O-N 3.39Å; F679-M681 VanDerWaalsContact C-N 3.34Å; F679-E682 PolarHBondContact O-N 3.06Å; F679-R683 VanDerWaalsContact O-CB 3.27Å; F679-R683 WeakPolarHBondContact O-CB 3.4Å; F679-R683 PolarHBondContact O-N 2.93Å
680	L	94.6	Very high	93.6	Very high	29 Å²	29	48.9 Å²	48.9	15%	0.152	28%	0.282	C	S	.	.	H	α-helix	trans	-66.9	-38.2	-179.8	-152	79.3	0	0	0	111.5	D535 T538 L542 S676 S677 N678 E682 G684 F685	D535-L680 HydrophobicContact CB-CD2 4.3Å; T538-L680 HydrophobicContact CG2-CD1 4.4Å; L542-L680 HydrophobicContact CD1-CD1 4.09Å; S676-L680 WeakPolarHBondContact O-CB 3.48Å; S676-L680 PolarHBondContact O-N 3.45Å; S677-L680 PolarHBondContact O-N 2.96Å; N678-L680 PolarHBondContact O-N 3.43Å; L680-E682 VanDerWaalsContact C-N 3.32Å; L680-E682 PolarHBondContact O-N 3.43Å; L680-G684 PolarHBondContact O-N 3.31Å; L680-F685 HydrophobicContact CD1-CB 3.96Å; L680-F685 HydrophobicContact CG-CB 4.19Å
681	M	93.6	Very high	93.6	Very high	144 Å²	144	50.5 Å²	50.5	71%	0.709	29%	0.291	S	S	*	.	H	α-helix	trans	-62.5	-37.6	177.6	-171	171.9	68.9	0	0	112.4	S677 N678 F679	S677-M681 WeakPolarHBondContact O-CB 3.44Å; S677-M681 PolarHBondContact O-N 3.27Å; N678-M681 PolarHBondContact O-N 2.99Å; F679-M681 VanDerWaalsContact C-N 3.34Å
682	E	91.6	Very high	93.6	Very high	79 Å²	79	50.9 Å²	50.9	37%	0.369	30%	0.295	S	S	.	.	H	α-helix	trans	-81.9	-42.2	179.3	-71	177.2	-159.8	0	0	113.3	K557 N678 F679 L680 G684	K557-E682 WeakPolarHBondContact CD-OE1 3.04Å; K557-E682 WeakPolarHBondContact CE-OE1 3.47Å; K557-E682 IonicContact NZ-OE1 3.62Å; K557-E682 PolarHBondContact NZ-OE1 3.45Å; K557-E682 IonicContact NZ-OE2 2.69Å; N678-E682 PolarHBondContact O-N 3.31Å; N678-E682 VanDerWaalsContact O-N 3.15Å; F679-E682 PolarHBondContact O-N 3.06Å; L680-E682 VanDerWaalsContact C-N 3.32Å; L680-E682 PolarHBondContact O-N 3.43Å; E682-G684 VanDerWaalsContact C-N 3.34Å
683	R	92	Very high	93.6	Very high	97 Å²	97	53.4 Å²	53.4	37%	0.366	31%	0.31	S	S	.	.	H	α-helix	trans	-67.6	-38.2	-179.4	-179.4	-179.2	171.3	153	4.3	111.8	L542 F679	L542-R683 VanDerWaalsContact CB-NH1 3.34Å; L542-R683 PolarHBondContact O-NH1 3.4Å; L542-R683 VanDerWaalsContact O-NH1 3.1Å; F679-R683 VanDerWaalsContact O-CB 3.27Å; F679-R683 WeakPolarHBondContact O-CB 3.4Å; F679-R683 PolarHBondContact O-N 2.93Å
684	G	93.7	Very high	93.5	Very high	48 Å²	48	54.4 Å²	54.4	50%	0.495	32%	0.317	S	S	.	.			trans	74.6	132.7	-165.5	0	0	0	0	0	112	L680 E682	L680-G684 PolarHBondContact O-N 3.31Å; E682-G684 VanDerWaalsContact C-N 3.34Å
685	F	95	Very high	93.4	Very high	61 Å²	61	54.6 Å²	54.6	27%	0.268	33%	0.326	S	S	.	.			trans	-143.5	120.6	171.1	-175.1	-106.5	0	0	0	108.1	T538 L542 L680 A765 I768 M769	T538-F685 HydrophobicContact CG2-CD1 4Å; T538-F685 HydrophobicContact CG2-CE1 3.79Å; T538-F685 HydrophobicContact CG2-CG 4.45Å; T538-F685 HydrophobicContact CG2-CZ 4.06Å; L542-F685 HydrophobicContact CD1-CD2 3.69Å; L542-F685 HydrophobicContact CD1-CE2 4.09Å; L542-F685 HydrophobicContact CD1-CG 4.19Å; L680-F685 HydrophobicContact CD1-CB 3.96Å; L680-F685 HydrophobicContact CG-CB 4.19Å; F685-A765 HydrophobicContact CE1-CB 4.32Å; F685-A765 HydrophobicContact CE2-CB 3.87Å; F685-A765 HydrophobicContact CZ-CB 3.64Å; F685-I768 HydrophobicContact CE2-CB 4.43Å; F685-I768 HydrophobicContact CE2-CD1 4.2Å; F685-I768 HydrophobicContact CE2-CG2 4.22Å; F685-I768 HydrophobicContact CZ-CB 4.36Å; F685-I768 HydrophobicContact CZ-CG2 4.18Å; F685-M769 HydrophobicContact CE1-CG 3.89Å; F685-M769 HydrophobicContact CE1-SD 4.07Å; F685-M769 HydrophobicContact CZ-CG 3.97Å
686	S	95	Very high	93.3	Very high	99 Å²	99	61.2 Å²	61.2	69%	0.692	36%	0.361	S	S	*	.			trans	-142.5	156.1	-174.5	-171	0	0	0	0	110	A765	S686-A765 VanDerWaalsContact O-CB 3.24Å; S686-A765 WeakPolarHBondContact O-CB 3.49Å
687	I	94.5	Very high	93.2	Very high	90 Å²	90	66.6 Å²	66.6	46%	0.462	39%	0.39	S	S	.	.			trans	-111.3	128.4	172.4	-176.6	-178.5	0	0	0	108.2	D691 A765 P766 M769	I687-D691 WeakPolarHBondContact CA-OD2 3.32Å; I687-D691 HydrophobicContact CG1-CB 4.39Å; I687-A765 HydrophobicContact CB-CB 4.35Å; I687-P766 HydrophobicContact CD1-CG 3.54Å; I687-P766 HydrophobicContact CG1-CG 3.91Å; I687-M769 HydrophobicContact CD1-CE 4.49Å
688	G	94	Very high	93.1	Very high	38 Å²	38	64.9 Å²	64.9	39%	0.392	38%	0.377	S	S	.	.			trans	-113.2	174.8	175.5	0	0	0	0	0	112.7	G690 D691	G688-G690 VanDerWaalsContact C-N 3.27Å; G688-G690 PolarHBondContact O-N 2.9Å; G688-D691 PolarHBondContact N-OD2 3.19Å; G688-D691 WeakPolarHBondContact O-CB 3.35Å; G688-D691 PolarHBondContact O-N 2.64Å
689	I	94.7	Very high	93	Very high	122 Å²	122	66.6 Å²	66.6	63%	0.626	39%	0.386	S	S	*	.	G	3₁₀ helix	trans	-64.7	-33.7	171.8	-169.5	63.2	0	0	0	111.8	D691 V692 T693 Y828	I689-D691 PolarHBondContact O-N 2.92Å; I689-V692 HydrophobicContact CD1-CG2 3.87Å; I689-V692 WeakPolarHBondContact O-CG2 3.08Å; I689-V692 PolarHBondContact O-N 3.37Å; I689-V692 VanDerWaalsContact O-N 3.1Å; I689-T693 PolarHBondContact O-N 3.36Å; I689-T693 PolarHBondContact O-OG1 2.95Å; I689-Y828 HydrophobicContact CD1-CD2 3.88Å; I689-Y828 HydrophobicContact CD1-CE2 3.86Å; I689-Y828 HydrophobicContact CG1-CD2 4.46Å; I689-Y828 HydrophobicContact CG1-CE2 3.95Å
690	G	92.6	Very high	92.9	Very high	54 Å²	54	68.8 Å²	68.8	56%	0.557	41%	0.407	S	S	*	.	G	3₁₀ helix	trans	-65.1	-21.9	178.9	0	0	0	0	0	114.3	G688 V692	G688-G690 VanDerWaalsContact C-N 3.27Å; G688-G690 PolarHBondContact O-N 2.9Å; G690-V692 PolarHBondContact O-N 2.89Å
691	D	92.7	Very high	92.7	Very high	39 Å²	39	69.5 Å²	69.5	21%	0.209	41%	0.409	C	S	.	.	G	3₁₀ helix	trans	-71.9	-21.8	176	-72.5	-38.5	0	0	0	112.9	I687 G688 I689 N764 P766	I687-D691 WeakPolarHBondContact CA-OD2 3.32Å; I687-D691 HydrophobicContact CG1-CB 4.39Å; G688-D691 PolarHBondContact N-OD2 3.19Å; G688-D691 WeakPolarHBondContact O-CB 3.35Å; G688-D691 PolarHBondContact O-N 2.64Å; I689-D691 PolarHBondContact O-N 2.92Å; D691-N764 WeakPolarHBondContact CA-OD1 3.19Å; D691-N764 WeakPolarHBondContact CB-OD1 3.34Å; D691-N764 PolarHBondContact O-ND2 3.24Å; D691-N764 PolarHBondContact O-OD1 3.11Å; D691-N764 PolarHBondContact OD1-OD1 3.29Å; D691-P766 HydrophobicContact CB-CG 4.25Å
692	V	93.8	Very high	92.7	Very high	18 Å²	18	64.1 Å²	64.1	11%	0.109	38%	0.382	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111	1.3	-179.6	-62.3	0	0	0	0	113.5	I689 G690 P766 M784 I785 Y828	I689-V692 HydrophobicContact CD1-CG2 3.87Å; I689-V692 WeakPolarHBondContact O-CG2 3.08Å; I689-V692 PolarHBondContact O-N 3.37Å; I689-V692 VanDerWaalsContact O-N 3.1Å; G690-V692 PolarHBondContact O-N 2.89Å; V692-P766 HydrophobicContact CG1-CG 4.48Å; V692-M784 HydrophobicContact CG1-CB 4.32Å; V692-M784 HydrophobicContact CG1-CE 4.49Å; V692-M784 HydrophobicContact CG1-SD 4.49Å; V692-I785 HydrophobicContact CB-CG1 4.12Å; V692-I785 HydrophobicContact CG1-CG1 4.41Å; V692-Y828 HydrophobicContact CG2-CD2 4.08Å
693	T	93	Very high	92.7	Very high	55 Å²	55	65.2 Å²	65.2	34%	0.337	39%	0.389	S	S	.	.	P	Polyproline II helix	trans	-74.8	122.5	174	-60.6	0	0	0	0	110.1	I689 Y828	I689-T693 PolarHBondContact O-N 3.36Å; I689-T693 PolarHBondContact O-OG1 2.95Å; T693-Y828 HydrophobicContact CG2-CE1 4.33Å; T693-Y828 HydrophobicContact CG2-CE2 4.49Å; T693-Y828 WeakPolarHBondContact CG2-OH 3.43Å; T693-Y828 WeakPolarHBondContact OG1-CE2 3.48Å; T693-Y828 PolarHBondContact OG1-OH 3.46Å
694	P	91.6	Very high	92.9	Very high	22 Å²	22	66.8 Å²	66.8	14%	0.143	40%	0.395	C	S	.	.	P	Polyproline II helix	trans	-70	141.1	174.1	29	-32.8	0	0	0	110.6	L698 L699 I785 Y828	P694-L698 HydrophobicContact CB-CD2 4.05Å; P694-L698 HydrophobicContact CB-CG 4.45Å; P694-L699 HydrophobicContact CG-CD1 4.21Å; P694-I785 HydrophobicContact CB-CG2 3.92Å; P694-Y828 VanDerWaalsContact CD-CD1 3.46Å; P694-Y828 HydrophobicContact CG-CD1 4.2Å; P694-Y828 HydrophobicContact CG-CE1 4.39Å
695	S	90.8	Very high	92.9	Very high	53 Å²	53	65 Å²	65	37%	0.371	37%	0.374	S	S	.	.	P	Polyproline II helix	trans	-71	155.4	168.5	61.7	0	0	0	0	111.1	D697 L698 L699	S695-D697 PolarHBondContact O-N 2.92Å; S695-L698 WeakPolarHBondContact O-CA 3.4Å; S695-L698 WeakPolarHBondContact O-CB 3.33Å; S695-L698 PolarHBondContact O-N 3.44Å; S695-L698 PolarHBondContact OG-N 3.44Å; S695-L699 PolarHBondContact O-N 3.31Å
696	D	91	Very high	92.8	Very high	138 Å²	138	62.7 Å²	62.7	74%	0.738	37%	0.365	S	S	*	.	H	α-helix	trans	-56.1	-39.7	178.8	-62.9	-34.4	0	0	0	111.8	L698 L699 A700	D696-L698 VanDerWaalsContact C-N 3.31Å; D696-L698 PolarHBondContact O-N 2.98Å; D696-L699 WeakPolarHBondContact O-CB 3.24Å; D696-L699 PolarHBondContact O-N 2.99Å; D696-L699 VanDerWaalsContact O-N 3.16Å; D696-A700 PolarHBondContact O-N 3.25Å
697	D	91.1	Very high	92.7	Very high	115 Å²	115	65.2 Å²	65.2	62%	0.615	36%	0.364	S	S	*	.	H	α-helix	trans	-62.8	-35.8	174.8	-62.1	-26	0	0	0	112.9	S695 E701 K759	S695-D697 PolarHBondContact O-N 2.92Å; D697-E701 VanDerWaalsContact O-CB 3.3Å; D697-E701 WeakPolarHBondContact O-CB 3.45Å; D697-E701 PolarHBondContact O-N 3.22Å; D697-E701 VanDerWaalsContact O-N 3.17Å; D697-K759 HydrophobicContact CB-CD 4.43Å; D697-K759 PolarHBondContact O-NZ 3.02Å
698	L	91	Very high	92.7	Very high	4 Å²	4	64.7 Å²	64.7	2%	0.021	36%	0.359	C	S	.	.	H	α-helix	trans	-72	-36.7	176	179.3	60.1	0	0	0	110.5	P694 S695 D696 E701 K702 A755 C756 K759 I785	P694-L698 HydrophobicContact CB-CD2 4.05Å; P694-L698 HydrophobicContact CB-CG 4.45Å; S695-L698 WeakPolarHBondContact O-CA 3.4Å; S695-L698 WeakPolarHBondContact O-CB 3.33Å; S695-L698 PolarHBondContact O-N 3.44Å; S695-L698 PolarHBondContact OG-N 3.44Å; D696-L698 VanDerWaalsContact C-N 3.31Å; D696-L698 PolarHBondContact O-N 2.98Å; L698-E701 PolarHBondContact O-N 3.25Å; L698-K702 VanDerWaalsContact O-CB 3.25Å; L698-K702 WeakPolarHBondContact O-CB 3.44Å; L698-K702 PolarHBondContact O-N 3.24Å; L698-A755 HydrophobicContact CD1-CB 4.33Å; L698-C756 HydrophobicContact CD1-CB 4.12Å; L698-C756 HydrophobicContact CD2-CB 4Å; L698-K759 HydrophobicContact CB-CD 4.09Å; L698-K759 HydrophobicContact CD1-CD 4.45Å; L698-I785 HydrophobicContact CD2-CG2 3.75Å
699	L	91.3	Very high	92.7	Very high	78 Å²	78	62.9 Å²	62.9	41%	0.408	34%	0.341	S	S	.	.	H	α-helix	trans	-65.8	-45	177.9	-160.4	118.9	0	0	0	111.3	P694 S695 D696 E701 K702 I703	P694-L699 HydrophobicContact CG-CD1 4.21Å; S695-L699 PolarHBondContact O-N 3.31Å; D696-L699 WeakPolarHBondContact O-CB 3.24Å; D696-L699 PolarHBondContact O-N 2.99Å; D696-L699 VanDerWaalsContact O-N 3.16Å; L699-E701 PolarHBondContact O-N 3.16Å; L699-K702 WeakPolarHBondContact O-CB 3.36Å; L699-K702 PolarHBondContact O-N 2.94Å; L699-I703 HydrophobicContact CD2-CD1 3.86Å; L699-I703 HydrophobicContact CG-CD1 4.45Å; L699-I703 VanDerWaalsContact O-CG1 3.29Å; L699-I703 WeakPolarHBondContact O-CG1 3.08Å; L699-I703 PolarHBondContact O-N 3.48Å
700	A	93	Very high	92.7	Very high	61 Å²	61	59.7 Å²	59.7	50%	0.504	32%	0.321	S	S	.	.	H	α-helix	trans	-60.4	-45.4	174.1	0	0	0	0	0	111.7	D696 I703 R704	D696-A700 PolarHBondContact O-N 3.25Å; A700-I703 PolarHBondContact O-N 3.25Å; A700-R704 PolarHBondContact O-N 2.95Å
701	E	91	Very high	92.8	Very high	44 Å²	44	61.1 Å²	61.1	21%	0.206	32%	0.319	C	S	.	.	H	α-helix	trans	-65.4	-40.2	178.3	-176.6	59.7	-167.3	0	0	112.3	D697 L698 L699 R704 L705 A755	D697-E701 VanDerWaalsContact O-CB 3.3Å; D697-E701 WeakPolarHBondContact O-CB 3.45Å; D697-E701 PolarHBondContact O-N 3.22Å; D697-E701 VanDerWaalsContact O-N 3.17Å; L698-E701 PolarHBondContact O-N 3.25Å; L699-E701 PolarHBondContact O-N 3.16Å; E701-R704 VanDerWaalsContact CD-NH2 3.26Å; E701-R704 WeakPolarHBondContact O-CB 3.22Å; E701-R704 PolarHBondContact O-N 3.15Å; E701-R704 IonicContact OE1-CZ 3.29Å; E701-R704 IonicContact OE1-NE 2.99Å; E701-R704 IonicContact OE1-NH2 3.05Å; E701-R704 PolarHBondContact OE1-NH2 2.97Å; E701-R704 IonicContact OE2-CZ 3.92Å; E701-R704 VanDerWaalsContact OE2-CZ 3.29Å; E701-R704 IonicContact OE2-NE 3.18Å; E701-R704 PolarHBondContact OE2-NE 3.42Å; E701-R704 IonicContact OE2-NH2 2.91Å; E701-R704 PolarHBondContact OE2-NH2 2.86Å; E701-L705 HydrophobicContact CG-CD1 4.19Å; E701-L705 WeakPolarHBondContact O-CG 3.4Å; E701-L705 PolarHBondContact O-N 3.18Å; E701-A755 HydrophobicContact CG-CB 4.22Å
702	K	92.5	Very high	92.8	Very high	31 Å²	31	60.5 Å²	60.5	14%	0.135	32%	0.32	C	S	.	.	H	α-helix	trans	-58.3	-51.5	173.4	171.3	-166.2	170	167.4	0	110.9	L698 L699 R704 L705 V706 A786 D824	L698-K702 VanDerWaalsContact O-CB 3.25Å; L698-K702 WeakPolarHBondContact O-CB 3.44Å; L698-K702 PolarHBondContact O-N 3.24Å; L699-K702 WeakPolarHBondContact O-CB 3.36Å; L699-K702 PolarHBondContact O-N 2.94Å; K702-R704 PolarHBondContact O-N 3.36Å; K702-L705 PolarHBondContact O-N 3.09Å; K702-V706 HydrophobicContact CG-CG2 4.35Å; K702-V706 WeakPolarHBondContact O-CG2 3.41Å; K702-V706 PolarHBondContact O-N 2.94Å; K702-A786 VanDerWaalsContact CD-O 3.26Å; K702-A786 WeakPolarHBondContact CD-O 3.46Å; K702-A786 WeakPolarHBondContact CE-O 3.36Å; K702-A786 PolarHBondContact NZ-O 3.12Å; K702-D824 WeakPolarHBondContact CE-O 3.38Å; K702-D824 PolarHBondContact NZ-O 3.3Å
703	I	92.6	Very high	92.7	Very high	102 Å²	102	59.7 Å²	59.7	52%	0.523	32%	0.315	S	S	.	.	H	α-helix	trans	-58.3	-42.4	-179.2	-69.6	165.1	0	0	0	109.9	L699 A700 K707	L699-I703 HydrophobicContact CD2-CD1 3.86Å; L699-I703 HydrophobicContact CG-CD1 4.45Å; L699-I703 VanDerWaalsContact O-CG1 3.29Å; L699-I703 WeakPolarHBondContact O-CG1 3.08Å; L699-I703 PolarHBondContact O-N 3.48Å; A700-I703 PolarHBondContact O-N 3.25Å; I703-K707 VanDerWaalsContact O-CB 3.28Å; I703-K707 WeakPolarHBondContact O-CB 3.4Å; I703-K707 PolarHBondContact O-N 3.31Å
704	R	95.1	Very high	92.7	Very high	131 Å²	131	60.4 Å²	60.4	49%	0.494	32%	0.316	S	S	.	.	H	α-helix	trans	-59	-53.7	175.4	-172	178.7	73.6	134.2	4.6	112	A700 E701 K702 V706 K707 E708	A700-R704 PolarHBondContact O-N 2.95Å; E701-R704 VanDerWaalsContact CD-NH2 3.26Å; E701-R704 WeakPolarHBondContact O-CB 3.22Å; E701-R704 PolarHBondContact O-N 3.15Å; E701-R704 IonicContact OE1-CZ 3.29Å; E701-R704 IonicContact OE1-NE 2.99Å; E701-R704 IonicContact OE1-NH2 3.05Å; E701-R704 PolarHBondContact OE1-NH2 2.97Å; E701-R704 IonicContact OE2-CZ 3.92Å; E701-R704 VanDerWaalsContact OE2-CZ 3.29Å; E701-R704 IonicContact OE2-NE 3.18Å; E701-R704 PolarHBondContact OE2-NE 3.42Å; E701-R704 IonicContact OE2-NH2 2.91Å; E701-R704 PolarHBondContact OE2-NH2 2.86Å; K702-R704 PolarHBondContact O-N 3.36Å; R704-V706 PolarHBondContact O-N 3.25Å; R704-K707 PolarHBondContact O-N 3.1Å; R704-E708 WeakPolarHBondContact O-CG 3.3Å; R704-E708 PolarHBondContact O-N 2.86Å
705	L	93.7	Very high	92.8	Very high	9 Å²	9	64.4 Å²	64.4	5%	0.047	33%	0.333	C	S	.	.	H	α-helix	trans	-63	-39.4	-178.3	-70.5	171.8	0	0	0	113.1	E701 K702 G709 R751 A752	E701-L705 HydrophobicContact CG-CD1 4.19Å; E701-L705 WeakPolarHBondContact O-CG 3.4Å; E701-L705 PolarHBondContact O-N 3.18Å; K702-L705 PolarHBondContact O-N 3.09Å; L705-G709 PolarHBondContact O-N 2.8Å; L705-R751 HydrophobicContact CD1-CB 4.22Å; L705-R751 HydrophobicContact CD2-CB 4.3Å; L705-A752 HydrophobicContact CD1-CB 4.26Å
706	V	93	Very high	92.8	Very high	14 Å²	14	64.1 Å²	64.1	9%	0.085	33%	0.325	C	S	.	.	H	α-helix	trans	-66.3	-44.3	176.7	172.5	0	0	0	0	110.3	K702 R704 E708 G709 Y710 V748 F822 D824	K702-V706 HydrophobicContact CG-CG2 4.35Å; K702-V706 WeakPolarHBondContact O-CG2 3.41Å; K702-V706 PolarHBondContact O-N 2.94Å; R704-V706 PolarHBondContact O-N 3.25Å; V706-E708 PolarHBondContact O-N 3.34Å; V706-G709 PolarHBondContact O-N 2.75Å; V706-Y710 HydrophobicContact CG1-CD1 4Å; V706-Y710 HydrophobicContact CG1-CE1 3.77Å; V706-Y710 VanDerWaalsContact O-CD1 3.3Å; V706-Y710 WeakPolarHBondContact O-CD1 3.37Å; V706-Y710 PolarHBondContact O-N 3.14Å; V706-V748 HydrophobicContact CG2-CG1 4.4Å; V706-F822 HydrophobicContact CG1-CE1 4.45Å; V706-D824 HydrophobicContact CG1-CB 4.05Å; V706-D824 HydrophobicContact CG2-CB 4.39Å
707	K	94.2	Very high	92.7	Very high	151 Å²	151	58.2 Å²	58.2	66%	0.657	29%	0.293	S	S	*	.	H	α-helix	trans	-62.7	-41.4	177.5	-171.4	176.4	-179.3	180	0	112	I703 R704 Y710 T711	I703-K707 VanDerWaalsContact O-CB 3.28Å; I703-K707 WeakPolarHBondContact O-CB 3.4Å; I703-K707 PolarHBondContact O-N 3.31Å; R704-K707 PolarHBondContact O-N 3.1Å; K707-Y710 PolarHBondContact O-N 2.75Å; K707-T711 WeakPolarHBondContact O-CB 3.43Å; K707-T711 PolarHBondContact O-N 3.38Å; K707-T711 PolarHBondContact O-OG1 3.42Å
708	E	94.7	Very high	92.7	Very high	79 Å²	79	56.9 Å²	56.9	37%	0.369	29%	0.286	S	S	.	.	H	α-helix	trans	-58.4	-48.2	172.1	-74.9	174	-168.5	0	0	111.5	R704 V706 Y710 T711 A712 R751	R704-E708 WeakPolarHBondContact O-CG 3.3Å; R704-E708 PolarHBondContact O-N 2.86Å; V706-E708 PolarHBondContact O-N 3.34Å; E708-Y710 VanDerWaalsContact C-N 3.35Å; E708-Y710 PolarHBondContact O-N 3.45Å; E708-T711 PolarHBondContact O-N 3.18Å; E708-A712 WeakPolarHBondContact O-CB 3.36Å; E708-A712 PolarHBondContact O-N 3.43Å; E708-R751 IonicContact OE2-NH1 2.62Å; E708-R751 PolarHBondContact OE2-NH1 3.47Å
709	G	92.7	Very high	92.7	Very high	0 Å²	0	59.1 Å²	59.1	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-61.4	-40.1	178.1	0	0	0	0	0	113.4	L705 V706 A712 C713	L705-G709 PolarHBondContact O-N 2.8Å; V706-G709 PolarHBondContact O-N 2.75Å; G709-A712 PolarHBondContact O-N 3.07Å; G709-C713 PolarHBondContact O-N 3.15Å; G709-C713 PolarHBondContact O-SG 3.15Å
710	Y	94.5	Very high	92.6	Very high	55 Å²	55	57.7 Å²	57.7	22%	0.216	29%	0.289	C	S	.	.	H	α-helix	trans	-68	-43.8	177.2	-82.1	34.4	0	0	0	110.9	V706 K707 E708 A712 C713 D714 P817 F822	V706-Y710 HydrophobicContact CG1-CD1 4Å; V706-Y710 HydrophobicContact CG1-CE1 3.77Å; V706-Y710 VanDerWaalsContact O-CD1 3.3Å; V706-Y710 WeakPolarHBondContact O-CD1 3.37Å; V706-Y710 PolarHBondContact O-N 3.14Å; K707-Y710 PolarHBondContact O-N 2.75Å; E708-Y710 VanDerWaalsContact C-N 3.35Å; E708-Y710 PolarHBondContact O-N 3.45Å; Y710-A712 VanDerWaalsContact C-N 3.3Å; Y710-A712 PolarHBondContact O-N 3.32Å; Y710-C713 WeakPolarHBondContact O-CB 3.49Å; Y710-C713 PolarHBondContact O-N 2.97Å; Y710-C713 VanDerWaalsContact O-N 3.12Å; Y710-D714 PolarHBondContact O-N 3.35Å; Y710-P817 HydrophobicContact CD1-CB 4.22Å; Y710-P817 HydrophobicContact CD1-CG 4.11Å; Y710-P817 HydrophobicContact CE1-CB 3.76Å; Y710-P817 HydrophobicContact CE1-CG 4.17Å; Y710-P817 HydrophobicContact CG-CG 4.45Å; Y710-F822 AromaticContact CE1-CD1 3.6Å; Y710-F822 HydrophobicContact CE1-CD1 3.6Å; Y710-F822 AromaticContact CE1-CE1 3.74Å; Y710-F822 HydrophobicContact CE1-CE1 3.74Å; Y710-F822 HydrophobicContact CE1-CG 4.49Å; Y710-F822 AromaticContact CZ-CD1 3.99Å; Y710-F822 WeakPolarHBondContact OH-CD1 3.37Å
711	T	95.1	Very high	92.3	Very high	84 Å²	84	62.8 Å²	62.8	52%	0.515	30%	0.3	S	S	.	.	H	α-helix	trans	-61.2	-39.9	177.3	-52	0	0	0	0	111.4	K707 E708 D714 H715	K707-T711 WeakPolarHBondContact O-CB 3.43Å; K707-T711 PolarHBondContact O-N 3.38Å; K707-T711 PolarHBondContact O-OG1 3.42Å; E708-T711 PolarHBondContact O-N 3.18Å; T711-D714 PolarHBondContact O-N 3.31Å; T711-H715 PolarHBondContact O-N 3.07Å
712	A	93.6	Very high	92.3	Very high	27 Å²	27	65 Å²	65	22%	0.223	32%	0.316	C	S	.	.	H	α-helix	trans	-64.1	-43.3	174.1	0	0	0	0	0	111.8	E708 G709 Y710 H715 F716 E744	E708-A712 WeakPolarHBondContact O-CB 3.36Å; E708-A712 PolarHBondContact O-N 3.43Å; G709-A712 PolarHBondContact O-N 3.07Å; Y710-A712 VanDerWaalsContact C-N 3.3Å; Y710-A712 PolarHBondContact O-N 3.32Å; A712-H715 WeakPolarHBondContact O-CB 3.47Å; A712-H715 PolarHBondContact O-N 3.25Å; A712-F716 HydrophobicContact CB-CE2 4.39Å; A712-F716 WeakPolarHBondContact O-CD2 3.36Å; A712-F716 WeakPolarHBondContact O-CG 3.45Å; A712-F716 PolarHBondContact O-N 3.38Å; A712-E744 HydrophobicContact CB-CG 4.14Å
713	C	92	Very high	92	Very high	0 Å²	0	66.7 Å²	66.7	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-61.6	-44.1	175.2	-71.1	0	0	0	0	112.3	G709 Y710 H715 F716 M717 M741 P817	G709-C713 PolarHBondContact O-N 3.15Å; G709-C713 PolarHBondContact O-SG 3.15Å; Y710-C713 WeakPolarHBondContact O-CB 3.49Å; Y710-C713 PolarHBondContact O-N 2.97Å; Y710-C713 VanDerWaalsContact O-N 3.12Å; C713-H715 VanDerWaalsContact C-N 3.27Å; C713-H715 PolarHBondContact O-N 3.22Å; C713-F716 PolarHBondContact O-N 3.38Å; C713-M717 WeakPolarHBondContact O-CG 3.35Å; C713-M717 PolarHBondContact O-N 2.91Å; C713-M741 HydrophobicContact CB-CE 3.9Å; C713-P817 HydrophobicContact CB-CG 3.87Å
714	D	92	Very high	91.8	Very high	70 Å²	70	69.4 Å²	69.4	37%	0.374	35%	0.351	S	S	.	.	H	α-helix	trans	-61.3	-38.2	176.3	-70.1	-24.6	0	0	0	111.5	Y710 T711 M717 N718	Y710-D714 PolarHBondContact O-N 3.35Å; T711-D714 PolarHBondContact O-N 3.31Å; D714-M717 HydrophobicContact CB-CE 4.4Å; D714-M717 PolarHBondContact O-N 3.1Å; D714-M717 WeakPolarHBondContact OD1-CE 3.34Å; D714-N718 WeakPolarHBondContact O-CB 3.41Å; D714-N718 VanDerWaalsContact O-CG 3.26Å; D714-N718 PolarHBondContact O-N 2.98Å; D714-N718 PolarHBondContact O-ND2 2.87Å
715	H	93.2	Very high	91.4	Very high	107 Å²	107	64 Å²	64	50%	0.495	33%	0.332	S	S	.	.	H	α-helix	trans	-60.9	-48.5	173.4	-172.7	75.6	0	0	0	111.9	T711 A712 C713 M717 N718 Q719	T711-H715 PolarHBondContact O-N 3.07Å; A712-H715 WeakPolarHBondContact O-CB 3.47Å; A712-H715 PolarHBondContact O-N 3.25Å; C713-H715 VanDerWaalsContact C-N 3.27Å; C713-H715 PolarHBondContact O-N 3.22Å; H715-M717 VanDerWaalsContact C-N 3.34Å; H715-M717 PolarHBondContact O-N 3Å; H715-N718 PolarHBondContact O-N 3.24Å; H715-Q719 PolarHBondContact CD2-NE2 2.81Å; H715-Q719 PolarHBondContact NE2-NE2 3.47Å; H715-Q719 WeakPolarHBondContact O-CG 3.23Å; H715-Q719 PolarHBondContact O-N 3.46Å
716	F	91.7	Very high	90.9	Very high	47 Å²	47	70.2 Å²	70.2	21%	0.206	37%	0.365	C	S	.	.	H	α-helix	trans	-63.8	-37.8	177.4	-61.9	-50.8	0	0	0	112.7	A712 C713 Q719 L720 L737 V740	A712-F716 HydrophobicContact CB-CE2 4.39Å; A712-F716 WeakPolarHBondContact O-CD2 3.36Å; A712-F716 WeakPolarHBondContact O-CG 3.45Å; A712-F716 PolarHBondContact O-N 3.38Å; C713-F716 PolarHBondContact O-N 3.38Å; F716-Q719 WeakPolarHBondContact O-CB 3.46Å; F716-Q719 PolarHBondContact O-N 3.12Å; F716-L720 PolarHBondContact O-N 3.35Å; F716-L737 HydrophobicContact CB-CD1 3.61Å; F716-V740 HydrophobicContact CD1-CG1 4.04Å; F716-V740 HydrophobicContact CD2-CG1 3.62Å; F716-V740 HydrophobicContact CE1-CG1 3.89Å; F716-V740 HydrophobicContact CE2-CG1 3.45Å; F716-V740 VanDerWaalsContact CE2-CG1 3.45Å; F716-V740 HydrophobicContact CG-CG1 3.92Å; F716-V740 HydrophobicContact CZ-CG1 3.6Å
717	M	89.4	Confident	90.3	Very high	14 Å²	14	73 Å²	73	7%	0.069	38%	0.384	C	S	.	.	H	α-helix	trans	-64.1	-40.3	174.3	-73	-173	-71.6	0	0	111.9	C713 D714 H715 L720 K721 L737 M741 P815 T816	C713-M717 WeakPolarHBondContact O-CG 3.35Å; C713-M717 PolarHBondContact O-N 2.91Å; D714-M717 HydrophobicContact CB-CE 4.4Å; D714-M717 PolarHBondContact O-N 3.1Å; D714-M717 WeakPolarHBondContact OD1-CE 3.34Å; H715-M717 VanDerWaalsContact C-N 3.34Å; H715-M717 PolarHBondContact O-N 3Å; M717-L720 PolarHBondContact O-N 3.35Å; M717-K721 WeakPolarHBondContact O-CG 3.24Å; M717-K721 PolarHBondContact O-N 3.29Å; M717-L737 HydrophobicContact CG-CD1 4.35Å; M717-L737 HydrophobicContact CG-CD2 4.16Å; M717-M741 HydrophobicContact CG-SD 4.35Å; M717-P815 HydrophobicContact CG-CG 4.48Å; M717-P815 HydrophobicContact SD-CG 3.81Å; M717-T816 HydrophobicContact CE-CG2 3.9Å; M717-T816 HydrophobicContact SD-CG2 4.43Å
718	N	91.1	Very high	89.4	Confident	86 Å²	86	68.9 Å²	68.9	46%	0.46	37%	0.367	S	S	.	.	H	α-helix	trans	-68.4	-35.4	175.5	-73.1	-24.9	0	0	0	112.1	D714 H715 L720 K721 T722	D714-N718 WeakPolarHBondContact O-CB 3.41Å; D714-N718 VanDerWaalsContact O-CG 3.26Å; D714-N718 PolarHBondContact O-N 2.98Å; D714-N718 PolarHBondContact O-ND2 2.87Å; H715-N718 PolarHBondContact O-N 3.24Å; N718-L720 VanDerWaalsContact C-N 3.34Å; N718-K721 PolarHBondContact O-N 3.15Å; N718-T722 WeakPolarHBondContact O-CB 3.42Å; N718-T722 WeakPolarHBondContact O-CG2 3.45Å; N718-T722 PolarHBondContact O-N 3.3Å; N718-T722 PolarHBondContact O-OG1 3.33Å
719	Q	90.8	Very high	88.3	Confident	52 Å²	52	69.2 Å²	69.2	24%	0.243	38%	0.376	C	S	.	.	H	α-helix	trans	-62.1	-40.4	171.4	-72.6	-177	-11.4	0	0	112	H715 F716 T722 G723 K724 L725	H715-Q719 PolarHBondContact CD2-NE2 2.81Å; H715-Q719 PolarHBondContact NE2-NE2 3.47Å; H715-Q719 WeakPolarHBondContact O-CG 3.23Å; H715-Q719 PolarHBondContact O-N 3.46Å; F716-Q719 WeakPolarHBondContact O-CB 3.46Å; F716-Q719 PolarHBondContact O-N 3.12Å; Q719-T722 WeakPolarHBondContact CA-OG1 3.42Å; Q719-T722 PolarHBondContact O-N 2.89Å; Q719-T722 PolarHBondContact O-OG1 3.28Å; Q719-G723 PolarHBondContact O-N 3.16Å; Q719-G723 VanDerWaalsContact O-N 3.1Å; Q719-K724 PolarHBondContact O-N 3.04Å; Q719-L725 HydrophobicContact CB-CB 4.05Å; Q719-L725 HydrophobicContact CB-CD1 4.39Å; Q719-L725 PolarHBondContact O-N 2.79Å
720	L	87.9	Confident	87.1	Confident	48 Å²	48	70.9 Å²	70.9	25%	0.251	39%	0.393	S	S	.	.	H	α-helix	trans	-63.8	-47.7	174.6	-178.1	67.6	0	0	0	111.1	F716 M717 N718 T722 G723 L725 P733 L737	F716-L720 PolarHBondContact O-N 3.35Å; M717-L720 PolarHBondContact O-N 3.35Å; N718-L720 VanDerWaalsContact C-N 3.34Å; L720-T722 VanDerWaalsContact C-N 3.27Å; L720-T722 PolarHBondContact O-N 3.28Å; L720-G723 PolarHBondContact O-N 3.11Å; L720-L725 HydrophobicContact CB-CD2 4.21Å; L720-L725 HydrophobicContact CD1-CD2 4.17Å; L720-P733 HydrophobicContact CD1-CB 3.48Å; L720-P733 VanDerWaalsContact CD1-CB 3.48Å; L720-L737 HydrophobicContact CB-CD2 4.42Å; L720-L737 HydrophobicContact CD2-CB 4.4Å; L720-L737 HydrophobicContact CD2-CD2 3.5Å
721	K	87.9	Confident	86.2	Confident	167 Å²	167	69.1 Å²	69.1	73%	0.726	39%	0.388	S	S	*	.	H	α-helix	trans	-60.1	-36.5	178.7	-72.2	175.3	-175.6	172.4	0	112.9	M717 N718 G723	M717-K721 WeakPolarHBondContact O-CG 3.24Å; M717-K721 PolarHBondContact O-N 3.29Å; N718-K721 PolarHBondContact O-N 3.15Å; K721-G723 VanDerWaalsContact C-N 3.3Å
722	T	90.6	Very high	85.7	Confident	90 Å²	90	67.8 Å²	67.8	55%	0.552	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.9	-0.5	177.9	54.5	0	0	0	0	113.4	N718 Q719 L720 K724	N718-T722 WeakPolarHBondContact O-CB 3.42Å; N718-T722 WeakPolarHBondContact O-CG2 3.45Å; N718-T722 PolarHBondContact O-N 3.3Å; N718-T722 PolarHBondContact O-OG1 3.33Å; Q719-T722 WeakPolarHBondContact CA-OG1 3.42Å; Q719-T722 PolarHBondContact O-N 2.89Å; Q719-T722 PolarHBondContact O-OG1 3.28Å; L720-T722 VanDerWaalsContact C-N 3.27Å; L720-T722 PolarHBondContact O-N 3.28Å; T722-K724 PolarHBondContact O-N 3.11Å
723	G	86.2	Confident	85.4	Confident	68 Å²	68	68.9 Å²	68.9	70%	0.701	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	69	10.6	-177.5	0	0	0	0	0	114.7	Q719 L720 K721	Q719-G723 PolarHBondContact O-N 3.16Å; Q719-G723 VanDerWaalsContact O-N 3.1Å; L720-G723 PolarHBondContact O-N 3.11Å; K721-G723 VanDerWaalsContact C-N 3.3Å
724	K	88.9	Confident	85.1	Confident	159 Å²	159	73.9 Å²	73.9	69%	0.691	41%	0.408	S	S	*	.			trans	-87	-8.5	-178.8	-67.2	-174.1	178.6	-177	0	113.7	Q719 T722 N726	Q719-K724 PolarHBondContact O-N 3.04Å; T722-K724 PolarHBondContact O-N 3.11Å; K724-N726 PolarHBondContact O-N 3.07Å
725	L	86.4	Confident	84.7	Confident	16 Å²	16	75.4 Å²	75.4	8%	0.084	41%	0.413	C	S	.	.			trans	-71.8	113.5	179.9	-175	68.4	0	0	0	110.1	Q719 L720 P727 L737	Q719-L725 HydrophobicContact CB-CB 4.05Å; Q719-L725 HydrophobicContact CB-CD1 4.39Å; Q719-L725 PolarHBondContact O-N 2.79Å; L720-L725 HydrophobicContact CB-CD2 4.21Å; L720-L725 HydrophobicContact CD1-CD2 4.17Å; L725-P727 VanDerWaalsContact O-CD 3.31Å; L725-P727 WeakPolarHBondContact O-CD 3.2Å; L725-L737 HydrophobicContact CD2-CB 3.95Å; L725-L737 HydrophobicContact CD2-CD1 4.44Å
726	N	83.1	Confident	84.4	Confident	140 Å²	140	70.4 Å²	70.4	75%	0.749	39%	0.39	S	S	*	.	P	Polyproline II helix	trans	-69.5	116.9	175.9	-70.3	-23.5	0	0	0	109.7	K724	K724-N726 PolarHBondContact O-N 3.07Å
727	P	80	Confident	84.2	Confident	73 Å²	73	68.4 Å²	68.4	47%	0.474	38%	0.382	S	S	.	.	P	Polyproline II helix	trans	-67.1	138.1	179.1	27.3	-32.9	0	0	0	110.3	L725 P733 T736	L725-P727 VanDerWaalsContact O-CD 3.31Å; L725-P727 WeakPolarHBondContact O-CD 3.2Å; P727-P733 HydrophobicContact CB-CG 4.43Å; P727-T736 WeakPolarHBondContact CA-OG1 3.41Å
728	Q	76.4	Confident	84	Confident	65 Å²	65	70.7 Å²	70.7	30%	0.304	39%	0.392	S	S	.	.	P	Polyproline II helix	trans	-66.4	151	171.3	-80.2	173.3	-1.1	0	0	110.4	G730 C731 T736	Q728-G730 PolarHBondContact O-N 2.95Å; Q728-C731 HydrophobicContact CB-CB 4.31Å; Q728-C731 PolarHBondContact O-N 3.14Å; Q728-T736 HydrophobicContact CB-CG2 4.08Å; Q728-T736 HydrophobicContact CG-CG2 3.77Å; Q728-T736 PolarHBondContact N-OG1 3.27Å
729	P	70.3	Confident	83.6	Confident	86 Å²	86	68.2 Å²	68.2	56%	0.558	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	116	-176	-23.3	32.2	0	0	0	112.2	S1064	P729-S1064 WeakPolarHBondContact O-CB 3.48Å; P729-S1064 PolarHBondContact O-OG 3.43Å
730	G	68.5	Low	83.4	Confident	35 Å²	35	67.1 Å²	67.1	36%	0.361	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.6	3	178.1	0	0	0	0	0	115.7	Q728 S1064 R1215	Q728-G730 PolarHBondContact O-N 2.95Å; G730-S1064 VanDerWaalsContact C-CB 3.47Å; G730-R1215 PolarHBondContact O-NH1 3.19Å
731	C	74.1	Confident	83.4	Confident	17 Å²	17	64.8 Å²	64.8	12%	0.115	37%	0.368	C	S	.	.			trans	-105.7	150.1	175.7	-67.1	0	0	0	0	111.1	Q728 Q735 T736 A1063	Q728-C731 HydrophobicContact CB-CB 4.31Å; Q728-C731 PolarHBondContact O-N 3.14Å; C731-Q735 HydrophobicContact CB-CB 3.99Å; C731-T736 WeakPolarHBondContact CB-OG1 3.28Å; C731-A1063 PolarHBondContact SG-O 3.41Å
732	T	85.7	Confident	83.4	Confident	57 Å²	57	58.9 Å²	58.9	35%	0.35	34%	0.344	S	S	.	.			trans	-70.9	161.3	163.9	77.4	0	0	0	0	110.1	E734 Q735 T736	T732-E734 WeakPolarHBondContact CB-OE2 3.48Å; T732-E734 PolarHBondContact O-N 3.47Å; T732-E734 PolarHBondContact OG1-N 3.36Å; T732-E734 PolarHBondContact OG1-OE2 3.1Å; T732-Q735 VanDerWaalsContact N-OE1 3.17Å; T732-Q735 PolarHBondContact O-N 2.83Å; T732-Q735 WeakPolarHBondContact OG1-CG 3.22Å; T732-Q735 PolarHBondContact OG1-N 2.78Å; T732-T736 WeakPolarHBondContact O-CB 3.43Å; T732-T736 PolarHBondContact O-N 2.88Å; T732-T736 PolarHBondContact O-OG1 2.87Å
733	P	86.4	Confident	83.1	Confident	49 Å²	49	62.5 Å²	62.5	32%	0.318	35%	0.352	S	S	.	.	H	α-helix	trans	-53.3	-36.7	173.4	-27.6	36.7	0	0	0	113	L720 P727 T736 L737	L720-P733 HydrophobicContact CD1-CB 3.48Å; L720-P733 VanDerWaalsContact CD1-CB 3.48Å; P727-P733 HydrophobicContact CB-CG 4.43Å; P733-T736 WeakPolarHBondContact O-CB 3.47Å; P733-T736 PolarHBondContact O-N 2.82Å; P733-L737 PolarHBondContact O-N 3.31Å
734	E	86.3	Confident	83.3	Confident	106 Å²	106	61.4 Å²	61.4	50%	0.495	33%	0.329	S	S	.	.	H	α-helix	trans	-70.8	-43.2	178.2	-53.9	72.7	-156.5	0	0	112	T732 T736 L737 E738	T732-E734 WeakPolarHBondContact CB-OE2 3.48Å; T732-E734 PolarHBondContact O-N 3.47Å; T732-E734 PolarHBondContact OG1-N 3.36Å; T732-E734 PolarHBondContact OG1-OE2 3.1Å; E734-T736 VanDerWaalsContact C-N 3.26Å; E734-T736 PolarHBondContact O-N 2.85Å; E734-L737 WeakPolarHBondContact O-CB 3.39Å; E734-L737 PolarHBondContact O-N 3.39Å; E734-E738 PolarHBondContact O-N 2.91Å
735	Q	83.7	Confident	83.4	Confident	102 Å²	102	53.9 Å²	53.9	48%	0.477	30%	0.296	S	S	.	.	H	α-helix	trans	-63.4	-36.8	175.1	-71.1	174	-11.1	0	0	111.5	C731 T732 E738 A739	C731-Q735 HydrophobicContact CB-CB 3.99Å; T732-Q735 VanDerWaalsContact N-OE1 3.17Å; T732-Q735 PolarHBondContact O-N 2.83Å; T732-Q735 WeakPolarHBondContact OG1-CG 3.22Å; T732-Q735 PolarHBondContact OG1-N 2.78Å; Q735-E738 PolarHBondContact O-N 2.93Å; Q735-A739 PolarHBondContact O-N 3.1Å
736	T	85.8	Confident	83.3	Confident	2 Å²	2	55 Å²	55	1%	0.012	31%	0.306	C	S	.	.	H	α-helix	trans	-64.2	-44.8	174.8	-57.2	0	0	0	0	110.7	P727 Q728 C731 T732 P733 E734 E738 A739 V740	P727-T736 WeakPolarHBondContact CA-OG1 3.41Å; Q728-T736 HydrophobicContact CB-CG2 4.08Å; Q728-T736 HydrophobicContact CG-CG2 3.77Å; Q728-T736 PolarHBondContact N-OG1 3.27Å; C731-T736 WeakPolarHBondContact CB-OG1 3.28Å; T732-T736 WeakPolarHBondContact O-CB 3.43Å; T732-T736 PolarHBondContact O-N 2.88Å; T732-T736 PolarHBondContact O-OG1 2.87Å; P733-T736 WeakPolarHBondContact O-CB 3.47Å; P733-T736 PolarHBondContact O-N 2.82Å; E734-T736 VanDerWaalsContact C-N 3.26Å; E734-T736 PolarHBondContact O-N 2.85Å; T736-E738 VanDerWaalsContact C-N 3.34Å; T736-E738 PolarHBondContact O-N 2.89Å; T736-A739 PolarHBondContact O-N 2.89Å; T736-V740 HydrophobicContact CG2-CG2 4.29Å; T736-V740 VanDerWaalsContact O-CG2 3.32Å; T736-V740 WeakPolarHBondContact O-CG2 3.41Å; T736-V740 PolarHBondContact O-N 2.91Å
737	L	88.3	Confident	83.6	Confident	5 Å²	5	50 Å²	50	3%	0.026	28%	0.283	C	S	.	.	H	α-helix	trans	-57	-48	175.1	179.4	66.2	0	0	0	111	F716 M717 L720 L725 P733 E734 A739 V740 M741	F716-L737 HydrophobicContact CB-CD1 3.61Å; M717-L737 HydrophobicContact CG-CD1 4.35Å; M717-L737 HydrophobicContact CG-CD2 4.16Å; L720-L737 HydrophobicContact CB-CD2 4.42Å; L720-L737 HydrophobicContact CD2-CB 4.4Å; L720-L737 HydrophobicContact CD2-CD2 3.5Å; L725-L737 HydrophobicContact CD2-CB 3.95Å; L725-L737 HydrophobicContact CD2-CD1 4.44Å; P733-L737 PolarHBondContact O-N 3.31Å; E734-L737 WeakPolarHBondContact O-CB 3.39Å; E734-L737 PolarHBondContact O-N 3.39Å; L737-A739 VanDerWaalsContact C-N 3.35Å; L737-A739 PolarHBondContact O-N 3.19Å; L737-V740 PolarHBondContact O-N 3.21Å; L737-M741 HydrophobicContact CD1-CG 3.95Å; L737-M741 HydrophobicContact CD1-SD 3.95Å; L737-M741 HydrophobicContact CD2-SD 4.33Å; L737-M741 HydrophobicContact CG-CG 4.23Å; L737-M741 HydrophobicContact CG-SD 3.88Å; L737-M741 WeakPolarHBondContact O-CB 3.08Å; L737-M741 VanDerWaalsContact O-CG 3.26Å; L737-M741 WeakPolarHBondContact O-CG 3.46Å; L737-M741 PolarHBondContact O-N 3.02Å
738	E	85.6	Confident	84.1	Confident	62 Å²	62	46.6 Å²	46.6	29%	0.29	26%	0.261	S	S	.	.	H	α-helix	trans	-60.2	-42.1	178.7	-72.2	-59.3	148.7	0	0	112.7	E734 Q735 T736 L742 R797	E734-E738 PolarHBondContact O-N 2.91Å; Q735-E738 PolarHBondContact O-N 2.93Å; T736-E738 VanDerWaalsContact C-N 3.34Å; T736-E738 PolarHBondContact O-N 2.89Å; E738-L742 VanDerWaalsContact O-CB 3.26Å; E738-L742 WeakPolarHBondContact O-CB 3.46Å; E738-L742 PolarHBondContact O-N 3.05Å; E738-R797 IonicContact OE1-NH1 3.5Å; E738-R797 PolarHBondContact OE1-NH1 3.46Å; E738-R797 WeakPolarHBondContact OE2-CD 3.37Å; E738-R797 IonicContact OE2-CZ 3.33Å; E738-R797 IonicContact OE2-NE 2.7Å; E738-R797 IonicContact OE2-NH1 2.79Å; E738-R797 PolarHBondContact OE2-NH1 3.41Å
739	A	82.3	Confident	84.6	Confident	33 Å²	33	46.3 Å²	46.3	27%	0.273	26%	0.257	S	S	.	.	H	α-helix	trans	-65.3	-45.1	178.4	0	0	0	0	0	112.2	Q735 T736 L737 K743	Q735-A739 PolarHBondContact O-N 3.1Å; T736-A739 PolarHBondContact O-N 2.89Å; L737-A739 VanDerWaalsContact C-N 3.35Å; L737-A739 PolarHBondContact O-N 3.19Å; A739-K743 WeakPolarHBondContact O-CB 3.37Å; A739-K743 PolarHBondContact O-N 2.81Å
740	V	86.8	Confident	85.3	Confident	29 Å²	29	45.2 Å²	45.2	18%	0.176	25%	0.247	C	C	.	.	H	α-helix	trans	-66.6	-44.6	179.4	174.5	0	0	0	0	110.8	F716 T736 L737 K743 E744	F716-V740 HydrophobicContact CD1-CG1 4.04Å; F716-V740 HydrophobicContact CD2-CG1 3.62Å; F716-V740 HydrophobicContact CE1-CG1 3.89Å; F716-V740 HydrophobicContact CE2-CG1 3.45Å; F716-V740 VanDerWaalsContact CE2-CG1 3.45Å; F716-V740 HydrophobicContact CG-CG1 3.92Å; F716-V740 HydrophobicContact CZ-CG1 3.6Å; T736-V740 HydrophobicContact CG2-CG2 4.29Å; T736-V740 VanDerWaalsContact O-CG2 3.32Å; T736-V740 WeakPolarHBondContact O-CG2 3.41Å; T736-V740 PolarHBondContact O-N 2.91Å; L737-V740 PolarHBondContact O-N 3.21Å; V740-K743 PolarHBondContact O-N 3.42Å; V740-E744 PolarHBondContact O-N 3.2Å
741	M	88.5	Confident	86.4	Confident	0 Å²	0	47 Å²	47	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-61.1	-46.6	176.3	-73.3	-173.4	71.5	0	0	111.6	C713 M717 L737 K743 E744 L745 R797 P815 P817	C713-M741 HydrophobicContact CB-CE 3.9Å; M717-M741 HydrophobicContact CG-SD 4.35Å; L737-M741 HydrophobicContact CD1-CG 3.95Å; L737-M741 HydrophobicContact CD1-SD 3.95Å; L737-M741 HydrophobicContact CD2-SD 4.33Å; L737-M741 HydrophobicContact CG-CG 4.23Å; L737-M741 HydrophobicContact CG-SD 3.88Å; L737-M741 WeakPolarHBondContact O-CB 3.08Å; L737-M741 VanDerWaalsContact O-CG 3.26Å; L737-M741 WeakPolarHBondContact O-CG 3.46Å; L737-M741 PolarHBondContact O-N 3.02Å; M741-K743 VanDerWaalsContact C-N 3.3Å; M741-K743 PolarHBondContact O-N 3.27Å; M741-E744 PolarHBondContact O-N 2.97Å; M741-L745 WeakPolarHBondContact O-CB 3.44Å; M741-L745 WeakPolarHBondContact O-CG 3.21Å; M741-L745 PolarHBondContact O-N 3.27Å; M741-R797 VanDerWaalsContact CE-NH2 3.33Å; M741-R797 PolarHBondContact SD-NH1 2.97Å; M741-P815 WeakPolarHBondContact CE-O 3.47Å; M741-P817 HydrophobicContact CE-CG 4.11Å
742	L	86.5	Confident	87.1	Confident	42 Å²	42	46.2 Å²	46.2	22%	0.22	24%	0.238	C	C	.	.	H	α-helix	trans	-61	-39.5	178.6	-176.2	63.3	0	0	0	112.1	E738 S746 Q790 R797	E738-L742 VanDerWaalsContact O-CB 3.26Å; E738-L742 WeakPolarHBondContact O-CB 3.46Å; E738-L742 PolarHBondContact O-N 3.05Å; L742-S746 WeakPolarHBondContact O-CB 3.37Å; L742-S746 PolarHBondContact O-N 3.06Å; L742-S746 PolarHBondContact O-OG 3.19Å; L742-Q790 HydrophobicContact CD1-CB 4.48Å; L742-Q790 HydrophobicContact CD1-CG 3.65Å; L742-R797 HydrophobicContact CD1-CG 4.41Å
743	K	85.6	Confident	87.2	Confident	166 Å²	166	43.8 Å²	43.8	72%	0.722	22%	0.224	S	C	*	.	H	α-helix	trans	-62.5	-48.6	176	-176.5	178.7	178.9	178.7	0	111.2	A739 V740 M741 S746 A747	A739-K743 WeakPolarHBondContact O-CB 3.37Å; A739-K743 PolarHBondContact O-N 2.81Å; V740-K743 PolarHBondContact O-N 3.42Å; M741-K743 VanDerWaalsContact C-N 3.3Å; M741-K743 PolarHBondContact O-N 3.27Å; K743-S746 PolarHBondContact O-N 2.76Å; K743-A747 PolarHBondContact O-N 3.07Å
744	E	90.4	Very high	87.3	Confident	46 Å²	46	49.2 Å²	49.2	22%	0.215	24%	0.238	C	C	.	.	H	α-helix	trans	-64.8	-46.8	-179.6	-173.4	53.8	-143.8	0	0	111.6	A712 V740 M741 S746 A747 V748 R751	A712-E744 HydrophobicContact CB-CG 4.14Å; V740-E744 PolarHBondContact O-N 3.2Å; M741-E744 PolarHBondContact O-N 2.97Å; E744-S746 VanDerWaalsContact C-N 3.28Å; E744-S746 PolarHBondContact O-N 3.14Å; E744-A747 WeakPolarHBondContact O-CB 3.42Å; E744-A747 PolarHBondContact O-N 3.42Å; E744-V748 WeakPolarHBondContact O-CG2 3.34Å; E744-V748 PolarHBondContact O-N 3.43Å; E744-R751 IonicContact OE1-NH2 2.83Å; E744-R751 PolarHBondContact OE1-NH2 2.74Å
745	L	89.7	Confident	87.5	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-64.1	-33.2	179.4	-65.4	175.7	0	0	0	112.6	M741 R749 Q790 P817 F822	M741-L745 WeakPolarHBondContact O-CB 3.44Å; M741-L745 WeakPolarHBondContact O-CG 3.21Å; M741-L745 PolarHBondContact O-N 3.27Å; L745-R749 PolarHBondContact O-N 3.23Å; L745-Q790 HydrophobicContact CB-CB 4.41Å; L745-Q790 VanDerWaalsContact CD1-OE1 3.28Å; L745-P817 HydrophobicContact CD1-CB 4.04Å; L745-P817 HydrophobicContact CD1-CG 4.38Å; L745-P817 HydrophobicContact CD2-CB 3.96Å; L745-P817 HydrophobicContact CD2-CG 4.07Å; L745-F822 HydrophobicContact CB-CD2 3.82Å; L745-F822 HydrophobicContact CB-CE2 3.86Å; L745-F822 HydrophobicContact CD1-CB 4.37Å; L745-F822 HydrophobicContact CD1-CD2 4.03Å; L745-F822 HydrophobicContact CD1-CG 4.44Å; L745-F822 HydrophobicContact CD2-CD2 3.72Å; L745-F822 HydrophobicContact CD2-CE2 3.84Å; L745-F822 HydrophobicContact CD2-CG 4.1Å; L745-F822 HydrophobicContact CD2-CZ 4.31Å; L745-F822 HydrophobicContact CG-CD2 4.05Å; L745-F822 HydrophobicContact CG-CE2 4.34Å
746	S	86.3	Confident	87.8	Confident	41 Å²	41	40.4 Å²	40.4	29%	0.287	20%	0.201	S	C	.	.	H	α-helix	trans	-67.5	-41.3	172.3	-60.2	0	0	0	0	111.6	L742 K743 E744 V748 R749 D750	L742-S746 WeakPolarHBondContact O-CB 3.37Å; L742-S746 PolarHBondContact O-N 3.06Å; L742-S746 PolarHBondContact O-OG 3.19Å; K743-S746 PolarHBondContact O-N 2.76Å; E744-S746 VanDerWaalsContact C-N 3.28Å; E744-S746 PolarHBondContact O-N 3.14Å; S746-V748 VanDerWaalsContact C-N 3.35Å; S746-V748 PolarHBondContact O-N 3.32Å; S746-R749 PolarHBondContact O-N 3.07Å; S746-D750 PolarHBondContact O-N 2.96Å; S746-D750 VanDerWaalsContact O-N 3.12Å
747	A	88.7	Confident	87.8	Confident	34 Å²	34	42 Å²	42	28%	0.281	21%	0.209	S	C	.	.	H	α-helix	trans	-64.7	-37.5	177.2	0	0	0	0	0	112.4	K743 E744 D750 R751	K743-A747 PolarHBondContact O-N 3.07Å; E744-A747 WeakPolarHBondContact O-CB 3.42Å; E744-A747 PolarHBondContact O-N 3.42Å; A747-D750 PolarHBondContact O-N 3.01Å; A747-R751 WeakPolarHBondContact O-CB 3.36Å; A747-R751 WeakPolarHBondContact O-CG 3.42Å; A747-R751 PolarHBondContact O-N 3.28Å
748	V	90.1	Very high	87.7	Confident	1 Å²	1	45.1 Å²	45.1	1%	0.006	24%	0.242	C	C	.	.	H	α-helix	trans	-58.2	-47.7	174.5	172.2	0	0	0	0	110.8	V706 E744 S746 D750 R751 A752 F822	V706-V748 HydrophobicContact CG2-CG1 4.4Å; E744-V748 WeakPolarHBondContact O-CG2 3.34Å; E744-V748 PolarHBondContact O-N 3.43Å; S746-V748 VanDerWaalsContact C-N 3.35Å; S746-V748 PolarHBondContact O-N 3.32Å; V748-D750 VanDerWaalsContact C-N 3.34Å; V748-D750 PolarHBondContact O-N 2.87Å; V748-R751 PolarHBondContact O-N 3.35Å; V748-A752 WeakPolarHBondContact O-CB 3.45Å; V748-A752 PolarHBondContact O-N 2.83Å; V748-F822 HydrophobicContact CG1-CZ 4.24Å
749	R	87.2	Confident	87.8	Confident	60 Å²	60	46.7 Å²	46.7	23%	0.226	25%	0.248	C	C	.	.	H	α-helix	trans	-59.2	-45.5	176.7	-175.6	-162.2	65.2	-174.2	-4.6	111.4	L745 S746 A752 G753	L745-R749 PolarHBondContact O-N 3.23Å; S746-R749 PolarHBondContact O-N 3.07Å; R749-A752 PolarHBondContact O-N 3.48Å; R749-G753 PolarHBondContact O-N 3.42Å
750	D	85.7	Confident	88.2	Confident	63 Å²	63	46.6 Å²	46.6	34%	0.337	24%	0.242	S	C	.	.	H	α-helix	trans	-69.3	-35.1	-177.8	-63.4	-11.7	0	0	0	112	S746 A747 V748 R754	S746-D750 PolarHBondContact O-N 2.96Å; S746-D750 VanDerWaalsContact O-N 3.12Å; A747-D750 PolarHBondContact O-N 3.01Å; V748-D750 VanDerWaalsContact C-N 3.34Å; V748-D750 PolarHBondContact O-N 2.87Å; D750-R754 WeakPolarHBondContact O-CG 3.35Å; D750-R754 PolarHBondContact O-N 2.89Å
751	R	91	Very high	88.3	Confident	72 Å²	72	50 Å²	50	27%	0.272	26%	0.26	S	S	.	.	H	α-helix	trans	-64.1	-50	171.6	-75.9	-168.4	-81.4	156.6	-9.8	111.2	L705 E708 E744 A747 V748 G753 R754 A755	L705-R751 HydrophobicContact CD1-CB 4.22Å; L705-R751 HydrophobicContact CD2-CB 4.3Å; E708-R751 IonicContact OE2-NH1 2.62Å; E708-R751 PolarHBondContact OE2-NH1 3.47Å; E744-R751 IonicContact OE1-NH2 2.83Å; E744-R751 PolarHBondContact OE1-NH2 2.74Å; A747-R751 WeakPolarHBondContact O-CB 3.36Å; A747-R751 WeakPolarHBondContact O-CG 3.42Å; A747-R751 PolarHBondContact O-N 3.28Å; V748-R751 PolarHBondContact O-N 3.35Å; R751-G753 VanDerWaalsContact C-N 3.28Å; R751-G753 PolarHBondContact O-N 2.91Å; R751-R754 PolarHBondContact O-N 3.05Å; R751-A755 PolarHBondContact O-N 2.64Å
752	A	89.1	Confident	88.2	Confident	1 Å²	1	58.5 Å²	58.5	1%	0.008	29%	0.292	C	S	.	.	H	α-helix	trans	-60.7	-38.8	177.4	0	0	0	0	0	111.7	L705 V748 R749 A755 C756 A786	L705-A752 HydrophobicContact CD1-CB 4.26Å; V748-A752 WeakPolarHBondContact O-CB 3.45Å; V748-A752 PolarHBondContact O-N 2.83Å; R749-A752 PolarHBondContact O-N 3.48Å; A752-A755 PolarHBondContact O-N 3.01Å; A752-C756 WeakPolarHBondContact O-CB 3.42Å; A752-C756 PolarHBondContact O-N 3.18Å; A752-A786 HydrophobicContact CB-CB 4.32Å
753	G	87.1	Confident	88.3	Confident	6 Å²	6	60.4 Å²	60.4	6%	0.062	30%	0.3	C	S	.	.	H	α-helix	trans	-64.5	-44.5	174.9	0	0	0	0	0	113.1	R749 R751 A755 C756 M757 S782	R749-G753 PolarHBondContact O-N 3.42Å; R751-G753 VanDerWaalsContact C-N 3.28Å; R751-G753 PolarHBondContact O-N 2.91Å; G753-A755 PolarHBondContact O-N 3.09Å; G753-C756 WeakPolarHBondContact O-CB 3.35Å; G753-C756 PolarHBondContact O-N 3.36Å; G753-M757 VanDerWaalsContact O-CG 3.24Å; G753-M757 WeakPolarHBondContact O-CG 3.41Å; G753-M757 PolarHBondContact O-N 3.21Å; G753-S782 WeakPolarHBondContact CA-OG 3.44Å
754	R	89.1	Confident	88.6	Confident	162 Å²	162	52.9 Å²	52.9	61%	0.611	27%	0.267	S	S	*	.	H	α-helix	trans	-62.8	-42.2	174.5	-75.3	-172	-66.2	-88.7	3.5	112.2	D750 R751 C756 M757 G758	D750-R754 WeakPolarHBondContact O-CG 3.35Å; D750-R754 PolarHBondContact O-N 2.89Å; R751-R754 PolarHBondContact O-N 3.05Å; R754-C756 VanDerWaalsContact C-N 3.33Å; R754-C756 PolarHBondContact O-N 2.91Å; R754-M757 PolarHBondContact O-N 3.04Å; R754-G758 PolarHBondContact O-N 2.86Å; R754-G758 VanDerWaalsContact O-N 3.08Å
755	A	90.2	Very high	88.8	Confident	23 Å²	23	50.8 Å²	50.8	19%	0.19	26%	0.258	C	S	.	.	H	α-helix	trans	-61.4	-42.4	176	0	0	0	0	0	111.6	L698 E701 R751 A752 G753 G758 K759	L698-A755 HydrophobicContact CD1-CB 4.33Å; E701-A755 HydrophobicContact CG-CB 4.22Å; R751-A755 PolarHBondContact O-N 2.64Å; A752-A755 PolarHBondContact O-N 3.01Å; G753-A755 PolarHBondContact O-N 3.09Å; A755-G758 PolarHBondContact O-N 3.01Å; A755-K759 WeakPolarHBondContact O-CG 3.21Å; A755-K759 PolarHBondContact O-N 2.72Å
756	C	89.9	Confident	89	Confident	0 Å²	0	51 Å²	51	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-57.2	-54.8	174	-179.6	0	0	0	0	111	L698 A752 G753 R754 G758 K759 L760 A786	L698-C756 HydrophobicContact CD1-CB 4.12Å; L698-C756 HydrophobicContact CD2-CB 4Å; A752-C756 WeakPolarHBondContact O-CB 3.42Å; A752-C756 PolarHBondContact O-N 3.18Å; G753-C756 WeakPolarHBondContact O-CB 3.35Å; G753-C756 PolarHBondContact O-N 3.36Å; R754-C756 VanDerWaalsContact C-N 3.33Å; R754-C756 PolarHBondContact O-N 2.91Å; C756-G758 VanDerWaalsContact C-N 3.26Å; C756-G758 PolarHBondContact O-N 3.01Å; C756-K759 PolarHBondContact O-N 2.86Å; C756-L760 WeakPolarHBondContact O-CG 3.27Å; C756-L760 PolarHBondContact O-N 3.28Å; C756-A786 HydrophobicContact CB-CB 4.16Å
757	M	86.2	Confident	89.3	Confident	36 Å²	36	49.7 Å²	49.7	18%	0.177	25%	0.249	C	C	.	.	H	α-helix	trans	-62.1	-31.6	-176.5	-63.5	-65.1	-75.2	0	0	113.8	G753 R754 K759 L760 L767 V778 V781	G753-M757 VanDerWaalsContact O-CG 3.24Å; G753-M757 WeakPolarHBondContact O-CG 3.41Å; G753-M757 PolarHBondContact O-N 3.21Å; R754-M757 PolarHBondContact O-N 3.04Å; M757-K759 VanDerWaalsContact C-N 3.32Å; M757-L760 HydrophobicContact SD-CD1 4.32Å; M757-L767 HydrophobicContact CE-CD1 3.15Å; M757-L767 HydrophobicContact SD-CD1 3.95Å; M757-V778 HydrophobicContact CE-CB 4.2Å; M757-V778 HydrophobicContact CE-CG1 3.81Å; M757-V778 HydrophobicContact CE-CG2 3.76Å; M757-V778 HydrophobicContact CG-CG1 3.58Å; M757-V778 HydrophobicContact SD-CG1 3.87Å; M757-V781 HydrophobicContact SD-CB 4.31Å; M757-V781 HydrophobicContact SD-CG1 4.11Å
758	G	85.8	Confident	89.5	Confident	71 Å²	71	48.3 Å²	48.3	73%	0.732	24%	0.237	S	C	*	.	H	α-helix	trans	-72.2	-22.9	176.2	0	0	0	0	0	114.2	R754 A755 C756	R754-G758 PolarHBondContact O-N 2.86Å; R754-G758 VanDerWaalsContact O-N 3.08Å; A755-G758 PolarHBondContact O-N 3.01Å; C756-G758 VanDerWaalsContact C-N 3.26Å; C756-G758 PolarHBondContact O-N 3.01Å
759	K	88.4	Confident	89.7	Confident	95 Å²	95	50.3 Å²	50.3	41%	0.413	25%	0.246	S	C	.	.	H	α-helix	trans	-99.8	-18	-176.5	-67.9	-172.8	-177	-168	0	114.1	D697 L698 A755 C756 M757	D697-K759 HydrophobicContact CB-CD 4.43Å; D697-K759 PolarHBondContact O-NZ 3.02Å; L698-K759 HydrophobicContact CB-CD 4.09Å; L698-K759 HydrophobicContact CD1-CD 4.45Å; A755-K759 WeakPolarHBondContact O-CG 3.21Å; A755-K759 PolarHBondContact O-N 2.72Å; C756-K759 PolarHBondContact O-N 2.86Å; M757-K759 VanDerWaalsContact C-N 3.32Å
760	L	89.5	Confident	89.9	Confident	30 Å²	30	47.5 Å²	47.5	16%	0.157	24%	0.236	C	C	.	.	S	Bend	trans	-70	144.5	179.8	-65.7	170.6	0	0	0	112.1	C756 M757 N764 L767 V781 I785	C756-L760 WeakPolarHBondContact O-CG 3.27Å; C756-L760 PolarHBondContact O-N 3.28Å; M757-L760 HydrophobicContact SD-CD1 4.32Å; L760-N764 WeakPolarHBondContact CD2-ND2 3.49Å; L760-L767 HydrophobicContact CB-CD2 4.12Å; L760-V781 HydrophobicContact CD1-CG1 3.77Å; L760-I785 HydrophobicContact CD1-CD1 3.87Å; L760-I785 HydrophobicContact CD2-CD1 3.7Å; L760-I785 HydrophobicContact CG-CD1 4.41Å
761	N	88.9	Confident	90.2	Very high	101 Å²	101	46.9 Å²	46.9	54%	0.54	23%	0.233	S	C	.	.			trans	-61.6	139.3	174.9	-174.2	-15.8	0	0	0	110.8	H763 N764 L767	N761-H763 PolarHBondContact O-N 2.83Å; N761-H763 VanDerWaalsContact O-N 3.08Å; N761-H763 PolarHBondContact OD1-CD2 3.07Å; N761-H763 PolarHBondContact OD1-N 3.4Å; N761-N764 WeakPolarHBondContact O-CB 3.46Å; N761-N764 PolarHBondContact O-N 3.23Å; N761-L767 WeakPolarHBondContact O-CD2 3.47Å
762	R	85.8	Confident	90.2	Very high	178 Å²	178	43.5 Å²	43.5	67%	0.672	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-21	174.3	69.1	179.6	178.1	-166.5	-5.8	114.8
763	H	89.2	Confident	90.3	Very high	83 Å²	83	44 Å²	44	38%	0.384	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.1	-2.8	177.5	-61.8	-70.9	0	0	0	113.3	D547 N761 A765	D547-H763 IonicContact OD2-CE1 3.05Å; N761-H763 PolarHBondContact O-N 2.83Å; N761-H763 VanDerWaalsContact O-N 3.08Å; N761-H763 PolarHBondContact OD1-CD2 3.07Å; N761-H763 PolarHBondContact OD1-N 3.4Å; H763-A765 PolarHBondContact O-N 2.88Å
764	N	92.9	Very high	90.5	Very high	7 Å²	7	44.4 Å²	44.4	4%	0.037	23%	0.227	C	C	.	.			trans	-63.3	128.2	-178.7	-171.2	0.2	0	0	0	111.3	D691 L760 N761 P766 L767 I768	D691-N764 WeakPolarHBondContact CA-OD1 3.19Å; D691-N764 WeakPolarHBondContact CB-OD1 3.34Å; D691-N764 PolarHBondContact O-ND2 3.24Å; D691-N764 PolarHBondContact O-OD1 3.11Å; D691-N764 PolarHBondContact OD1-OD1 3.29Å; L760-N764 WeakPolarHBondContact CD2-ND2 3.49Å; N761-N764 WeakPolarHBondContact O-CB 3.46Å; N761-N764 PolarHBondContact O-N 3.23Å; N764-P766 WeakPolarHBondContact OD1-CD 3.5Å; N764-L767 HydrophobicContact CB-CB 4.03Å; N764-L767 WeakPolarHBondContact O-CB 3.27Å; N764-L767 PolarHBondContact O-N 3.37Å; N764-I768 WeakPolarHBondContact O-CG1 3.43Å; N764-I768 PolarHBondContact O-N 2.99Å
765	A	94.4	Very high	90.6	Very high	3 Å²	3	43.1 Å²	43.1	3%	0.025	23%	0.226	C	C	.	.	H	α-helix	trans	-64.7	-48.9	-171.2	0	0	0	0	0	114.1	F685 S686 I687 H763 L767 I768 M769	F685-A765 HydrophobicContact CE1-CB 4.32Å; F685-A765 HydrophobicContact CE2-CB 3.87Å; F685-A765 HydrophobicContact CZ-CB 3.64Å; S686-A765 VanDerWaalsContact O-CB 3.24Å; S686-A765 WeakPolarHBondContact O-CB 3.49Å; I687-A765 HydrophobicContact CB-CB 4.35Å; H763-A765 PolarHBondContact O-N 2.88Å; A765-L767 VanDerWaalsContact C-N 3.28Å; A765-L767 PolarHBondContact O-N 3.37Å; A765-I768 PolarHBondContact O-N 2.92Å; A765-I768 VanDerWaalsContact O-N 3.17Å; A765-M769 WeakPolarHBondContact O-CG 3.02Å; A765-M769 PolarHBondContact O-N 3.3Å
766	P	94.1	Very high	90.4	Very high	4 Å²	4	44.1 Å²	44.1	3%	0.026	24%	0.239	C	C	.	.	H	α-helix	trans	-61.7	-34.6	175.6	-24.6	38.2	0	0	0	113.2	I687 D691 V692 N764 M769 A770 V781 M784	I687-P766 HydrophobicContact CD1-CG 3.54Å; I687-P766 HydrophobicContact CG1-CG 3.91Å; D691-P766 HydrophobicContact CB-CG 4.25Å; V692-P766 HydrophobicContact CG1-CG 4.48Å; N764-P766 WeakPolarHBondContact OD1-CD 3.5Å; P766-M769 HydrophobicContact CB-CE 4.41Å; P766-M769 HydrophobicContact CG-CE 4.43Å; P766-M769 PolarHBondContact O-N 3.11Å; P766-A770 WeakPolarHBondContact O-CB 3.22Å; P766-A770 PolarHBondContact O-N 2.96Å; P766-V781 HydrophobicContact CB-CG2 3.89Å; P766-M784 HydrophobicContact CB-CE 4.39Å
767	L	92.5	Very high	90.3	Very high	13 Å²	13	46 Å²	46	7%	0.068	25%	0.252	C	S	.	.	H	α-helix	trans	-63.4	-47.4	174.5	177.1	61	0	0	0	110.5	M757 L760 N761 N764 A765 M769 A770 L771	M757-L767 HydrophobicContact CE-CD1 3.15Å; M757-L767 HydrophobicContact SD-CD1 3.95Å; L760-L767 HydrophobicContact CB-CD2 4.12Å; N761-L767 WeakPolarHBondContact O-CD2 3.47Å; N764-L767 HydrophobicContact CB-CB 4.03Å; N764-L767 WeakPolarHBondContact O-CB 3.27Å; N764-L767 PolarHBondContact O-N 3.37Å; A765-L767 VanDerWaalsContact C-N 3.28Å; A765-L767 PolarHBondContact O-N 3.37Å; L767-M769 PolarHBondContact O-N 3.24Å; L767-A770 PolarHBondContact O-N 2.92Å; L767-L771 HydrophobicContact CD1-CD1 3.94Å; L767-L771 HydrophobicContact CD1-CG 4.05Å; L767-L771 HydrophobicContact CG-CD1 3.9Å; L767-L771 HydrophobicContact CG-CG 4.4Å; L767-L771 WeakPolarHBondContact O-CB 3.44Å; L767-L771 VanDerWaalsContact O-CG 3.27Å; L767-L771 WeakPolarHBondContact O-CG 3.41Å; L767-L771 PolarHBondContact O-N 3.01Å
768	I	93.2	Very high	90.3	Very high	5 Å²	5	47.3 Å²	47.3	3%	0.026	26%	0.261	C	S	.	.	H	α-helix	trans	-59.3	-47.8	177.3	-71.7	164.1	0	0	0	110.8	Y541 L542 F685 N764 A765 A770 L771 C772	Y541-I768 HydrophobicContact CD1-CG2 3.91Å; Y541-I768 HydrophobicContact CE1-CG2 3.94Å; L542-I768 HydrophobicContact CD2-CD1 4.2Å; L542-I768 HydrophobicContact CD2-CG2 3.98Å; L542-I768 HydrophobicContact CG-CG2 4.4Å; F685-I768 HydrophobicContact CE2-CB 4.43Å; F685-I768 HydrophobicContact CE2-CD1 4.2Å; F685-I768 HydrophobicContact CE2-CG2 4.22Å; F685-I768 HydrophobicContact CZ-CB 4.36Å; F685-I768 HydrophobicContact CZ-CG2 4.18Å; N764-I768 WeakPolarHBondContact O-CG1 3.43Å; N764-I768 PolarHBondContact O-N 2.99Å; A765-I768 PolarHBondContact O-N 2.92Å; A765-I768 VanDerWaalsContact O-N 3.17Å; I768-A770 VanDerWaalsContact C-N 3.32Å; I768-A770 PolarHBondContact O-N 2.73Å; I768-L771 PolarHBondContact O-N 3.09Å; I768-C772 PolarHBondContact O-N 2.97Å; I768-C772 PolarHBondContact O-SG 3.5Å
769	M	94.1	Very high	90.4	Very high	43 Å²	43	47.7 Å²	47.7	21%	0.212	25%	0.246	C	C	.	.	H	α-helix	trans	-61.6	-38.8	179.5	-67.3	-173.2	-70.3	0	0	112.4	F685 I687 A765 P766 L767 C772 G773 S774 K775	F685-M769 HydrophobicContact CE1-CG 3.89Å; F685-M769 HydrophobicContact CE1-SD 4.07Å; F685-M769 HydrophobicContact CZ-CG 3.97Å; I687-M769 HydrophobicContact CD1-CE 4.49Å; A765-M769 WeakPolarHBondContact O-CG 3.02Å; A765-M769 PolarHBondContact O-N 3.3Å; P766-M769 HydrophobicContact CB-CE 4.41Å; P766-M769 HydrophobicContact CG-CE 4.43Å; P766-M769 PolarHBondContact O-N 3.11Å; L767-M769 PolarHBondContact O-N 3.24Å; M769-C772 PolarHBondContact O-SG 3.14Å; M769-G773 WeakPolarHBondContact O-CA 3.45Å; M769-G773 PolarHBondContact O-N 3.22Å; M769-S774 PolarHBondContact O-N 3.1Å; M769-K775 WeakPolarHBondContact CB-O 3.34Å
770	A	91.5	Very high	90.6	Very high	1 Å²	1	46.8 Å²	46.8	1%	0.008	25%	0.245	C	C	.	.	H	α-helix	trans	-70.2	-37.6	176.5	0	0	0	0	0	113.1	P766 L767 I768 V781	P766-A770 WeakPolarHBondContact O-CB 3.22Å; P766-A770 PolarHBondContact O-N 2.96Å; L767-A770 PolarHBondContact O-N 2.92Å; I768-A770 VanDerWaalsContact C-N 3.32Å; I768-A770 PolarHBondContact O-N 2.73Å; A770-V781 HydrophobicContact CB-CG2 4.1Å
771	L	90.4	Very high	90.7	Very high	51 Å²	51	45.5 Å²	45.5	27%	0.267	24%	0.239	S	C	.	.	H	α-helix	trans	-70.8	-50.8	178.2	-73	174.1	0	0	0	111.6	L767 I768 G773	L767-L771 HydrophobicContact CD1-CD1 3.94Å; L767-L771 HydrophobicContact CD1-CG 4.05Å; L767-L771 HydrophobicContact CG-CD1 3.9Å; L767-L771 HydrophobicContact CG-CG 4.4Å; L767-L771 WeakPolarHBondContact O-CB 3.44Å; L767-L771 VanDerWaalsContact O-CG 3.27Å; L767-L771 WeakPolarHBondContact O-CG 3.41Å; L767-L771 PolarHBondContact O-N 3.01Å; I768-L771 PolarHBondContact O-N 3.09Å; L771-G773 PolarHBondContact O-N 3.44Å
772	C	91.8	Very high	90.8	Very high	1 Å²	1	41 Å²	41	1%	0.007	22%	0.215	C	C	.	.	H	α-helix	trans	-69.5	-22.7	178.1	74.1	0	0	0	0	112.2	I537 Y541 K641 I768 M769 S774	I537-C772 HydrophobicContact CG2-CB 4.31Å; Y541-C772 HydrophobicContact CD1-CB 3.87Å; Y541-C772 HydrophobicContact CD2-CB 3.68Å; Y541-C772 HydrophobicContact CE1-CB 4.46Å; Y541-C772 HydrophobicContact CE2-CB 4.29Å; Y541-C772 HydrophobicContact CG-CB 3.45Å; Y541-C772 VanDerWaalsContact CG-CB 3.45Å; K641-C772 VanDerWaalsContact CB-O 3.32Å; K641-C772 WeakPolarHBondContact CB-O 3.49Å; K641-C772 PolarHBondContact N-O 2.83Å; I768-C772 PolarHBondContact O-N 2.97Å; I768-C772 PolarHBondContact O-SG 3.5Å; M769-C772 PolarHBondContact O-SG 3.14Å; C772-S774 PolarHBondContact SG-N 3.14Å; C772-S774 PolarHBondContact SG-OG 2.97Å
773	G	90.7	Very high	91.1	Very high	11 Å²	11	34.5 Å²	34.5	11%	0.113	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	80.9	20.1	178.2	0	0	0	0	0	114	K641 M769 L771	K641-G773 WeakPolarHBondContact CD-O 3.48Å; M769-G773 WeakPolarHBondContact O-CA 3.45Å; M769-G773 PolarHBondContact O-N 3.22Å; L771-G773 PolarHBondContact O-N 3.44Å
774	S	91.7	Very high	91.3	Very high	15 Å²	15	33.3 Å²	33.3	11%	0.105	19%	0.188	C	C	.	.	S	Bend	trans	-65.1	-55.3	178.6	56.4	0	0	0	0	111.5	Q534 T538 M769 C772	Q534-S774 WeakPolarHBondContact O-CB 3.4Å; T538-S774 WeakPolarHBondContact OG1-CB 3.14Å; T538-S774 PolarHBondContact OG1-OG 3.22Å; M769-S774 PolarHBondContact O-N 3.1Å; C772-S774 PolarHBondContact SG-N 3.14Å; C772-S774 PolarHBondContact SG-OG 2.97Å
775	K	91.3	Very high	91.3	Very high	135 Å²	135	33 Å²	33	59%	0.587	19%	0.186	S	C	*	.	S	Bend	trans	-153.4	143.9	174.7	-160	161.2	-174.3	170.8	0	110.9	M769	M769-K775 WeakPolarHBondContact CB-O 3.34Å
776	G	86.8	Confident	91.1	Very high	44 Å²	44	33 Å²	33	45%	0.454	19%	0.186	S	C	.	.			trans	82.7	170.9	-176.7	0	0	0	0	0	113.5
777	S	87.5	Confident	91.1	Very high	40 Å²	40	32.8 Å²	32.8	28%	0.28	18%	0.184	S	C	.	.			trans	-133.1	169.5	177.9	78.8	0	0	0	0	110.3	I779 N780 V781	S777-I779 PolarHBondContact O-N 2.87Å; S777-I779 PolarHBondContact OG-N 2.7Å; S777-N780 WeakPolarHBondContact CB-OD1 3.25Å; S777-N780 PolarHBondContact N-OD1 3.06Å; S777-N780 WeakPolarHBondContact O-CB 3.47Å; S777-N780 PolarHBondContact O-N 3.45Å; S777-N780 PolarHBondContact OG-N 3.31Å; S777-N780 PolarHBondContact OG-OD1 3.37Å; S777-V781 PolarHBondContact O-N 2.73Å
778	V	86.5	Confident	91.1	Very high	62 Å²	62	32.2 Å²	32.2	38%	0.376	18%	0.182	S	C	.	.	H	α-helix	trans	-54.7	-33.8	172.6	177.8	0	0	0	0	111.7	M757 S782	M757-V778 HydrophobicContact CE-CB 4.2Å; M757-V778 HydrophobicContact CE-CG1 3.81Å; M757-V778 HydrophobicContact CE-CG2 3.76Å; M757-V778 HydrophobicContact CG-CG1 3.58Å; M757-V778 HydrophobicContact SD-CG1 3.87Å; V778-S782 WeakPolarHBondContact O-CB 3.39Å; V778-S782 PolarHBondContact O-N 3.46Å
779	I	87.3	Confident	91	Very high	79 Å²	79	32 Å²	32	41%	0.405	18%	0.181	S	C	.	.	H	α-helix	trans	-67.3	-44.1	177.6	-59.8	172.5	0	0	0	110.3	S777 V781 S782 Q783	S777-I779 PolarHBondContact O-N 2.87Å; S777-I779 PolarHBondContact OG-N 2.7Å; I779-V781 VanDerWaalsContact C-N 3.34Å; I779-V781 PolarHBondContact O-N 3.03Å; I779-S782 WeakPolarHBondContact O-CB 3.25Å; I779-S782 PolarHBondContact O-N 3.41Å; I779-Q783 HydrophobicContact CG2-CG 4.29Å; I779-Q783 VanDerWaalsContact O-CG 3.3Å; I779-Q783 WeakPolarHBondContact O-CG 3.31Å; I779-Q783 PolarHBondContact O-N 2.79Å
780	N	91.4	Very high	90.8	Very high	76 Å²	76	31 Å²	31	41%	0.406	18%	0.175	S	C	.	.	H	α-helix	trans	-61.2	-43.8	179.1	-62.1	75.8	0	0	0	111.4	S777 S782 Q783 M784	S777-N780 WeakPolarHBondContact CB-OD1 3.25Å; S777-N780 PolarHBondContact N-OD1 3.06Å; S777-N780 WeakPolarHBondContact O-CB 3.47Å; S777-N780 PolarHBondContact O-N 3.45Å; S777-N780 PolarHBondContact OG-N 3.31Å; S777-N780 PolarHBondContact OG-OD1 3.37Å; N780-S782 VanDerWaalsContact C-N 3.34Å; N780-Q783 PolarHBondContact O-N 3.26Å; N780-M784 WeakPolarHBondContact O-CG 3.48Å; N780-M784 PolarHBondContact O-N 3.12Å; N780-M784 VanDerWaalsContact O-N 3.12Å
781	V	92	Very high	90.8	Very high	4 Å²	4	31.8 Å²	31.8	2%	0.024	18%	0.179	C	C	.	.	H	α-helix	trans	-62	-44.8	176.2	-178.7	0	0	0	0	110.4	M757 L760 P766 A770 S777 I779 Q783 M784 I785	M757-V781 HydrophobicContact SD-CB 4.31Å; M757-V781 HydrophobicContact SD-CG1 4.11Å; L760-V781 HydrophobicContact CD1-CG1 3.77Å; P766-V781 HydrophobicContact CB-CG2 3.89Å; A770-V781 HydrophobicContact CB-CG2 4.1Å; S777-V781 PolarHBondContact O-N 2.73Å; I779-V781 VanDerWaalsContact C-N 3.34Å; I779-V781 PolarHBondContact O-N 3.03Å; V781-Q783 VanDerWaalsContact C-N 3.32Å; V781-Q783 PolarHBondContact O-N 3.04Å; V781-M784 HydrophobicContact CG2-CE 4.48Å; V781-M784 PolarHBondContact O-N 3.29Å; V781-I785 HydrophobicContact CG1-CD1 3.81Å; V781-I785 WeakPolarHBondContact O-CG1 3.34Å; V781-I785 PolarHBondContact O-N 2.89Å; V781-I785 VanDerWaalsContact O-N 3.17Å
782	S	91.1	Very high	90.4	Very high	5 Å²	5	31.6 Å²	31.6	4%	0.035	18%	0.184	C	C	.	.	H	α-helix	trans	-59.2	-40.1	175.3	-178.5	0	0	0	0	113	G753 V778 I779 N780 A786 C787	G753-S782 WeakPolarHBondContact CA-OG 3.44Å; V778-S782 WeakPolarHBondContact O-CB 3.39Å; V778-S782 PolarHBondContact O-N 3.46Å; I779-S782 WeakPolarHBondContact O-CB 3.25Å; I779-S782 PolarHBondContact O-N 3.41Å; N780-S782 VanDerWaalsContact C-N 3.34Å; S782-A786 WeakPolarHBondContact O-CA 3.5Å; S782-A786 WeakPolarHBondContact O-CB 3.42Å; S782-A786 PolarHBondContact O-N 3.31Å; S782-C787 PolarHBondContact O-N 2.97Å
783	Q	91.8	Very high	90	Very high	43 Å²	43	33.2 Å²	33.2	20%	0.201	19%	0.193	C	C	.	.	H	α-helix	trans	-70	-34.9	-179	-71.3	179	-38.7	0	0	112.8	I779 N780 V781 C787 V788 F827	I779-Q783 HydrophobicContact CG2-CG 4.29Å; I779-Q783 VanDerWaalsContact O-CG 3.3Å; I779-Q783 WeakPolarHBondContact O-CG 3.31Å; I779-Q783 PolarHBondContact O-N 2.79Å; N780-Q783 PolarHBondContact O-N 3.26Å; V781-Q783 VanDerWaalsContact C-N 3.32Å; V781-Q783 PolarHBondContact O-N 3.04Å; Q783-C787 WeakPolarHBondContact CA-O 3.43Å; Q783-V788 PolarHBondContact NE2-O 3.48Å; Q783-F827 HydrophobicContact CB-CD2 4.35Å; Q783-F827 HydrophobicContact CB-CE2 3.98Å; Q783-F827 PolarHBondContact O-N 3.14Å
784	M	93.6	Very high	89.3	Confident	57 Å²	57	37.4 Å²	37.4	28%	0.281	21%	0.212	S	C	.	.	H	α-helix	trans	-70.2	-37.3	177.1	-68	-176.8	-62.4	0	0	112.3	V692 P766 N780 V781 S826 F827 Y828	V692-M784 HydrophobicContact CG1-CB 4.32Å; V692-M784 HydrophobicContact CG1-CE 4.49Å; V692-M784 HydrophobicContact CG1-SD 4.49Å; P766-M784 HydrophobicContact CB-CE 4.39Å; N780-M784 WeakPolarHBondContact O-CG 3.48Å; N780-M784 PolarHBondContact O-N 3.12Å; N780-M784 VanDerWaalsContact O-N 3.12Å; V781-M784 HydrophobicContact CG2-CE 4.48Å; V781-M784 PolarHBondContact O-N 3.29Å; M784-S826 WeakPolarHBondContact O-CB 3.33Å; M784-S826 PolarHBondContact O-OG 3.15Å; M784-F827 HydrophobicContact CG-CD2 4.08Å; M784-Y828 WeakPolarHBondContact O-CB 3.47Å; M784-Y828 PolarHBondContact O-N 2.73Å; M784-Y828 VanDerWaalsContact O-N 3.15Å
785	I	93.3	Very high	88.4	Confident	2 Å²	2	39 Å²	39	1%	0.01	23%	0.231	C	C	.	.	H	α-helix	trans	-102.2	-53.3	-169.8	-53.6	-178.3	0	0	0	112.4	V692 P694 L698 L760 V781 S826	V692-I785 HydrophobicContact CB-CG1 4.12Å; V692-I785 HydrophobicContact CG1-CG1 4.41Å; P694-I785 HydrophobicContact CB-CG2 3.92Å; L698-I785 HydrophobicContact CD2-CG2 3.75Å; L760-I785 HydrophobicContact CD1-CD1 3.87Å; L760-I785 HydrophobicContact CD2-CD1 3.7Å; L760-I785 HydrophobicContact CG-CD1 4.41Å; V781-I785 HydrophobicContact CG1-CD1 3.81Å; V781-I785 WeakPolarHBondContact O-CG1 3.34Å; V781-I785 PolarHBondContact O-N 2.89Å; V781-I785 VanDerWaalsContact O-N 3.17Å; I785-S826 WeakPolarHBondContact O-CB 3.19Å; I785-S826 PolarHBondContact O-OG 3.1Å
786	A	91.2	Very high	87.8	Confident	1 Å²	1	39.8 Å²	39.8	1%	0.008	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.4	-76.3	-170	0	0	0	0	0	112.6	K702 A752 C756 S782	K702-A786 VanDerWaalsContact CD-O 3.26Å; K702-A786 WeakPolarHBondContact CD-O 3.46Å; K702-A786 WeakPolarHBondContact CE-O 3.36Å; K702-A786 PolarHBondContact NZ-O 3.12Å; A752-A786 HydrophobicContact CB-CB 4.32Å; C756-A786 HydrophobicContact CB-CB 4.16Å; S782-A786 WeakPolarHBondContact O-CA 3.5Å; S782-A786 WeakPolarHBondContact O-CB 3.42Å; S782-A786 PolarHBondContact O-N 3.31Å
787	C	92.2	Very high	87.8	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	21%	0.211	C	C	.	.			trans	-155.6	147.5	177	64.5	0	0	0	0	111.1	S782 Q783 D824	S782-C787 PolarHBondContact O-N 2.97Å; Q783-C787 WeakPolarHBondContact CA-O 3.43Å; C787-D824 VanDerWaalsContact CB-O 3.23Å; C787-D824 WeakPolarHBondContact CB-O 3.4Å
788	V	92.5	Very high	87.9	Confident	2 Å²	2	36.5 Å²	36.5	1%	0.012	20%	0.199	C	C	.	.			trans	-70.2	-39.8	177.9	179.6	0	0	0	0	111.1	Q783 I823 S825 F827 L831	Q783-V788 PolarHBondContact NE2-O 3.48Å; V788-I823 HydrophobicContact CB-CB 4.11Å; V788-I823 HydrophobicContact CB-CG2 3.95Å; V788-I823 HydrophobicContact CG1-CD1 4.46Å; V788-I823 HydrophobicContact CG2-CG2 4.26Å; V788-S825 PolarHBondContact N-O 2.95Å; V788-F827 HydrophobicContact CG1-CZ 4.35Å; V788-F827 HydrophobicContact CG2-CD1 4.26Å; V788-F827 HydrophobicContact CG2-CD2 4.35Å; V788-F827 HydrophobicContact CG2-CE1 4.02Å; V788-F827 HydrophobicContact CG2-CE2 4.12Å; V788-F827 HydrophobicContact CG2-CG 4.42Å; V788-F827 HydrophobicContact CG2-CZ 3.95Å; V788-L831 HydrophobicContact CG2-CD2 4.24Å
789	G	91.6	Very high	88	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	88.9	-167.3	178.3	0	0	0	0	0	114.2	Q791 I823	G789-Q791 PolarHBondContact O-N 3.05Å; G789-Q791 PolarHBondContact O-NE2 3.4Å; G789-Q791 VanDerWaalsContact O-NE2 3.11Å; G789-I823 PolarHBondContact N-O 3.09Å; G789-I823 PolarHBondContact O-N 2.76Å
790	Q	90.5	Very high	88.1	Confident	22 Å²	22	37.2 Å²	37.2	10%	0.103	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	127	-176.9	-178.1	60.6	60.6	0	0	112.4	L742 L745 R797 K820 G821 F822	L742-Q790 HydrophobicContact CD1-CB 4.48Å; L742-Q790 HydrophobicContact CD1-CG 3.65Å; L745-Q790 HydrophobicContact CB-CB 4.41Å; L745-Q790 VanDerWaalsContact CD1-OE1 3.28Å; Q790-R797 HydrophobicContact CG-CG 4.32Å; Q790-K820 PolarHBondContact NE2-O 2.88Å; Q790-G821 VanDerWaalsContact NE2-C 3.34Å; Q790-G821 PolarHBondContact NE2-O 3.48Å; Q790-F822 HydrophobicContact CB-CD2 4.04Å
791	Q	90.5	Very high	88	Confident	18 Å²	18	36.7 Å²	36.7	8%	0.084	23%	0.225	C	C	.	.			trans	-84.7	118.5	168.5	-55.2	-51.2	-76	0	0	109.3	G789 G821 I823 F838 H839 A842	G789-Q791 PolarHBondContact O-N 3.05Å; G789-Q791 PolarHBondContact O-NE2 3.4Å; G789-Q791 VanDerWaalsContact O-NE2 3.11Å; Q791-G821 PolarHBondContact N-O 3.25Å; Q791-I823 HydrophobicContact CG-CD1 3.5Å; Q791-I823 HydrophobicContact CG-CG1 4.12Å; Q791-F838 HydrophobicContact CG-CB 4.42Å; Q791-H839 PolarHBondContact OE1-ND1 3.12Å; Q791-A842 HydrophobicContact CB-CB 4.08Å
792	A	83.8	Confident	88	Confident	46 Å²	46	41.6 Å²	41.6	38%	0.38	25%	0.246	S	C	.	.			trans	-108.1	133.1	178.5	0	0	0	0	0	110	R796	A792-R796 CarbonylContact C-O 3.53Å; A792-R796 VanDerWaalsContact CA-O 3.31Å; A792-R796 WeakPolarHBondContact CA-O 3.4Å
793	I	82.1	Confident	88	Confident	36 Å²	36	48.3 Å²	48.3	19%	0.185	28%	0.28	C	S	.	.	B	Isolated β-bridge	trans	-118.4	123.5	177.6	-57.5	173.8	0	0	0	108	G795 R796 P798 M841 E845	I793-G795 PolarHBondContact O-N 2.83Å; I793-G795 VanDerWaalsContact O-N 3.17Å; I793-R796 PolarHBondContact N-O 2.89Å; I793-R796 PolarHBondContact O-N 2.99Å; I793-R796 VanDerWaalsContact O-O 3.12Å; I793-P798 HydrophobicContact CD1-CB 4.27Å; I793-P798 HydrophobicContact CD1-CG 4.23Å; I793-M841 HydrophobicContact CD1-CB 3.89Å; I793-M841 HydrophobicContact CD1-CE 3.9Å; I793-E845 WeakPolarHBondContact CA-OE2 3.31Å; I793-E845 WeakPolarHBondContact CG2-OE2 3.21Å
794	N	75.6	Confident	87.9	Confident	98 Å²	98	50.9 Å²	50.9	52%	0.524	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.7	34.5	-172	-66.7	-52.2	0	0	0	114	R796 E845	N794-R796 PolarHBondContact O-N 3.03Å; N794-E845 PolarHBondContact N-OE1 3.22Å; N794-E845 PolarHBondContact OD1-OE1 3.34Å
795	G	73.3	Confident	87.8	Confident	49 Å²	49	51.7 Å²	51.7	51%	0.505	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.2	8.2	-178.4	0	0	0	0	0	115.3	I793	I793-G795 PolarHBondContact O-N 2.83Å; I793-G795 VanDerWaalsContact O-N 3.17Å
796	R	79.4	Confident	87.6	Confident	152 Å²	152	51.9 Å²	51.9	57%	0.574	30%	0.297	S	S	*	.	B	Isolated β-bridge	trans	-120.5	165.7	175.6	-60.9	-177.8	-174.2	-176.8	1.7	110.7	A792 I793 N794	A792-R796 CarbonylContact C-O 3.53Å; A792-R796 VanDerWaalsContact CA-O 3.31Å; A792-R796 WeakPolarHBondContact CA-O 3.4Å; I793-R796 PolarHBondContact N-O 2.89Å; I793-R796 PolarHBondContact O-N 2.99Å; I793-R796 VanDerWaalsContact O-O 3.12Å; N794-R796 PolarHBondContact O-N 3.03Å
797	R	87.3	Confident	87.5	Confident	12 Å²	12	52.9 Å²	52.9	5%	0.045	30%	0.301	C	S	.	.	S	Bend	trans	-65.2	155	166.8	-70.7	173.3	57.4	-144.2	18.3	109.6	E738 M741 L742 Q790 A799 P815 T816 K820	E738-R797 IonicContact OE1-NH1 3.5Å; E738-R797 PolarHBondContact OE1-NH1 3.46Å; E738-R797 WeakPolarHBondContact OE2-CD 3.37Å; E738-R797 IonicContact OE2-CZ 3.33Å; E738-R797 IonicContact OE2-NE 2.7Å; E738-R797 IonicContact OE2-NH1 2.79Å; E738-R797 PolarHBondContact OE2-NH1 3.41Å; M741-R797 VanDerWaalsContact CE-NH2 3.33Å; M741-R797 PolarHBondContact SD-NH1 2.97Å; L742-R797 HydrophobicContact CD1-CG 4.41Å; Q790-R797 HydrophobicContact CG-CG 4.32Å; R797-A799 PolarHBondContact O-N 2.99Å; R797-P815 PolarHBondContact NH2-O 3.41Å; R797-T816 PolarHBondContact NH2-O 3.13Å; R797-K820 HydrophobicContact CB-CB 4.4Å; R797-K820 VanDerWaalsContact CZ-CB 3.42Å
798	P	89.4	Confident	87.5	Confident	2 Å²	2	56 Å²	56	1%	0.013	32%	0.321	C	S	.	.	P	Polyproline II helix	trans	-49.5	130.1	-179.9	-27.7	36.6	0	0	0	112.1	I793 C806 K820 F838	I793-P798 HydrophobicContact CD1-CB 4.27Å; I793-P798 HydrophobicContact CD1-CG 4.23Å; P798-C806 PolarHBondContact O-SG 3.19Å; P798-C806 VanDerWaalsContact O-SG 3.41Å; P798-K820 WeakPolarHBondContact CD-O 3.48Å; P798-F838 HydrophobicContact CB-CD1 4.05Å; P798-F838 HydrophobicContact CB-CE1 3.92Å; P798-F838 HydrophobicContact CG-CD1 3.83Å; P798-F838 HydrophobicContact CG-CE1 4.08Å
799	A	88.1	Confident	87.4	Confident	81 Å²	81	63.6 Å²	63.6	67%	0.669	36%	0.356	S	S	*	.	P	Polyproline II helix	trans	-70.5	160.6	177	0	0	0	0	0	111.1	R797 G801 C806	R797-A799 PolarHBondContact O-N 2.99Å; A799-G801 PolarHBondContact O-N 2.73Å; A799-C806 PolarHBondContact O-SG 3.3Å
800	D	90	Very high	87.4	Confident	76 Å²	76	64.9 Å²	64.9	41%	0.406	36%	0.362	S	S	.	.			trans	-72.2	108.3	175.5	-68.6	-44.8	0	0	0	110.3	F802 R805 C806 K820	D800-F802 VanDerWaalsContact C-N 3.31Å; D800-R805 WeakPolarHBondContact OD1-CA 3.34Å; D800-R805 PolarHBondContact OD1-N 3.15Å; D800-C806 PolarHBondContact OD1-N 3.39Å; D800-C806 VanDerWaalsContact OD1-N 3.09Å; D800-K820 IonicContact OD1-NZ 3.49Å; D800-K820 PolarHBondContact OD1-NZ 2.65Å; D800-K820 IonicContact OD2-NZ 3.7Å; D800-K820 PolarHBondContact OD2-NZ 2.79Å
801	G	89	Confident	87.2	Confident	65 Å²	65	71.2 Å²	71.2	67%	0.67	39%	0.389	S	S	*	.	S	Bend	trans	-79	-15.2	174.4	0	0	0	0	0	113.5	A799 R805	A799-G801 PolarHBondContact O-N 2.73Å; G801-R805 PolarHBondContact N-O 2.83Å
802	F	91.5	Very high	87.1	Confident	107 Å²	107	74.1 Å²	74.1	47%	0.469	41%	0.409	S	S	.	.	B	Isolated β-bridge	trans	-123.7	174.5	175.6	-65.3	-97.5	0	0	0	109.9	D800 N804 R805 C806 P808	D800-F802 VanDerWaalsContact C-N 3.31Å; F802-N804 PolarHBondContact O-N 3.25Å; F802-R805 CarbonylContact C-O 3.52Å; F802-R805 WeakPolarHBondContact CA-O 3.39Å; F802-R805 HydrophobicContact CB-CG 3.89Å; F802-R805 WeakPolarHBondContact CB-O 3.42Å; F802-R805 PolarHBondContact N-O 3.04Å; F802-R805 PolarHBondContact O-N 3.28Å; F802-C806 VanDerWaalsContact CD2-O 3.26Å; F802-C806 WeakPolarHBondContact CD2-O 3.49Å; F802-P808 HydrophobicContact CD1-CG 4.26Å; F802-P808 HydrophobicContact CE1-CG 3.91Å; F802-P808 HydrophobicContact CE2-CG 4.2Å; F802-P808 HydrophobicContact CZ-CG 3.88Å
803	I	91.9	Very high	87.1	Confident	146 Å²	146	76.1 Å²	76.1	75%	0.749	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	105.4	-179.5	-56.9	167.9	0	0	0	110	R805	I803-R805 PolarHBondContact O-N 3.08Å
804	N	89.7	Confident	87	Confident	97 Å²	97	78.6 Å²	78.6	52%	0.519	43%	0.431	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.2	28.3	-178.9	-57.9	-24.5	0	0	0	115.2	F802 S813	F802-N804 PolarHBondContact O-N 3.25Å; N804-S813 PolarHBondContact O-N 3.32Å
805	R	91	Very high	87.3	Confident	74 Å²	74	75.7 Å²	75.7	28%	0.279	42%	0.418	S	S	.	.	B	Isolated β-bridge	trans	-158.7	155.3	176.1	60.2	-169.6	172	165.4	-0.6	112.9	D800 G801 F802 I803 F807 P808 F810	D800-R805 WeakPolarHBondContact OD1-CA 3.34Å; D800-R805 PolarHBondContact OD1-N 3.15Å; G801-R805 PolarHBondContact N-O 2.83Å; F802-R805 CarbonylContact C-O 3.52Å; F802-R805 WeakPolarHBondContact CA-O 3.39Å; F802-R805 HydrophobicContact CB-CG 3.89Å; F802-R805 WeakPolarHBondContact CB-O 3.42Å; F802-R805 PolarHBondContact N-O 3.04Å; F802-R805 PolarHBondContact O-N 3.28Å; I803-R805 PolarHBondContact O-N 3.08Å; R805-F807 WeakPolarHBondContact CD-O 3.48Å; R805-P808 PolarHBondContact NH1-O 3.32Å; R805-F810 VanDerWaalsContact CD-O 3.26Å; R805-F810 WeakPolarHBondContact CD-O 3.2Å; R805-F810 PolarHBondContact NH1-O 3.44Å; R805-F810 VanDerWaalsContact NH1-O 3.11Å
806	C	90	Very high	88	Confident	6 Å²	6	74 Å²	74	4%	0.041	40%	0.398	C	S	.	.	S	Bend	trans	-74.6	-42.8	176.3	-71.8	0	0	0	0	113.3	P798 A799 D800 F802 A819 K820 F838	P798-C806 PolarHBondContact O-SG 3.19Å; P798-C806 VanDerWaalsContact O-SG 3.41Å; A799-C806 PolarHBondContact O-SG 3.3Å; D800-C806 PolarHBondContact OD1-N 3.39Å; D800-C806 VanDerWaalsContact OD1-N 3.09Å; F802-C806 VanDerWaalsContact CD2-O 3.26Å; F802-C806 WeakPolarHBondContact CD2-O 3.49Å; C806-A819 WeakPolarHBondContact CB-O 3.39Å; C806-K820 VanDerWaalsContact SG-CD 3.56Å; C806-F838 HydrophobicContact CB-CE1 3.92Å; C806-F838 HydrophobicContact CB-CZ 3.89Å
807	F	89.2	Confident	88.6	Confident	22 Å²	22	66.9 Å²	66.9	10%	0.096	37%	0.371	C	S	.	.	S	Bend	trans	-135.9	156.5	178.3	-60.6	-45.7	0	0	0	111.9	R805 H809 F810 N834 F837 F838 M841	R805-F807 WeakPolarHBondContact CD-O 3.48Å; F807-H809 PolarHBondContact O-N 2.83Å; F807-F810 HydrophobicContact CB-CD2 4Å; F807-F810 HydrophobicContact CB-CE2 4.34Å; F807-F810 HydrophobicContact CD2-CD2 4.24Å; F807-F810 AromaticContact CD2-CE2 3.77Å; F807-F810 HydrophobicContact CD2-CE2 3.77Å; F807-F810 PolarHBondContact O-N 3.13Å; F807-N834 HydrophobicContact CD2-CB 4.47Å; F807-F837 AromaticContact CE1-CD1 3.56Å; F807-F837 HydrophobicContact CE1-CD1 3.56Å; F807-F837 AromaticContact CE1-CE1 3.77Å; F807-F837 HydrophobicContact CE1-CE1 3.77Å; F807-F837 HydrophobicContact CE1-CG 4.23Å; F807-F837 HydrophobicContact CE2-CB 4.38Å; F807-F837 HydrophobicContact CE2-CD1 4.41Å; F807-F837 HydrophobicContact CZ-CB 4.03Å; F807-F837 AromaticContact CZ-CD1 3.32Å; F807-F837 HydrophobicContact CZ-CD1 3.32Å; F807-F837 HydrophobicContact CZ-CE1 4Å; F807-F837 AromaticContact CZ-CG 3.91Å; F807-F837 HydrophobicContact CZ-CG 3.91Å; F807-F838 HydrophobicContact CD2-CE1 4.2Å; F807-F838 AromaticContact CD2-CE2 3.99Å; F807-F838 HydrophobicContact CD2-CE2 3.99Å; F807-F838 AromaticContact CD2-CZ 3.66Å; F807-F838 HydrophobicContact CD2-CZ 3.66Å; F807-F838 AromaticContact CE2-CD1 3.81Å; F807-F838 HydrophobicContact CE2-CD1 3.81Å; F807-F838 AromaticContact CE2-CD2 3.86Å; F807-F838 HydrophobicContact CE2-CD2 3.86Å; F807-F838 AromaticContact CE2-CE1 3.37Å; F807-F838 HydrophobicContact CE2-CE1 3.37Å; F807-F838 AromaticContact CE2-CE2 3.45Å; F807-F838 HydrophobicContact CE2-CE2 3.45Å; F807-F838 VanDerWaalsContact CE2-CE2 3.45Å; F807-F838 HydrophobicContact CE2-CG 4.03Å; F807-F838 AromaticContact CE2-CZ 3.17Å; F807-F838 HydrophobicContact CE2-CZ 3.17Å; F807-F838 AromaticContact CZ-CD1 3.81Å; F807-F838 HydrophobicContact CZ-CD1 3.81Å; F807-F838 AromaticContact CZ-CE1 3.55Å; F807-F838 HydrophobicContact CZ-CE1 3.55Å; F807-F838 HydrophobicContact CZ-CE2 4.4Å; F807-F838 HydrophobicContact CZ-CG 4.34Å; F807-F838 AromaticContact CZ-CZ 3.87Å; F807-F838 HydrophobicContact CZ-CZ 3.87Å; F807-M841 HydrophobicContact CZ-SD 4.37Å
808	P	91.5	Very high	88.8	Confident	64 Å²	64	69.1 Å²	69.1	42%	0.416	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-23.5	175.5	-24.5	35.7	0	0	0	114.4	F802 R805 F810	F802-P808 HydrophobicContact CD1-CG 4.26Å; F802-P808 HydrophobicContact CE1-CG 3.91Å; F802-P808 HydrophobicContact CE2-CG 4.2Å; F802-P808 HydrophobicContact CZ-CG 3.88Å; R805-P808 PolarHBondContact NH1-O 3.32Å; P808-F810 PolarHBondContact O-N 2.9Å
809	H	90.3	Very high	88.9	Confident	163 Å²	163	69.2 Å²	69.2	76%	0.755	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.8	-18	178.6	-55.5	-66	0	0	0	113.7	F807	F807-H809 PolarHBondContact O-N 2.83Å
810	F	90.6	Very high	89	Confident	26 Å²	26	66.2 Å²	66.2	11%	0.114	36%	0.357	C	S	.	.	S	Bend	trans	-101.7	152.7	178.4	-59.2	-66.1	0	0	0	111.1	R805 F807 P808 D818 A819 N834 F838	R805-F810 VanDerWaalsContact CD-O 3.26Å; R805-F810 WeakPolarHBondContact CD-O 3.2Å; R805-F810 PolarHBondContact NH1-O 3.44Å; R805-F810 VanDerWaalsContact NH1-O 3.11Å; F807-F810 HydrophobicContact CB-CD2 4Å; F807-F810 HydrophobicContact CB-CE2 4.34Å; F807-F810 HydrophobicContact CD2-CD2 4.24Å; F807-F810 AromaticContact CD2-CE2 3.77Å; F807-F810 HydrophobicContact CD2-CE2 3.77Å; F807-F810 PolarHBondContact O-N 3.13Å; P808-F810 PolarHBondContact O-N 2.9Å; F810-D818 WeakPolarHBondContact CZ-O 3.41Å; F810-A819 HydrophobicContact CB-CB 4.19Å; F810-A819 HydrophobicContact CD1-CB 3.76Å; F810-A819 HydrophobicContact CD2-CB 4.05Å; F810-A819 HydrophobicContact CE1-CB 4.07Å; F810-A819 HydrophobicContact CE2-CB 4.33Å; F810-A819 HydrophobicContact CG-CB 3.75Å; F810-A819 HydrophobicContact CZ-CB 4.34Å; F810-N834 HydrophobicContact CZ-CB 4.29Å; F810-N834 WeakPolarHBondContact CZ-ND2 3.35Å; F810-F838 HydrophobicContact CE2-CE2 4.03Å; F810-F838 HydrophobicContact CE2-CZ 4.15Å; F810-F838 HydrophobicContact CZ-CE2 4.44Å
811	K	88.1	Confident	89	Confident	155 Å²	155	62.6 Å²	62.6	67%	0.674	34%	0.338	S	S	*	.	P	Polyproline II helix	trans	-67.4	145.2	174.5	-68.2	-176.6	179.6	179.4	0	109.9	H814	K811-H814 HydrophobicContact CB-CB 4.18Å; K811-H814 VanDerWaalsContact O-CB 3.25Å; K811-H814 WeakPolarHBondContact O-CB 3.5Å
812	P	87.6	Confident	89.2	Confident	79 Å²	79	59.6 Å²	59.6	51%	0.513	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.2	145.4	171.9	-22.4	33.2	0	0	0	112	H814	P812-H814 PolarHBondContact O-N 3.35Å
813	S	83.5	Confident	89.4	Confident	88 Å²	88	54.5 Å²	54.5	62%	0.615	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	56	34.6	178.2	-54.7	0	0	0	0	114.1	N804 P815	N804-S813 PolarHBondContact O-N 3.32Å; S813-P815 VanDerWaalsContact O-CD 3.22Å; S813-P815 WeakPolarHBondContact O-CD 3.39Å
814	H	79.2	Confident	89.4	Confident	88 Å²	88	50 Å²	50	41%	0.407	26%	0.261	S	S	.	.			trans	-110.9	89.6	-177.9	-151.3	110.4	0	0	0	110.4	K811 P812 T816 A819	K811-H814 HydrophobicContact CB-CB 4.18Å; K811-H814 VanDerWaalsContact O-CB 3.25Å; K811-H814 WeakPolarHBondContact O-CB 3.5Å; P812-H814 PolarHBondContact O-N 3.35Å; H814-T816 WeakPolarHBondContact CD2-CG2 3.49Å; H814-T816 PolarHBondContact CD2-OG1 3.08Å; H814-T816 WeakPolarHBondContact NE2-CG2 3.41Å; H814-T816 PolarHBondContact O-N 2.95Å; H814-T816 VanDerWaalsContact O-N 3.15Å; H814-A819 WeakPolarHBondContact O-CB 3.47Å
815	P	82.4	Confident	89.7	Confident	37 Å²	37	46 Å²	46	24%	0.24	24%	0.241	C	C	.	.			trans	-85.7	32.4	-172.9	35	-35.8	0	0	0	114	M717 M741 R797 S813	M717-P815 HydrophobicContact CG-CG 4.48Å; M717-P815 HydrophobicContact SD-CG 3.81Å; M741-P815 WeakPolarHBondContact CE-O 3.47Å; R797-P815 PolarHBondContact NH2-O 3.41Å; S813-P815 VanDerWaalsContact O-CD 3.22Å; S813-P815 WeakPolarHBondContact O-CD 3.39Å
816	T	89.2	Confident	89.8	Confident	15 Å²	15	42.6 Å²	42.6	9%	0.092	23%	0.228	C	C	.	.			trans	-62.7	158	178.9	48.3	0	0	0	0	112.2	M717 R797 H814 D818 A819 K820	M717-T816 HydrophobicContact CE-CG2 3.9Å; M717-T816 HydrophobicContact SD-CG2 4.43Å; R797-T816 PolarHBondContact NH2-O 3.13Å; H814-T816 WeakPolarHBondContact CD2-CG2 3.49Å; H814-T816 PolarHBondContact CD2-OG1 3.08Å; H814-T816 WeakPolarHBondContact NE2-CG2 3.41Å; H814-T816 PolarHBondContact O-N 2.95Å; H814-T816 VanDerWaalsContact O-N 3.15Å; T816-D818 VanDerWaalsContact C-N 3.34Å; T816-D818 WeakPolarHBondContact CB-OD1 3.24Å; T816-D818 PolarHBondContact O-N 3.44Å; T816-D818 PolarHBondContact OG1-OD1 3.33Å; T816-A819 PolarHBondContact O-N 2.94Å; T816-A819 WeakPolarHBondContact OG1-CB 3.4Å; T816-K820 PolarHBondContact O-N 3.13Å
817	P	91.6	Very high	90.1	Very high	2 Å²	2	46.7 Å²	46.7	1%	0.013	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.5	-47.7	178.7	-29.3	37	0	0	0	113.8	Y710 C713 M741 L745 K820 G821 F822	Y710-P817 HydrophobicContact CD1-CB 4.22Å; Y710-P817 HydrophobicContact CD1-CG 4.11Å; Y710-P817 HydrophobicContact CE1-CB 3.76Å; Y710-P817 HydrophobicContact CE1-CG 4.17Å; Y710-P817 HydrophobicContact CG-CG 4.45Å; C713-P817 HydrophobicContact CB-CG 3.87Å; M741-P817 HydrophobicContact CE-CG 4.11Å; L745-P817 HydrophobicContact CD1-CB 4.04Å; L745-P817 HydrophobicContact CD1-CG 4.38Å; L745-P817 HydrophobicContact CD2-CB 3.96Å; L745-P817 HydrophobicContact CD2-CG 4.07Å; P817-K820 CarbonylContact O-C 3.52Å; P817-K820 PolarHBondContact O-N 2.96Å; P817-G821 PolarHBondContact O-N 3.38Å; P817-F822 HydrophobicContact CB-CB 3.75Å; P817-F822 HydrophobicContact CB-CD1 4.49Å; P817-F822 HydrophobicContact CB-CG 4.22Å; P817-F822 WeakPolarHBondContact O-CB 3.35Å; P817-F822 PolarHBondContact O-N 3.32Å
818	D	91.2	Very high	90.3	Very high	58 Å²	58	50.4 Å²	50.4	31%	0.31	26%	0.259	S	S	.	.	G	3₁₀ helix	trans	-66.5	-38	-178.8	66.9	-43	0	0	0	113.3	F810 T816 K820 F838	F810-D818 WeakPolarHBondContact CZ-O 3.41Å; T816-D818 VanDerWaalsContact C-N 3.34Å; T816-D818 WeakPolarHBondContact CB-OD1 3.24Å; T816-D818 PolarHBondContact O-N 3.44Å; T816-D818 PolarHBondContact OG1-OD1 3.33Å; D818-K820 PolarHBondContact O-N 3.21Å; D818-F838 WeakPolarHBondContact O-CE2 3.32Å
819	A	91.3	Very high	90.4	Very high	4 Å²	4	50.6 Å²	50.6	3%	0.033	26%	0.263	C	S	.	.	G	3₁₀ helix	trans	-69.8	-15.7	177.9	0	0	0	0	0	113.7	C806 F810 H814 T816 F838	C806-A819 WeakPolarHBondContact CB-O 3.39Å; F810-A819 HydrophobicContact CB-CB 4.19Å; F810-A819 HydrophobicContact CD1-CB 3.76Å; F810-A819 HydrophobicContact CD2-CB 4.05Å; F810-A819 HydrophobicContact CE1-CB 4.07Å; F810-A819 HydrophobicContact CE2-CB 4.33Å; F810-A819 HydrophobicContact CG-CB 3.75Å; F810-A819 HydrophobicContact CZ-CB 4.34Å; H814-A819 WeakPolarHBondContact O-CB 3.47Å; T816-A819 PolarHBondContact O-N 2.94Å; T816-A819 WeakPolarHBondContact OG1-CB 3.4Å; A819-F838 VanDerWaalsContact O-CZ 3.31Å; A819-F838 WeakPolarHBondContact O-CZ 3.23Å
820	K	91	Very high	90.6	Very high	19 Å²	19	44.5 Å²	44.5	8%	0.083	24%	0.244	C	C	.	.	G	3₁₀ helix	trans	-128.5	40.9	-175.1	-63.2	-71.3	-164.4	174.5	0	111	Q790 R797 P798 D800 C806 T816 P817 D818 F822	Q790-K820 PolarHBondContact NE2-O 2.88Å; R797-K820 HydrophobicContact CB-CB 4.4Å; R797-K820 VanDerWaalsContact CZ-CB 3.42Å; P798-K820 WeakPolarHBondContact CD-O 3.48Å; D800-K820 IonicContact OD1-NZ 3.49Å; D800-K820 PolarHBondContact OD1-NZ 2.65Å; D800-K820 IonicContact OD2-NZ 3.7Å; D800-K820 PolarHBondContact OD2-NZ 2.79Å; C806-K820 VanDerWaalsContact SG-CD 3.56Å; T816-K820 PolarHBondContact O-N 3.13Å; P817-K820 CarbonylContact O-C 3.52Å; P817-K820 PolarHBondContact O-N 2.96Å; D818-K820 PolarHBondContact O-N 3.21Å; K820-F822 PolarHBondContact O-N 2.89Å
821	G	89.9	Confident	90.9	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	79.1	19	164.1	0	0	0	0	0	117.4	Q790 Q791 P817	Q790-G821 VanDerWaalsContact NE2-C 3.34Å; Q790-G821 PolarHBondContact NE2-O 3.48Å; Q791-G821 PolarHBondContact N-O 3.25Å; P817-G821 PolarHBondContact O-N 3.38Å
822	F	93.4	Very high	91.1	Very high	2 Å²	2	42 Å²	42	1%	0.009	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	125.9	164	-170.3	-98.7	0	0	0	110.5	V706 Y710 L745 V748 Q790 P817 K820 D824	V706-F822 HydrophobicContact CG1-CE1 4.45Å; Y710-F822 AromaticContact CE1-CD1 3.6Å; Y710-F822 HydrophobicContact CE1-CD1 3.6Å; Y710-F822 AromaticContact CE1-CE1 3.74Å; Y710-F822 HydrophobicContact CE1-CE1 3.74Å; Y710-F822 HydrophobicContact CE1-CG 4.49Å; Y710-F822 AromaticContact CZ-CD1 3.99Å; Y710-F822 WeakPolarHBondContact OH-CD1 3.37Å; L745-F822 HydrophobicContact CB-CD2 3.82Å; L745-F822 HydrophobicContact CB-CE2 3.86Å; L745-F822 HydrophobicContact CD1-CB 4.37Å; L745-F822 HydrophobicContact CD1-CD2 4.03Å; L745-F822 HydrophobicContact CD1-CG 4.44Å; L745-F822 HydrophobicContact CD2-CD2 3.72Å; L745-F822 HydrophobicContact CD2-CE2 3.84Å; L745-F822 HydrophobicContact CD2-CG 4.1Å; L745-F822 HydrophobicContact CD2-CZ 4.31Å; L745-F822 HydrophobicContact CG-CD2 4.05Å; L745-F822 HydrophobicContact CG-CE2 4.34Å; V748-F822 HydrophobicContact CG1-CZ 4.24Å; Q790-F822 HydrophobicContact CB-CD2 4.04Å; P817-F822 HydrophobicContact CB-CB 3.75Å; P817-F822 HydrophobicContact CB-CD1 4.49Å; P817-F822 HydrophobicContact CB-CG 4.22Å; P817-F822 WeakPolarHBondContact O-CB 3.35Å; P817-F822 PolarHBondContact O-N 3.32Å; K820-F822 PolarHBondContact O-N 2.89Å; F822-D824 HydrophobicContact CD1-CB 4.41Å; F822-D824 HydrophobicContact CE1-CB 4.07Å
823	I	94.7	Very high	91.5	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	104	-179.9	-56	175.2	0	0	0	108.5	V788 G789 Q791 L831 Q835 H839	V788-I823 HydrophobicContact CB-CB 4.11Å; V788-I823 HydrophobicContact CB-CG2 3.95Å; V788-I823 HydrophobicContact CG1-CD1 4.46Å; V788-I823 HydrophobicContact CG2-CG2 4.26Å; G789-I823 PolarHBondContact N-O 3.09Å; G789-I823 PolarHBondContact O-N 2.76Å; Q791-I823 HydrophobicContact CG-CD1 3.5Å; Q791-I823 HydrophobicContact CG-CG1 4.12Å; I823-L831 HydrophobicContact CG2-CD2 3.64Å; I823-Q835 HydrophobicContact CD1-CB 4.34Å; I823-Q835 WeakPolarHBondContact CD1-O 3.15Å; I823-Q835 HydrophobicContact CG1-CB 3.99Å; I823-Q835 HydrophobicContact CG1-CG 4.26Å; I823-Q835 HydrophobicContact CG2-CB 4.11Å; I823-Q835 HydrophobicContact CG2-CG 4.28Å; I823-H839 HydrophobicContact CD1-CB 3.75Å
824	D	92.9	Very high	91.9	Very high	50 Å²	50	41.4 Å²	41.4	27%	0.267	23%	0.23	S	C	.	.			trans	-78.4	-28.2	176.4	64.8	-24.6	0	0	0	112.4	K702 V706 C787 F822 Q835	K702-D824 WeakPolarHBondContact CE-O 3.38Å; K702-D824 PolarHBondContact NZ-O 3.3Å; V706-D824 HydrophobicContact CG1-CB 4.05Å; V706-D824 HydrophobicContact CG2-CB 4.39Å; C787-D824 VanDerWaalsContact CB-O 3.23Å; C787-D824 WeakPolarHBondContact CB-O 3.4Å; F822-D824 HydrophobicContact CD1-CB 4.41Å; F822-D824 HydrophobicContact CE1-CB 4.07Å; D824-Q835 PolarHBondContact OD1-NE2 3.41Å
825	S	94.3	Very high	92.6	Very high	15 Å²	15	37.8 Å²	37.8	11%	0.105	21%	0.214	C	C	.	.	S	Bend	trans	-61.4	152.2	170.8	-59.3	0	0	0	0	112.6	V788 S829 G830 Q835	V788-S825 PolarHBondContact N-O 2.95Å; S825-S829 WeakPolarHBondContact CA-OG 3.37Å; S825-S829 WeakPolarHBondContact CB-OG 3.17Å; S825-G830 VanDerWaalsContact CB-O 3.26Å; S825-G830 WeakPolarHBondContact CB-O 2.86Å; S825-G830 PolarHBondContact OG-O 2.71Å; S825-Q835 PolarHBondContact OG-OE1 3.01Å
826	S	94.4	Very high	93.2	Very high	1 Å²	1	42 Å²	42	1%	0.007	23%	0.228	C	C	.	.			trans	-100.1	170.6	167.4	64.3	0	0	0	0	110.3	M784 I785 Y828 S829 G830	M784-S826 WeakPolarHBondContact O-CB 3.33Å; M784-S826 PolarHBondContact O-OG 3.15Å; I785-S826 WeakPolarHBondContact O-CB 3.19Å; I785-S826 PolarHBondContact O-OG 3.1Å; S826-Y828 PolarHBondContact O-N 2.77Å; S826-S829 PolarHBondContact N-OG 2.84Å; S826-S829 PolarHBondContact O-N 2.8Å; S826-S829 PolarHBondContact O-OG 2.8Å; S826-S829 VanDerWaalsContact O-OG 3.11Å; S826-S829 PolarHBondContact OG-N 2.86Å; S826-G830 PolarHBondContact O-N 3.38Å
827	F	95.3	Very high	93.5	Very high	92 Å²	92	46.8 Å²	46.8	40%	0.404	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64	-30.7	172.9	-63.8	-59.2	0	0	0	112.2	Q783 M784 V788 L831 H839	Q783-F827 HydrophobicContact CB-CD2 4.35Å; Q783-F827 HydrophobicContact CB-CE2 3.98Å; Q783-F827 PolarHBondContact O-N 3.14Å; M784-F827 HydrophobicContact CG-CD2 4.08Å; V788-F827 HydrophobicContact CG1-CZ 4.35Å; V788-F827 HydrophobicContact CG2-CD1 4.26Å; V788-F827 HydrophobicContact CG2-CD2 4.35Å; V788-F827 HydrophobicContact CG2-CE1 4.02Å; V788-F827 HydrophobicContact CG2-CE2 4.12Å; V788-F827 HydrophobicContact CG2-CG 4.42Å; V788-F827 HydrophobicContact CG2-CZ 3.95Å; F827-L831 HydrophobicContact CE1-CD1 4.39Å; F827-H839 AromaticContact CE1-NE2 3.72Å; F827-H839 AromaticContact CZ-CE1 4Å; F827-H839 AromaticContact CZ-NE2 3.81Å
828	Y	94.6	Very high	93.6	Very high	100 Å²	100	46.8 Å²	46.8	39%	0.392	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-45.7	173.8	177.4	-94.3	0	0	0	112.5	I689 V692 T693 P694 M784 S826 G830	I689-Y828 HydrophobicContact CD1-CD2 3.88Å; I689-Y828 HydrophobicContact CD1-CE2 3.86Å; I689-Y828 HydrophobicContact CG1-CD2 4.46Å; I689-Y828 HydrophobicContact CG1-CE2 3.95Å; V692-Y828 HydrophobicContact CG2-CD2 4.08Å; T693-Y828 HydrophobicContact CG2-CE1 4.33Å; T693-Y828 HydrophobicContact CG2-CE2 4.49Å; T693-Y828 WeakPolarHBondContact CG2-OH 3.43Å; T693-Y828 WeakPolarHBondContact OG1-CE2 3.48Å; T693-Y828 PolarHBondContact OG1-OH 3.46Å; P694-Y828 VanDerWaalsContact CD-CD1 3.46Å; P694-Y828 HydrophobicContact CG-CD1 4.2Å; P694-Y828 HydrophobicContact CG-CE1 4.39Å; M784-Y828 WeakPolarHBondContact O-CB 3.47Å; M784-Y828 PolarHBondContact O-N 2.73Å; M784-Y828 VanDerWaalsContact O-N 3.15Å; S826-Y828 PolarHBondContact O-N 2.77Å; Y828-G830 PolarHBondContact O-N 3.48Å
829	S	92.8	Very high	93.7	Very high	69 Å²	69	46.7 Å²	46.7	48%	0.483	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71	-18.4	-179.4	66.3	0	0	0	0	113.5	S825 S826	S825-S829 WeakPolarHBondContact CA-OG 3.37Å; S825-S829 WeakPolarHBondContact CB-OG 3.17Å; S826-S829 PolarHBondContact N-OG 2.84Å; S826-S829 PolarHBondContact O-N 2.8Å; S826-S829 PolarHBondContact O-OG 2.8Å; S826-S829 VanDerWaalsContact O-OG 3.11Å; S826-S829 PolarHBondContact OG-N 2.86Å
830	G	95	Very high	93.9	Very high	35 Å²	35	48.6 Å²	48.6	36%	0.361	26%	0.262	S	S	.	.			trans	84.8	147.5	-173	0	0	0	0	0	112.5	S825 S826 Y828	S825-G830 VanDerWaalsContact CB-O 3.26Å; S825-G830 WeakPolarHBondContact CB-O 2.86Å; S825-G830 PolarHBondContact OG-O 2.71Å; S826-G830 PolarHBondContact O-N 3.38Å; Y828-G830 PolarHBondContact O-N 3.48Å
831	L	95.8	Very high	93.9	Very high	40 Å²	40	51.1 Å²	51.1	21%	0.209	28%	0.275	C	S	.	.			trans	-94.5	134.7	-179	-56.6	-173.1	0	0	0	110.8	V788 I823 F827 Q835 F836 H839	V788-L831 HydrophobicContact CG2-CD2 4.24Å; I823-L831 HydrophobicContact CG2-CD2 3.64Å; F827-L831 HydrophobicContact CE1-CD1 4.39Å; L831-Q835 HydrophobicContact CB-CB 4.33Å; L831-F836 HydrophobicContact CB-CB 4.19Å; L831-H839 HydrophobicContact CD1-CB 4.12Å
832	N	93.6	Very high	93.8	Very high	87 Å²	87	52.1 Å²	52.1	47%	0.465	28%	0.282	S	S	.	.			trans	-64.5	156	170.4	-71.1	-32.2	0	0	0	111	N834 Q835 F836	N832-N834 VanDerWaalsContact C-N 3.3Å; N832-N834 WeakPolarHBondContact CB-OD1 3.47Å; N832-N834 PolarHBondContact O-N 2.85Å; N832-Q835 HydrophobicContact CB-CB 4.34Å; N832-Q835 HydrophobicContact CB-CG 4.12Å; N832-Q835 CarbonylContact O-C 3.39Å; N832-Q835 WeakPolarHBondContact O-CA 3.05Å; N832-Q835 WeakPolarHBondContact O-CB 3.29Å; N832-Q835 PolarHBondContact O-N 2.97Å; N832-F836 WeakPolarHBondContact O-CB 3.32Å; N832-F836 PolarHBondContact O-N 2.89Å
833	P	94.9	Very high	93.6	Very high	111 Å²	111	53.6 Å²	53.6	72%	0.721	30%	0.298	S	S	*	.	H	α-helix	trans	-54.2	-40.7	-176.7	-29	35.7	0	0	0	114.7	F837	P833-F837 PolarHBondContact O-N 2.94Å; P833-F837 VanDerWaalsContact O-N 3.13Å
834	N	92.1	Very high	93.4	Very high	44 Å²	44	62.1 Å²	62.1	24%	0.235	33%	0.331	C	S	.	.	H	α-helix	trans	-66.2	-43.5	174.6	57.3	-16.5	0	0	0	112.3	F807 F810 N832 F837 F838	F807-N834 HydrophobicContact CD2-CB 4.47Å; F810-N834 HydrophobicContact CZ-CB 4.29Å; F810-N834 WeakPolarHBondContact CZ-ND2 3.35Å; N832-N834 VanDerWaalsContact C-N 3.3Å; N832-N834 WeakPolarHBondContact CB-OD1 3.47Å; N832-N834 PolarHBondContact O-N 2.85Å; N834-F837 PolarHBondContact O-N 2.89Å; N834-F838 WeakPolarHBondContact O-CD2 3.43Å; N834-F838 PolarHBondContact O-N 3.25Å; N834-F838 VanDerWaalsContact O-N 3.15Å
835	Q	94.1	Very high	93	Very high	12 Å²	12	62.3 Å²	62.3	6%	0.056	33%	0.33	C	S	.	.	H	α-helix	trans	-64.4	-43	176.7	-66.3	175.5	-13	0	0	111.9	I823 D824 S825 L831 N832 F837 F838 H839	I823-Q835 HydrophobicContact CD1-CB 4.34Å; I823-Q835 WeakPolarHBondContact CD1-O 3.15Å; I823-Q835 HydrophobicContact CG1-CB 3.99Å; I823-Q835 HydrophobicContact CG1-CG 4.26Å; I823-Q835 HydrophobicContact CG2-CB 4.11Å; I823-Q835 HydrophobicContact CG2-CG 4.28Å; D824-Q835 PolarHBondContact OD1-NE2 3.41Å; S825-Q835 PolarHBondContact OG-OE1 3.01Å; L831-Q835 HydrophobicContact CB-CB 4.33Å; N832-Q835 HydrophobicContact CB-CB 4.34Å; N832-Q835 HydrophobicContact CB-CG 4.12Å; N832-Q835 CarbonylContact O-C 3.39Å; N832-Q835 WeakPolarHBondContact O-CA 3.05Å; N832-Q835 WeakPolarHBondContact O-CB 3.29Å; N832-Q835 PolarHBondContact O-N 2.97Å; Q835-F837 VanDerWaalsContact C-N 3.31Å; Q835-F837 PolarHBondContact O-N 2.82Å; Q835-F838 PolarHBondContact O-N 2.99Å; Q835-H839 WeakPolarHBondContact O-CB 3.28Å; Q835-H839 PolarHBondContact O-N 2.88Å
836	F	95.8	Very high	92.2	Very high	126 Å²	126	63.4 Å²	63.4	55%	0.553	34%	0.343	S	S	*	.	H	α-helix	trans	-57.9	-45.3	175.6	175.8	-97.6	0	0	0	110.9	L831 N832 H839 A840	L831-F836 HydrophobicContact CB-CB 4.19Å; N832-F836 WeakPolarHBondContact O-CB 3.32Å; N832-F836 PolarHBondContact O-N 2.89Å; F836-H839 PolarHBondContact O-N 2.93Å; F836-A840 WeakPolarHBondContact O-CB 3.07Å; F836-A840 PolarHBondContact O-N 3.3Å
837	F	94.7	Very high	91.8	Very high	115 Å²	115	69.4 Å²	69.4	50%	0.504	37%	0.374	S	S	.	.	H	α-helix	trans	-63.3	-45.5	178.6	-160.2	-78.2	0	0	0	111.8	F807 P833 N834 Q835 H839 A840 M841	F807-F837 AromaticContact CE1-CD1 3.56Å; F807-F837 HydrophobicContact CE1-CD1 3.56Å; F807-F837 AromaticContact CE1-CE1 3.77Å; F807-F837 HydrophobicContact CE1-CE1 3.77Å; F807-F837 HydrophobicContact CE1-CG 4.23Å; F807-F837 HydrophobicContact CE2-CB 4.38Å; F807-F837 HydrophobicContact CE2-CD1 4.41Å; F807-F837 HydrophobicContact CZ-CB 4.03Å; F807-F837 AromaticContact CZ-CD1 3.32Å; F807-F837 HydrophobicContact CZ-CD1 3.32Å; F807-F837 HydrophobicContact CZ-CE1 4Å; F807-F837 AromaticContact CZ-CG 3.91Å; F807-F837 HydrophobicContact CZ-CG 3.91Å; P833-F837 PolarHBondContact O-N 2.94Å; P833-F837 VanDerWaalsContact O-N 3.13Å; N834-F837 PolarHBondContact O-N 2.89Å; Q835-F837 VanDerWaalsContact C-N 3.31Å; Q835-F837 PolarHBondContact O-N 2.82Å; F837-H839 VanDerWaalsContact C-N 3.31Å; F837-H839 PolarHBondContact O-N 3.16Å; F837-A840 PolarHBondContact O-N 3.39Å; F837-M841 HydrophobicContact CD1-CG 3.78Å; F837-M841 HydrophobicContact CD1-SD 3.62Å; F837-M841 HydrophobicContact CE1-CG 3.73Å; F837-M841 HydrophobicContact CE1-SD 3.59Å; F837-M841 VanDerWaalsContact CE1-SD 3.59Å; F837-M841 WeakPolarHBondContact O-CG 3.02Å; F837-M841 PolarHBondContact O-N 3.39Å
838	F	93.6	Very high	91.3	Very high	2 Å²	2	69.6 Å²	69.6	1%	0.009	38%	0.379	C	S	.	.	H	α-helix	trans	-59.9	-41	175.3	-72.4	-53.9	0	0	0	112.6	Q791 P798 C806 F807 F810 D818 A819 N834 Q835 M841 A842	Q791-F838 HydrophobicContact CG-CB 4.42Å; P798-F838 HydrophobicContact CB-CD1 4.05Å; P798-F838 HydrophobicContact CB-CE1 3.92Å; P798-F838 HydrophobicContact CG-CD1 3.83Å; P798-F838 HydrophobicContact CG-CE1 4.08Å; C806-F838 HydrophobicContact CB-CE1 3.92Å; C806-F838 HydrophobicContact CB-CZ 3.89Å; F807-F838 HydrophobicContact CD2-CE1 4.2Å; F807-F838 AromaticContact CD2-CE2 3.99Å; F807-F838 HydrophobicContact CD2-CE2 3.99Å; F807-F838 AromaticContact CD2-CZ 3.66Å; F807-F838 HydrophobicContact CD2-CZ 3.66Å; F807-F838 AromaticContact CE2-CD1 3.81Å; F807-F838 HydrophobicContact CE2-CD1 3.81Å; F807-F838 AromaticContact CE2-CD2 3.86Å; F807-F838 HydrophobicContact CE2-CD2 3.86Å; F807-F838 AromaticContact CE2-CE1 3.37Å; F807-F838 HydrophobicContact CE2-CE1 3.37Å; F807-F838 AromaticContact CE2-CE2 3.45Å; F807-F838 HydrophobicContact CE2-CE2 3.45Å; F807-F838 VanDerWaalsContact CE2-CE2 3.45Å; F807-F838 HydrophobicContact CE2-CG 4.03Å; F807-F838 AromaticContact CE2-CZ 3.17Å; F807-F838 HydrophobicContact CE2-CZ 3.17Å; F807-F838 AromaticContact CZ-CD1 3.81Å; F807-F838 HydrophobicContact CZ-CD1 3.81Å; F807-F838 AromaticContact CZ-CE1 3.55Å; F807-F838 HydrophobicContact CZ-CE1 3.55Å; F807-F838 HydrophobicContact CZ-CE2 4.4Å; F807-F838 HydrophobicContact CZ-CG 4.34Å; F807-F838 AromaticContact CZ-CZ 3.87Å; F807-F838 HydrophobicContact CZ-CZ 3.87Å; F810-F838 HydrophobicContact CE2-CE2 4.03Å; F810-F838 HydrophobicContact CE2-CZ 4.15Å; F810-F838 HydrophobicContact CZ-CE2 4.44Å; D818-F838 WeakPolarHBondContact O-CE2 3.32Å; A819-F838 VanDerWaalsContact O-CZ 3.31Å; A819-F838 WeakPolarHBondContact O-CZ 3.23Å; N834-F838 WeakPolarHBondContact O-CD2 3.43Å; N834-F838 PolarHBondContact O-N 3.25Å; N834-F838 VanDerWaalsContact O-N 3.15Å; Q835-F838 PolarHBondContact O-N 2.99Å; F838-M841 HydrophobicContact CD1-SD 4.37Å; F838-M841 PolarHBondContact O-N 3.44Å; F838-A842 PolarHBondContact O-N 3.23Å
839	H	94.2	Very high	90.5	Very high	56 Å²	56	66 Å²	66	26%	0.259	37%	0.366	S	S	.	.	H	α-helix	trans	-64.1	-44.3	175.4	-173.6	52.4	0	0	0	112	Q791 I823 F827 L831 Q835 F836 F837 M841 A842 G843	Q791-H839 PolarHBondContact OE1-ND1 3.12Å; I823-H839 HydrophobicContact CD1-CB 3.75Å; F827-H839 AromaticContact CE1-NE2 3.72Å; F827-H839 AromaticContact CZ-CE1 4Å; F827-H839 AromaticContact CZ-NE2 3.81Å; L831-H839 HydrophobicContact CD1-CB 4.12Å; Q835-H839 WeakPolarHBondContact O-CB 3.28Å; Q835-H839 PolarHBondContact O-N 2.88Å; F836-H839 PolarHBondContact O-N 2.93Å; F837-H839 VanDerWaalsContact C-N 3.31Å; F837-H839 PolarHBondContact O-N 3.16Å; H839-M841 VanDerWaalsContact C-N 3.31Å; H839-M841 PolarHBondContact O-N 3.02Å; H839-A842 PolarHBondContact O-N 3.11Å; H839-G843 PolarHBondContact O-N 2.99Å
840	A	94.7	Very high	89.5	Confident	45 Å²	45	67.1 Å²	67.1	37%	0.372	37%	0.37	S	S	.	.	H	α-helix	trans	-63	-36.4	178	0	0	0	0	0	112.4	F836 F837 R844	F836-A840 WeakPolarHBondContact O-CB 3.07Å; F836-A840 PolarHBondContact O-N 3.3Å; F837-A840 PolarHBondContact O-N 3.39Å; A840-R844 WeakPolarHBondContact O-CB 3.44Å; A840-R844 PolarHBondContact O-N 3.36Å
841	M	91.6	Very high	88.8	Confident	72 Å²	72	68.6 Å²	68.6	36%	0.355	38%	0.379	S	S	.	.	H	α-helix	trans	-60.8	-51.1	173.6	-71.4	175.7	74.4	0	0	111.6	I793 F807 F837 F838 H839 R844 E845	I793-M841 HydrophobicContact CD1-CB 3.89Å; I793-M841 HydrophobicContact CD1-CE 3.9Å; F807-M841 HydrophobicContact CZ-SD 4.37Å; F837-M841 HydrophobicContact CD1-CG 3.78Å; F837-M841 HydrophobicContact CD1-SD 3.62Å; F837-M841 HydrophobicContact CE1-CG 3.73Å; F837-M841 HydrophobicContact CE1-SD 3.59Å; F837-M841 VanDerWaalsContact CE1-SD 3.59Å; F837-M841 WeakPolarHBondContact O-CG 3.02Å; F837-M841 PolarHBondContact O-N 3.39Å; F838-M841 HydrophobicContact CD1-SD 4.37Å; F838-M841 PolarHBondContact O-N 3.44Å; H839-M841 VanDerWaalsContact C-N 3.31Å; H839-M841 PolarHBondContact O-N 3.02Å; M841-R844 PolarHBondContact O-N 3.4Å; M841-E845 PolarHBondContact O-N 3.15Å
842	A	87.5	Confident	88	Confident	20 Å²	20	70.3 Å²	70.3	17%	0.165	39%	0.391	C	S	.	.	H	α-helix	trans	-65.2	-38.9	179.1	0	0	0	0	0	112.1	Q791 F838 H839 R844 E845 G846	Q791-A842 HydrophobicContact CB-CB 4.08Å; F838-A842 PolarHBondContact O-N 3.23Å; H839-A842 PolarHBondContact O-N 3.11Å; A842-R844 PolarHBondContact O-N 3.31Å; A842-E845 PolarHBondContact O-N 3.5Å; A842-G846 PolarHBondContact O-N 2.8Å
843	G	88.5	Confident	86.9	Confident	33 Å²	33	66.9 Å²	66.9	34%	0.34	37%	0.372	S	S	.	.	H	α-helix	trans	-59.3	-46.3	174	0	0	0	0	0	112.2	H839 E845 G846 L847	H839-G843 PolarHBondContact O-N 2.99Å; G843-E845 VanDerWaalsContact C-N 3.31Å; G843-E845 PolarHBondContact O-N 3.46Å; G843-G846 PolarHBondContact O-N 3.48Å; G843-G846 VanDerWaalsContact O-N 3.16Å; G843-L847 WeakPolarHBondContact O-CD1 3.36Å; G843-L847 PolarHBondContact O-N 3.01Å
844	R	91.4	Very high	85.9	Confident	180 Å²	180	65.9 Å²	65.9	68%	0.679	36%	0.364	S	S	*	.	H	α-helix	trans	-62.4	-36.1	-179.6	-176.2	173.6	-71	-175.9	-1.3	112.9	A840 M841 A842 L847 I848	A840-R844 WeakPolarHBondContact O-CB 3.44Å; A840-R844 PolarHBondContact O-N 3.36Å; M841-R844 PolarHBondContact O-N 3.4Å; A842-R844 PolarHBondContact O-N 3.31Å; R844-L847 PolarHBondContact O-N 3.17Å; R844-I848 HydrophobicContact CG-CD1 3.83Å; R844-I848 HydrophobicContact CG-CG1 4.32Å; R844-I848 WeakPolarHBondContact O-CG1 3.39Å; R844-I848 PolarHBondContact O-N 2.88Å
845	E	83.7	Confident	85.3	Confident	54 Å²	54	67.2 Å²	67.2	25%	0.252	38%	0.381	S	S	.	.	H	α-helix	trans	-57.8	-47.9	174	-176.8	-175.3	179.2	0	0	111.2	I793 N794 M841 A842 G843 L847 I848 D849	I793-E845 WeakPolarHBondContact CA-OE2 3.31Å; I793-E845 WeakPolarHBondContact CG2-OE2 3.21Å; N794-E845 PolarHBondContact N-OE1 3.22Å; N794-E845 PolarHBondContact OD1-OE1 3.34Å; M841-E845 PolarHBondContact O-N 3.15Å; A842-E845 PolarHBondContact O-N 3.5Å; G843-E845 VanDerWaalsContact C-N 3.31Å; G843-E845 PolarHBondContact O-N 3.46Å; E845-L847 VanDerWaalsContact C-N 3.33Å; E845-L847 PolarHBondContact O-N 3.41Å; E845-I848 PolarHBondContact O-N 3.38Å; E845-D849 VanDerWaalsContact O-CB 3.25Å; E845-D849 WeakPolarHBondContact O-CB 3.44Å; E845-D849 PolarHBondContact O-N 2.88Å
846	G	78.7	Confident	84.7	Confident	37 Å²	37	71 Å²	71	38%	0.381	40%	0.399	S	S	.	.	H	α-helix	trans	-61.8	-36.1	177.5	0	0	0	0	0	114	A842 G843 T850	A842-G846 PolarHBondContact O-N 2.8Å; G843-G846 PolarHBondContact O-N 3.48Å; G843-G846 VanDerWaalsContact O-N 3.16Å; G846-T850 PolarHBondContact O-N 3.26Å; G846-T850 PolarHBondContact O-OG1 3.02Å
847	L	85.4	Confident	84	Confident	127 Å²	127	65.1 Å²	65.1	67%	0.665	37%	0.373	S	S	*	.	H	α-helix	trans	-67.9	-45.1	174.7	-84	90	0	0	0	112.1	G843 R844 E845 D849 T850 A851	G843-L847 WeakPolarHBondContact O-CD1 3.36Å; G843-L847 PolarHBondContact O-N 3.01Å; R844-L847 PolarHBondContact O-N 3.17Å; E845-L847 VanDerWaalsContact C-N 3.33Å; E845-L847 PolarHBondContact O-N 3.41Å; L847-D849 VanDerWaalsContact C-N 3.31Å; L847-D849 PolarHBondContact O-N 3.23Å; L847-T850 PolarHBondContact O-N 2.72Å; L847-A851 PolarHBondContact O-N 3.12Å; L847-A851 VanDerWaalsContact O-N 3.13Å
848	I	85.4	Confident	83.4	Confident	97 Å²	97	61.1 Å²	61.1	50%	0.497	37%	0.365	S	S	.	.	H	α-helix	trans	-64.2	-41.2	178.1	-67.4	169.4	0	0	0	110.2	R844 E845 T850 A851 V852	R844-I848 HydrophobicContact CG-CD1 3.83Å; R844-I848 HydrophobicContact CG-CG1 4.32Å; R844-I848 WeakPolarHBondContact O-CG1 3.39Å; R844-I848 PolarHBondContact O-N 2.88Å; E845-I848 PolarHBondContact O-N 3.38Å; I848-T850 VanDerWaalsContact C-N 3.3Å; I848-T850 PolarHBondContact O-N 2.63Å; I848-A851 PolarHBondContact O-N 2.64Å; I848-A851 VanDerWaalsContact O-N 3.12Å; I848-V852 HydrophobicContact CG2-CG2 4.03Å; I848-V852 WeakPolarHBondContact O-CG2 3.38Å; I848-V852 PolarHBondContact O-N 3.22Å
849	D	75.9	Confident	83	Confident	24 Å²	24	65.5 Å²	65.5	13%	0.128	38%	0.382	C	S	.	.	H	α-helix	trans	-55.4	-46.2	177	-173	44.5	0	0	0	111.2	E845 L847 A851 K853 L1054	E845-D849 VanDerWaalsContact O-CB 3.25Å; E845-D849 WeakPolarHBondContact O-CB 3.44Å; E845-D849 PolarHBondContact O-N 2.88Å; L847-D849 VanDerWaalsContact C-N 3.31Å; L847-D849 PolarHBondContact O-N 3.23Å; D849-A851 PolarHBondContact O-N 2.9Å; D849-K853 VanDerWaalsContact O-CB 3.26Å; D849-K853 WeakPolarHBondContact O-CB 3.37Å; D849-K853 WeakPolarHBondContact O-CD 3.33Å; D849-K853 WeakPolarHBondContact O-CG 3.49Å; D849-K853 PolarHBondContact O-N 3.18Å; D849-K853 VanDerWaalsContact O-N 3.12Å; D849-K853 WeakPolarHBondContact OD1-CE 3.44Å; D849-K853 IonicContact OD1-NZ 2.69Å; D849-K853 PolarHBondContact OD1-NZ 2.87Å; D849-K853 IonicContact OD2-NZ 3.95Å; D849-K853 PolarHBondContact OD2-NZ 2.75Å; D849-L1054 WeakPolarHBondContact OD1-CB 3.49Å; D849-L1054 WeakPolarHBondContact OD1-CD1 3.32Å; D849-L1054 VanDerWaalsContact OD1-CG 3.28Å; D849-L1054 WeakPolarHBondContact OD1-CG 3.42Å
850	T	73.7	Confident	82.7	Confident	92 Å²	92	63 Å²	63	56%	0.564	37%	0.37	S	S	*	.	H	α-helix	trans	-62.4	-43.7	176.1	-53.9	0	0	0	0	111.8	G846 L847 I848 T854	G846-T850 PolarHBondContact O-N 3.26Å; G846-T850 PolarHBondContact O-OG1 3.02Å; L847-T850 PolarHBondContact O-N 2.72Å; I848-T850 VanDerWaalsContact C-N 3.3Å; I848-T850 PolarHBondContact O-N 2.63Å; T850-T854 WeakPolarHBondContact O-CG2 3.48Å
851	A	80	Confident	82.4	Confident	67 Å²	67	61.8 Å²	61.8	55%	0.554	36%	0.357	S	S	*	.	H	α-helix	trans	-67.2	-45.4	-178.5	0	0	0	0	0	113	L847 I848 D849 T854	L847-A851 PolarHBondContact O-N 3.12Å; L847-A851 VanDerWaalsContact O-N 3.13Å; I848-A851 PolarHBondContact O-N 2.64Å; I848-A851 VanDerWaalsContact O-N 3.12Å; D849-A851 PolarHBondContact O-N 2.9Å; A851-T854 PolarHBondContact O-OG1 2.99Å
852	V	77.7	Confident	82.2	Confident	75 Å²	75	60.6 Å²	60.6	46%	0.455	35%	0.348	S	S	.	.	H	α-helix	trans	-70.5	-38.3	-177.6	174.7	0	0	0	0	111.4	I848 T854 A855	I848-V852 HydrophobicContact CG2-CG2 4.03Å; I848-V852 WeakPolarHBondContact O-CG2 3.38Å; I848-V852 PolarHBondContact O-N 3.22Å; V852-T854 PolarHBondContact O-N 3.28Å; V852-A855 PolarHBondContact O-N 3.45Å
853	K	71.3	Confident	82.2	Confident	15 Å²	15	60.4 Å²	60.4	7%	0.065	34%	0.343	C	S	.	.	H	α-helix	trans	-63.3	-39.8	-175.6	-84	175.8	175.9	165.7	0	114.9	D849 A855 E856 T857 M1052	D849-K853 VanDerWaalsContact O-CB 3.26Å; D849-K853 WeakPolarHBondContact O-CB 3.37Å; D849-K853 WeakPolarHBondContact O-CD 3.33Å; D849-K853 WeakPolarHBondContact O-CG 3.49Å; D849-K853 PolarHBondContact O-N 3.18Å; D849-K853 VanDerWaalsContact O-N 3.12Å; D849-K853 WeakPolarHBondContact OD1-CE 3.44Å; D849-K853 IonicContact OD1-NZ 2.69Å; D849-K853 PolarHBondContact OD1-NZ 2.87Å; D849-K853 IonicContact OD2-NZ 3.95Å; D849-K853 PolarHBondContact OD2-NZ 2.75Å; K853-A855 PolarHBondContact O-N 2.97Å; K853-E856 PolarHBondContact O-N 3Å; K853-T857 WeakPolarHBondContact O-CB 3.25Å; K853-T857 WeakPolarHBondContact O-CG2 3.45Å; K853-T857 PolarHBondContact O-N 3.48Å; K853-T857 PolarHBondContact O-OG1 3.2Å; K853-M1052 WeakPolarHBondContact CE-O 3.45Å; K853-M1052 PolarHBondContact NZ-O 3.16Å
854	T	74.7	Confident	82.4	Confident	91 Å²	91	58.8 Å²	58.8	56%	0.558	33%	0.327	S	S	*	.	H	α-helix	trans	-57.4	-38.5	-175.1	53.4	0	0	0	0	111.4	T850 A851 V852 T857 G858	T850-T854 WeakPolarHBondContact O-CG2 3.48Å; A851-T854 PolarHBondContact O-OG1 2.99Å; V852-T854 PolarHBondContact O-N 3.28Å; T854-T857 PolarHBondContact O-OG1 2.95Å; T854-G858 PolarHBondContact O-N 3.48Å; T854-G858 VanDerWaalsContact O-N 3.15Å
855	A	79.5	Confident	82.5	Confident	71 Å²	71	52.1 Å²	52.1	59%	0.587	31%	0.306	S	S	*	.	H	α-helix	trans	-71.1	-47.3	177.8	0	0	0	0	0	112.9	V852 K853 Y859	V852-A855 PolarHBondContact O-N 3.45Å; K853-A855 PolarHBondContact O-N 2.97Å; A855-Y859 WeakPolarHBondContact O-CB 3.27Å; A855-Y859 PolarHBondContact O-N 3.16Å
856	E	80	Confident	82.8	Confident	93 Å²	93	51.1 Å²	51.1	44%	0.435	30%	0.301	S	S	.	.	H	α-helix	trans	-68.6	-45.6	-176.9	-67.7	-160.2	153.3	0	0	112.5	K853 Y859 M860	K853-E856 PolarHBondContact O-N 3Å; E856-Y859 PolarHBondContact O-N 3.24Å; E856-M860 PolarHBondContact O-N 3.32Å
857	T	81.2	Confident	83.3	Confident	1 Å²	1	49.8 Å²	49.8	1%	0.006	29%	0.286	C	S	.	.	H	α-helix	trans	-67.1	-42.2	179.4	56.3	0	0	0	0	111.4	K853 T854 Y859 M860 Q861 S1049 T1050 V1071	K853-T857 WeakPolarHBondContact O-CB 3.25Å; K853-T857 WeakPolarHBondContact O-CG2 3.45Å; K853-T857 PolarHBondContact O-N 3.48Å; K853-T857 PolarHBondContact O-OG1 3.2Å; T854-T857 PolarHBondContact O-OG1 2.95Å; T857-Y859 VanDerWaalsContact C-N 3.33Å; T857-Y859 PolarHBondContact O-N 3.1Å; T857-M860 WeakPolarHBondContact O-CB 3.49Å; T857-M860 PolarHBondContact O-N 2.96Å; T857-Q861 WeakPolarHBondContact O-CB 3.37Å; T857-Q861 PolarHBondContact O-N 3.33Å; T857-S1049 WeakPolarHBondContact CG2-O 3.33Å; T857-T1050 HydrophobicContact CG2-CG2 4.43Å; T857-T1050 WeakPolarHBondContact OG1-CG2 3.15Å; T857-V1071 HydrophobicContact CG2-CG1 4.12Å; T857-V1071 HydrophobicContact CG2-CG2 4.04Å
858	G	83.6	Confident	83.7	Confident	32 Å²	32	43.8 Å²	43.8	33%	0.33	25%	0.254	S	S	.	.	H	α-helix	trans	-62.3	-38.4	174.4	0	0	0	0	0	112.8	T854 R862	T854-G858 PolarHBondContact O-N 3.48Å; T854-G858 VanDerWaalsContact O-N 3.15Å; G858-R862 WeakPolarHBondContact O-CB 3.45Å; G858-R862 PolarHBondContact O-N 3.36Å
859	Y	84.7	Confident	84	Confident	93 Å²	93	40 Å²	40	37%	0.365	23%	0.234	S	C	.	.	H	α-helix	trans	-66.1	-45.5	172.4	178.1	-107.1	0	0	0	111.3	A855 E856 T857 Q861 R862 R863 E1327	A855-Y859 WeakPolarHBondContact O-CB 3.27Å; A855-Y859 PolarHBondContact O-N 3.16Å; E856-Y859 PolarHBondContact O-N 3.24Å; T857-Y859 VanDerWaalsContact C-N 3.33Å; T857-Y859 PolarHBondContact O-N 3.1Å; Y859-Q861 PolarHBondContact O-N 2.8Å; Y859-R862 PolarHBondContact O-N 3.15Å; Y859-R863 HydrophobicContact CD1-CG 4.49Å; Y859-R863 VanDerWaalsContact CE1-CD 3.44Å; Y859-R863 HydrophobicContact CE1-CG 4.15Å; Y859-R863 HydrophobicContact CE2-CG 4.34Å; Y859-R863 WeakPolarHBondContact O-CG 3.4Å; Y859-R863 PolarHBondContact O-N 3.2Å; Y859-R863 VanDerWaalsContact O-N 3.1Å; Y859-E1327 PolarHBondContact OH-OE1 3.32Å
860	M	86.8	Confident	84.8	Confident	4 Å²	4	39.6 Å²	39.6	2%	0.02	23%	0.232	C	C	.	.	H	α-helix	trans	-57.6	-49.4	176.5	-177.3	177.7	76.2	0	0	112.2	E856 T857 R862 R863 L864 S1049 I1074	E856-M860 PolarHBondContact O-N 3.32Å; T857-M860 WeakPolarHBondContact O-CB 3.49Å; T857-M860 PolarHBondContact O-N 2.96Å; M860-R862 VanDerWaalsContact C-N 3.34Å; M860-R862 PolarHBondContact O-N 3.26Å; M860-R863 WeakPolarHBondContact O-CB 3.45Å; M860-R863 PolarHBondContact O-N 3.06Å; M860-R863 VanDerWaalsContact O-N 3.07Å; M860-L864 HydrophobicContact CG-CD1 4.4Å; M860-L864 PolarHBondContact O-N 2.83Å; M860-S1049 VanDerWaalsContact CE-CB 3.42Å; M860-S1049 VanDerWaalsContact CE-OG 3.22Å; M860-S1049 WeakPolarHBondContact CE-OG 3.33Å; M860-I1074 HydrophobicContact CE-CG2 4.2Å; M860-I1074 HydrophobicContact SD-CG2 3.94Å
861	Q	89.5	Confident	85.7	Confident	20 Å²	20	35.2 Å²	35.2	9%	0.093	21%	0.206	C	C	.	.	H	α-helix	trans	-58.4	-44.9	177.5	-178.7	179.3	-8.4	0	0	111.5	L459 T857 Y859 R863 L864 V865	L459-Q861 PolarHBondContact O-NE2 2.94Å; L459-Q861 PolarHBondContact O-OE1 3Å; T857-Q861 WeakPolarHBondContact O-CB 3.37Å; T857-Q861 PolarHBondContact O-N 3.33Å; Y859-Q861 PolarHBondContact O-N 2.8Å; Q861-R863 PolarHBondContact O-N 3.36Å; Q861-L864 PolarHBondContact O-N 3.26Å; Q861-V865 HydrophobicContact CG-CG2 4.35Å; Q861-V865 WeakPolarHBondContact O-CG2 3.27Å; Q861-V865 PolarHBondContact O-N 3.31Å
862	R	86.7	Confident	86.4	Confident	46 Å²	46	32.4 Å²	32.4	17%	0.174	18%	0.181	C	C	.	.	H	α-helix	trans	-56.5	-39.6	175.4	176	179.4	170.7	-106.2	-2.1	112.1	G858 Y859 M860 K866 S1325 F1326	G858-R862 WeakPolarHBondContact O-CB 3.45Å; G858-R862 PolarHBondContact O-N 3.36Å; Y859-R862 PolarHBondContact O-N 3.15Å; M860-R862 VanDerWaalsContact C-N 3.34Å; M860-R862 PolarHBondContact O-N 3.26Å; R862-K866 WeakPolarHBondContact O-CB 3.43Å; R862-K866 WeakPolarHBondContact O-CG 3.33Å; R862-K866 PolarHBondContact O-N 3.25Å; R862-K866 VanDerWaalsContact O-N 3.07Å; R862-S1325 PolarHBondContact NH2-O 3.31Å; R862-S1325 VanDerWaalsContact NH2-O 3.14Å; R862-F1326 PolarHBondContact NH2-O 3.01Å
863	R	88.7	Confident	87.3	Confident	16 Å²	16	28.9 Å²	28.9	6%	0.06	16%	0.16	C	C	.	.	H	α-helix	trans	-67.3	-45.5	178.1	-61	-171.3	-70.3	159.9	16.1	111.8	Y859 M860 Q861 K866 C867 N1079 F1326	Y859-R863 HydrophobicContact CD1-CG 4.49Å; Y859-R863 VanDerWaalsContact CE1-CD 3.44Å; Y859-R863 HydrophobicContact CE1-CG 4.15Å; Y859-R863 HydrophobicContact CE2-CG 4.34Å; Y859-R863 WeakPolarHBondContact O-CG 3.4Å; Y859-R863 PolarHBondContact O-N 3.2Å; Y859-R863 VanDerWaalsContact O-N 3.1Å; M860-R863 WeakPolarHBondContact O-CB 3.45Å; M860-R863 PolarHBondContact O-N 3.06Å; M860-R863 VanDerWaalsContact O-N 3.07Å; Q861-R863 PolarHBondContact O-N 3.36Å; R863-K866 PolarHBondContact O-N 3.33Å; R863-C867 PolarHBondContact O-N 3.26Å; R863-C867 VanDerWaalsContact O-N 3.15Å; R863-C867 PolarHBondContact O-SG 2.85Å; R863-N1079 VanDerWaalsContact CZ-OD1 3.26Å; R863-N1079 PolarHBondContact NH1-OD1 3Å; R863-N1079 PolarHBondContact NH2-OD1 2.86Å; R863-F1326 HydrophobicContact CB-CE2 4.09Å; R863-F1326 HydrophobicContact CB-CZ 4.02Å; R863-F1326 HydrophobicContact CG-CE2 3.72Å; R863-F1326 HydrophobicContact CG-CZ 3.57Å
864	L	92.2	Very high	88.4	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-59.1	-48.4	176.5	-71.4	173.5	0	0	0	111.2	M860 Q861 K866 C867 L868 A1042 I1045 V1078 L1295 M1308	M860-L864 HydrophobicContact CG-CD1 4.4Å; M860-L864 PolarHBondContact O-N 2.83Å; Q861-L864 PolarHBondContact O-N 3.26Å; L864-K866 PolarHBondContact O-N 3.19Å; L864-C867 PolarHBondContact O-N 3.44Å; L864-L868 WeakPolarHBondContact O-CB 3.44Å; L864-L868 WeakPolarHBondContact O-CG 3.14Å; L864-L868 PolarHBondContact O-N 3.32Å; L864-A1042 HydrophobicContact CB-CB 4Å; L864-I1045 HydrophobicContact CD1-CB 4.45Å; L864-I1045 HydrophobicContact CD1-CG2 4.07Å; L864-V1078 HydrophobicContact CD2-CG1 3.65Å; L864-V1078 HydrophobicContact CD2-CG2 4.31Å; L864-V1078 HydrophobicContact CG-CG1 4.43Å; L864-L1295 HydrophobicContact CD2-CD1 3.88Å; L864-M1308 HydrophobicContact CD2-CB 4.4Å; L864-M1308 HydrophobicContact CD2-CG 4.29Å
865	V	92	Very high	89.2	Confident	39 Å²	39	33 Å²	33	24%	0.236	17%	0.168	C	C	.	.	H	α-helix	trans	-59	-47.5	178.6	172.9	0	0	0	0	110.8	Q861 C867 L868 E869 A1042 T1043	Q861-V865 HydrophobicContact CG-CG2 4.35Å; Q861-V865 WeakPolarHBondContact O-CG2 3.27Å; Q861-V865 PolarHBondContact O-N 3.31Å; V865-C867 PolarHBondContact O-N 3.21Å; V865-L868 PolarHBondContact O-N 3.48Å; V865-L868 VanDerWaalsContact O-N 3.16Å; V865-E869 WeakPolarHBondContact O-CA 3.22Å; V865-E869 WeakPolarHBondContact O-CB 3.36Å; V865-E869 WeakPolarHBondContact O-CG 3.41Å; V865-E869 PolarHBondContact O-N 3.14Å; V865-A1042 HydrophobicContact CB-CB 4.38Å; V865-A1042 HydrophobicContact CG2-CB 3.76Å; V865-T1043 HydrophobicContact CG2-CG2 4.33Å
866	K	90.1	Very high	89.8	Confident	33 Å²	33	33.3 Å²	33.3	14%	0.143	16%	0.16	C	C	.	.	H	α-helix	trans	-63.8	-25.6	-179.4	-76.8	-76.2	160.7	-140.1	0	114.3	R862 R863 L864 E869 L1322 F1326 S1349	R862-K866 WeakPolarHBondContact O-CB 3.43Å; R862-K866 WeakPolarHBondContact O-CG 3.33Å; R862-K866 PolarHBondContact O-N 3.25Å; R862-K866 VanDerWaalsContact O-N 3.07Å; R863-K866 PolarHBondContact O-N 3.33Å; L864-K866 PolarHBondContact O-N 3.19Å; K866-E869 IonicContact NZ-OE1 3.58Å; K866-E869 IonicContact NZ-OE2 3.94Å; K866-E869 PolarHBondContact NZ-OE2 3.06Å; K866-L1322 HydrophobicContact CD-CD1 3.86Å; K866-F1326 HydrophobicContact CB-CD2 3.95Å; K866-F1326 HydrophobicContact CB-CE2 4.25Å; K866-F1326 HydrophobicContact CG-CD2 4.04Å; K866-S1349 PolarHBondContact NZ-OG 3.01Å
867	C	90.4	Very high	90.3	Very high	9 Å²	9	31.1 Å²	31.1	6%	0.061	15%	0.151	C	C	.	.	H	α-helix	trans	-87.6	-27.2	176.7	-57.5	0	0	0	0	112.6	R863 L864 V865 M1298 M1308 L1313	R863-C867 PolarHBondContact O-N 3.26Å; R863-C867 VanDerWaalsContact O-N 3.15Å; R863-C867 PolarHBondContact O-SG 2.85Å; L864-C867 PolarHBondContact O-N 3.44Å; V865-C867 PolarHBondContact O-N 3.21Å; C867-M1298 WeakPolarHBondContact O-CE 3.23Å; C867-M1308 HydrophobicContact CB-CB 4.49Å; C867-M1308 HydrophobicContact CB-CG 4.42Å; C867-M1308 HydrophobicContact CB-SD 3.31Å; C867-M1308 WeakPolarHBondContact CB-SD 3.33Å; C867-L1313 HydrophobicContact CB-CD1 4.21Å
868	L	93.4	Very high	90.9	Very high	1 Å²	1	31.7 Å²	31.7	1%	0.005	16%	0.155	C	C	.	.	H	α-helix	trans	-107.8	-7.2	-172.9	-63.1	171.2	0	0	0	114.1	L864 V865 D870 L871 G1038 A1042 L1295 M1298	L864-L868 WeakPolarHBondContact O-CB 3.44Å; L864-L868 WeakPolarHBondContact O-CG 3.14Å; L864-L868 PolarHBondContact O-N 3.32Å; V865-L868 PolarHBondContact O-N 3.48Å; V865-L868 VanDerWaalsContact O-N 3.16Å; L868-D870 PolarHBondContact O-N 3.28Å; L868-D870 VanDerWaalsContact O-N 3.13Å; L868-L871 HydrophobicContact CD2-CD1 3.57Å; L868-L871 PolarHBondContact O-N 3.32Å; L868-L871 VanDerWaalsContact O-N 3.12Å; L868-G1038 WeakPolarHBondContact CB-O 3.39Å; L868-G1038 CarbonylContact O-C 3.53Å; L868-G1038 VanDerWaalsContact O-CA 3.31Å; L868-G1038 WeakPolarHBondContact O-CA 3.4Å; L868-A1042 HydrophobicContact CB-CB 4.27Å; L868-A1042 HydrophobicContact CD1-CB 3.84Å; L868-L1295 HydrophobicContact CD1-CD1 4.23Å; L868-M1298 HydrophobicContact CD2-CB 3.76Å; L868-M1298 HydrophobicContact CD2-CG 3.71Å
869	E	92.7	Very high	91.5	Very high	17 Å²	17	30.1 Å²	30.1	8%	0.079	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59	-28	-172.4	56.1	179.4	-139.5	0	0	114.5	V865 K866 L1322 V1348 S1349	V865-E869 WeakPolarHBondContact O-CA 3.22Å; V865-E869 WeakPolarHBondContact O-CB 3.36Å; V865-E869 WeakPolarHBondContact O-CG 3.41Å; V865-E869 PolarHBondContact O-N 3.14Å; K866-E869 IonicContact NZ-OE1 3.58Å; K866-E869 IonicContact NZ-OE2 3.94Å; K866-E869 PolarHBondContact NZ-OE2 3.06Å; E869-L1322 WeakPolarHBondContact OE1-CD1 3.38Å; E869-V1348 HydrophobicContact CB-CG2 4.29Å; E869-V1348 HydrophobicContact CG-CB 4.47Å; E869-V1348 HydrophobicContact CG-CG2 4.4Å; E869-V1348 VanDerWaalsContact O-CG2 3.31Å; E869-V1348 WeakPolarHBondContact O-CG2 3.19Å; E869-S1349 VanDerWaalsContact OE1-CB 3.28Å; E869-S1349 WeakPolarHBondContact OE1-CB 2.96Å; E869-S1349 PolarHBondContact OE1-N 3.44Å; E869-S1349 PolarHBondContact OE1-OG 2.9Å; E869-S1349 PolarHBondContact OE2-OG 3.41Å
870	D	91.3	Very high	91.9	Very high	16 Å²	16	29 Å²	29	9%	0.086	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.6	-8.4	-178.3	-70.5	-18.4	0	0	0	114.2	L868 C872 S882 K1317 G1347 V1348	L868-D870 PolarHBondContact O-N 3.28Å; L868-D870 VanDerWaalsContact O-N 3.13Å; D870-C872 PolarHBondContact O-N 3.14Å; D870-S882 PolarHBondContact OD2-OG 3.49Å; D870-K1317 IonicContact OD1-NZ 2.63Å; D870-K1317 WeakPolarHBondContact OD2-CD 3.4Å; D870-K1317 WeakPolarHBondContact OD2-CE 3.4Å; D870-K1317 IonicContact OD2-NZ 3.55Å; D870-K1317 PolarHBondContact OD2-NZ 3.15Å; D870-G1347 WeakPolarHBondContact OD1-CA 3.09Å; D870-V1348 WeakPolarHBondContact OD1-CG2 3.25Å; D870-V1348 PolarHBondContact OD1-N 3.34Å
871	L	94	Very high	92	Very high	1 Å²	1	29.7 Å²	29.7	1%	0.005	14%	0.138	C	C	.	.			trans	-76.7	117	-178.1	-66.7	171.7	0	0	0	110.5	L868 V879 R880 N881 A887 V1037 G1038 I1294 M1298	L868-L871 HydrophobicContact CD2-CD1 3.57Å; L868-L871 PolarHBondContact O-N 3.32Å; L868-L871 VanDerWaalsContact O-N 3.12Å; L871-V879 HydrophobicContact CB-CG1 4.17Å; L871-V879 HydrophobicContact CD2-CG1 4.31Å; L871-R880 WeakPolarHBondContact CA-O 3.41Å; L871-N881 HydrophobicContact CD2-CB 4.09Å; L871-A887 HydrophobicContact CD2-CB 3.84Å; L871-V1037 PolarHBondContact O-N 2.92Å; L871-G1038 PolarHBondContact O-N 3.44Å; L871-G1038 VanDerWaalsContact O-N 3.15Å; L871-I1294 HydrophobicContact CD1-CG2 3.81Å; L871-M1298 HydrophobicContact CD1-CB 4.31Å; L871-M1298 HydrophobicContact CD1-CE 4.21Å; L871-M1298 HydrophobicContact CD1-CG 4.35Å; L871-M1298 HydrophobicContact CD1-SD 4.21Å; L871-M1298 HydrophobicContact CD2-CE 4.33Å; L871-M1298 HydrophobicContact CD2-SD 4.39Å; L871-M1298 HydrophobicContact CG-CE 4.25Å
872	C	94.8	Very high	91.8	Very high	7 Å²	7	29.8 Å²	29.8	5%	0.047	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	148.2	-178.8	-171.5	0	0	0	0	110.9	D870 H874 V879 R880 G1034 L1360	D870-C872 PolarHBondContact O-N 3.14Å; C872-H874 PolarHBondContact O-CD2 3Å; C872-V879 WeakPolarHBondContact O-CA 3.37Å; C872-R880 PolarHBondContact N-O 2.99Å; C872-R880 VanDerWaalsContact N-O 3.08Å; C872-R880 PolarHBondContact O-N 3.27Å; C872-R880 VanDerWaalsContact O-N 3.1Å; C872-G1034 PolarHBondContact SG-O 3.09Å; C872-G1034 VanDerWaalsContact SG-O 3.32Å; C872-L1360 HydrophobicContact CB-CB 4.38Å
873	L	95.1	Very high	91.6	Very high	2 Å²	2	31.8 Å²	31.8	1%	0.01	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	121.5	170.6	180	57.4	0	0	0	109.9	V879 F891 A1031 G1034 T1035 V1037	L873-V879 HydrophobicContact CD1-CG2 4.31Å; L873-F891 HydrophobicContact CD1-CB 3.94Å; L873-A1031 HydrophobicContact CD2-CB 3.59Å; L873-G1034 PolarHBondContact O-N 3.25Å; L873-T1035 PolarHBondContact N-O 3.37Å; L873-T1035 VanDerWaalsContact N-O 3.13Å; L873-V1037 HydrophobicContact CB-CG1 4.22Å
874	H	94.4	Very high	91.4	Very high	53 Å²	53	32.9 Å²	32.9	25%	0.245	17%	0.171	C	C	.	.			trans	-90.3	163.9	178.7	-73.1	-102	0	0	0	112.7	C872 D876 N877 T878 R880 M1364	C872-H874 PolarHBondContact O-CD2 3Å; H874-D876 WeakPolarHBondContact CB-OD1 3.44Å; H874-D876 PolarHBondContact O-N 3.35Å; H874-D876 VanDerWaalsContact O-N 3.13Å; H874-N877 WeakPolarHBondContact O-CA 3.41Å; H874-N877 PolarHBondContact O-N 3.29Å; H874-T878 PolarHBondContact N-O 2.92Å; H874-R880 WeakPolarHBondContact NE2-CB 3.46Å; H874-M1364 HydrophobicContact CB-CE 4.14Å; H874-M1364 WeakPolarHBondContact ND1-CE 3.41Å
875	Y	92.7	Very high	91.2	Very high	140 Å²	140	36 Å²	36	55%	0.549	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-19.8	179.4	-78.3	-78.5	0	0	0	114.5	N877 P1033 M1364 I1365	Y875-N877 VanDerWaalsContact C-N 3.26Å; Y875-P1033 HydrophobicContact CD1-CB 3.72Å; Y875-P1033 HydrophobicContact CD1-CG 3.93Å; Y875-P1033 HydrophobicContact CD2-CB 4.46Å; Y875-P1033 HydrophobicContact CE1-CB 3.88Å; Y875-P1033 HydrophobicContact CE1-CG 4.27Å; Y875-P1033 HydrophobicContact CG-CB 4.02Å; Y875-M1364 HydrophobicContact CD2-CE 4.04Å; Y875-M1364 HydrophobicContact CD2-SD 4.32Å; Y875-M1364 HydrophobicContact CE2-CE 4.37Å; Y875-M1364 HydrophobicContact CE2-CG 4.41Å; Y875-M1364 HydrophobicContact CE2-SD 4.09Å; Y875-I1365 HydrophobicContact CE2-CG2 3.81Å; Y875-I1365 WeakPolarHBondContact OH-CG2 3.4Å
876	D	92.1	Very high	91.3	Very high	77 Å²	77	36.9 Å²	36.9	41%	0.412	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.6	10.9	173.8	68.1	-13	0	0	0	113.2	H874 T878 R880	H874-D876 WeakPolarHBondContact CB-OD1 3.44Å; H874-D876 PolarHBondContact O-N 3.35Å; H874-D876 VanDerWaalsContact O-N 3.13Å; D876-T878 VanDerWaalsContact CG-OG1 3.25Å; D876-T878 PolarHBondContact O-N 3.4Å; D876-T878 WeakPolarHBondContact OD1-CB 3.34Å; D876-T878 PolarHBondContact OD1-N 3.3Å; D876-T878 VanDerWaalsContact OD1-N 3.16Å; D876-T878 PolarHBondContact OD1-OG1 2.92Å; D876-T878 PolarHBondContact OD2-OG1 2.86Å; D876-R880 IonicContact OD2-CZ 2.98Å; D876-R880 IonicContact OD2-NE 3.98Å; D876-R880 IonicContact OD2-NH2 3.37Å; D876-R880 PolarHBondContact OD2-NH2 2.71Å
877	N	88.9	Confident	91.4	Very high	47 Å²	47	36.1 Å²	36.1	25%	0.251	20%	0.195	S	C	.	.	S	Bend	trans	66.5	11.4	-177.2	-53.5	-63.5	0	0	0	115.6	H874 Y875 R895	H874-N877 WeakPolarHBondContact O-CA 3.41Å; H874-N877 PolarHBondContact O-N 3.29Å; Y875-N877 VanDerWaalsContact C-N 3.26Å; N877-R895 HydrophobicContact CB-CG 4.48Å
878	T	94.7	Very high	91.6	Very high	12 Å²	12	36.2 Å²	36.2	7%	0.074	20%	0.195	C	C	.	.			trans	-88.4	148.9	173.9	67.1	0	0	0	0	111.1	H874 D876 R880 Q888 F889	H874-T878 PolarHBondContact N-O 2.92Å; D876-T878 VanDerWaalsContact CG-OG1 3.25Å; D876-T878 PolarHBondContact O-N 3.4Å; D876-T878 WeakPolarHBondContact OD1-CB 3.34Å; D876-T878 PolarHBondContact OD1-N 3.3Å; D876-T878 VanDerWaalsContact OD1-N 3.16Å; D876-T878 PolarHBondContact OD1-OG1 2.92Å; D876-T878 PolarHBondContact OD2-OG1 2.86Å; T878-R880 WeakPolarHBondContact OG1-CG 3.41Å; T878-R880 PolarHBondContact OG1-NE 3.09Å; T878-Q888 WeakPolarHBondContact CA-O 3.29Å; T878-F889 WeakPolarHBondContact CG2-O 3.27Å
879	V	95.9	Very high	91.6	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	119.8	170.4	-176.2	0	0	0	0	108.2	L871 C872 L873 A887 Q888 F891 V1037	L871-V879 HydrophobicContact CB-CG1 4.17Å; L871-V879 HydrophobicContact CD2-CG1 4.31Å; C872-V879 WeakPolarHBondContact O-CA 3.37Å; L873-V879 HydrophobicContact CD1-CG2 4.31Å; V879-A887 PolarHBondContact O-N 3.38Å; V879-Q888 HydrophobicContact CB-CB 4.03Å; V879-Q888 HydrophobicContact CG2-CB 4.09Å; V879-Q888 PolarHBondContact N-O 3.27Å; V879-Q888 PolarHBondContact O-N 3.45Å; V879-F891 HydrophobicContact CG2-CB 4.01Å; V879-F891 HydrophobicContact CG2-CD2 3.82Å; V879-F891 HydrophobicContact CG2-CG 4.42Å; V879-V1037 HydrophobicContact CG1-CG2 3.73Å; V879-V1037 HydrophobicContact CG2-CG2 4.33Å
880	R	93.3	Very high	91.6	Very high	69 Å²	69	46.5 Å²	46.5	26%	0.26	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	157.6	-178.2	-44.1	-175.5	179.9	-159.5	0.8	111.6	L871 C872 H874 D876 T878 C885 I886	L871-R880 WeakPolarHBondContact CA-O 3.41Å; C872-R880 PolarHBondContact N-O 2.99Å; C872-R880 VanDerWaalsContact N-O 3.08Å; C872-R880 PolarHBondContact O-N 3.27Å; C872-R880 VanDerWaalsContact O-N 3.1Å; H874-R880 WeakPolarHBondContact NE2-CB 3.46Å; D876-R880 IonicContact OD2-CZ 2.98Å; D876-R880 IonicContact OD2-NE 3.98Å; D876-R880 IonicContact OD2-NH2 3.37Å; D876-R880 PolarHBondContact OD2-NH2 2.71Å; T878-R880 WeakPolarHBondContact OG1-CG 3.41Å; T878-R880 PolarHBondContact OG1-NE 3.09Å; R880-C885 VanDerWaalsContact CA-O 3.22Å; R880-C885 WeakPolarHBondContact CA-O 3.42Å; R880-C885 WeakPolarHBondContact CB-O 3.39Å; R880-I886 HydrophobicContact CG-CG1 4.13Å
881	N	89.4	Confident	91.6	Very high	18 Å²	18	46 Å²	46	10%	0.096	24%	0.238	C	C	.	.			trans	-87.6	178.1	168.3	73.5	-1.9	0	0	0	111.2	L871 D883 G884 C885	L871-N881 HydrophobicContact CD2-CB 4.09Å; N881-D883 PolarHBondContact O-N 3.29Å; N881-D883 PolarHBondContact OD1-N 3.3Å; N881-G884 PolarHBondContact O-N 3.32Å; N881-G884 PolarHBondContact OD1-N 2.95Å; N881-G884 VanDerWaalsContact OD1-N 3.17Å; N881-C885 PolarHBondContact N-O 3.47Å; N881-C885 WeakPolarHBondContact OD1-CA 3.36Å; N881-C885 VanDerWaalsContact OD1-CB 3.25Å; N881-C885 WeakPolarHBondContact OD1-CB 3.44Å; N881-C885 PolarHBondContact OD1-N 3.35Å; N881-C885 PolarHBondContact OD1-O 3.24Å
882	S	84.4	Confident	91.2	Very high	23 Å²	23	46.3 Å²	46.3	16%	0.161	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-21.3	179.5	48.8	0	0	0	0	115	D870 G884 K1317 T1346	D870-S882 PolarHBondContact OD2-OG 3.49Å; S882-G884 VanDerWaalsContact C-N 3.32Å; S882-K1317 VanDerWaalsContact OG-CE 3.32Å; S882-K1317 WeakPolarHBondContact OG-CE 3.28Å; S882-T1346 PolarHBondContact O-OG1 3.24Å
883	D	82.5	Confident	90.9	Very high	87 Å²	87	48.3 Å²	48.3	47%	0.465	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87	-3.1	175.7	-61.7	-39.5	0	0	0	112.4	N881 C885	N881-D883 PolarHBondContact O-N 3.29Å; N881-D883 PolarHBondContact OD1-N 3.3Å; D883-C885 VanDerWaalsContact C-N 3.34Å
884	G	85.8	Confident	90.5	Very high	40 Å²	40	49.8 Å²	49.8	41%	0.412	27%	0.27	S	S	.	.			trans	81.9	6.9	-176.7	0	0	0	0	0	114.8	N881 S882	N881-G884 PolarHBondContact O-N 3.32Å; N881-G884 PolarHBondContact OD1-N 2.95Å; N881-G884 VanDerWaalsContact OD1-N 3.17Å; S882-G884 VanDerWaalsContact C-N 3.32Å
885	C	88.1	Confident	90.2	Very high	65 Å²	65	51 Å²	51	44%	0.439	27%	0.273	S	S	.	.			trans	-70	130.9	173	-171.5	0	0	0	0	110.2	R880 N881 D883	R880-C885 VanDerWaalsContact CA-O 3.22Å; R880-C885 WeakPolarHBondContact CA-O 3.42Å; R880-C885 WeakPolarHBondContact CB-O 3.39Å; N881-C885 PolarHBondContact N-O 3.47Å; N881-C885 WeakPolarHBondContact OD1-CA 3.36Å; N881-C885 VanDerWaalsContact OD1-CB 3.25Å; N881-C885 WeakPolarHBondContact OD1-CB 3.44Å; N881-C885 PolarHBondContact OD1-N 3.35Å; N881-C885 PolarHBondContact OD1-O 3.24Å; D883-C885 VanDerWaalsContact C-N 3.34Å
886	I	93.3	Very high	90.1	Very high	57 Å²	57	44.3 Å²	44.3	29%	0.292	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	120.4	-179.8	-58.6	175.4	0	0	0	108.7	R880 Q888 F889	R880-I886 HydrophobicContact CG-CG1 4.13Å; I886-Q888 WeakPolarHBondContact CG2-O 3.37Å; I886-F889 HydrophobicContact CD1-CD1 4.47Å; I886-F889 HydrophobicContact CD1-CE1 4.16Å; I886-F889 HydrophobicContact CG2-CD1 4.22Å; I886-F889 HydrophobicContact CG2-CE1 4.38Å; I886-F889 HydrophobicContact CG2-CG 4.42Å
887	A	92.3	Very high	90.2	Very high	18 Å²	18	42.4 Å²	42.4	15%	0.149	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	-39.7	170.6	0	0	0	0	0	111.3	L871 V879	L871-A887 HydrophobicContact CD2-CB 3.84Å; V879-A887 PolarHBondContact O-N 3.38Å
888	Q	94.7	Very high	90.3	Very high	11 Å²	11	40.2 Å²	40.2	5%	0.051	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	134.3	174.6	-64.6	179.3	-22.3	0	0	110	T878 V879 I886 Q890 G892 D1297	T878-Q888 WeakPolarHBondContact CA-O 3.29Å; V879-Q888 HydrophobicContact CB-CB 4.03Å; V879-Q888 HydrophobicContact CG2-CB 4.09Å; V879-Q888 PolarHBondContact N-O 3.27Å; V879-Q888 PolarHBondContact O-N 3.45Å; I886-Q888 WeakPolarHBondContact CG2-O 3.37Å; Q888-Q890 VanDerWaalsContact C-N 3.28Å; Q888-G892 VanDerWaalsContact OE1-N 3.09Å; Q888-D1297 HydrophobicContact CG-CB 4.09Å; Q888-D1297 WeakPolarHBondContact CG-OD2 3.26Å; Q888-D1297 PolarHBondContact NE2-OD2 2.82Å
889	F	94.2	Very high	90.2	Very high	169 Å²	169	40.5 Å²	40.5	74%	0.741	23%	0.227	S	C	*	.	S	Bend	trans	-69.7	-29.4	172.1	-69.9	-78.6	0	0	0	112.5	T878 I886	T878-F889 WeakPolarHBondContact CG2-O 3.27Å; I886-F889 HydrophobicContact CD1-CD1 4.47Å; I886-F889 HydrophobicContact CD1-CE1 4.16Å; I886-F889 HydrophobicContact CG2-CD1 4.22Å; I886-F889 HydrophobicContact CG2-CE1 4.38Å; I886-F889 HydrophobicContact CG2-CG 4.42Å
890	Q	90.8	Very high	90	Very high	65 Å²	65	43.5 Å²	43.5	30%	0.304	24%	0.241	S	C	.	.	S	Bend	trans	-141	127	176.8	-175.5	170.9	-11.6	0	0	108.1	Q888 G892 G893 R895	Q888-Q890 VanDerWaalsContact C-N 3.28Å; Q890-G892 PolarHBondContact O-N 2.72Å; Q890-G892 VanDerWaalsContact O-N 3.16Å; Q890-G893 VanDerWaalsContact CD-O 3.24Å; Q890-G893 PolarHBondContact NE2-O 2.92Å; Q890-G893 VanDerWaalsContact NE2-O 3.14Å; Q890-G893 PolarHBondContact O-N 3.42Å; Q890-G893 VanDerWaalsContact O-N 3.16Å; Q890-R895 HydrophobicContact CG-CG 3.49Å; Q890-R895 VanDerWaalsContact CG-CG 3.49Å
891	F	91.2	Very high	89.9	Confident	5 Å²	5	40.4 Å²	40.4	2%	0.022	23%	0.229	C	C	.	.	G	3₁₀ helix	trans	-54.4	120.8	179.4	176.2	-113.6	0	0	0	111.4	L873 V879 G893 D894 R895 I896 A1031 V1037 I1294	L873-F891 HydrophobicContact CD1-CB 3.94Å; V879-F891 HydrophobicContact CG2-CB 4.01Å; V879-F891 HydrophobicContact CG2-CD2 3.82Å; V879-F891 HydrophobicContact CG2-CG 4.42Å; F891-G893 PolarHBondContact O-N 3.07Å; F891-D894 PolarHBondContact O-N 2.9Å; F891-R895 WeakPolarHBondContact O-CA 3.5Å; F891-R895 PolarHBondContact O-N 3.45Å; F891-I896 VanDerWaalsContact CE1-O 3.23Å; F891-I896 WeakPolarHBondContact CE1-O 3.45Å; F891-A1031 HydrophobicContact CD1-CB 3.76Å; F891-A1031 HydrophobicContact CE1-CB 3.89Å; F891-V1037 HydrophobicContact CD2-CB 4.33Å; F891-V1037 HydrophobicContact CD2-CG1 3.97Å; F891-V1037 HydrophobicContact CD2-CG2 4.45Å; F891-V1037 HydrophobicContact CE2-CB 3.68Å; F891-V1037 HydrophobicContact CE2-CG1 3.44Å; F891-V1037 VanDerWaalsContact CE2-CG1 3.44Å; F891-V1037 HydrophobicContact CE2-CG2 4.23Å; F891-V1037 HydrophobicContact CZ-CB 4.41Å; F891-V1037 HydrophobicContact CZ-CG1 3.9Å; F891-I1294 HydrophobicContact CD2-CD1 4.34Å; F891-I1294 HydrophobicContact CE2-CD1 3.54Å; F891-I1294 HydrophobicContact CE2-CG1 4.32Å; F891-I1294 HydrophobicContact CZ-CD1 4.37Å
892	G	87.5	Confident	89.9	Confident	8 Å²	8	39.8 Å²	39.8	8%	0.082	23%	0.226	C	C	.	.	G	3₁₀ helix	trans	61.8	6.7	177.6	0	0	0	0	0	115.7	Q888 Q890 D894 M1293	Q888-G892 VanDerWaalsContact OE1-N 3.09Å; Q890-G892 PolarHBondContact O-N 2.72Å; Q890-G892 VanDerWaalsContact O-N 3.16Å; G892-D894 PolarHBondContact O-N 3.36Å; G892-M1293 VanDerWaalsContact O-CE 3.27Å; G892-M1293 WeakPolarHBondContact O-CE 3.16Å
893	G	87	Confident	89.9	Confident	48 Å²	48	40 Å²	40	50%	0.495	23%	0.227	S	C	.	.	G	3₁₀ helix	trans	79.3	-15.9	-170.5	0	0	0	0	0	115	Q890 F891	Q890-G893 VanDerWaalsContact CD-O 3.24Å; Q890-G893 PolarHBondContact NE2-O 2.92Å; Q890-G893 VanDerWaalsContact NE2-O 3.14Å; Q890-G893 PolarHBondContact O-N 3.42Å; Q890-G893 VanDerWaalsContact O-N 3.16Å; F891-G893 PolarHBondContact O-N 3.07Å
894	D	87.4	Confident	89.7	Confident	33 Å²	33	41.4 Å²	41.4	18%	0.176	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-131.5	-5.8	-172	63.3	2.6	0	0	0	114.9	F891 G892 I896 R1290	F891-D894 PolarHBondContact O-N 2.9Å; G892-D894 PolarHBondContact O-N 3.36Å; D894-I896 HydrophobicContact CB-CG1 4.16Å; D894-I896 PolarHBondContact O-N 2.92Å; D894-I896 PolarHBondContact OD1-N 3.47Å; D894-R1290 IonicContact OD1-CZ 3.85Å; D894-R1290 IonicContact OD1-NE 3.77Å; D894-R1290 PolarHBondContact OD1-NE 2.93Å; D894-R1290 IonicContact OD2-CZ 3.93Å; D894-R1290 IonicContact OD2-NE 2.93Å; D894-R1290 PolarHBondContact OD2-NE 2.99Å; D894-R1290 IonicContact OD2-NH2 2.78Å; D894-R1290 PolarHBondContact OD2-NH2 3.43Å
895	R	88.7	Confident	89.2	Confident	78 Å²	78	45.7 Å²	45.7	29%	0.294	25%	0.252	S	S	.	.			trans	65.7	11.7	-176.9	-49.1	168.8	-143.8	-177.1	6	114.4	N877 Q890 F891 I1030 A1031	N877-R895 HydrophobicContact CB-CG 4.48Å; Q890-R895 HydrophobicContact CG-CG 3.49Å; Q890-R895 VanDerWaalsContact CG-CG 3.49Å; F891-R895 WeakPolarHBondContact O-CA 3.5Å; F891-R895 PolarHBondContact O-N 3.45Å; R895-I1030 HydrophobicContact CB-CG2 4.37Å; R895-I1030 WeakPolarHBondContact O-CA 3.44Å; R895-A1031 WeakPolarHBondContact O-CB 3.21Å; R895-A1031 PolarHBondContact O-N 3.35Å
896	I	90.7	Very high	88.9	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	25%	0.249	C	C	.	.	B	Isolated β-bridge	trans	-89.9	133.2	-174.4	-57.6	-58.6	0	0	0	110.8	F891 D894 P898 M901 V907 Y1026 A1029 R1290	F891-I896 VanDerWaalsContact CE1-O 3.23Å; F891-I896 WeakPolarHBondContact CE1-O 3.45Å; D894-I896 HydrophobicContact CB-CG1 4.16Å; D894-I896 PolarHBondContact O-N 2.92Å; D894-I896 PolarHBondContact OD1-N 3.47Å; I896-P898 WeakPolarHBondContact O-CD 3.18Å; I896-M901 HydrophobicContact CB-SD 4.5Å; I896-M901 HydrophobicContact CG2-CG 4.22Å; I896-M901 HydrophobicContact CG2-SD 3.51Å; I896-M901 VanDerWaalsContact CG2-SD 3.51Å; I896-V907 HydrophobicContact CD1-CG1 4.46Å; I896-V907 HydrophobicContact CD1-CG2 4.39Å; I896-V907 HydrophobicContact CG1-CG2 4.05Å; I896-V907 HydrophobicContact CG2-CG1 4.2Å; I896-V907 HydrophobicContact CG2-CG2 4.24Å; I896-Y1026 HydrophobicContact CD1-CE2 3.88Å; I896-A1029 WeakPolarHBondContact CA-O 3.39Å; I896-A1029 HydrophobicContact CD1-CB 4.35Å; I896-A1029 HydrophobicContact CG2-CB 4.19Å; I896-R1290 WeakPolarHBondContact O-CD 3.33Å; I896-R1290 PolarHBondContact O-NE 3.35Å
897	D	92.7	Very high	88.6	Confident	38 Å²	38	44.5 Å²	44.5	20%	0.203	24%	0.24	C	C	.	.			trans	-71.9	122.7	172.1	-178.6	-0.4	0	0	0	110.5	T899 Q900 A1029 A1031	D897-T899 PolarHBondContact O-N 3.02Å; D897-T899 WeakPolarHBondContact OD1-CG2 3.33Å; D897-T899 PolarHBondContact OD1-N 3.06Å; D897-T899 PolarHBondContact OD1-OG1 3.47Å; D897-T899 PolarHBondContact OD2-OG1 2.84Å; D897-Q900 HydrophobicContact CB-CB 4.48Å; D897-Q900 HydrophobicContact CB-CG 4.01Å; D897-Q900 PolarHBondContact O-N 3.32Å; D897-A1029 PolarHBondContact N-O 3.44Å; D897-A1031 HydrophobicContact CB-CB 4.13Å
898	P	92.3	Very high	88.4	Confident	1 Å²	1	43.8 Å²	43.8	1%	0.006	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-50.4	-29.1	172.4	-29.8	36.9	0	0	0	114.5	I896 Q900 D1288 R1290	I896-P898 WeakPolarHBondContact O-CD 3.18Å; P898-Q900 PolarHBondContact O-N 3.24Å; P898-D1288 HydrophobicContact CB-CB 3.92Å; P898-D1288 HydrophobicContact CG-CB 4.34Å; P898-R1290 HydrophobicContact CG-CB 4.1Å
899	T	92	Very high	88.2	Confident	18 Å²	18	44.1 Å²	44.1	11%	0.11	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-22.9	178.9	78.6	0	0	0	0	112.6	P523 R658 D897	P523-T899 HydrophobicContact CB-CG2 3.83Å; R658-T899 PolarHBondContact NH2-O 2.9Å; D897-T899 PolarHBondContact O-N 3.02Å; D897-T899 WeakPolarHBondContact OD1-CG2 3.33Å; D897-T899 PolarHBondContact OD1-N 3.06Å; D897-T899 PolarHBondContact OD1-OG1 3.47Å; D897-T899 PolarHBondContact OD2-OG1 2.84Å
900	Q	91.5	Very high	88	Confident	63 Å²	63	36.5 Å²	36.5	29%	0.294	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.7	-9.3	-173.3	-59.2	-63.7	-23.6	0	0	113.6	D897 P898 E902 A1029	D897-Q900 HydrophobicContact CB-CB 4.48Å; D897-Q900 HydrophobicContact CB-CG 4.01Å; D897-Q900 PolarHBondContact O-N 3.32Å; P898-Q900 PolarHBondContact O-N 3.24Å; Q900-E902 PolarHBondContact O-N 2.87Å; Q900-A1029 HydrophobicContact CB-CB 3.78Å
901	M	90.7	Very high	88	Confident	3 Å²	3	38.1 Å²	38.1	2%	0.015	21%	0.214	C	C	.	.			trans	-62.9	117	178.9	-67.3	-67.8	-67.8	0	0	112.3	K649 Y654 I896 V907 R1290	K649-M901 PolarHBondContact NZ-O 2.95Å; Y654-M901 PolarHBondContact OH-O 3.21Å; I896-M901 HydrophobicContact CB-SD 4.5Å; I896-M901 HydrophobicContact CG2-CG 4.22Å; I896-M901 HydrophobicContact CG2-SD 3.51Å; I896-M901 VanDerWaalsContact CG2-SD 3.51Å; M901-V907 HydrophobicContact CE-CG2 4.39Å; M901-V907 HydrophobicContact SD-CB 4.26Å; M901-V907 HydrophobicContact SD-CG1 4.48Å; M901-V907 HydrophobicContact SD-CG2 3.87Å; M901-R1290 PolarHBondContact SD-NH2 3.37Å
902	E	90	Very high	87.9	Confident	6 Å²	6	38.3 Å²	38.3	3%	0.028	22%	0.215	C	C	.	.	S	Bend	trans	-78.8	-30.6	178.8	-67	-169.3	159.5	0	0	113.8	K649 R658 Q900 V907 N909 K1025	K649-E902 WeakPolarHBondContact CB-O 3.47Å; K649-E902 WeakPolarHBondContact CD-O 3.32Å; R658-E902 HydrophobicContact CG-CG 4.46Å; Q900-E902 PolarHBondContact O-N 2.87Å; E902-V907 WeakPolarHBondContact CB-O 3.43Å; E902-V907 PolarHBondContact N-O 2.69Å; E902-N909 HydrophobicContact CB-CB 4.23Å; E902-N909 PolarHBondContact OE2-N 2.78Å; E902-K1025 WeakPolarHBondContact OE1-CD 3.3Å; E902-K1025 WeakPolarHBondContact OE1-CE 3.3Å; E902-K1025 IonicContact OE1-NZ 2.74Å; E902-K1025 PolarHBondContact OE1-NZ 3.09Å; E902-K1025 IonicContact OE2-NZ 3.54Å
903	C	84.9	Confident	87.9	Confident	28 Å²	28	38.2 Å²	38.2	19%	0.189	21%	0.214	C	C	.	.	S	Bend	trans	-117.4	-179.7	174.9	-65.9	0	0	0	0	110.5	K649 E906	K649-C903 PolarHBondContact NZ-O 3.32Å; C903-E906 HydrophobicContact CB-CB 3.94Å; C903-E906 WeakPolarHBondContact CB-O 3.03Å; C903-E906 PolarHBondContact N-O 2.99Å; C903-E906 VanDerWaalsContact N-O 3.09Å
904	T	77.2	Confident	88	Confident	115 Å²	115	36.9 Å²	36.9	71%	0.706	19%	0.194	S	C	*	.	S	Bend	trans	-71.3	-44.9	174.2	-50.7	0	0	0	0	110.9
905	D	75.9	Confident	88	Confident	131 Å²	131	38 Å²	38	70%	0.701	20%	0.198	S	C	*	.	S	Bend	trans	-111.1	-17.1	-173.8	-52.8	-47.3	0	0	0	113.1
906	E	82.2	Confident	88	Confident	80 Å²	80	35.2 Å²	35.2	37%	0.374	19%	0.188	S	C	.	.			trans	-112.2	139	-178.8	-61.8	178.2	169.1	0	0	111.4	C903	C903-E906 HydrophobicContact CB-CB 3.94Å; C903-E906 WeakPolarHBondContact CB-O 3.03Å; C903-E906 PolarHBondContact N-O 2.99Å; C903-E906 VanDerWaalsContact N-O 3.09Å
907	V	86	Confident	87.8	Confident	16 Å²	16	35.3 Å²	35.3	10%	0.097	19%	0.189	C	C	.	.	S	Bend	trans	-66.5	-46.7	178.1	-176.4	0	0	0	0	110.8	I896 M901 E902 Y1026 A1029	I896-V907 HydrophobicContact CD1-CG1 4.46Å; I896-V907 HydrophobicContact CD1-CG2 4.39Å; I896-V907 HydrophobicContact CG1-CG2 4.05Å; I896-V907 HydrophobicContact CG2-CG1 4.2Å; I896-V907 HydrophobicContact CG2-CG2 4.24Å; M901-V907 HydrophobicContact CE-CG2 4.39Å; M901-V907 HydrophobicContact SD-CB 4.26Å; M901-V907 HydrophobicContact SD-CG1 4.48Å; M901-V907 HydrophobicContact SD-CG2 3.87Å; E902-V907 WeakPolarHBondContact CB-O 3.43Å; E902-V907 PolarHBondContact N-O 2.69Å; V907-Y1026 HydrophobicContact CB-CD2 4.5Å; V907-Y1026 HydrophobicContact CG1-CD2 4.22Å; V907-Y1026 HydrophobicContact CG2-CE2 4.49Å; V907-A1029 HydrophobicContact CG1-CB 3.5Å; V907-A1029 VanDerWaalsContact CG1-CB 3.5Å
908	V	88.6	Confident	87.5	Confident	3 Å²	3	35.2 Å²	35.2	2%	0.018	19%	0.188	C	C	.	.	S	Bend	trans	-117	133	-177.7	-178.1	0	0	0	0	108.8	L910 F954 K1025	V908-L910 HydrophobicContact CB-CD2 4.39Å; V908-L910 HydrophobicContact CG1-CD2 4.3Å; V908-L910 PolarHBondContact O-N 2.99Å; V908-F954 HydrophobicContact CB-CE2 4.34Å; V908-F954 HydrophobicContact CG2-CE2 4.07Å; V908-K1025 HydrophobicContact CG1-CB 4.45Å; V908-K1025 HydrophobicContact CG1-CD 4.09Å; V908-K1025 HydrophobicContact CG2-CB 3.86Å
909	N	90.5	Very high	87	Confident	19 Å²	19	36.3 Å²	36.3	10%	0.102	20%	0.196	C	C	.	.			trans	-76.1	91.8	172.9	-173.4	-27.6	0	0	0	109.7	E902 N911 H912 G913	E902-N909 HydrophobicContact CB-CB 4.23Å; E902-N909 PolarHBondContact OE2-N 2.78Å; N909-N911 VanDerWaalsContact C-N 3.29Å; N909-N911 PolarHBondContact O-N 2.76Å; N909-N911 PolarHBondContact OD1-N 2.87Å; N909-H912 HydrophobicContact CB-CB 4.06Å; N909-H912 PolarHBondContact O-N 3.33Å; N909-H912 PolarHBondContact OD1-N 3.44Å; N909-G913 PolarHBondContact O-N 3.19Å
910	L	90.4	Very high	86.4	Confident	8 Å²	8	37.5 Å²	37.5	4%	0.042	21%	0.205	C	C	.	.	H	α-helix	trans	-61.4	-37.1	-175.5	-60.3	179.5	0	0	0	112.3	V908 G913 W914 L958 F961	V908-L910 HydrophobicContact CB-CD2 4.39Å; V908-L910 HydrophobicContact CG1-CD2 4.3Å; V908-L910 PolarHBondContact O-N 2.99Å; L910-G913 PolarHBondContact O-N 3.4Å; L910-W914 VanDerWaalsContact O-CB 3.31Å; L910-W914 WeakPolarHBondContact O-CB 3.46Å; L910-W914 PolarHBondContact O-N 3.24Å; L910-L958 HydrophobicContact CD2-CD1 3.94Å; L910-F961 HydrophobicContact CB-CD1 4.19Å; L910-F961 HydrophobicContact CB-CD2 3.96Å; L910-F961 HydrophobicContact CB-CE1 4.24Å; L910-F961 HydrophobicContact CB-CE2 4.01Å; L910-F961 HydrophobicContact CB-CG 4.04Å; L910-F961 HydrophobicContact CB-CZ 4.15Å; L910-F961 HydrophobicContact CD1-CB 3.69Å; L910-F961 HydrophobicContact CD1-CD1 4.42Å; L910-F961 HydrophobicContact CD1-CD2 4.23Å; L910-F961 HydrophobicContact CD1-CG 3.87Å
911	N	90.1	Very high	85.2	Confident	100 Å²	100	36.1 Å²	36.1	54%	0.535	20%	0.201	S	C	.	.	H	α-helix	trans	-63.2	-46.9	177.6	-71.4	-58	0	0	0	111.9	N909 E915	N909-N911 VanDerWaalsContact C-N 3.29Å; N909-N911 PolarHBondContact O-N 2.76Å; N909-N911 PolarHBondContact OD1-N 2.87Å; N911-E915 PolarHBondContact O-N 3.48Å; N911-E915 VanDerWaalsContact O-N 3.14Å
912	H	89.4	Confident	84	Confident	9 Å²	9	41.9 Å²	41.9	4%	0.042	24%	0.236	C	C	.	.	H	α-helix	trans	-65.4	-45.9	176.2	175.3	80.1	0	0	0	111.5	N606 D659 N909 W914 E915 H916	N606-H912 PolarHBondContact O-CE1 3.44Å; D659-H912 IonicContact OD1-NE2 3.25Å; D659-H912 IonicContact OD2-CD2 2.62Å; D659-H912 IonicContact OD2-CE1 3.41Å; D659-H912 IonicContact OD2-NE2 3.5Å; D659-H912 PolarHBondContact OD2-NE2 3.07Å; N909-H912 HydrophobicContact CB-CB 4.06Å; N909-H912 PolarHBondContact O-N 3.33Å; N909-H912 PolarHBondContact OD1-N 3.44Å; H912-W914 VanDerWaalsContact C-N 3.27Å; H912-W914 PolarHBondContact O-N 3.47Å; H912-E915 PolarHBondContact O-N 3.49Å; H912-H916 VanDerWaalsContact O-CB 3.23Å; H912-H916 WeakPolarHBondContact O-CB 3.27Å; H912-H916 PolarHBondContact O-N 3.06Å
913	G	88	Confident	82.4	Confident	6 Å²	6	44.4 Å²	44.4	6%	0.062	25%	0.254	C	S	.	.	H	α-helix	trans	-57.5	-40.5	178.1	0	0	0	0	0	112.6	N909 L910 S917	N909-G913 PolarHBondContact O-N 3.19Å; L910-G913 PolarHBondContact O-N 3.4Å; G913-S917 WeakPolarHBondContact O-CB 3.38Å; G913-S917 PolarHBondContact O-N 3.36Å; G913-S917 PolarHBondContact O-OG 3.41Å
914	W	89.5	Confident	81.1	Confident	20 Å²	20	49.1 Å²	49.1	8%	0.076	29%	0.287	C	S	.	.	H	α-helix	trans	-62.2	-55.2	175.4	178	-101	0	0	0	111.9	L910 H912 H916 S917 L918 M935 F961 K965 P1010 F1015 F1018	L910-W914 VanDerWaalsContact O-CB 3.31Å; L910-W914 WeakPolarHBondContact O-CB 3.46Å; L910-W914 PolarHBondContact O-N 3.24Å; H912-W914 VanDerWaalsContact C-N 3.27Å; H912-W914 PolarHBondContact O-N 3.47Å; W914-H916 VanDerWaalsContact C-N 3.3Å; W914-H916 PolarHBondContact O-N 2.81Å; W914-S917 PolarHBondContact O-N 2.84Å; W914-L918 HydrophobicContact CZ2-CD1 4.18Å; W914-L918 HydrophobicContact CZ2-CD2 4.4Å; W914-L918 PolarHBondContact O-N 3.22Å; W914-M935 HydrophobicContact CH2-CE 3.87Å; W914-M935 HydrophobicContact CZ3-CE 4.29Å; W914-F961 HydrophobicContact CB-CE1 4.24Å; W914-F961 HydrophobicContact CB-CZ 4.05Å; W914-F961 HydrophobicContact CE3-CE1 4.43Å; W914-F961 HydrophobicContact CG-CZ 4.39Å; W914-K965 HydrophobicContact CH2-CB 4.46Å; W914-K965 HydrophobicContact CZ2-CD 4.18Å; W914-P1010 HydrophobicContact CH2-CB 4.07Å; W914-P1010 HydrophobicContact CH2-CG 3.6Å; W914-P1010 HydrophobicContact CZ2-CG 4.28Å; W914-P1010 HydrophobicContact CZ3-CG 4.4Å; W914-F1015 HydrophobicContact CH2-CD2 4.3Å; W914-F1015 AromaticContact CZ3-CD2 3.7Å; W914-F1015 HydrophobicContact CZ3-CD2 3.7Å; W914-F1015 AromaticContact CZ3-CE2 3.9Å; W914-F1015 HydrophobicContact CZ3-CE2 3.9Å; W914-F1018 HydrophobicContact CB-CD2 4.38Å; W914-F1018 HydrophobicContact CB-CE2 4.08Å; W914-F1018 HydrophobicContact CE3-CD1 4.09Å; W914-F1018 HydrophobicContact CE3-CD2 4.37Å; W914-F1018 HydrophobicContact CE3-CE1 4.21Å; W914-F1018 HydrophobicContact CE3-CE2 4.48Å; W914-F1018 HydrophobicContact CE3-CG 4.17Å; W914-F1018 HydrophobicContact CE3-CZ 4.4Å; W914-F1018 HydrophobicContact CZ3-CD1 4.38Å
915	E	87.2	Confident	79.9	Confident	55 Å²	55	46.1 Å²	46.1	26%	0.257	27%	0.271	S	S	.	.	H	α-helix	trans	-61.8	-38.9	-179.8	-72.9	-162.2	175.5	0	0	113	N608 R630 N911 H912 S917 S919	N608-E915 WeakPolarHBondContact CB-OE2 3.47Å; N608-E915 VanDerWaalsContact ND2-CD 3.27Å; N608-E915 PolarHBondContact ND2-OE1 2.8Å; N608-E915 PolarHBondContact ND2-OE2 2.89Å; R630-E915 IonicContact CZ-OE2 3.84Å; R630-E915 IonicContact NH1-OE2 2.99Å; R630-E915 PolarHBondContact NH1-OE2 3.01Å; R630-E915 IonicContact NH2-OE2 2.89Å; R630-E915 PolarHBondContact NH2-OE2 3.14Å; N911-E915 PolarHBondContact O-N 3.48Å; N911-E915 VanDerWaalsContact O-N 3.14Å; H912-E915 PolarHBondContact O-N 3.49Å; E915-S917 VanDerWaalsContact C-N 3.34Å; E915-S919 WeakPolarHBondContact O-CB 3.42Å; E915-S919 PolarHBondContact O-N 3.48Å; E915-S919 VanDerWaalsContact O-N 3.15Å; E915-S919 PolarHBondContact O-OG 3.47Å
916	H	88.7	Confident	78.7	Confident	20 Å²	20	48 Å²	48	9%	0.093	28%	0.275	C	S	.	.	H	α-helix	trans	-60.5	-46.8	176.9	-177.5	88.1	0	0	0	110.5	N606 D659 F660 H912 W914 S919 S920	N606-H916 HydrophobicContact CB-CB 4.49Å; D659-H916 IonicContact OD2-ND1 2.77Å; F660-H916 AromaticContact CZ-CE1 3.92Å; H912-H916 VanDerWaalsContact O-CB 3.23Å; H912-H916 WeakPolarHBondContact O-CB 3.27Å; H912-H916 PolarHBondContact O-N 3.06Å; W914-H916 VanDerWaalsContact C-N 3.3Å; W914-H916 PolarHBondContact O-N 2.81Å; H916-S919 PolarHBondContact O-N 3.13Å; H916-S920 PolarHBondContact NE2-OG 3.18Å; H916-S920 WeakPolarHBondContact O-CB 3.27Å; H916-S920 PolarHBondContact O-N 3.07Å; H916-S920 PolarHBondContact O-OG 3.03Å
917	S	87.1	Confident	77.4	Confident	3 Å²	3	52.9 Å²	52.9	2%	0.021	30%	0.298	C	S	.	.	H	α-helix	trans	-66.4	-41.3	-177.9	-55.2	0	0	0	0	112.2	G913 W914 E915 S919 F1018	G913-S917 WeakPolarHBondContact O-CB 3.38Å; G913-S917 PolarHBondContact O-N 3.36Å; G913-S917 PolarHBondContact O-OG 3.41Å; W914-S917 PolarHBondContact O-N 2.84Å; E915-S917 VanDerWaalsContact C-N 3.34Å; S917-S919 VanDerWaalsContact C-N 3.28Å; S917-S919 PolarHBondContact O-N 3.47Å; S917-F1018 WeakPolarHBondContact OG-CA 3.45Å; S917-F1018 WeakPolarHBondContact OG-CB 3.24Å
918	L	85.5	Confident	76.4	Confident	35 Å²	35	56.7 Å²	56.7	18%	0.183	32%	0.318	C	S	.	.	H	α-helix	trans	-61.6	-34.5	175	-73.1	-179.6	0	0	0	113.1	W914 P1010 Q1014	W914-L918 HydrophobicContact CZ2-CD1 4.18Å; W914-L918 HydrophobicContact CZ2-CD2 4.4Å; W914-L918 PolarHBondContact O-N 3.22Å; L918-P1010 HydrophobicContact CD2-CB 3.74Å; L918-Q1014 PolarHBondContact O-NE2 3.43Å; L918-Q1014 VanDerWaalsContact O-NE2 3.14Å
919	S	82.4	Confident	75.7	Confident	25 Å²	25	58.9 Å²	58.9	18%	0.175	33%	0.331	C	S	.	.	H	α-helix	trans	-90	-26.9	-173.1	-56.7	0	0	0	0	113.7	N606 N631 E915 H916 S917	N606-S919 VanDerWaalsContact CG-CB 3.46Å; N606-S919 WeakPolarHBondContact ND2-CB 3.38Å; N606-S919 WeakPolarHBondContact OD1-CB 3.47Å; N631-S919 PolarHBondContact ND2-O 2.96Å; N631-S919 PolarHBondContact OD1-O 3.45Å; E915-S919 WeakPolarHBondContact O-CB 3.42Å; E915-S919 PolarHBondContact O-N 3.48Å; E915-S919 VanDerWaalsContact O-N 3.15Å; E915-S919 PolarHBondContact O-OG 3.47Å; H916-S919 PolarHBondContact O-N 3.13Å; S917-S919 VanDerWaalsContact C-N 3.28Å; S917-S919 PolarHBondContact O-N 3.47Å
920	S	78	Confident	75.3	Confident	43 Å²	43	58.8 Å²	58.8	30%	0.301	33%	0.33	S	S	.	.	H	α-helix	trans	-76	-37	-173.7	-71.4	0	0	0	0	113.5	N606 H916	N606-S920 PolarHBondContact ND2-OG 3.47Å; H916-S920 PolarHBondContact NE2-OG 3.18Å; H916-S920 WeakPolarHBondContact O-CB 3.27Å; H916-S920 PolarHBondContact O-N 3.07Å; H916-S920 PolarHBondContact O-OG 3.03Å
921	V	68	Low	74.9	Confident	33 Å²	33	61.7 Å²	61.7	20%	0.2	35%	0.346	C	S	.	.	S	Bend	trans	-103.5	118.8	179.4	-179.9	0	0	0	0	109.4	C923 Q1014	V921-C923 PolarHBondContact O-N 3.5Å; V921-Q1014 HydrophobicContact CB-CG 3.93Å; V921-Q1014 HydrophobicContact CG1-CG 4.39Å; V921-Q1014 PolarHBondContact O-NE2 3.28Å
922	T	64.2	Low	74.6	Confident	125 Å²	125	56.9 Å²	56.9	77%	0.767	32%	0.32	S	S	*	.			trans	-79.1	108.5	174.4	47.4	0	0	0	0	109.9	S924	T922-S924 PolarHBondContact O-N 3.15Å
923	C	57.4	Low	74.4	Confident	58 Å²	58	60.7 Å²	60.7	39%	0.392	34%	0.341	S	S	.	.			trans	-68.9	117.9	171.6	-167.3	0	0	0	0	109.6	V921 C925	V921-C923 PolarHBondContact O-N 3.5Å; C923-C925 PolarHBondContact SG-O 3.34Å
924	S	56	Low	74.3	Confident	127 Å²	127	62 Å²	62	89%	0.888	35%	0.35	S	S	*	.			trans	-84.9	-9.9	-174.9	46.9	0	0	0	0	114.4	T922	T922-S924 PolarHBondContact O-N 3.15Å
925	C	52.2	Low	74.2	Confident	53 Å²	53	61 Å²	61	36%	0.358	35%	0.347	S	S	.	.			trans	-132.1	142.6	-178.5	70.7	0	0	0	0	113.1	C923 Q927 D928	C923-C925 PolarHBondContact SG-O 3.34Å; C925-Q927 PolarHBondContact O-N 3.28Å; C925-D928 PolarHBondContact SG-OD2 2.65Å
926	E	52	Low	74.3	Confident	169 Å²	169	61.8 Å²	61.8	79%	0.79	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.7	-7	-177.3	-64	-172.2	154.6	0	0	113.5
927	Q	53.9	Low	74.3	Confident	183 Å²	183	66.1 Å²	66.1	86%	0.855	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.3	-4.4	-172	-70	-177.3	-19.4	0	0	114.8	C925	C925-Q927 PolarHBondContact O-N 3.28Å
928	D	64.9	Low	74.3	Confident	97 Å²	97	66.8 Å²	66.8	52%	0.519	38%	0.376	S	S	.	.			trans	-101.2	14.8	-171.8	-83	-5.8	0	0	0	115.1	C925 S1011	C925-D928 PolarHBondContact SG-OD2 2.65Å; D928-S1011 WeakPolarHBondContact O-CA 3.45Å
929	V	75.2	Confident	74.4	Confident	49 Å²	49	66 Å²	66	30%	0.297	37%	0.371	S	S	.	.	B	Isolated β-bridge	trans	-75.5	128.1	176.5	-97.6	0	0	0	0	110.9	L1009	V929-L1009 HydrophobicContact CB-CB 4.27Å; V929-L1009 HydrophobicContact CG1-CB 3.73Å
930	M	80.4	Confident	74.6	Confident	17 Å²	17	68.9 Å²	68.9	8%	0.084	38%	0.381	C	S	.	.	P	Polyproline II helix	trans	-76.5	142	-174.5	-60.4	-114.9	-56.8	0	0	112.2	A934 M935 C938 H973 P1010 S1012 F1015	M930-A934 HydrophobicContact CB-CB 4.39Å; M930-A934 HydrophobicContact CE-CB 3.85Å; M930-A934 WeakPolarHBondContact CE-O 3.24Å; M930-A934 HydrophobicContact SD-CB 3.8Å; M930-M935 HydrophobicContact CB-CG 3.78Å; M930-M935 HydrophobicContact CE-CB 4.12Å; M930-M935 HydrophobicContact CE-CG 3.65Å; M930-M935 VanDerWaalsContact CE-N 3.3Å; M930-C938 HydrophobicContact CE-CB 4.01Å; M930-H973 PolarHBondContact O-CE1 3.35Å; M930-P1010 PolarHBondContact N-O 2.94Å; M930-P1010 VanDerWaalsContact N-O 3.14Å; M930-S1012 VanDerWaalsContact SD-CA 3.59Å; M930-S1012 VanDerWaalsContact SD-CB 3.57Å; M930-F1015 HydrophobicContact CE-CD1 4.13Å
931	N	82.8	Confident	75	Confident	68 Å²	68	74.3 Å²	74.3	36%	0.364	40%	0.4	S	S	.	.	P	Polyproline II helix	trans	-84.3	170.1	164.7	66.1	-2.2	0	0	0	110.7	D933 A934 M935	N931-D933 VanDerWaalsContact C-N 3.28Å; N931-D933 PolarHBondContact O-N 3.1Å; N931-A934 PolarHBondContact O-N 3.13Å; N931-A934 WeakPolarHBondContact OD1-CB 2.88Å; N931-A934 PolarHBondContact OD1-N 3.38Å; N931-M935 WeakPolarHBondContact O-CG 3.4Å; N931-M935 PolarHBondContact O-N 3.27Å; N931-M935 VanDerWaalsContact O-N 3.1Å
932	G	84.1	Confident	75.8	Confident	0 Å²	0	74 Å²	74	0%	0	40%	0.396	C	S	.	.	H	α-helix	trans	-58.9	-37.9	-177.6	0	0	0	0	0	113.8	M935 R936 D970	G932-M935 WeakPolarHBondContact O-CB 3.34Å; G932-M935 PolarHBondContact O-N 3.13Å; G932-R936 PolarHBondContact O-N 3.4Å; G932-D970 WeakPolarHBondContact CA-OD1 3.31Å; G932-D970 PolarHBondContact N-OD1 3Å; G932-D970 VanDerWaalsContact N-OD1 3.12Å
933	D	85.2	Confident	76.6	Confident	89 Å²	89	69.9 Å²	69.9	48%	0.476	37%	0.369	S	S	.	.	H	α-helix	trans	-66.7	-46.5	179.2	-64.5	-31.7	0	0	0	112.4	N931 M935 R936 D937	N931-D933 VanDerWaalsContact C-N 3.28Å; N931-D933 PolarHBondContact O-N 3.1Å; D933-M935 PolarHBondContact O-N 3.36Å; D933-R936 WeakPolarHBondContact O-CB 3.47Å; D933-R936 PolarHBondContact O-N 2.9Å; D933-R936 VanDerWaalsContact O-N 3.09Å; D933-R936 IonicContact OD1-CZ 2.63Å; D933-R936 IonicContact OD1-NH1 3.34Å; D933-R936 PolarHBondContact OD1-NH1 3.23Å; D933-D937 PolarHBondContact O-N 3.37Å
934	A	85.9	Confident	77.7	Confident	32 Å²	32	74 Å²	74	26%	0.264	38%	0.381	S	S	.	.	H	α-helix	trans	-61.1	-36	175.5	0	0	0	0	0	111.5	M930 N931 C938	M930-A934 HydrophobicContact CB-CB 4.39Å; M930-A934 HydrophobicContact CE-CB 3.85Å; M930-A934 WeakPolarHBondContact CE-O 3.24Å; M930-A934 HydrophobicContact SD-CB 3.8Å; N931-A934 PolarHBondContact O-N 3.13Å; N931-A934 WeakPolarHBondContact OD1-CB 2.88Å; N931-A934 PolarHBondContact OD1-N 3.38Å; A934-C938 VanDerWaalsContact O-CB 3.3Å; A934-C938 WeakPolarHBondContact O-CB 3.43Å; A934-C938 PolarHBondContact O-N 3.46Å
935	M	87.6	Confident	78.7	Confident	0 Å²	0	72 Å²	72	0%	0	37%	0.366	C	S	.	.	H	α-helix	trans	-65.5	-42.5	175.6	-74.7	-176.6	70	0	0	110.9	W914 M930 N931 G932 D933 C938 F939 K965 I966 A969 P1010 F1015	W914-M935 HydrophobicContact CH2-CE 3.87Å; W914-M935 HydrophobicContact CZ3-CE 4.29Å; M930-M935 HydrophobicContact CB-CG 3.78Å; M930-M935 HydrophobicContact CE-CB 4.12Å; M930-M935 HydrophobicContact CE-CG 3.65Å; M930-M935 VanDerWaalsContact CE-N 3.3Å; N931-M935 WeakPolarHBondContact O-CG 3.4Å; N931-M935 PolarHBondContact O-N 3.27Å; N931-M935 VanDerWaalsContact O-N 3.1Å; G932-M935 WeakPolarHBondContact O-CB 3.34Å; G932-M935 PolarHBondContact O-N 3.13Å; D933-M935 PolarHBondContact O-N 3.36Å; M935-C938 PolarHBondContact O-N 2.92Å; M935-F939 VanDerWaalsContact O-CB 3.28Å; M935-F939 WeakPolarHBondContact O-CB 3.29Å; M935-F939 PolarHBondContact O-N 2.9Å; M935-K965 HydrophobicContact CE-CB 4.32Å; M935-I966 HydrophobicContact CB-CD1 4.29Å; M935-I966 HydrophobicContact CB-CG1 3.73Å; M935-I966 HydrophobicContact CE-CG1 4.36Å; M935-A969 HydrophobicContact SD-CB 4.08Å; M935-P1010 HydrophobicContact CE-CG 4.11Å; M935-P1010 HydrophobicContact SD-CG 4.12Å; M935-F1015 HydrophobicContact CB-CE1 4.2Å; M935-F1015 HydrophobicContact CB-CZ 4.4Å; M935-F1015 HydrophobicContact CE-CD2 3.81Å; M935-F1015 HydrophobicContact CE-CE2 3.51Å; M935-F1015 HydrophobicContact CE-CG 4.45Å; M935-F1015 HydrophobicContact CE-CZ 3.92Å; M935-F1015 VanDerWaalsContact O-CE1 3.26Å; M935-F1015 WeakPolarHBondContact O-CE1 3.29Å
936	R	88.9	Confident	79.5	Confident	72 Å²	72	69.7 Å²	69.7	27%	0.272	35%	0.351	S	S	.	.	H	α-helix	trans	-62	-46.5	176.7	-160.2	178	-64.2	106.1	0.1	111.4	G932 D933 C938 F939 E940 I966	G932-R936 PolarHBondContact O-N 3.4Å; D933-R936 WeakPolarHBondContact O-CB 3.47Å; D933-R936 PolarHBondContact O-N 2.9Å; D933-R936 VanDerWaalsContact O-N 3.09Å; D933-R936 IonicContact OD1-CZ 2.63Å; D933-R936 IonicContact OD1-NH1 3.34Å; D933-R936 PolarHBondContact OD1-NH1 3.23Å; R936-C938 PolarHBondContact O-N 3.47Å; R936-F939 WeakPolarHBondContact O-CB 3.2Å; R936-F939 PolarHBondContact O-N 2.98Å; R936-E940 PolarHBondContact O-N 3.49Å; R936-I966 HydrophobicContact CB-CD1 4.12Å; R936-I966 HydrophobicContact CG-CD1 4.49Å
937	D	88.5	Confident	79.9	Confident	111 Å²	111	67 Å²	67	59%	0.594	35%	0.346	S	S	*	.	H	α-helix	trans	-61.1	-45.3	177.4	-72.9	-14.1	0	0	0	112.2	D933 F939 E940 K941	D933-D937 PolarHBondContact O-N 3.37Å; D937-F939 VanDerWaalsContact C-N 3.33Å; D937-F939 PolarHBondContact O-N 2.76Å; D937-E940 PolarHBondContact O-N 2.85Å; D937-K941 WeakPolarHBondContact O-CB 3.34Å; D937-K941 PolarHBondContact O-N 2.83Å
938	C	86.9	Confident	80.1	Confident	17 Å²	17	65.1 Å²	65.1	12%	0.115	34%	0.337	C	S	.	.	H	α-helix	trans	-64.5	-39.2	178	-175.7	0	0	0	0	111.8	M930 A934 M935 R936 H942 F1015 S1016	M930-C938 HydrophobicContact CE-CB 4.01Å; A934-C938 VanDerWaalsContact O-CB 3.3Å; A934-C938 WeakPolarHBondContact O-CB 3.43Å; A934-C938 PolarHBondContact O-N 3.46Å; M935-C938 PolarHBondContact O-N 2.92Å; R936-C938 PolarHBondContact O-N 3.47Å; C938-H942 PolarHBondContact O-N 2.78Å; C938-H942 PolarHBondContact O-ND1 2.95Å; C938-F1015 HydrophobicContact CB-CD1 3.92Å; C938-F1015 HydrophobicContact CB-CE1 4.1Å; C938-S1016 PolarHBondContact SG-OG 3.23Å
939	F	88.5	Confident	79.9	Confident	17 Å²	17	62 Å²	62	8%	0.075	32%	0.321	C	S	.	.	H	α-helix	trans	-63.6	-50	176.1	176.6	-116.4	0	0	0	111.4	M935 R936 D937 K941 H942 L943 L958 S959 C962 F1015 L1019	M935-F939 VanDerWaalsContact O-CB 3.28Å; M935-F939 WeakPolarHBondContact O-CB 3.29Å; M935-F939 PolarHBondContact O-N 2.9Å; R936-F939 WeakPolarHBondContact O-CB 3.2Å; R936-F939 PolarHBondContact O-N 2.98Å; D937-F939 VanDerWaalsContact C-N 3.33Å; D937-F939 PolarHBondContact O-N 2.76Å; F939-K941 VanDerWaalsContact C-N 3.29Å; F939-K941 PolarHBondContact O-N 2.84Å; F939-H942 PolarHBondContact O-N 2.81Å; F939-L943 HydrophobicContact CE1-CD1 4.33Å; F939-L943 HydrophobicContact CE2-CD1 3.8Å; F939-L943 HydrophobicContact CZ-CD1 3.64Å; F939-L943 PolarHBondContact O-N 2.78Å; F939-L958 HydrophobicContact CE2-CD2 4Å; F939-L958 HydrophobicContact CE2-CG 3.94Å; F939-L958 HydrophobicContact CZ-CG 4.49Å; F939-S959 WeakPolarHBondContact CZ-OG 3.25Å; F939-C962 HydrophobicContact CD2-CB 4.32Å; F939-C962 HydrophobicContact CE2-CB 4.35Å; F939-C962 HydrophobicContact CG-CB 4.48Å; F939-F1015 HydrophobicContact CB-CE1 4.2Å; F939-F1015 HydrophobicContact CB-CZ 4.33Å; F939-L1019 HydrophobicContact CB-CD1 4.49Å; F939-L1019 HydrophobicContact CD2-CD1 4.25Å; F939-L1019 HydrophobicContact CD2-CD2 3.8Å; F939-L1019 HydrophobicContact CE2-CD2 4.24Å
940	E	86.5	Confident	79.1	Confident	86 Å²	86	68 Å²	68	40%	0.402	34%	0.339	S	S	.	.	H	α-helix	trans	-58.9	-40.3	178	-77.1	-165.6	-171.4	0	0	112.6	R936 D937 L943 K944	R936-E940 PolarHBondContact O-N 3.49Å; D937-E940 PolarHBondContact O-N 2.85Å; E940-L943 PolarHBondContact O-N 3.01Å; E940-K944 WeakPolarHBondContact O-CB 3.43Å; E940-K944 WeakPolarHBondContact O-CG 3.5Å; E940-K944 PolarHBondContact O-N 3.3Å; E940-K944 IonicContact OE2-NZ 3.08Å; E940-K944 PolarHBondContact OE2-NZ 2.81Å
941	K	87.2	Confident	78.5	Confident	158 Å²	158	68.7 Å²	68.7	69%	0.687	34%	0.343	S	S	*	.	H	α-helix	trans	-61.2	-45.3	178	-172.5	178.4	179.7	-179.9	0	111.8	D937 F939 K944 S945	D937-K941 WeakPolarHBondContact O-CB 3.34Å; D937-K941 PolarHBondContact O-N 2.83Å; F939-K941 VanDerWaalsContact C-N 3.29Å; F939-K941 PolarHBondContact O-N 2.84Å; K941-K944 PolarHBondContact O-N 2.92Å; K941-S945 PolarHBondContact O-N 3.22Å
942	H	84.5	Confident	78	Confident	26 Å²	26	71.1 Å²	71.1	12%	0.12	36%	0.356	C	S	.	.	H	α-helix	trans	-68.1	-39.5	177.5	-76.5	81.3	0	0	0	111.7	C938 F939 K944 S945 A946 L1019 N1020	C938-H942 PolarHBondContact O-N 2.78Å; C938-H942 PolarHBondContact O-ND1 2.95Å; F939-H942 PolarHBondContact O-N 2.81Å; H942-K944 PolarHBondContact O-N 3.09Å; H942-S945 PolarHBondContact O-N 2.75Å; H942-S945 PolarHBondContact O-OG 2.86Å; H942-A946 PolarHBondContact O-N 3.4Å; H942-A946 VanDerWaalsContact O-N 3.16Å; H942-L1019 HydrophobicContact CB-CB 4.42Å; H942-L1019 HydrophobicContact CB-CD1 4.03Å; H942-N1020 PolarHBondContact CD2-OD1 2.95Å; H942-N1020 PolarHBondContact NE2-ND2 2.81Å
943	L	79.7	Confident	77.7	Confident	38 Å²	38	78 Å²	78	20%	0.199	39%	0.386	C	S	.	.	H	α-helix	trans	-60.7	-44.4	176.7	-141.5	81.6	0	0	0	111.7	F939 E940 S945 A946 R955	F939-L943 HydrophobicContact CE1-CD1 4.33Å; F939-L943 HydrophobicContact CE2-CD1 3.8Å; F939-L943 HydrophobicContact CZ-CD1 3.64Å; F939-L943 PolarHBondContact O-N 2.78Å; E940-L943 PolarHBondContact O-N 3.01Å; L943-S945 VanDerWaalsContact C-N 3.29Å; L943-S945 PolarHBondContact O-N 2.91Å; L943-A946 PolarHBondContact O-N 3.11Å; L943-A946 VanDerWaalsContact O-N 3.14Å; L943-R955 HydrophobicContact CD1-CG 4.35Å; L943-R955 HydrophobicContact CD2-CG 4.41Å
944	K	80.3	Confident	77.6	Confident	146 Å²	146	74.4 Å²	74.4	64%	0.635	37%	0.366	S	S	*	.	H	α-helix	trans	-62.6	-34.4	176.1	-75.1	170.3	-176.2	159.8	0	112.3	E940 K941 H942 A946 V947	E940-K944 WeakPolarHBondContact O-CB 3.43Å; E940-K944 WeakPolarHBondContact O-CG 3.5Å; E940-K944 PolarHBondContact O-N 3.3Å; E940-K944 IonicContact OE2-NZ 3.08Å; E940-K944 PolarHBondContact OE2-NZ 2.81Å; K941-K944 PolarHBondContact O-N 2.92Å; H942-K944 PolarHBondContact O-N 3.09Å; K944-A946 VanDerWaalsContact C-N 3.29Å; K944-A946 PolarHBondContact O-N 3.07Å; K944-V947 WeakPolarHBondContact O-CG2 3.42Å
945	S	77.3	Confident	77.4	Confident	83 Å²	83	78.6 Å²	78.6	58%	0.58	38%	0.375	S	S	*	.	H	α-helix	trans	-73.4	-20.6	176.8	75.2	0	0	0	0	113.6	K941 H942 L943 V947	K941-S945 PolarHBondContact O-N 3.22Å; H942-S945 PolarHBondContact O-N 2.75Å; H942-S945 PolarHBondContact O-OG 2.86Å; L943-S945 VanDerWaalsContact C-N 3.29Å; L943-S945 PolarHBondContact O-N 2.91Å; S945-V947 PolarHBondContact O-N 3.18Å
946	A	70.3	Confident	77.3	Confident	6 Å²	6	81.9 Å²	81.9	5%	0.05	40%	0.398	C	S	.	.			trans	-100.8	49.1	-176.3	0	0	0	0	0	112.1	H942 L943 K944 E948 L949 I1023	H942-A946 PolarHBondContact O-N 3.4Å; H942-A946 VanDerWaalsContact O-N 3.16Å; L943-A946 PolarHBondContact O-N 3.11Å; L943-A946 VanDerWaalsContact O-N 3.14Å; K944-A946 VanDerWaalsContact C-N 3.29Å; K944-A946 PolarHBondContact O-N 3.07Å; A946-E948 PolarHBondContact O-N 2.69Å; A946-L949 HydrophobicContact CB-CD1 3.53Å; A946-L949 HydrophobicContact CB-CG 4.16Å; A946-L949 WeakPolarHBondContact O-CB 3.46Å; A946-L949 PolarHBondContact O-N 3.16Å; A946-I1023 HydrophobicContact CB-CD1 4.22Å
947	V	59.5	Low	77.1	Confident	113 Å²	113	79.9 Å²	79.9	69%	0.685	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.3	-23	-176.8	-172.9	0	0	0	0	113.4	K944 S945 L949	K944-V947 WeakPolarHBondContact O-CG2 3.42Å; S945-V947 PolarHBondContact O-N 3.18Å; V947-L949 VanDerWaalsContact C-N 3.34Å
948	E	58.1	Low	77.1	Confident	142 Å²	142	74.8 Å²	74.8	66%	0.664	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.7	-5.8	-179.6	-62	175.1	161.3	0	0	114.4	A946 Y950 R1027	A946-E948 PolarHBondContact O-N 2.69Å; E948-Y950 VanDerWaalsContact C-N 3.28Å; E948-Y950 WeakPolarHBondContact O-CD2 3.32Å; E948-Y950 PolarHBondContact O-N 3.02Å; E948-R1027 IonicContact OE2-NH2 3.6Å
949	L	59.9	Low	77.1	Confident	33 Å²	33	75.5 Å²	75.5	17%	0.173	38%	0.375	C	S	.	.			trans	-76.2	79.5	174	-74.5	167.5	0	0	0	110	A946 V947 D951 F954 I1023 Y1026	A946-L949 HydrophobicContact CB-CD1 3.53Å; A946-L949 HydrophobicContact CB-CG 4.16Å; A946-L949 WeakPolarHBondContact O-CB 3.46Å; A946-L949 PolarHBondContact O-N 3.16Å; V947-L949 VanDerWaalsContact C-N 3.34Å; L949-D951 PolarHBondContact O-N 3.02Å; L949-F954 HydrophobicContact CD2-CD1 4.2Å; L949-F954 HydrophobicContact CD2-CE1 4.44Å; L949-I1023 HydrophobicContact CD1-CG1 4.27Å; L949-Y1026 HydrophobicContact CD2-CD1 3.25Å; L949-Y1026 HydrophobicContact CD2-CE1 3.46Å; L949-Y1026 VanDerWaalsContact CD2-CE1 3.46Å; L949-Y1026 HydrophobicContact CD2-CG 4.06Å
950	Y	58.7	Low	77.3	Confident	174 Å²	174	79.2 Å²	79.2	68%	0.682	40%	0.4	S	S	*	.			trans	-74.4	-0.5	177.4	-76.4	-80.3	0	0	0	114.6	E948	E948-Y950 VanDerWaalsContact C-N 3.28Å; E948-Y950 WeakPolarHBondContact O-CD2 3.32Å; E948-Y950 PolarHBondContact O-N 3.02Å
951	D	68.2	Low	77.5	Confident	31 Å²	31	76.8 Å²	76.8	17%	0.166	39%	0.387	C	S	.	.			trans	-96.5	105.3	-176.3	-176.3	11.5	0	0	0	111.8	L949 F953 R955 Y1026	L949-D951 PolarHBondContact O-N 3.02Å; D951-F953 PolarHBondContact O-N 2.8Å; D951-F953 WeakPolarHBondContact OD1-CB 3.34Å; D951-F953 PolarHBondContact OD1-N 2.98Å; D951-R955 PolarHBondContact O-N 2.8Å; D951-Y1026 WeakPolarHBondContact CB-OH 3.28Å; D951-Y1026 PolarHBondContact OD2-OH 3.26Å
952	D	72.3	Confident	77.6	Confident	120 Å²	120	69.3 Å²	69.3	64%	0.642	36%	0.355	S	S	*	.	H	α-helix	trans	-60.9	-27.6	177.5	-71.8	-31.2	0	0	0	112.3	S956	D952-S956 WeakPolarHBondContact O-CB 3.38Å; D952-S956 PolarHBondContact O-N 3.17Å
953	F	77.4	Confident	78	Confident	145 Å²	145	73 Å²	73	64%	0.636	37%	0.373	S	S	*	.	H	α-helix	trans	-71	-50.9	-176.8	-171.2	-97.9	0	0	0	111.7	D951 R955 S956 A957	D951-F953 PolarHBondContact O-N 2.8Å; D951-F953 WeakPolarHBondContact OD1-CB 3.34Å; D951-F953 PolarHBondContact OD1-N 2.98Å; F953-R955 VanDerWaalsContact C-N 3.33Å; F953-R955 PolarHBondContact O-N 3Å; F953-S956 PolarHBondContact O-N 3.16Å; F953-A957 WeakPolarHBondContact O-CB 3.26Å; F953-A957 PolarHBondContact O-N 2.89Å
954	F	83.2	Confident	78.6	Confident	12 Å²	12	73.3 Å²	73.3	5%	0.053	38%	0.384	C	S	.	.	H	α-helix	trans	-63.4	-41.3	176.3	177	-109.6	0	0	0	111.7	V908 L949 S956 A957 L958 C1022 Y1026	V908-F954 HydrophobicContact CB-CE2 4.34Å; V908-F954 HydrophobicContact CG2-CE2 4.07Å; L949-F954 HydrophobicContact CD2-CD1 4.2Å; L949-F954 HydrophobicContact CD2-CE1 4.44Å; F954-S956 VanDerWaalsContact C-N 3.33Å; F954-S956 PolarHBondContact O-N 2.86Å; F954-A957 PolarHBondContact O-N 3.3Å; F954-L958 HydrophobicContact CE1-CD2 4.22Å; F954-L958 HydrophobicContact CZ-CD2 4.27Å; F954-L958 WeakPolarHBondContact O-CB 3.49Å; F954-L958 PolarHBondContact O-N 2.97Å; F954-C1022 HydrophobicContact CZ-CB 4.36Å; F954-Y1026 HydrophobicContact CB-CD2 3.89Å; F954-Y1026 HydrophobicContact CB-CE2 3.52Å; F954-Y1026 HydrophobicContact CD1-CD1 4.48Å; F954-Y1026 AromaticContact CD1-CD2 3.65Å; F954-Y1026 HydrophobicContact CD1-CD2 3.65Å; F954-Y1026 HydrophobicContact CD1-CE2 4.03Å; F954-Y1026 AromaticContact CD1-CG 3.9Å; F954-Y1026 HydrophobicContact CD1-CG 3.9Å; F954-Y1026 AromaticContact CD2-CD2 3.72Å; F954-Y1026 HydrophobicContact CD2-CD2 3.72Å; F954-Y1026 HydrophobicContact CD2-CE2 4.22Å; F954-Y1026 HydrophobicContact CE1-CD2 4.07Å; F954-Y1026 AromaticContact CE1-CG 4Å; F954-Y1026 HydrophobicContact CE1-CG 4Å; F954-Y1026 HydrophobicContact CE2-CD2 4.14Å; F954-Y1026 AromaticContact CG-CD2 3.45Å; F954-Y1026 HydrophobicContact CG-CD2 3.45Å; F954-Y1026 VanDerWaalsContact CG-CD2 3.45Å; F954-Y1026 AromaticContact CG-CE2 3.66Å; F954-Y1026 HydrophobicContact CG-CE2 3.66Å; F954-Y1026 HydrophobicContact CG-CG 4.18Å; F954-Y1026 HydrophobicContact CZ-CD2 4.29Å; F954-Y1026 HydrophobicContact CZ-CG 4.37Å
955	R	82.2	Confident	79.1	Confident	120 Å²	120	68.4 Å²	68.4	45%	0.453	36%	0.363	S	S	.	.	H	α-helix	trans	-60	-45.3	176.4	-172.4	177.1	177.1	-154.9	-3.1	111.2	L943 D951 F953 S959	L943-R955 HydrophobicContact CD1-CG 4.35Å; L943-R955 HydrophobicContact CD2-CG 4.41Å; D951-R955 PolarHBondContact O-N 2.8Å; F953-R955 VanDerWaalsContact C-N 3.33Å; F953-R955 PolarHBondContact O-N 3Å; R955-S959 VanDerWaalsContact O-CB 3.29Å; R955-S959 WeakPolarHBondContact O-CB 3.45Å; R955-S959 PolarHBondContact O-N 3.18Å; R955-S959 PolarHBondContact O-OG 3.36Å
956	S	84.2	Confident	79.6	Confident	69 Å²	69	64.6 Å²	64.6	48%	0.483	34%	0.336	S	S	.	.	H	α-helix	trans	-64	-44.9	177.4	-176.7	0	0	0	0	112.4	D952 F953 F954 S959 T960	D952-S956 WeakPolarHBondContact O-CB 3.38Å; D952-S956 PolarHBondContact O-N 3.17Å; F953-S956 PolarHBondContact O-N 3.16Å; F954-S956 VanDerWaalsContact C-N 3.33Å; F954-S956 PolarHBondContact O-N 2.86Å; S956-S959 PolarHBondContact O-N 3.4Å; S956-T960 WeakPolarHBondContact O-CB 3.33Å; S956-T960 PolarHBondContact O-N 3Å; S956-T960 PolarHBondContact O-OG1 3.22Å
957	A	85.5	Confident	80.6	Confident	30 Å²	30	67.1 Å²	67.1	25%	0.248	36%	0.357	C	S	.	.	H	α-helix	trans	-62.3	-45.8	177.5	0	0	0	0	0	111.8	F953 F954 T960 F961	F953-A957 WeakPolarHBondContact O-CB 3.26Å; F953-A957 PolarHBondContact O-N 2.89Å; F954-A957 PolarHBondContact O-N 3.3Å; A957-T960 PolarHBondContact O-N 3.28Å; A957-F961 WeakPolarHBondContact O-CB 3.3Å; A957-F961 PolarHBondContact O-N 3.33Å
958	L	87.8	Confident	82	Confident	4 Å²	4	65.2 Å²	65.2	2%	0.021	34%	0.341	C	S	.	.	H	α-helix	trans	-65.3	-44.4	177.6	-175.8	63.8	0	0	0	111.5	L910 F939 F954 F961 C962 F1018 L1019	L910-L958 HydrophobicContact CD2-CD1 3.94Å; F939-L958 HydrophobicContact CE2-CD2 4Å; F939-L958 HydrophobicContact CE2-CG 3.94Å; F939-L958 HydrophobicContact CZ-CG 4.49Å; F954-L958 HydrophobicContact CE1-CD2 4.22Å; F954-L958 HydrophobicContact CZ-CD2 4.27Å; F954-L958 WeakPolarHBondContact O-CB 3.49Å; F954-L958 PolarHBondContact O-N 2.97Å; L958-F961 PolarHBondContact O-N 3.43Å; L958-C962 WeakPolarHBondContact O-CB 3.43Å; L958-C962 PolarHBondContact O-N 2.95Å; L958-C962 PolarHBondContact O-SG 2.84Å; L958-C962 VanDerWaalsContact O-SG 3.37Å; L958-F1018 HydrophobicContact CD1-CE1 4.29Å; L958-F1018 HydrophobicContact CD1-CZ 4.3Å; L958-L1019 HydrophobicContact CD2-CD2 4.45Å
959	S	88.5	Confident	83.4	Confident	32 Å²	32	58.5 Å²	58.5	22%	0.224	31%	0.31	C	S	.	.	H	α-helix	trans	-59	-48.1	174.9	-68	0	0	0	0	111.3	F939 R955 S956 F961 C962 E963	F939-S959 WeakPolarHBondContact CZ-OG 3.25Å; R955-S959 VanDerWaalsContact O-CB 3.29Å; R955-S959 WeakPolarHBondContact O-CB 3.45Å; R955-S959 PolarHBondContact O-N 3.18Å; R955-S959 PolarHBondContact O-OG 3.36Å; S956-S959 PolarHBondContact O-N 3.4Å; S959-F961 VanDerWaalsContact C-N 3.31Å; S959-F961 PolarHBondContact O-N 2.93Å; S959-C962 PolarHBondContact O-N 3.5Å; S959-E963 VanDerWaalsContact O-CB 3.29Å; S959-E963 WeakPolarHBondContact O-CB 3.44Å; S959-E963 VanDerWaalsContact O-CG 3.23Å; S959-E963 WeakPolarHBondContact O-CG 3.13Å; S959-E963 PolarHBondContact O-N 3.05Å
960	T	91.1	Very high	84.7	Confident	96 Å²	96	59.8 Å²	59.8	59%	0.589	32%	0.317	S	S	*	.	H	α-helix	trans	-60.4	-41.9	179.4	-56.4	0	0	0	0	111.3	S956 A957 G964	S956-T960 WeakPolarHBondContact O-CB 3.33Å; S956-T960 PolarHBondContact O-N 3Å; S956-T960 PolarHBondContact O-OG1 3.22Å; A957-T960 PolarHBondContact O-N 3.28Å; T960-G964 PolarHBondContact O-N 3.17Å
961	F	91.1	Very high	86	Confident	34 Å²	34	54.8 Å²	54.8	15%	0.149	31%	0.307	C	S	.	.	H	α-helix	trans	-66.1	-46.2	176.5	-176.9	-93.1	0	0	0	112.1	L910 W914 A957 L958 S959 G964 K965 F1018	L910-F961 HydrophobicContact CB-CD1 4.19Å; L910-F961 HydrophobicContact CB-CD2 3.96Å; L910-F961 HydrophobicContact CB-CE1 4.24Å; L910-F961 HydrophobicContact CB-CE2 4.01Å; L910-F961 HydrophobicContact CB-CG 4.04Å; L910-F961 HydrophobicContact CB-CZ 4.15Å; L910-F961 HydrophobicContact CD1-CB 3.69Å; L910-F961 HydrophobicContact CD1-CD1 4.42Å; L910-F961 HydrophobicContact CD1-CD2 4.23Å; L910-F961 HydrophobicContact CD1-CG 3.87Å; W914-F961 HydrophobicContact CB-CE1 4.24Å; W914-F961 HydrophobicContact CB-CZ 4.05Å; W914-F961 HydrophobicContact CE3-CE1 4.43Å; W914-F961 HydrophobicContact CG-CZ 4.39Å; A957-F961 WeakPolarHBondContact O-CB 3.3Å; A957-F961 PolarHBondContact O-N 3.33Å; L958-F961 PolarHBondContact O-N 3.43Å; S959-F961 VanDerWaalsContact C-N 3.31Å; S959-F961 PolarHBondContact O-N 2.93Å; F961-G964 PolarHBondContact O-N 3.24Å; F961-K965 HydrophobicContact CD1-CG 4.35Å; F961-K965 HydrophobicContact CE1-CG 3.98Å; F961-K965 HydrophobicContact CZ-CG 4.26Å; F961-K965 WeakPolarHBondContact O-CG 3.14Å; F961-K965 PolarHBondContact O-N 3.15Å; F961-F1018 HydrophobicContact CD1-CZ 4.03Å; F961-F1018 HydrophobicContact CE1-CE1 4.4Å; F961-F1018 HydrophobicContact CE1-CE2 4.46Å; F961-F1018 AromaticContact CE1-CZ 3.76Å; F961-F1018 HydrophobicContact CE1-CZ 3.76Å
962	C	90.7	Very high	86.9	Confident	1 Å²	1	53.8 Å²	53.8	1%	0.007	30%	0.302	C	S	.	.	H	α-helix	trans	-64.1	-43.7	178.2	-74.8	0	0	0	0	111.9	F939 L958 S959 G964 K965 I966	F939-C962 HydrophobicContact CD2-CB 4.32Å; F939-C962 HydrophobicContact CE2-CB 4.35Å; F939-C962 HydrophobicContact CG-CB 4.48Å; L958-C962 WeakPolarHBondContact O-CB 3.43Å; L958-C962 PolarHBondContact O-N 2.95Å; L958-C962 PolarHBondContact O-SG 2.84Å; L958-C962 VanDerWaalsContact O-SG 3.37Å; S959-C962 PolarHBondContact O-N 3.5Å; C962-G964 VanDerWaalsContact C-N 3.33Å; C962-G964 PolarHBondContact O-N 3.38Å; C962-K965 CarbonylContact O-C 3.46Å; C962-K965 PolarHBondContact O-N 2.96Å; C962-K965 VanDerWaalsContact O-N 3.12Å; C962-I966 WeakPolarHBondContact O-CB 3.18Å; C962-I966 WeakPolarHBondContact O-CD1 3.43Å; C962-I966 VanDerWaalsContact O-CG1 3.22Å; C962-I966 WeakPolarHBondContact O-CG1 3.4Å; C962-I966 PolarHBondContact O-N 3.44Å
963	E	91.2	Very high	87.4	Confident	105 Å²	105	50.9 Å²	50.9	49%	0.491	28%	0.284	S	S	.	.	H	α-helix	trans	-56.4	-45.7	172.6	-77.4	-81.5	158.4	0	0	111.2	S959 K965 I966 A967	S959-E963 VanDerWaalsContact O-CB 3.29Å; S959-E963 WeakPolarHBondContact O-CB 3.44Å; S959-E963 VanDerWaalsContact O-CG 3.23Å; S959-E963 WeakPolarHBondContact O-CG 3.13Å; S959-E963 PolarHBondContact O-N 3.05Å; E963-K965 VanDerWaalsContact C-N 3.31Å; E963-K965 PolarHBondContact O-N 2.69Å; E963-I966 PolarHBondContact O-N 3.33Å; E963-A967 WeakPolarHBondContact O-CB 3.47Å; E963-A967 PolarHBondContact O-N 3.07Å
964	G	92.6	Very high	87.6	Confident	43 Å²	43	48.5 Å²	48.5	44%	0.443	29%	0.285	S	S	.	.	H	α-helix	trans	-59.9	-38.9	174.9	0	0	0	0	0	113.2	T960 F961 C962 E968	T960-G964 PolarHBondContact O-N 3.17Å; F961-G964 PolarHBondContact O-N 3.24Å; C962-G964 VanDerWaalsContact C-N 3.33Å; C962-G964 PolarHBondContact O-N 3.38Å; G964-E968 PolarHBondContact O-N 3.01Å
965	K	90.6	Very high	87.6	Confident	44 Å²	44	50.2 Å²	50.2	19%	0.191	29%	0.294	C	S	.	.	H	α-helix	trans	-74.8	-33	176.6	-68.7	-67.7	166.7	-164.3	0	113.5	W914 M935 F961 C962 E963 E968 A969	W914-K965 HydrophobicContact CH2-CB 4.46Å; W914-K965 HydrophobicContact CZ2-CD 4.18Å; M935-K965 HydrophobicContact CE-CB 4.32Å; F961-K965 HydrophobicContact CD1-CG 4.35Å; F961-K965 HydrophobicContact CE1-CG 3.98Å; F961-K965 HydrophobicContact CZ-CG 4.26Å; F961-K965 WeakPolarHBondContact O-CG 3.14Å; F961-K965 PolarHBondContact O-N 3.15Å; C962-K965 CarbonylContact O-C 3.46Å; C962-K965 PolarHBondContact O-N 2.96Å; C962-K965 VanDerWaalsContact O-N 3.12Å; E963-K965 VanDerWaalsContact C-N 3.31Å; E963-K965 PolarHBondContact O-N 2.69Å; K965-E968 WeakPolarHBondContact CD-OE2 3.32Å; K965-E968 IonicContact NZ-OE2 3.93Å; K965-E968 PolarHBondContact NZ-OE2 2.99Å; K965-E968 PolarHBondContact O-N 2.78Å; K965-A969 WeakPolarHBondContact O-CB 3.34Å; K965-A969 PolarHBondContact O-N 3.41Å
966	I	89.5	Confident	87.2	Confident	2 Å²	2	46.7 Å²	46.7	1%	0.01	29%	0.29	C	S	.	.	H	α-helix	trans	-63.7	-47.5	171.9	-73.8	163.1	0	0	0	109.7	M935 R936 C962 E963 E968 A969 D970	M935-I966 HydrophobicContact CB-CD1 4.29Å; M935-I966 HydrophobicContact CB-CG1 3.73Å; M935-I966 HydrophobicContact CE-CG1 4.36Å; R936-I966 HydrophobicContact CB-CD1 4.12Å; R936-I966 HydrophobicContact CG-CD1 4.49Å; C962-I966 WeakPolarHBondContact O-CB 3.18Å; C962-I966 WeakPolarHBondContact O-CD1 3.43Å; C962-I966 VanDerWaalsContact O-CG1 3.22Å; C962-I966 WeakPolarHBondContact O-CG1 3.4Å; C962-I966 PolarHBondContact O-N 3.44Å; E963-I966 PolarHBondContact O-N 3.33Å; I966-E968 VanDerWaalsContact C-N 3.32Å; I966-E968 PolarHBondContact O-N 3.36Å; I966-A969 WeakPolarHBondContact O-CA 2.86Å; I966-A969 WeakPolarHBondContact O-CB 3.46Å; I966-A969 PolarHBondContact O-N 2.9Å; I966-D970 PolarHBondContact O-N 3.31Å
967	A	90.7	Very high	86.6	Confident	59 Å²	59	45.3 Å²	45.3	49%	0.488	28%	0.279	S	S	.	.	H	α-helix	trans	-62.1	-38.7	176.1	0	0	0	0	0	112.4	E963 A969 D970 S971	E963-A967 WeakPolarHBondContact O-CB 3.47Å; E963-A967 PolarHBondContact O-N 3.07Å; A967-A969 VanDerWaalsContact C-N 3.33Å; A967-D970 PolarHBondContact O-N 3.44Å; A967-S971 WeakPolarHBondContact O-CB 3.24Å; A967-S971 PolarHBondContact O-N 3.41Å
968	E	88.7	Confident	86.1	Confident	74 Å²	74	46.6 Å²	46.6	35%	0.346	28%	0.28	S	S	.	.	H	α-helix	trans	-62.1	-41.1	172.2	-171.8	176.2	-172.9	0	0	111.1	G964 K965 I966 S971 I972	G964-E968 PolarHBondContact O-N 3.01Å; K965-E968 WeakPolarHBondContact CD-OE2 3.32Å; K965-E968 IonicContact NZ-OE2 3.93Å; K965-E968 PolarHBondContact NZ-OE2 2.99Å; K965-E968 PolarHBondContact O-N 2.78Å; I966-E968 VanDerWaalsContact C-N 3.32Å; I966-E968 PolarHBondContact O-N 3.36Å; E968-S971 PolarHBondContact O-N 3.12Å; E968-I972 HydrophobicContact CG-CD1 4.11Å; E968-I972 WeakPolarHBondContact O-CD1 3.46Å; E968-I972 VanDerWaalsContact O-CG1 3.27Å; E968-I972 WeakPolarHBondContact O-CG1 3.31Å; E968-I972 PolarHBondContact O-N 2.93Å
969	A	86.8	Confident	85.6	Confident	1 Å²	1	46.6 Å²	46.6	1%	0.008	28%	0.28	C	S	.	.	H	α-helix	trans	-64.9	-43.4	177	0	0	0	0	0	112.9	M935 K965 I966 A967 I972 H973 L1009	M935-A969 HydrophobicContact SD-CB 4.08Å; K965-A969 WeakPolarHBondContact O-CB 3.34Å; K965-A969 PolarHBondContact O-N 3.41Å; I966-A969 WeakPolarHBondContact O-CA 2.86Å; I966-A969 WeakPolarHBondContact O-CB 3.46Å; I966-A969 PolarHBondContact O-N 2.9Å; A967-A969 VanDerWaalsContact C-N 3.33Å; A969-I972 PolarHBondContact O-N 2.88Å; A969-H973 WeakPolarHBondContact O-CB 3.19Å; A969-H973 PolarHBondContact O-N 3.26Å; A969-H973 PolarHBondContact O-ND1 3.45Å; A969-L1009 HydrophobicContact CB-CD2 3.57Å
970	D	87.2	Confident	85	Confident	60 Å²	60	50.6 Å²	50.6	32%	0.321	31%	0.305	S	S	.	.	H	α-helix	trans	-67.9	-38.1	177.4	-69	-25.9	0	0	0	111.6	G932 I966 A967 H973 S974	G932-D970 WeakPolarHBondContact CA-OD1 3.31Å; G932-D970 PolarHBondContact N-OD1 3Å; G932-D970 VanDerWaalsContact N-OD1 3.12Å; I966-D970 PolarHBondContact O-N 3.31Å; A967-D970 PolarHBondContact O-N 3.44Å; D970-H973 PolarHBondContact O-N 3.44Å; D970-S974 WeakPolarHBondContact O-CB 3.49Å; D970-S974 PolarHBondContact O-N 3.34Å; D970-S974 PolarHBondContact O-OG 3.2Å
971	S	87.5	Confident	83.9	Confident	69 Å²	69	50.2 Å²	50.2	48%	0.483	31%	0.312	S	S	.	.	H	α-helix	trans	-60.9	-44.3	172.9	-173.9	0	0	0	0	111.8	A967 E968 S974 M975	A967-S971 WeakPolarHBondContact O-CB 3.24Å; A967-S971 PolarHBondContact O-N 3.41Å; E968-S971 PolarHBondContact O-N 3.12Å; S971-S974 WeakPolarHBondContact CA-OG 3.41Å; S971-S974 PolarHBondContact O-N 2.76Å; S971-S974 PolarHBondContact O-OG 2.84Å; S971-M975 WeakPolarHBondContact O-CG 3.32Å; S971-M975 PolarHBondContact O-N 3.17Å; S971-M975 VanDerWaalsContact O-N 3.08Å
972	I	85.1	Confident	83.1	Confident	10 Å²	10	51.7 Å²	51.7	5%	0.051	32%	0.319	C	S	.	.	H	α-helix	trans	-68.2	-39.2	178	-67.4	165	0	0	0	111.2	E968 A969 S974 M975 K1001 L1004 M1005 T1008 L1009	E968-I972 HydrophobicContact CG-CD1 4.11Å; E968-I972 WeakPolarHBondContact O-CD1 3.46Å; E968-I972 VanDerWaalsContact O-CG1 3.27Å; E968-I972 WeakPolarHBondContact O-CG1 3.31Å; E968-I972 PolarHBondContact O-N 2.93Å; A969-I972 PolarHBondContact O-N 2.88Å; I972-S974 VanDerWaalsContact C-N 3.34Å; I972-M975 WeakPolarHBondContact O-CB 3.33Å; I972-M975 PolarHBondContact O-N 2.92Å; I972-K1001 WeakPolarHBondContact O-CE 3.43Å; I972-L1004 HydrophobicContact CG2-CB 4.06Å; I972-M1005 HydrophobicContact CG2-CG 3.74Å; I972-T1008 WeakPolarHBondContact CD1-OG1 3.5Å; I972-L1009 HydrophobicContact CD1-CD2 4.1Å; I972-L1009 HydrophobicContact CG2-CD1 4.26Å
973	H	82.8	Confident	81.9	Confident	59 Å²	59	55.9 Å²	55.9	27%	0.273	35%	0.348	S	S	.	.	H	α-helix	trans	-65.7	-36.4	175.7	-83.4	87.3	0	0	0	112.4	M930 A969 D970 K1001 L1009	M930-H973 PolarHBondContact O-CE1 3.35Å; A969-H973 WeakPolarHBondContact O-CB 3.19Å; A969-H973 PolarHBondContact O-N 3.26Å; A969-H973 PolarHBondContact O-ND1 3.45Å; D970-H973 PolarHBondContact O-N 3.44Å; H973-K1001 WeakPolarHBondContact O-CE 3.34Å; H973-K1001 PolarHBondContact O-NZ 2.89Å; H973-L1009 VanDerWaalsContact CE1-CD1 3.49Å; H973-L1009 WeakPolarHBondContact CE1-CD1 3.49Å
974	S	83.5	Confident	80.6	Confident	94 Å²	94	59.9 Å²	59.9	66%	0.657	37%	0.367	S	S	*	.	H	α-helix	trans	-79.8	-10.5	177.4	56.9	0	0	0	0	114.4	D970 S971 I972 A976	D970-S974 WeakPolarHBondContact O-CB 3.49Å; D970-S974 PolarHBondContact O-N 3.34Å; D970-S974 PolarHBondContact O-OG 3.2Å; S971-S974 WeakPolarHBondContact CA-OG 3.41Å; S971-S974 PolarHBondContact O-N 2.76Å; S971-S974 PolarHBondContact O-OG 2.84Å; I972-S974 VanDerWaalsContact C-N 3.34Å; S974-A976 PolarHBondContact O-N 3.22Å
975	M	81.8	Confident	79.2	Confident	48 Å²	48	59.8 Å²	59.8	24%	0.236	37%	0.366	C	S	.	.	S	Bend	trans	-55.5	129.3	176.2	-79.3	-178.3	62.9	0	0	111.9	S971 I972 K1000 K1001 L1004	S971-M975 WeakPolarHBondContact O-CG 3.32Å; S971-M975 PolarHBondContact O-N 3.17Å; S971-M975 VanDerWaalsContact O-N 3.08Å; I972-M975 WeakPolarHBondContact O-CB 3.33Å; I972-M975 PolarHBondContact O-N 2.92Å; M975-K1000 HydrophobicContact CE-CD 4.24Å; M975-K1000 HydrophobicContact CE-CG 4.35Å; M975-K1001 HydrophobicContact CB-CD 4.4Å; M975-K1001 WeakPolarHBondContact O-CD 3.5Å; M975-K1001 PolarHBondContact O-NZ 2.94Å; M975-L1004 HydrophobicContact CE-CD1 3.78Å; M975-L1004 HydrophobicContact SD-CD1 3.53Å; M975-L1004 VanDerWaalsContact SD-CD1 3.53Å
976	A	73.6	Confident	77.8	Confident	46 Å²	46	68 Å²	68	38%	0.38	40%	0.396	S	S	.	.			trans	-61.8	134.5	177.1	0	0	0	0	0	111.1	S974 F978	S974-A976 PolarHBondContact O-N 3.22Å; A976-F978 VanDerWaalsContact C-N 3.32Å; A976-F978 HydrophobicContact CB-CE1 4.44Å; A976-F978 HydrophobicContact CB-CE2 4.31Å; A976-F978 HydrophobicContact CB-CZ 4.28Å
977	T	73	Confident	76.5	Confident	41 Å²	41	70 Å²	70	25%	0.252	41%	0.409	S	S	.	.	S	Bend	trans	-87.7	-4.6	174.5	48.6	0	0	0	0	112.5	Q998 K1001	T977-Q998 HydrophobicContact CG2-CG 4.42Å; T977-Q998 WeakPolarHBondContact O-CG 3.23Å; T977-K1001 HydrophobicContact CG2-CD 3.7Å
978	F	74.7	Confident	75.4	Confident	57 Å²	57	69 Å²	69	25%	0.25	40%	0.398	C	S	.	.	S	Bend	trans	-121.6	151	-175.1	47.3	-91.4	0	0	0	110.6	A976 H982 P987	A976-F978 VanDerWaalsContact C-N 3.32Å; A976-F978 HydrophobicContact CB-CE1 4.44Å; A976-F978 HydrophobicContact CB-CE2 4.31Å; A976-F978 HydrophobicContact CB-CZ 4.28Å; F978-H982 HydrophobicContact CB-CB 4.18Å; F978-H982 WeakPolarHBondContact CD2-O 3.46Å; F978-P987 HydrophobicContact CB-CB 4.23Å
979	C	77	Confident	74.4	Confident	4 Å²	4	71.9 Å²	71.9	3%	0.027	42%	0.416	C	S	.	.			trans	-78.9	165.6	177.6	72.4	0	0	0	0	111	A981 H982 S993 C994	C979-A981 PolarHBondContact O-N 2.76Å; C979-H982 CarbonylContact O-C 3.42Å; C979-H982 PolarHBondContact O-N 3.15Å; C979-H982 PolarHBondContact SG-ND1 3.3Å; C979-S993 VanDerWaalsContact CB-OG 3.29Å; C979-S993 WeakPolarHBondContact CB-OG 3.37Å; C979-S993 PolarHBondContact SG-OG 2.94Å; C979-C994 PolarHBondContact N-SG 3.21Å
980	P	75	Confident	73.7	Confident	116 Å²	116	77 Å²	77	75%	0.753	45%	0.452	S	S	*	.	G	3₁₀ helix	trans	-56.3	-24.6	180	-25.6	34.4	0	0	0	114.4	H982	P980-H982 VanDerWaalsContact C-N 3.33Å
981	A	69.5	Low	73.2	Confident	88 Å²	88	75.1 Å²	75.1	73%	0.727	44%	0.443	S	S	*	.	G	3₁₀ helix	trans	-77.5	-13.4	177	0	0	0	0	0	114.1	C979	C979-A981 PolarHBondContact O-N 2.76Å
982	H	73.8	Confident	72.8	Confident	64 Å²	64	80.8 Å²	80.8	30%	0.296	46%	0.459	S	S	.	.	G	3₁₀ helix	trans	-118.1	45.1	176.1	-63.5	98.9	0	0	0	110.4	F978 C979 P980 E984 C991 C994	F978-H982 HydrophobicContact CB-CB 4.18Å; F978-H982 WeakPolarHBondContact CD2-O 3.46Å; C979-H982 CarbonylContact O-C 3.42Å; C979-H982 PolarHBondContact O-N 3.15Å; C979-H982 PolarHBondContact SG-ND1 3.3Å; P980-H982 VanDerWaalsContact C-N 3.33Å; H982-E984 PolarHBondContact O-N 2.82Å; H982-E984 VanDerWaalsContact O-N 3.13Å; H982-C991 VanDerWaalsContact CE1-CB 3.46Å; H982-C991 WeakPolarHBondContact CE1-CB 3.45Å; H982-C991 PolarHBondContact CE1-SG 3.39Å; H982-C994 PolarHBondContact ND1-SG 3.14Å
983	S	64.6	Low	72.4	Confident	89 Å²	89	82.7 Å²	82.7	62%	0.622	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	-10.2	-175.2	52.7	0	0	0	0	114.6	G985	S983-G985 PolarHBondContact O-N 2.9Å; S983-G985 VanDerWaalsContact O-N 3.1Å
984	E	64.3	Low	72.2	Confident	190 Å²	190	79.9 Å²	79.9	89%	0.888	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	10.4	177.1	-60.9	-172.4	176.7	0	0	114.5	H982 R986	H982-E984 PolarHBondContact O-N 2.82Å; H982-E984 VanDerWaalsContact O-N 3.13Å; E984-R986 PolarHBondContact O-N 2.67Å
985	G	62.6	Low	72.1	Confident	41 Å²	41	81.1 Å²	81.1	42%	0.423	45%	0.454	S	S	.	.	S	Bend	trans	84.5	7	167.4	0	0	0	0	0	116	S983	S983-G985 PolarHBondContact O-N 2.9Å; S983-G985 VanDerWaalsContact O-N 3.1Å
986	R	62.2	Low	72	Confident	216 Å²	216	82.4 Å²	82.4	82%	0.815	47%	0.468	S	S	*	.			trans	-118.8	111.3	173.2	-66.8	-173.4	-172.5	-173.3	3.4	110.9	E984 S988	E984-R986 PolarHBondContact O-N 2.67Å; R986-S988 PolarHBondContact O-N 2.88Å
987	P	62	Low	72.4	Confident	45 Å²	45	83.4 Å²	83.4	29%	0.292	46%	0.464	S	S	.	.			trans	-66.6	132.2	174.4	27.6	-32.2	0	0	0	110	F978 C994 Q998	F978-P987 HydrophobicContact CB-CB 4.23Å; P987-C994 HydrophobicContact CB-CB 4.34Å; P987-Q998 VanDerWaalsContact CB-NE2 3.35Å
988	S	67.7	Low	72.8	Confident	36 Å²	36	83.3 Å²	83.3	25%	0.252	46%	0.461	S	S	.	.			trans	-90.7	124.3	172.9	175.5	0	0	0	0	110.4	R986 S990 C991	R986-S988 PolarHBondContact O-N 2.88Å; S988-S990 PolarHBondContact O-N 2.89Å; S988-S990 PolarHBondContact OG-N 3.3Å; S988-S990 PolarHBondContact OG-OG 2.94Å; S988-C991 WeakPolarHBondContact O-CB 3.22Å; S988-C991 PolarHBondContact O-N 3.48Å
989	D	68.3	Low	73.1	Confident	135 Å²	135	83.3 Å²	83.3	72%	0.722	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-21	178.1	-72.9	-21	0	0	0	112.9	C991	D989-C991 VanDerWaalsContact C-N 3.33Å
990	S	72.2	Confident	73.5	Confident	109 Å²	109	88.7 Å²	88.7	76%	0.762	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.8	-12.1	174.6	64.2	0	0	0	0	113.2	S988 K992	S988-S990 PolarHBondContact O-N 2.89Å; S988-S990 PolarHBondContact OG-N 3.3Å; S988-S990 PolarHBondContact OG-OG 2.94Å; S990-K992 PolarHBondContact O-N 3.46Å
991	C	76.6	Confident	73.9	Confident	20 Å²	20	84.8 Å²	84.8	14%	0.135	46%	0.461	C	S	.	.			trans	-88.8	110.2	-178.8	-177.7	0	0	0	0	111.5	H982 S988 D989 S993 C994 F995	H982-C991 VanDerWaalsContact CE1-CB 3.46Å; H982-C991 WeakPolarHBondContact CE1-CB 3.45Å; H982-C991 PolarHBondContact CE1-SG 3.39Å; S988-C991 WeakPolarHBondContact O-CB 3.22Å; S988-C991 PolarHBondContact O-N 3.48Å; D989-C991 VanDerWaalsContact C-N 3.33Å; C991-S993 PolarHBondContact O-N 3.19Å; C991-S993 VanDerWaalsContact O-N 3.15Å; C991-S993 PolarHBondContact SG-OG 2.81Å; C991-C994 HydrophobicContact CB-CB 3.9Å; C991-C994 PolarHBondContact O-N 3.35Å; C991-C994 VanDerWaalsContact O-N 3.11Å; C991-F995 PolarHBondContact O-N 3.01Å
992	K	78.4	Confident	74.5	Confident	189 Å²	189	87.5 Å²	87.5	82%	0.822	46%	0.457	S	S	*	.	H	α-helix	trans	-53.4	-35.7	178.1	-70.1	-178.6	179.9	176.8	0	113.6	S990 S996	S990-K992 PolarHBondContact O-N 3.46Å; K992-S996 WeakPolarHBondContact O-CB 3.39Å; K992-S996 PolarHBondContact O-N 3.4Å
993	S	77.4	Confident	74.9	Confident	50 Å²	50	90.3 Å²	90.3	35%	0.35	47%	0.473	S	S	.	.	H	α-helix	trans	-75.2	-41.7	178.5	52.7	0	0	0	0	112	C979 C991 F995 S996 H997	C979-S993 VanDerWaalsContact CB-OG 3.29Å; C979-S993 WeakPolarHBondContact CB-OG 3.37Å; C979-S993 PolarHBondContact SG-OG 2.94Å; C991-S993 PolarHBondContact O-N 3.19Å; C991-S993 VanDerWaalsContact O-N 3.15Å; C991-S993 PolarHBondContact SG-OG 2.81Å; S993-F995 PolarHBondContact O-N 3.21Å; S993-S996 WeakPolarHBondContact O-CB 3.34Å; S993-S996 PolarHBondContact O-N 3.22Å; S993-H997 PolarHBondContact O-CD2 3Å; S993-H997 PolarHBondContact O-N 3.24Å
994	C	78.4	Confident	75.7	Confident	0 Å²	0	88.3 Å²	88.3	0%	0	46%	0.456	C	S	.	.	H	α-helix	trans	-59.9	-44.2	171.3	-66.9	0	0	0	0	111.7	C979 H982 P987 C991 S996 H997 Q998	C979-C994 PolarHBondContact N-SG 3.21Å; H982-C994 PolarHBondContact ND1-SG 3.14Å; P987-C994 HydrophobicContact CB-CB 4.34Å; C991-C994 HydrophobicContact CB-CB 3.9Å; C991-C994 PolarHBondContact O-N 3.35Å; C991-C994 VanDerWaalsContact O-N 3.11Å; C994-S996 VanDerWaalsContact C-N 3.34Å; C994-S996 PolarHBondContact O-N 3.45Å; C994-H997 PolarHBondContact O-N 2.96Å; C994-Q998 WeakPolarHBondContact O-CG 2.89Å; C994-Q998 PolarHBondContact O-N 3.03Å
995	F	80.9	Confident	76.5	Confident	120 Å²	120	81.1 Å²	81.1	53%	0.526	42%	0.422	S	S	.	.	H	α-helix	trans	-58.8	-44.3	174	-177.5	-99.4	0	0	0	111.9	C991 S993 H997 Q998 C999	C991-F995 PolarHBondContact O-N 3.01Å; S993-F995 PolarHBondContact O-N 3.21Å; F995-H997 PolarHBondContact O-N 2.97Å; F995-Q998 PolarHBondContact O-N 2.9Å; F995-C999 VanDerWaalsContact CE1-SG 3.54Å; F995-C999 VanDerWaalsContact CZ-SG 3.54Å; F995-C999 WeakPolarHBondContact O-CB 3.4Å; F995-C999 PolarHBondContact O-N 2.86Å; F995-C999 PolarHBondContact O-SG 3.42Å
996	S	81	Confident	77.3	Confident	75 Å²	75	87 Å²	87	52%	0.524	44%	0.436	S	S	.	.	H	α-helix	trans	-60.4	-43	174.8	-176.1	0	0	0	0	112.6	K992 S993 C994 C999 K1000	K992-S996 WeakPolarHBondContact O-CB 3.39Å; K992-S996 PolarHBondContact O-N 3.4Å; S993-S996 WeakPolarHBondContact O-CB 3.34Å; S993-S996 PolarHBondContact O-N 3.22Å; C994-S996 VanDerWaalsContact C-N 3.34Å; C994-S996 PolarHBondContact O-N 3.45Å; S996-C999 PolarHBondContact O-N 2.77Å; S996-K1000 VanDerWaalsContact O-CB 3.3Å; S996-K1000 WeakPolarHBondContact O-CB 3.33Å; S996-K1000 PolarHBondContact O-N 2.87Å
997	H	81.7	Confident	77.9	Confident	66 Å²	66	80.2 Å²	80.2	31%	0.306	42%	0.422	S	S	.	.	H	α-helix	trans	-64.2	-43.7	175.5	-79	-77.1	0	0	0	112.3	S993 C994 F995 K1000 K1001	S993-H997 PolarHBondContact O-CD2 3Å; S993-H997 PolarHBondContact O-N 3.24Å; C994-H997 PolarHBondContact O-N 2.96Å; F995-H997 PolarHBondContact O-N 2.97Å; H997-K1000 PolarHBondContact O-N 3.37Å; H997-K1001 PolarHBondContact O-N 3.16Å
998	Q	80.9	Confident	78.7	Confident	40 Å²	40	79.8 Å²	79.8	19%	0.187	42%	0.419	C	S	.	.	H	α-helix	trans	-60.7	-47.9	173.7	-74.4	-178.8	-4.6	0	0	112	T977 P987 C994 F995 K1000 K1001 K1002	T977-Q998 HydrophobicContact CG2-CG 4.42Å; T977-Q998 WeakPolarHBondContact O-CG 3.23Å; P987-Q998 VanDerWaalsContact CB-NE2 3.35Å; C994-Q998 WeakPolarHBondContact O-CG 2.89Å; C994-Q998 PolarHBondContact O-N 3.03Å; F995-Q998 PolarHBondContact O-N 2.9Å; Q998-K1000 VanDerWaalsContact C-N 3.35Å; Q998-K1000 PolarHBondContact O-N 3.28Å; Q998-K1001 PolarHBondContact O-N 3.5Å; Q998-K1002 WeakPolarHBondContact O-CG 3.49Å; Q998-K1002 PolarHBondContact O-N 2.83Å
999	C	81.3	Confident	79.4	Confident	57 Å²	57	78.6 Å²	78.6	39%	0.385	41%	0.409	S	S	.	.	H	α-helix	trans	-61.2	-42.7	176.9	-78.2	0	0	0	0	111.7	F995 S996 K1002 L1003	F995-C999 VanDerWaalsContact CE1-SG 3.54Å; F995-C999 VanDerWaalsContact CZ-SG 3.54Å; F995-C999 WeakPolarHBondContact O-CB 3.4Å; F995-C999 PolarHBondContact O-N 2.86Å; F995-C999 PolarHBondContact O-SG 3.42Å; S996-C999 PolarHBondContact O-N 2.77Å; C999-K1002 PolarHBondContact O-N 3.28Å; C999-L1003 VanDerWaalsContact O-CB 3.26Å; C999-L1003 WeakPolarHBondContact O-CB 3.4Å; C999-L1003 PolarHBondContact O-N 3.29Å
1000	K	84.1	Confident	80.3	Confident	117 Å²	117	72.2 Å²	72.2	51%	0.509	38%	0.375	S	S	.	.	H	α-helix	trans	-60.9	-46.2	176.2	-175.8	178	179.1	-178.4	0	111.3	M975 S996 H997 Q998 L1003 L1004	M975-K1000 HydrophobicContact CE-CD 4.24Å; M975-K1000 HydrophobicContact CE-CG 4.35Å; S996-K1000 VanDerWaalsContact O-CB 3.3Å; S996-K1000 WeakPolarHBondContact O-CB 3.33Å; S996-K1000 PolarHBondContact O-N 2.87Å; H997-K1000 PolarHBondContact O-N 3.37Å; Q998-K1000 VanDerWaalsContact C-N 3.35Å; Q998-K1000 PolarHBondContact O-N 3.28Å; K1000-L1003 PolarHBondContact O-N 3.08Å; K1000-L1004 HydrophobicContact CG-CD1 4.06Å; K1000-L1004 WeakPolarHBondContact O-CB 3.2Å; K1000-L1004 VanDerWaalsContact O-CG 3.29Å; K1000-L1004 WeakPolarHBondContact O-CG 3.42Å; K1000-L1004 PolarHBondContact O-N 3.14Å
1001	K	84	Confident	80.9	Confident	33 Å²	33	67.4 Å²	67.4	14%	0.143	34%	0.342	C	S	.	.	H	α-helix	trans	-61.8	-48.5	176.9	-175.3	175.7	-173.6	166.5	0	111.6	I972 H973 M975 T977 H997 Q998 L1003 L1004 M1005	I972-K1001 WeakPolarHBondContact O-CE 3.43Å; H973-K1001 WeakPolarHBondContact O-CE 3.34Å; H973-K1001 PolarHBondContact O-NZ 2.89Å; M975-K1001 HydrophobicContact CB-CD 4.4Å; M975-K1001 WeakPolarHBondContact O-CD 3.5Å; M975-K1001 PolarHBondContact O-NZ 2.94Å; T977-K1001 HydrophobicContact CG2-CD 3.7Å; H997-K1001 PolarHBondContact O-N 3.16Å; Q998-K1001 PolarHBondContact O-N 3.5Å; K1001-L1003 VanDerWaalsContact C-N 3.34Å; K1001-L1003 PolarHBondContact O-N 2.74Å; K1001-L1004 PolarHBondContact O-N 3.35Å; K1001-M1005 HydrophobicContact CD-CE 4.44Å; K1001-M1005 HydrophobicContact CG-CE 4.27Å; K1001-M1005 HydrophobicContact CG-CG 4.47Å; K1001-M1005 HydrophobicContact CG-SD 4.1Å; K1001-M1005 WeakPolarHBondContact O-CB 3.42Å; K1001-M1005 WeakPolarHBondContact O-CG 3.29Å; K1001-M1005 PolarHBondContact O-N 2.93Å
1002	K	82.5	Confident	81.3	Confident	145 Å²	145	69.4 Å²	69.4	63%	0.63	36%	0.356	S	S	*	.	H	α-helix	trans	-59.4	-42.6	176.7	-77	-174.4	176.2	-175.3	0	112.4	Q998 C999 M1005 K1006	Q998-K1002 WeakPolarHBondContact O-CG 3.49Å; Q998-K1002 PolarHBondContact O-N 2.83Å; C999-K1002 PolarHBondContact O-N 3.28Å; K1002-M1005 PolarHBondContact O-N 3.23Å; K1002-K1006 WeakPolarHBondContact O-CB 3.43Å; K1002-K1006 PolarHBondContact O-N 3.5Å
1003	L	81.3	Confident	81.6	Confident	124 Å²	124	66.7 Å²	66.7	65%	0.649	35%	0.346	S	S	*	.	H	α-helix	trans	-63.8	-46.3	177.8	-172.2	76.6	0	0	0	111.1	C999 K1000 K1001 K1006 S1007	C999-L1003 VanDerWaalsContact O-CB 3.26Å; C999-L1003 WeakPolarHBondContact O-CB 3.4Å; C999-L1003 PolarHBondContact O-N 3.29Å; K1000-L1003 PolarHBondContact O-N 3.08Å; K1001-L1003 VanDerWaalsContact C-N 3.34Å; K1001-L1003 PolarHBondContact O-N 2.74Å; L1003-K1006 PolarHBondContact O-N 2.83Å; L1003-S1007 VanDerWaalsContact O-CB 3.25Å; L1003-S1007 WeakPolarHBondContact O-CB 3.5Å; L1003-S1007 PolarHBondContact O-N 3.01Å; L1003-S1007 PolarHBondContact O-OG 3.13Å
1004	L	82	Confident	82.1	Confident	47 Å²	47	65 Å²	65	25%	0.246	33%	0.333	C	S	.	.	H	α-helix	trans	-59.4	-53.5	175.9	-73.1	169.5	0	0	0	110	I972 M975 K1000 K1001 K1006 S1007 T1008	I972-L1004 HydrophobicContact CG2-CB 4.06Å; M975-L1004 HydrophobicContact CE-CD1 3.78Å; M975-L1004 HydrophobicContact SD-CD1 3.53Å; M975-L1004 VanDerWaalsContact SD-CD1 3.53Å; K1000-L1004 HydrophobicContact CG-CD1 4.06Å; K1000-L1004 WeakPolarHBondContact O-CB 3.2Å; K1000-L1004 VanDerWaalsContact O-CG 3.29Å; K1000-L1004 WeakPolarHBondContact O-CG 3.42Å; K1000-L1004 PolarHBondContact O-N 3.14Å; K1001-L1004 PolarHBondContact O-N 3.35Å; L1004-K1006 VanDerWaalsContact C-N 3.26Å; L1004-K1006 PolarHBondContact O-N 3.26Å; L1004-K1006 VanDerWaalsContact O-N 3.16Å; L1004-S1007 PolarHBondContact O-N 2.83Å; L1004-S1007 PolarHBondContact O-OG 2.92Å; L1004-T1008 PolarHBondContact O-N 3.37Å; L1004-T1008 PolarHBondContact O-OG1 2.85Å
1005	M	81.4	Confident	82.6	Confident	38 Å²	38	65.1 Å²	65.1	19%	0.187	33%	0.333	C	S	.	.	H	α-helix	trans	-49.8	-46.2	177.3	-74.9	177.9	154.8	0	0	112.6	I972 K1001 K1002 L1009	I972-M1005 HydrophobicContact CG2-CG 3.74Å; K1001-M1005 HydrophobicContact CD-CE 4.44Å; K1001-M1005 HydrophobicContact CG-CE 4.27Å; K1001-M1005 HydrophobicContact CG-CG 4.47Å; K1001-M1005 HydrophobicContact CG-SD 4.1Å; K1001-M1005 WeakPolarHBondContact O-CB 3.42Å; K1001-M1005 WeakPolarHBondContact O-CG 3.29Å; K1001-M1005 PolarHBondContact O-N 2.93Å; K1002-M1005 PolarHBondContact O-N 3.23Å; M1005-L1009 HydrophobicContact CB-CD1 4.09Å; M1005-L1009 HydrophobicContact CG-CD1 3.83Å; M1005-L1009 VanDerWaalsContact O-CB 3.31Å; M1005-L1009 WeakPolarHBondContact O-CB 3.38Å; M1005-L1009 PolarHBondContact O-N 3.37Å
1006	K	78.2	Confident	83	Confident	165 Å²	165	60.6 Å²	60.6	72%	0.717	32%	0.316	S	S	*	.	H	α-helix	trans	-72.4	-29.7	179.8	-171.4	170.6	-175.9	166.8	0	114.2	K1002 L1003 L1004	K1002-K1006 WeakPolarHBondContact O-CB 3.43Å; K1002-K1006 PolarHBondContact O-N 3.5Å; L1003-K1006 PolarHBondContact O-N 2.83Å; L1004-K1006 VanDerWaalsContact C-N 3.26Å; L1004-K1006 PolarHBondContact O-N 3.26Å; L1004-K1006 VanDerWaalsContact O-N 3.16Å
1007	S	76.2	Confident	83.3	Confident	73 Å²	73	60 Å²	60	51%	0.51	31%	0.305	S	S	.	.	H	α-helix	trans	-92.8	-29.9	-172.5	67.8	0	0	0	0	114.2	L1003 L1004	L1003-S1007 VanDerWaalsContact O-CB 3.25Å; L1003-S1007 WeakPolarHBondContact O-CB 3.5Å; L1003-S1007 PolarHBondContact O-N 3.01Å; L1003-S1007 PolarHBondContact O-OG 3.13Å; L1004-S1007 PolarHBondContact O-N 2.83Å; L1004-S1007 PolarHBondContact O-OG 2.92Å
1008	T	78.8	Confident	83.8	Confident	37 Å²	37	56.9 Å²	56.9	23%	0.227	29%	0.291	C	S	.	.	H	α-helix	trans	-115	-25.5	-173.1	46.5	0	0	0	0	114.5	I972 L1004	I972-T1008 WeakPolarHBondContact CD1-OG1 3.5Å; L1004-T1008 PolarHBondContact O-N 3.37Å; L1004-T1008 PolarHBondContact O-OG1 2.85Å
1009	L	83	Confident	84.3	Confident	10 Å²	10	55.1 Å²	55.1	5%	0.052	28%	0.283	C	S	.	.	P	Polyproline II helix	trans	-91.4	139.3	-176.8	-53.9	-179.9	0	0	0	112.2	V929 A969 I972 H973 M1005	V929-L1009 HydrophobicContact CB-CB 4.27Å; V929-L1009 HydrophobicContact CG1-CB 3.73Å; A969-L1009 HydrophobicContact CB-CD2 3.57Å; I972-L1009 HydrophobicContact CD1-CD2 4.1Å; I972-L1009 HydrophobicContact CG2-CD1 4.26Å; H973-L1009 VanDerWaalsContact CE1-CD1 3.49Å; H973-L1009 WeakPolarHBondContact CE1-CD1 3.49Å; M1005-L1009 HydrophobicContact CB-CD1 4.09Å; M1005-L1009 HydrophobicContact CG-CD1 3.83Å; M1005-L1009 VanDerWaalsContact O-CB 3.31Å; M1005-L1009 WeakPolarHBondContact O-CB 3.38Å; M1005-L1009 PolarHBondContact O-N 3.37Å
1010	P	85.4	Confident	84.7	Confident	2 Å²	2	56.3 Å²	56.3	1%	0.013	29%	0.285	C	S	.	.	P	Polyproline II helix	trans	-85.5	157.2	178.3	37.7	-38.6	0	0	0	112.3	W914 L918 M930 M935 Q1014 F1015	W914-P1010 HydrophobicContact CH2-CB 4.07Å; W914-P1010 HydrophobicContact CH2-CG 3.6Å; W914-P1010 HydrophobicContact CZ2-CG 4.28Å; W914-P1010 HydrophobicContact CZ3-CG 4.4Å; L918-P1010 HydrophobicContact CD2-CB 3.74Å; M930-P1010 PolarHBondContact N-O 2.94Å; M930-P1010 VanDerWaalsContact N-O 3.14Å; M935-P1010 HydrophobicContact CE-CG 4.11Å; M935-P1010 HydrophobicContact SD-CG 4.12Å; P1010-Q1014 HydrophobicContact CB-CB 4.16Å; P1010-F1015 HydrophobicContact CB-CB 4.14Å; P1010-F1015 HydrophobicContact CG-CB 4.11Å; P1010-F1015 HydrophobicContact CG-CD2 4.34Å; P1010-F1015 HydrophobicContact CG-CG 4.48Å
1011	S	86	Confident	85	Confident	8 Å²	8	52.6 Å²	52.6	6%	0.056	27%	0.272	C	S	.	.	B	Isolated β-bridge	trans	-76.2	162.8	156.9	75.4	0	0	0	0	111.3	D928 E1013 Q1014 F1015	D928-S1011 WeakPolarHBondContact O-CA 3.45Å; S1011-E1013 PolarHBondContact O-N 2.99Å; S1011-Q1014 PolarHBondContact O-N 3.09Å; S1011-Q1014 WeakPolarHBondContact OG-CG 3.28Å; S1011-Q1014 PolarHBondContact OG-N 2.66Å; S1011-F1015 PolarHBondContact O-N 3.13Å
1012	S	84.8	Confident	85.2	Confident	62 Å²	62	51 Å²	51	43%	0.434	27%	0.266	S	S	.	.	H	α-helix	trans	-55.6	-39.2	176.3	-170.7	0	0	0	0	112.8	M930 S1016	M930-S1012 VanDerWaalsContact SD-CA 3.59Å; M930-S1012 VanDerWaalsContact SD-CB 3.57Å; S1012-S1016 WeakPolarHBondContact O-CB 3.4Å; S1012-S1016 PolarHBondContact O-N 3.3Å; S1012-S1016 PolarHBondContact O-OG 3.34Å
1013	E	84.8	Confident	85.6	Confident	132 Å²	132	44.8 Å²	44.8	62%	0.617	24%	0.239	S	C	*	.	H	α-helix	trans	-68.9	-45	177.8	-172.1	176.5	-171.1	0	0	112	S1011 F1015 S1016 Q1017	S1011-E1013 PolarHBondContact O-N 2.99Å; E1013-F1015 VanDerWaalsContact C-N 3.32Å; E1013-F1015 PolarHBondContact O-N 3.22Å; E1013-S1016 PolarHBondContact O-N 3.33Å; E1013-Q1017 WeakPolarHBondContact O-CB 3.31Å; E1013-Q1017 PolarHBondContact O-N 3.41Å
1014	Q	87.5	Confident	85.9	Confident	15 Å²	15	45.7 Å²	45.7	7%	0.07	24%	0.238	C	C	.	.	H	α-helix	trans	-60.7	-43.1	177	-74.5	171.9	-19.2	0	0	111.5	L918 V921 P1010 S1011 Q1017 F1018	L918-Q1014 PolarHBondContact O-NE2 3.43Å; L918-Q1014 VanDerWaalsContact O-NE2 3.14Å; V921-Q1014 HydrophobicContact CB-CG 3.93Å; V921-Q1014 HydrophobicContact CG1-CG 4.39Å; V921-Q1014 PolarHBondContact O-NE2 3.28Å; P1010-Q1014 HydrophobicContact CB-CB 4.16Å; S1011-Q1014 PolarHBondContact O-N 3.09Å; S1011-Q1014 WeakPolarHBondContact OG-CG 3.28Å; S1011-Q1014 PolarHBondContact OG-N 2.66Å; Q1014-Q1017 PolarHBondContact O-N 3.3Å; Q1014-F1018 WeakPolarHBondContact O-CB 3.41Å; Q1014-F1018 PolarHBondContact O-N 3.1Å
1015	F	89.1	Confident	86.3	Confident	1 Å²	1	44.9 Å²	44.9	0%	0.004	23%	0.232	C	C	.	.	H	α-helix	trans	-66.8	-42.5	178.6	-169.9	-119.4	0	0	0	111.7	W914 M930 M935 C938 F939 P1010 S1011 E1013 Q1017 F1018 L1019	W914-F1015 HydrophobicContact CH2-CD2 4.3Å; W914-F1015 AromaticContact CZ3-CD2 3.7Å; W914-F1015 HydrophobicContact CZ3-CD2 3.7Å; W914-F1015 AromaticContact CZ3-CE2 3.9Å; W914-F1015 HydrophobicContact CZ3-CE2 3.9Å; M930-F1015 HydrophobicContact CE-CD1 4.13Å; M935-F1015 HydrophobicContact CB-CE1 4.2Å; M935-F1015 HydrophobicContact CB-CZ 4.4Å; M935-F1015 HydrophobicContact CE-CD2 3.81Å; M935-F1015 HydrophobicContact CE-CE2 3.51Å; M935-F1015 HydrophobicContact CE-CG 4.45Å; M935-F1015 HydrophobicContact CE-CZ 3.92Å; M935-F1015 VanDerWaalsContact O-CE1 3.26Å; M935-F1015 WeakPolarHBondContact O-CE1 3.29Å; C938-F1015 HydrophobicContact CB-CD1 3.92Å; C938-F1015 HydrophobicContact CB-CE1 4.1Å; F939-F1015 HydrophobicContact CB-CE1 4.2Å; F939-F1015 HydrophobicContact CB-CZ 4.33Å; P1010-F1015 HydrophobicContact CB-CB 4.14Å; P1010-F1015 HydrophobicContact CG-CB 4.11Å; P1010-F1015 HydrophobicContact CG-CD2 4.34Å; P1010-F1015 HydrophobicContact CG-CG 4.48Å; S1011-F1015 PolarHBondContact O-N 3.13Å; E1013-F1015 VanDerWaalsContact C-N 3.32Å; E1013-F1015 PolarHBondContact O-N 3.22Å; F1015-Q1017 PolarHBondContact O-N 3.01Å; F1015-F1018 HydrophobicContact CD2-CD1 4.26Å; F1015-F1018 HydrophobicContact CE2-CD1 4.17Å; F1015-F1018 WeakPolarHBondContact O-CB 3.32Å; F1015-F1018 PolarHBondContact O-N 3.26Å; F1015-L1019 HydrophobicContact CD1-CD1 4.09Å; F1015-L1019 HydrophobicContact CE1-CD1 3.71Å; F1015-L1019 HydrophobicContact CE1-CG 4.41Å; F1015-L1019 HydrophobicContact CZ-CD1 4.04Å; F1015-L1019 HydrophobicContact CZ-CD2 4.38Å; F1015-L1019 HydrophobicContact CZ-CG 4.35Å; F1015-L1019 WeakPolarHBondContact O-CG 3.49Å; F1015-L1019 PolarHBondContact O-N 2.98Å
1016	S	89.3	Confident	86.7	Confident	25 Å²	25	43.6 Å²	43.6	18%	0.175	23%	0.226	C	C	.	.	H	α-helix	trans	-62.2	-41.6	174.2	-61.8	0	0	0	0	111.9	C938 S1012 E1013 L1019 N1020	C938-S1016 PolarHBondContact SG-OG 3.23Å; S1012-S1016 WeakPolarHBondContact O-CB 3.4Å; S1012-S1016 PolarHBondContact O-N 3.3Å; S1012-S1016 PolarHBondContact O-OG 3.34Å; E1013-S1016 PolarHBondContact O-N 3.33Å; S1016-L1019 PolarHBondContact O-N 3.23Å; S1016-N1020 WeakPolarHBondContact O-CB 3.36Å; S1016-N1020 PolarHBondContact O-N 3.02Å; S1016-N1020 PolarHBondContact O-ND2 2.92Å
1017	Q	88	Confident	87.2	Confident	63 Å²	63	41.9 Å²	41.9	29%	0.294	22%	0.215	S	C	.	.	H	α-helix	trans	-64.2	-41.9	176.2	-177.9	178.8	-1.7	0	0	111.9	E1013 Q1014 F1015 N1020 T1021	E1013-Q1017 WeakPolarHBondContact O-CB 3.31Å; E1013-Q1017 PolarHBondContact O-N 3.41Å; Q1014-Q1017 PolarHBondContact O-N 3.3Å; F1015-Q1017 PolarHBondContact O-N 3.01Å; Q1017-N1020 PolarHBondContact O-N 3.16Å; Q1017-T1021 VanDerWaalsContact O-CB 3.29Å; Q1017-T1021 WeakPolarHBondContact O-CB 3.45Å; Q1017-T1021 PolarHBondContact O-N 2.81Å; Q1017-T1021 PolarHBondContact O-OG1 3.13Å
1018	F	91.5	Very high	87.8	Confident	1 Å²	1	42.2 Å²	42.2	0%	0.004	22%	0.216	C	C	.	.	H	α-helix	trans	-55.6	-53.8	174.6	164.8	-108	0	0	0	110.8	W914 S917 L958 F961 Q1014 F1015 N1020 T1021 C1022	W914-F1018 HydrophobicContact CB-CD2 4.38Å; W914-F1018 HydrophobicContact CB-CE2 4.08Å; W914-F1018 HydrophobicContact CE3-CD1 4.09Å; W914-F1018 HydrophobicContact CE3-CD2 4.37Å; W914-F1018 HydrophobicContact CE3-CE1 4.21Å; W914-F1018 HydrophobicContact CE3-CE2 4.48Å; W914-F1018 HydrophobicContact CE3-CG 4.17Å; W914-F1018 HydrophobicContact CE3-CZ 4.4Å; W914-F1018 HydrophobicContact CZ3-CD1 4.38Å; S917-F1018 WeakPolarHBondContact OG-CA 3.45Å; S917-F1018 WeakPolarHBondContact OG-CB 3.24Å; L958-F1018 HydrophobicContact CD1-CE1 4.29Å; L958-F1018 HydrophobicContact CD1-CZ 4.3Å; F961-F1018 HydrophobicContact CD1-CZ 4.03Å; F961-F1018 HydrophobicContact CE1-CE1 4.4Å; F961-F1018 HydrophobicContact CE1-CE2 4.46Å; F961-F1018 AromaticContact CE1-CZ 3.76Å; F961-F1018 HydrophobicContact CE1-CZ 3.76Å; Q1014-F1018 WeakPolarHBondContact O-CB 3.41Å; Q1014-F1018 PolarHBondContact O-N 3.1Å; F1015-F1018 HydrophobicContact CD2-CD1 4.26Å; F1015-F1018 HydrophobicContact CE2-CD1 4.17Å; F1015-F1018 WeakPolarHBondContact O-CB 3.32Å; F1015-F1018 PolarHBondContact O-N 3.26Å; F1018-N1020 PolarHBondContact O-N 2.91Å; F1018-T1021 PolarHBondContact O-N 3.32Å; F1018-C1022 WeakPolarHBondContact CE2-SG 3.37Å; F1018-C1022 PolarHBondContact O-N 2.85Å; F1018-C1022 PolarHBondContact O-SG 2.96Å; F1018-C1022 VanDerWaalsContact O-SG 3.4Å
1019	L	90.7	Very high	88.4	Confident	2 Å²	2	40.6 Å²	40.6	1%	0.01	21%	0.206	C	C	.	.	H	α-helix	trans	-60.2	-47.1	-179.8	-66	175.8	0	0	0	111.9	F939 H942 L958 F1015 S1016 T1021 C1022 I1023	F939-L1019 HydrophobicContact CB-CD1 4.49Å; F939-L1019 HydrophobicContact CD2-CD1 4.25Å; F939-L1019 HydrophobicContact CD2-CD2 3.8Å; F939-L1019 HydrophobicContact CE2-CD2 4.24Å; H942-L1019 HydrophobicContact CB-CB 4.42Å; H942-L1019 HydrophobicContact CB-CD1 4.03Å; L958-L1019 HydrophobicContact CD2-CD2 4.45Å; F1015-L1019 HydrophobicContact CD1-CD1 4.09Å; F1015-L1019 HydrophobicContact CE1-CD1 3.71Å; F1015-L1019 HydrophobicContact CE1-CG 4.41Å; F1015-L1019 HydrophobicContact CZ-CD1 4.04Å; F1015-L1019 HydrophobicContact CZ-CD2 4.38Å; F1015-L1019 HydrophobicContact CZ-CG 4.35Å; F1015-L1019 WeakPolarHBondContact O-CG 3.49Å; F1015-L1019 PolarHBondContact O-N 2.98Å; S1016-L1019 PolarHBondContact O-N 3.23Å; L1019-T1021 VanDerWaalsContact C-N 3.3Å; L1019-T1021 PolarHBondContact O-N 2.84Å; L1019-C1022 PolarHBondContact O-N 2.73Å; L1019-I1023 VanDerWaalsContact O-CG1 3.27Å; L1019-I1023 WeakPolarHBondContact O-CG1 3.37Å; L1019-I1023 PolarHBondContact O-N 2.83Å
1020	N	90.2	Very high	88.8	Confident	82 Å²	82	43.3 Å²	43.3	44%	0.439	22%	0.22	S	C	.	.	H	α-helix	trans	-61.6	-37.8	177.5	-76.1	-45.3	0	0	0	112.5	H942 S1016 Q1017 F1018 K1024	H942-N1020 PolarHBondContact CD2-OD1 2.95Å; H942-N1020 PolarHBondContact NE2-ND2 2.81Å; S1016-N1020 WeakPolarHBondContact O-CB 3.36Å; S1016-N1020 PolarHBondContact O-N 3.02Å; S1016-N1020 PolarHBondContact O-ND2 2.92Å; Q1017-N1020 PolarHBondContact O-N 3.16Å; F1018-N1020 PolarHBondContact O-N 2.91Å; N1020-K1024 WeakPolarHBondContact O-CB 3.29Å; N1020-K1024 PolarHBondContact O-N 3.12Å
1021	T	89.5	Confident	89.1	Confident	39 Å²	39	43.5 Å²	43.5	24%	0.239	22%	0.222	C	C	.	.	H	α-helix	trans	-67.5	-45	177.3	-57.2	0	0	0	0	110.9	Q1017 F1018 L1019 K1024 K1025	Q1017-T1021 VanDerWaalsContact O-CB 3.29Å; Q1017-T1021 WeakPolarHBondContact O-CB 3.45Å; Q1017-T1021 PolarHBondContact O-N 2.81Å; Q1017-T1021 PolarHBondContact O-OG1 3.13Å; F1018-T1021 PolarHBondContact O-N 3.32Å; L1019-T1021 VanDerWaalsContact C-N 3.3Å; L1019-T1021 PolarHBondContact O-N 2.84Å; T1021-K1024 PolarHBondContact O-N 2.9Å; T1021-K1025 HydrophobicContact CG2-CD 4.37Å; T1021-K1025 HydrophobicContact CG2-CG 4.47Å; T1021-K1025 WeakPolarHBondContact O-CB 3.36Å; T1021-K1025 WeakPolarHBondContact O-CG 3.31Å; T1021-K1025 PolarHBondContact O-N 3.25Å
1022	C	90.1	Very high	89.5	Confident	1 Å²	1	50 Å²	50	1%	0.007	25%	0.251	C	S	.	.	H	α-helix	trans	-60	-47	175.6	-71.5	0	0	0	0	111.9	F954 F1018 L1019 K1024 K1025 Y1026	F954-C1022 HydrophobicContact CZ-CB 4.36Å; F1018-C1022 WeakPolarHBondContact CE2-SG 3.37Å; F1018-C1022 PolarHBondContact O-N 2.85Å; F1018-C1022 PolarHBondContact O-SG 2.96Å; F1018-C1022 VanDerWaalsContact O-SG 3.4Å; L1019-C1022 PolarHBondContact O-N 2.73Å; C1022-K1024 PolarHBondContact O-N 2.86Å; C1022-K1025 PolarHBondContact O-N 3.17Å; C1022-Y1026 WeakPolarHBondContact O-CB 3.5Å; C1022-Y1026 PolarHBondContact O-N 3.4Å
1023	I	88.9	Confident	89.9	Confident	13 Å²	13	49.4 Å²	49.4	7%	0.067	25%	0.246	C	C	.	.	H	α-helix	trans	-63	-43.4	178	-66	165.9	0	0	0	110.8	A946 L949 L1019 Y1026 R1027	A946-I1023 HydrophobicContact CB-CD1 4.22Å; L949-I1023 HydrophobicContact CD1-CG1 4.27Å; L1019-I1023 VanDerWaalsContact O-CG1 3.27Å; L1019-I1023 WeakPolarHBondContact O-CG1 3.37Å; L1019-I1023 PolarHBondContact O-N 2.83Å; I1023-Y1026 PolarHBondContact O-N 3.03Å; I1023-R1027 WeakPolarHBondContact O-CG 3.08Å; I1023-R1027 PolarHBondContact O-N 3.01Å
1024	K	89.4	Confident	90.2	Very high	143 Å²	143	43.4 Å²	43.4	62%	0.622	22%	0.22	S	C	*	.	H	α-helix	trans	-62.3	-46.4	176.7	-178.6	-178.9	176.1	-175.7	0	111.7	N1020 T1021 C1022 Y1026 R1027 C1028	N1020-K1024 WeakPolarHBondContact O-CB 3.29Å; N1020-K1024 PolarHBondContact O-N 3.12Å; T1021-K1024 PolarHBondContact O-N 2.9Å; C1022-K1024 PolarHBondContact O-N 2.86Å; K1024-Y1026 VanDerWaalsContact C-N 3.33Å; K1024-Y1026 PolarHBondContact O-N 3.29Å; K1024-R1027 PolarHBondContact O-N 3.42Å; K1024-C1028 PolarHBondContact O-N 3.48Å; K1024-C1028 PolarHBondContact O-SG 3.42Å; K1024-C1028 VanDerWaalsContact O-SG 3.37Å
1025	K	90.2	Very high	90.5	Very high	30 Å²	30	44.5 Å²	44.5	13%	0.13	23%	0.227	C	C	.	.	H	α-helix	trans	-61.2	-42.4	177.8	-77.7	-172.7	171.1	-161.1	0	111.5	D659 E902 V908 T1021 C1022 C1028 A1029	D659-K1025 WeakPolarHBondContact OD1-CE 3.28Å; D659-K1025 IonicContact OD1-NZ 2.65Å; D659-K1025 PolarHBondContact OD1-NZ 3.27Å; E902-K1025 WeakPolarHBondContact OE1-CD 3.3Å; E902-K1025 WeakPolarHBondContact OE1-CE 3.3Å; E902-K1025 IonicContact OE1-NZ 2.74Å; E902-K1025 PolarHBondContact OE1-NZ 3.09Å; E902-K1025 IonicContact OE2-NZ 3.54Å; V908-K1025 HydrophobicContact CG1-CB 4.45Å; V908-K1025 HydrophobicContact CG1-CD 4.09Å; V908-K1025 HydrophobicContact CG2-CB 3.86Å; T1021-K1025 HydrophobicContact CG2-CD 4.37Å; T1021-K1025 HydrophobicContact CG2-CG 4.47Å; T1021-K1025 WeakPolarHBondContact O-CB 3.36Å; T1021-K1025 WeakPolarHBondContact O-CG 3.31Å; T1021-K1025 PolarHBondContact O-N 3.25Å; C1022-K1025 PolarHBondContact O-N 3.17Å; K1025-C1028 PolarHBondContact O-N 3.42Å; K1025-A1029 WeakPolarHBondContact O-CB 2.81Å; K1025-A1029 PolarHBondContact O-N 3.41Å
1026	Y	89.4	Confident	90.8	Very high	12 Å²	12	45.7 Å²	45.7	5%	0.047	24%	0.237	C	C	.	.	H	α-helix	trans	-60.7	-46.6	175	-176.1	-88.7	0	0	0	112	I896 V907 L949 D951 F954 C1022 I1023 K1024 C1028 A1029 I1030	I896-Y1026 HydrophobicContact CD1-CE2 3.88Å; V907-Y1026 HydrophobicContact CB-CD2 4.5Å; V907-Y1026 HydrophobicContact CG1-CD2 4.22Å; V907-Y1026 HydrophobicContact CG2-CE2 4.49Å; L949-Y1026 HydrophobicContact CD2-CD1 3.25Å; L949-Y1026 HydrophobicContact CD2-CE1 3.46Å; L949-Y1026 VanDerWaalsContact CD2-CE1 3.46Å; L949-Y1026 HydrophobicContact CD2-CG 4.06Å; D951-Y1026 WeakPolarHBondContact CB-OH 3.28Å; D951-Y1026 PolarHBondContact OD2-OH 3.26Å; F954-Y1026 HydrophobicContact CB-CD2 3.89Å; F954-Y1026 HydrophobicContact CB-CE2 3.52Å; F954-Y1026 HydrophobicContact CD1-CD1 4.48Å; F954-Y1026 AromaticContact CD1-CD2 3.65Å; F954-Y1026 HydrophobicContact CD1-CD2 3.65Å; F954-Y1026 HydrophobicContact CD1-CE2 4.03Å; F954-Y1026 AromaticContact CD1-CG 3.9Å; F954-Y1026 HydrophobicContact CD1-CG 3.9Å; F954-Y1026 AromaticContact CD2-CD2 3.72Å; F954-Y1026 HydrophobicContact CD2-CD2 3.72Å; F954-Y1026 HydrophobicContact CD2-CE2 4.22Å; F954-Y1026 HydrophobicContact CE1-CD2 4.07Å; F954-Y1026 AromaticContact CE1-CG 4Å; F954-Y1026 HydrophobicContact CE1-CG 4Å; F954-Y1026 HydrophobicContact CE2-CD2 4.14Å; F954-Y1026 AromaticContact CG-CD2 3.45Å; F954-Y1026 HydrophobicContact CG-CD2 3.45Å; F954-Y1026 VanDerWaalsContact CG-CD2 3.45Å; F954-Y1026 AromaticContact CG-CE2 3.66Å; F954-Y1026 HydrophobicContact CG-CE2 3.66Å; F954-Y1026 HydrophobicContact CG-CG 4.18Å; F954-Y1026 HydrophobicContact CZ-CD2 4.29Å; F954-Y1026 HydrophobicContact CZ-CG 4.37Å; C1022-Y1026 WeakPolarHBondContact O-CB 3.5Å; C1022-Y1026 PolarHBondContact O-N 3.4Å; I1023-Y1026 PolarHBondContact O-N 3.03Å; K1024-Y1026 VanDerWaalsContact C-N 3.33Å; K1024-Y1026 PolarHBondContact O-N 3.29Å; Y1026-C1028 VanDerWaalsContact C-N 3.32Å; Y1026-C1028 PolarHBondContact O-N 3.16Å; Y1026-A1029 WeakPolarHBondContact O-CA 3.34Å; Y1026-A1029 WeakPolarHBondContact O-CB 3.3Å; Y1026-A1029 PolarHBondContact O-N 3.48Å; Y1026-I1030 HydrophobicContact CE1-CD1 4.39Å; Y1026-I1030 HydrophobicContact CE1-CG1 4.46Å; Y1026-I1030 PolarHBondContact O-N 2.88Å
1027	R	88	Confident	91.1	Very high	129 Å²	129	44.8 Å²	44.8	49%	0.487	23%	0.231	S	C	.	.	H	α-helix	trans	-58.1	-42.6	176.4	-75.6	177.4	172.4	166	-3.4	112.7	E948 I1023 K1024 A1029 I1030	E948-R1027 IonicContact OE2-NH2 3.6Å; I1023-R1027 WeakPolarHBondContact O-CG 3.08Å; I1023-R1027 PolarHBondContact O-N 3.01Å; K1024-R1027 PolarHBondContact O-N 3.42Å; R1027-A1029 PolarHBondContact O-N 2.94Å; R1027-I1030 PolarHBondContact O-N 3.04Å
1028	C	89.5	Confident	91.4	Very high	80 Å²	80	41.8 Å²	41.8	54%	0.541	22%	0.217	S	C	.	.	H	α-helix	trans	-69.7	-17.7	175.9	-64.7	0	0	0	0	113.4	K1024 K1025 Y1026	K1024-C1028 PolarHBondContact O-N 3.48Å; K1024-C1028 PolarHBondContact O-SG 3.42Å; K1024-C1028 VanDerWaalsContact O-SG 3.37Å; K1025-C1028 PolarHBondContact O-N 3.42Å; Y1026-C1028 VanDerWaalsContact C-N 3.32Å; Y1026-C1028 PolarHBondContact O-N 3.16Å
1029	A	91.4	Very high	91.5	Very high	3 Å²	3	43.2 Å²	43.2	3%	0.025	23%	0.229	C	C	.	.	H	α-helix	trans	-84.1	-13.8	179.3	0	0	0	0	0	113.4	I896 D897 Q900 V907 K1025 Y1026 R1027 A1031	I896-A1029 WeakPolarHBondContact CA-O 3.39Å; I896-A1029 HydrophobicContact CD1-CB 4.35Å; I896-A1029 HydrophobicContact CG2-CB 4.19Å; D897-A1029 PolarHBondContact N-O 3.44Å; Q900-A1029 HydrophobicContact CB-CB 3.78Å; V907-A1029 HydrophobicContact CG1-CB 3.5Å; V907-A1029 VanDerWaalsContact CG1-CB 3.5Å; K1025-A1029 WeakPolarHBondContact O-CB 2.81Å; K1025-A1029 PolarHBondContact O-N 3.41Å; Y1026-A1029 WeakPolarHBondContact O-CA 3.34Å; Y1026-A1029 WeakPolarHBondContact O-CB 3.3Å; Y1026-A1029 PolarHBondContact O-N 3.48Å; R1027-A1029 PolarHBondContact O-N 2.94Å; A1029-A1031 PolarHBondContact O-N 2.86Å
1030	I	90.7	Very high	91.7	Very high	67 Å²	67	44.3 Å²	44.3	34%	0.344	23%	0.234	S	C	.	.	B	Isolated β-bridge	trans	-64.8	130.8	176	-60.2	173	0	0	0	109.1	R895 Y1026 R1027 E1032	R895-I1030 HydrophobicContact CB-CG2 4.37Å; R895-I1030 WeakPolarHBondContact O-CA 3.44Å; Y1026-I1030 HydrophobicContact CE1-CD1 4.39Å; Y1026-I1030 HydrophobicContact CE1-CG1 4.46Å; Y1026-I1030 PolarHBondContact O-N 2.88Å; R1027-I1030 PolarHBondContact O-N 3.04Å; I1030-E1032 PolarHBondContact O-N 3.02Å
1031	A	92.4	Very high	91.9	Very high	5 Å²	5	40.4 Å²	40.4	4%	0.041	21%	0.213	C	C	.	.	P	Polyproline II helix	trans	-64.2	132.1	179.4	0	0	0	0	0	111.4	L873 F891 R895 D897 A1029	L873-A1031 HydrophobicContact CD2-CB 3.59Å; F891-A1031 HydrophobicContact CD1-CB 3.76Å; F891-A1031 HydrophobicContact CE1-CB 3.89Å; R895-A1031 WeakPolarHBondContact O-CB 3.21Å; R895-A1031 PolarHBondContact O-N 3.35Å; D897-A1031 HydrophobicContact CB-CB 4.13Å; A1029-A1031 PolarHBondContact O-N 2.86Å
1032	E	93	Very high	92.1	Very high	145 Å²	145	38.5 Å²	38.5	68%	0.678	20%	0.202	S	C	*	.	P	Polyproline II helix	trans	-75	133.1	-178.5	-64	-178	164	0	0	111.4	I1030 T1035	I1030-E1032 PolarHBondContact O-N 3.02Å; E1032-T1035 VanDerWaalsContact O-CB 3.3Å; E1032-T1035 WeakPolarHBondContact O-CB 3.44Å; E1032-T1035 PolarHBondContact O-N 3.26Å; E1032-T1035 PolarHBondContact O-OG1 3.31Å
1033	P	93.5	Very high	92.2	Very high	49 Å²	49	39.5 Å²	39.5	32%	0.318	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.2	146.4	169.5	-25	34.7	0	0	0	112.1	Y875 T1035	Y875-P1033 HydrophobicContact CD1-CB 3.72Å; Y875-P1033 HydrophobicContact CD1-CG 3.93Å; Y875-P1033 HydrophobicContact CD2-CB 4.46Å; Y875-P1033 HydrophobicContact CE1-CB 3.88Å; Y875-P1033 HydrophobicContact CE1-CG 4.27Å; Y875-P1033 HydrophobicContact CG-CB 4.02Å; P1033-T1035 VanDerWaalsContact C-N 3.3Å
1034	G	92.6	Very high	92.4	Very high	7 Å²	7	39.1 Å²	39.1	7%	0.072	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	88.7	-12.4	-173.6	0	0	0	0	0	113.9	C872 L873 A1036 G1361	C872-G1034 PolarHBondContact SG-O 3.09Å; C872-G1034 VanDerWaalsContact SG-O 3.32Å; L873-G1034 PolarHBondContact O-N 3.25Å; G1034-A1036 PolarHBondContact O-N 3.07Å; G1034-G1361 WeakPolarHBondContact O-CA 3.3Å; G1034-G1361 PolarHBondContact O-N 3.41Å
1035	T	93.7	Very high	92.5	Very high	38 Å²	38	32.3 Å²	32.3	23%	0.233	18%	0.177	C	C	.	.			trans	-60.4	128	178.1	-60.8	0	0	0	0	111.1	L873 E1032 P1033 V1037 I1040	L873-T1035 PolarHBondContact N-O 3.37Å; L873-T1035 VanDerWaalsContact N-O 3.13Å; E1032-T1035 VanDerWaalsContact O-CB 3.3Å; E1032-T1035 WeakPolarHBondContact O-CB 3.44Å; E1032-T1035 PolarHBondContact O-N 3.26Å; E1032-T1035 PolarHBondContact O-OG1 3.31Å; P1033-T1035 VanDerWaalsContact C-N 3.3Å; T1035-V1037 HydrophobicContact CG2-CG1 3.86Å; T1035-V1037 PolarHBondContact O-N 3.28Å; T1035-I1040 HydrophobicContact CG2-CD1 3.78Å
1036	A	94.4	Very high	92.3	Very high	26 Å²	26	30.9 Å²	30.9	22%	0.215	17%	0.171	C	C	.	.			trans	-77.4	66.5	176.9	0	0	0	0	0	111.5	G1034 G1038 A1039 I1040 L1360	G1034-A1036 PolarHBondContact O-N 3.07Å; A1036-G1038 VanDerWaalsContact C-N 3.29Å; A1036-G1038 PolarHBondContact O-N 3.25Å; A1036-A1039 HydrophobicContact CB-CB 4.36Å; A1036-A1039 PolarHBondContact O-N 2.93Å; A1036-I1040 WeakPolarHBondContact O-CG1 3.4Å; A1036-I1040 PolarHBondContact O-N 2.95Å; A1036-L1360 HydrophobicContact CB-CD1 3.92Å
1037	V	95	Very high	92	Very high	5 Å²	5	31.4 Å²	31.4	3%	0.03	17%	0.173	C	C	.	.	H	α-helix	trans	-59.6	-34.7	-170.7	-65.2	0	0	0	0	113.4	L871 L873 V879 F891 T1035 I1040 A1041 I1294	L871-V1037 PolarHBondContact O-N 2.92Å; L873-V1037 HydrophobicContact CB-CG1 4.22Å; V879-V1037 HydrophobicContact CG1-CG2 3.73Å; V879-V1037 HydrophobicContact CG2-CG2 4.33Å; F891-V1037 HydrophobicContact CD2-CB 4.33Å; F891-V1037 HydrophobicContact CD2-CG1 3.97Å; F891-V1037 HydrophobicContact CD2-CG2 4.45Å; F891-V1037 HydrophobicContact CE2-CB 3.68Å; F891-V1037 HydrophobicContact CE2-CG1 3.44Å; F891-V1037 VanDerWaalsContact CE2-CG1 3.44Å; F891-V1037 HydrophobicContact CE2-CG2 4.23Å; F891-V1037 HydrophobicContact CZ-CB 4.41Å; F891-V1037 HydrophobicContact CZ-CG1 3.9Å; T1035-V1037 HydrophobicContact CG2-CG1 3.86Å; T1035-V1037 PolarHBondContact O-N 3.28Å; V1037-I1040 PolarHBondContact O-N 3.13Å; V1037-A1041 WeakPolarHBondContact O-CB 3.5Å; V1037-A1041 PolarHBondContact O-N 3.1Å; V1037-I1294 HydrophobicContact CB-CD1 4.13Å; V1037-I1294 HydrophobicContact CG2-CD1 4.42Å
1038	G	94.3	Very high	91.7	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-70.9	-40	179	0	0	0	0	0	113.7	L868 L871 A1036 I1040 A1041 A1042	L868-G1038 WeakPolarHBondContact CB-O 3.39Å; L868-G1038 CarbonylContact O-C 3.53Å; L868-G1038 VanDerWaalsContact O-CA 3.31Å; L868-G1038 WeakPolarHBondContact O-CA 3.4Å; L871-G1038 PolarHBondContact O-N 3.44Å; L871-G1038 VanDerWaalsContact O-N 3.15Å; A1036-G1038 VanDerWaalsContact C-N 3.29Å; A1036-G1038 PolarHBondContact O-N 3.25Å; G1038-I1040 VanDerWaalsContact C-N 3.32Å; G1038-I1040 PolarHBondContact O-N 3.38Å; G1038-A1041 PolarHBondContact O-N 3.48Å; G1038-A1042 WeakPolarHBondContact O-CB 3.48Å; G1038-A1042 PolarHBondContact O-N 2.87Å
1039	A	94	Very high	91.2	Very high	31 Å²	31	21.5 Å²	21.5	26%	0.256	13%	0.125	S	C	.	.	H	α-helix	trans	-63.7	-40.6	175.4	0	0	0	0	0	111.2	A1036 T1043	A1036-A1039 HydrophobicContact CB-CB 4.36Å; A1036-A1039 PolarHBondContact O-N 2.93Å; A1039-T1043 WeakPolarHBondContact O-CG2 3.35Å; A1039-T1043 PolarHBondContact O-N 3.49Å; A1039-T1043 VanDerWaalsContact O-N 3.16Å; A1039-T1043 PolarHBondContact O-OG1 3.12Å
1040	I	94.6	Very high	90.2	Very high	25 Å²	25	23 Å²	23	13%	0.128	13%	0.134	C	C	.	.	H	α-helix	trans	-62.8	-52.2	175.7	-64	170.4	0	0	0	110.1	P523 T1035 A1036 V1037 G1038 A1042 T1043 S1044	P523-I1040 HydrophobicContact CB-CG2 3.67Å; P523-I1040 HydrophobicContact CG-CG2 4.19Å; T1035-I1040 HydrophobicContact CG2-CD1 3.78Å; A1036-I1040 WeakPolarHBondContact O-CG1 3.4Å; A1036-I1040 PolarHBondContact O-N 2.95Å; V1037-I1040 PolarHBondContact O-N 3.13Å; G1038-I1040 VanDerWaalsContact C-N 3.32Å; G1038-I1040 PolarHBondContact O-N 3.38Å; I1040-A1042 VanDerWaalsContact C-N 3.31Å; I1040-A1042 PolarHBondContact O-N 3.35Å; I1040-T1043 PolarHBondContact O-N 2.96Å; I1040-T1043 VanDerWaalsContact O-N 3.12Å; I1040-T1043 PolarHBondContact O-OG1 2.93Å; I1040-S1044 WeakPolarHBondContact O-CB 3.39Å; I1040-S1044 PolarHBondContact O-N 3.19Å; I1040-S1044 PolarHBondContact O-OG 3.5Å
1041	A	94.3	Very high	89.1	Confident	0 Å²	0	25.3 Å²	25.3	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-57.3	-43	179.1	0	0	0	0	0	112.5	V1037 G1038 T1043 S1044 I1045 H1291 I1294	V1037-A1041 WeakPolarHBondContact O-CB 3.5Å; V1037-A1041 PolarHBondContact O-N 3.1Å; G1038-A1041 PolarHBondContact O-N 3.48Å; A1041-T1043 VanDerWaalsContact C-N 3.34Å; A1041-T1043 PolarHBondContact O-N 3.33Å; A1041-S1044 PolarHBondContact O-N 2.86Å; A1041-I1045 WeakPolarHBondContact O-CD1 3.29Å; A1041-I1045 WeakPolarHBondContact O-CG1 3.43Å; A1041-I1045 PolarHBondContact O-N 2.89Å; A1041-H1291 WeakPolarHBondContact CA-ND1 3.39Å; A1041-H1291 HydrophobicContact CB-CB 4.03Å; A1041-I1294 HydrophobicContact CB-CB 4.39Å; A1041-I1294 HydrophobicContact CB-CD1 4.12Å; A1041-I1294 HydrophobicContact CB-CG2 4.39Å
1042	A	93.8	Very high	87.9	Confident	0 Å²	0	25.2 Å²	25.2	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-58.9	-43.5	176.9	0	0	0	0	0	112.4	L864 V865 L868 G1038 I1040 G1046	L864-A1042 HydrophobicContact CB-CB 4Å; V865-A1042 HydrophobicContact CB-CB 4.38Å; V865-A1042 HydrophobicContact CG2-CB 3.76Å; L868-A1042 HydrophobicContact CB-CB 4.27Å; L868-A1042 HydrophobicContact CD1-CB 3.84Å; G1038-A1042 WeakPolarHBondContact O-CB 3.48Å; G1038-A1042 PolarHBondContact O-N 2.87Å; I1040-A1042 VanDerWaalsContact C-N 3.31Å; I1040-A1042 PolarHBondContact O-N 3.35Å; A1042-G1046 PolarHBondContact O-N 3.25Å
1043	T	93	Very high	86.1	Confident	22 Å²	22	21.7 Å²	21.7	14%	0.135	13%	0.13	C	C	.	.	H	α-helix	trans	-72.9	-37.8	177.5	60.6	0	0	0	0	112.6	V865 A1039 I1040 A1041 I1045 G1046 E1047	V865-T1043 HydrophobicContact CG2-CG2 4.33Å; A1039-T1043 WeakPolarHBondContact O-CG2 3.35Å; A1039-T1043 PolarHBondContact O-N 3.49Å; A1039-T1043 VanDerWaalsContact O-N 3.16Å; A1039-T1043 PolarHBondContact O-OG1 3.12Å; I1040-T1043 PolarHBondContact O-N 2.96Å; I1040-T1043 VanDerWaalsContact O-N 3.12Å; I1040-T1043 PolarHBondContact O-OG1 2.93Å; A1041-T1043 VanDerWaalsContact C-N 3.34Å; A1041-T1043 PolarHBondContact O-N 3.33Å; T1043-I1045 VanDerWaalsContact C-N 3.27Å; T1043-I1045 PolarHBondContact O-N 3.09Å; T1043-G1046 PolarHBondContact O-N 3.18Å; T1043-E1047 VanDerWaalsContact O-CB 3.32Å; T1043-E1047 WeakPolarHBondContact O-CB 3.46Å; T1043-E1047 PolarHBondContact O-N 2.95Å
1044	S	92.6	Very high	84.1	Confident	5 Å²	5	23 Å²	23	4%	0.035	13%	0.134	C	C	.	.	H	α-helix	trans	-66.6	-25.9	178.5	-69.5	0	0	0	0	113	R524 I1040 A1041 P1048	R524-S1044 WeakPolarHBondContact CA-OG 3.27Å; I1040-S1044 WeakPolarHBondContact O-CB 3.39Å; I1040-S1044 PolarHBondContact O-N 3.19Å; I1040-S1044 PolarHBondContact O-OG 3.5Å; A1041-S1044 PolarHBondContact O-N 2.86Å; S1044-P1048 WeakPolarHBondContact O-CD 3.31Å; S1044-P1048 VanDerWaalsContact O-CG 3.24Å; S1044-P1048 WeakPolarHBondContact O-CG 3.32Å
1045	I	91.3	Very high	81.9	Confident	0 Å²	0	28.3 Å²	28.3	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-87.5	-37.5	173.4	-63.6	163.2	0	0	0	111.1	L864 A1041 T1043 S1049 M1280 L1287 L1292 L1295	L864-I1045 HydrophobicContact CD1-CB 4.45Å; L864-I1045 HydrophobicContact CD1-CG2 4.07Å; A1041-I1045 WeakPolarHBondContact O-CD1 3.29Å; A1041-I1045 WeakPolarHBondContact O-CG1 3.43Å; A1041-I1045 PolarHBondContact O-N 2.89Å; T1043-I1045 VanDerWaalsContact C-N 3.27Å; T1043-I1045 PolarHBondContact O-N 3.09Å; I1045-S1049 PolarHBondContact O-OG 3.13Å; I1045-M1280 HydrophobicContact CG2-CE 4.26Å; I1045-L1287 HydrophobicContact CG1-CD2 3.96Å; I1045-L1292 HydrophobicContact CD1-CD2 4.13Å; I1045-L1292 HydrophobicContact CG1-CD2 4.25Å; I1045-L1295 HydrophobicContact CD1-CB 3.99Å; I1045-L1295 HydrophobicContact CD1-CD2 3.77Å; I1045-L1295 HydrophobicContact CD1-CG 4.45Å
1046	G	87.8	Confident	79.6	Confident	0 Å²	0	27.7 Å²	27.7	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-70.9	-44.3	-178	0	0	0	0	0	114.3	A1042 T1043 S1049	A1042-G1046 PolarHBondContact O-N 3.25Å; T1043-G1046 PolarHBondContact O-N 3.18Å; G1046-S1049 VanDerWaalsContact O-CB 3.29Å; G1046-S1049 WeakPolarHBondContact O-CB 3.12Å; G1046-S1049 PolarHBondContact O-N 2.79Å
1047	E	82.9	Confident	77.1	Confident	22 Å²	22	30.8 Å²	30.8	10%	0.103	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59	-53.8	-176.4	176.2	-78.6	142.2	0	0	112.7	L459 H460 R524 T1043 S1049 T1050 Q1051	L459-E1047 HydrophobicContact CB-CG 4.31Å; H460-E1047 HydrophobicContact CB-CB 4.27Å; H460-E1047 HydrophobicContact CB-CG 4.1Å; R524-E1047 IonicContact NH1-OE2 3.18Å; R524-E1047 PolarHBondContact NH1-OE2 2.85Å; T1043-E1047 VanDerWaalsContact O-CB 3.32Å; T1043-E1047 WeakPolarHBondContact O-CB 3.46Å; T1043-E1047 PolarHBondContact O-N 2.95Å; E1047-S1049 PolarHBondContact O-N 2.62Å; E1047-S1049 VanDerWaalsContact O-N 3.12Å; E1047-T1050 WeakPolarHBondContact O-CB 3.4Å; E1047-T1050 PolarHBondContact O-N 2.77Å; E1047-T1050 PolarHBondContact O-OG1 2.84Å; E1047-Q1051 PolarHBondContact OE1-NE2 2.99Å
1048	P	80.7	Confident	74.7	Confident	1 Å²	1	33.6 Å²	33.6	1%	0.006	17%	0.173	C	C	.	.	G	3₁₀ helix	trans	-66.9	-21.3	-177.9	-15.4	28.5	0	0	0	112.6	S1044 T1050 Q1051 M1052 I1285	S1044-P1048 WeakPolarHBondContact O-CD 3.31Å; S1044-P1048 VanDerWaalsContact O-CG 3.24Å; S1044-P1048 WeakPolarHBondContact O-CG 3.32Å; P1048-T1050 PolarHBondContact O-N 2.86Å; P1048-T1050 VanDerWaalsContact O-N 3.16Å; P1048-Q1051 WeakPolarHBondContact O-CB 3.37Å; P1048-Q1051 PolarHBondContact O-N 2.92Å; P1048-M1052 PolarHBondContact O-N 2.94Å; P1048-I1285 HydrophobicContact CB-CB 4.44Å; P1048-I1285 HydrophobicContact CB-CD1 3.79Å; P1048-I1285 HydrophobicContact CB-CG1 4.35Å; P1048-I1285 HydrophobicContact CB-CG2 3.39Å; P1048-I1285 HydrophobicContact CG-CG2 3.9Å
1049	S	78.5	Confident	72.5	Confident	0 Å²	0	38 Å²	38	0%	0	19%	0.192	C	C	.	.	G	3₁₀ helix	trans	-62.5	-22.1	176	-59.1	0	0	0	0	112.8	T857 M860 I1045 G1046 E1047 Q1051 M1052 V1071	T857-S1049 WeakPolarHBondContact CG2-O 3.33Å; M860-S1049 VanDerWaalsContact CE-CB 3.42Å; M860-S1049 VanDerWaalsContact CE-OG 3.22Å; M860-S1049 WeakPolarHBondContact CE-OG 3.33Å; I1045-S1049 PolarHBondContact O-OG 3.13Å; G1046-S1049 VanDerWaalsContact O-CB 3.29Å; G1046-S1049 WeakPolarHBondContact O-CB 3.12Å; G1046-S1049 PolarHBondContact O-N 2.79Å; E1047-S1049 PolarHBondContact O-N 2.62Å; E1047-S1049 VanDerWaalsContact O-N 3.12Å; S1049-Q1051 VanDerWaalsContact C-N 3.33Å; S1049-M1052 VanDerWaalsContact CA-CE 3.46Å; S1049-V1071 WeakPolarHBondContact O-CG2 3.25Å
1050	T	71.2	Confident	70.2	Confident	35 Å²	35	38.5 Å²	38.5	22%	0.215	20%	0.197	C	C	.	.	G	3₁₀ helix	trans	-72.3	-27.8	172.3	67.6	0	0	0	0	112.4	L459 T857 E1047 P1048	L459-T1050 HydrophobicContact CD1-CG2 4.21Å; L459-T1050 HydrophobicContact CD2-CG2 4.01Å; T857-T1050 HydrophobicContact CG2-CG2 4.43Å; T857-T1050 WeakPolarHBondContact OG1-CG2 3.15Å; E1047-T1050 WeakPolarHBondContact O-CB 3.4Å; E1047-T1050 PolarHBondContact O-N 2.77Å; E1047-T1050 PolarHBondContact O-OG1 2.84Å; P1048-T1050 PolarHBondContact O-N 2.86Å; P1048-T1050 VanDerWaalsContact O-N 3.16Å
1051	Q	68.1	Low	68	Low	116 Å²	116	41 Å²	41	54%	0.542	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.7	-20.2	-176.7	-53.5	-172	9.2	0	0	113	E1047 P1048 S1049 T1053	E1047-Q1051 PolarHBondContact OE1-NE2 2.99Å; P1048-Q1051 WeakPolarHBondContact O-CB 3.37Å; P1048-Q1051 PolarHBondContact O-N 2.92Å; S1049-Q1051 VanDerWaalsContact C-N 3.33Å; Q1051-T1053 PolarHBondContact O-N 3.22Å
1052	M	67.9	Low	65.8	Low	3 Å²	3	41.7 Å²	41.7	2%	0.015	23%	0.233	C	C	.	.			trans	-68.1	118.9	179.6	-65.3	-171.4	-68.4	0	0	110.8	K853 P1048 S1049 V1071 I1074 M1280 H1283 I1285	K853-M1052 WeakPolarHBondContact CE-O 3.45Å; K853-M1052 PolarHBondContact NZ-O 3.16Å; P1048-M1052 PolarHBondContact O-N 2.94Å; S1049-M1052 VanDerWaalsContact CA-CE 3.46Å; M1052-V1071 HydrophobicContact CB-CG2 4.36Å; M1052-V1071 HydrophobicContact CE-CB 4.4Å; M1052-V1071 HydrophobicContact CE-CG2 3.66Å; M1052-I1074 HydrophobicContact CE-CD1 3.24Å; M1052-I1074 HydrophobicContact SD-CD1 3.84Å; M1052-M1280 HydrophobicContact CE-CE 4.33Å; M1052-M1280 HydrophobicContact CE-SD 4.17Å; M1052-M1280 HydrophobicContact SD-SD 3.76Å; M1052-H1283 HydrophobicContact CG-CB 4.11Å; M1052-I1285 HydrophobicContact CG-CD1 3.54Å; M1052-I1285 HydrophobicContact SD-CD1 4.45Å
1053	T	53.8	Low	63.7	Low	71 Å²	71	43 Å²	43	44%	0.436	24%	0.244	S	C	.	.			trans	-67.3	151.6	173.7	45.6	0	0	0	0	111.3	Q1051 K1055	Q1051-T1053 PolarHBondContact O-N 3.22Å; T1053-K1055 PolarHBondContact O-N 3.42Å
1054	L	51.1	Low	61.9	Low	75 Å²	75	42.7 Å²	42.7	39%	0.393	24%	0.243	S	C	.	.			trans	-74.5	49.1	177.1	-93.1	172.2	0	0	0	109.6	D849 T1056 P1072	D849-L1054 WeakPolarHBondContact OD1-CB 3.49Å; D849-L1054 WeakPolarHBondContact OD1-CD1 3.32Å; D849-L1054 VanDerWaalsContact OD1-CG 3.28Å; D849-L1054 WeakPolarHBondContact OD1-CG 3.42Å; L1054-T1056 HydrophobicContact CB-CG2 4.48Å; L1054-T1056 HydrophobicContact CD2-CG2 3.33Å; L1054-T1056 HydrophobicContact CG-CG2 4.49Å; L1054-T1056 PolarHBondContact O-N 2.73Å; L1054-P1072 HydrophobicContact CD2-CG 4.28Å
1055	K	47.7	Very low	60.4	Low	120 Å²	120	43 Å²	43	52%	0.522	24%	0.243	S	C	.	.			trans	-75	71.3	159.2	-70.1	-170.5	-179.9	-179.8	0	107.2	T1053 F1057 H1058	T1053-K1055 PolarHBondContact O-N 3.42Å; K1055-F1057 PolarHBondContact O-N 3.42Å; K1055-H1058 WeakPolarHBondContact CB-NE2 3.21Å; K1055-H1058 WeakPolarHBondContact CD-NE2 3.28Å
1056	T	44.8	Very low	59.2	Low	25 Å²	25	45.6 Å²	45.6	15%	0.153	26%	0.258	C	S	.	.			trans	-67.1	-14.4	-179.6	41.9	0	0	0	0	112.7	L1054 Q1069 P1072	L1054-T1056 HydrophobicContact CB-CG2 4.48Å; L1054-T1056 HydrophobicContact CD2-CG2 3.33Å; L1054-T1056 HydrophobicContact CG-CG2 4.49Å; L1054-T1056 PolarHBondContact O-N 2.73Å; T1056-Q1069 PolarHBondContact O-N 3.32Å; T1056-P1072 HydrophobicContact CG2-CG 4.18Å
1057	F	42.2	Very low	58.2	Low	90 Å²	90	47 Å²	47	40%	0.395	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	95.7	-177.3	-54.8	-63	0	0	0	109.5	K1055 N1066	K1055-F1057 PolarHBondContact O-N 3.42Å; F1057-N1066 HydrophobicContact CD1-CB 3.72Å; F1057-N1066 HydrophobicContact CE1-CB 4.26Å
1058	H	44.8	Very low	57.7	Low	65 Å²	65	46.8 Å²	46.8	30%	0.301	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	124.9	159.8	-86.2	-78.1	0	0	0	107.7	K1055 A1060 Q1069	K1055-H1058 WeakPolarHBondContact CB-NE2 3.21Å; K1055-H1058 WeakPolarHBondContact CD-NE2 3.28Å; H1058-A1060 PolarHBondContact O-N 2.91Å; H1058-Q1069 HydrophobicContact CB-CG 4.4Å; H1058-Q1069 PolarHBondContact CD2-OE1 3.32Å
1059	F	48.7	Very low	57.4	Low	91 Å²	91	48.2 Å²	48.2	40%	0.399	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68	120.4	166.6	-61.9	-70.6	0	0	0	107.1	G1061 V1062 A1063 N1066	F1059-G1061 PolarHBondContact O-N 2.86Å; F1059-V1062 WeakPolarHBondContact CB-O 3.45Å; F1059-A1063 WeakPolarHBondContact CD1-O 3.33Å; F1059-A1063 WeakPolarHBondContact CE1-O 3.4Å; F1059-N1066 WeakPolarHBondContact CE1-OD1 3.42Å
1060	A	45.2	Very low	57.4	Low	43 Å²	43	48.3 Å²	48.3	36%	0.355	27%	0.272	S	S	.	.	S	Bend	trans	-70.7	61.2	-180	0	0	0	0	0	112	H1058 V1062 I1067	H1058-A1060 PolarHBondContact O-N 2.91Å; A1060-V1062 PolarHBondContact O-N 2.93Å; A1060-I1067 HydrophobicContact CB-CD1 3.31Å
1061	G	47.3	Very low	58	Low	78 Å²	78	47.1 Å²	47.1	80%	0.804	27%	0.265	S	S	*	.	S	Bend	trans	71.9	-25.7	-169.5	0	0	0	0	0	113.7	F1059	F1059-G1061 PolarHBondContact O-N 2.86Å
1062	V	48.8	Very low	58.8	Low	14 Å²	14	42.9 Å²	42.9	9%	0.085	25%	0.248	C	C	.	.	S	Bend	trans	-101.1	113.7	178.9	-163.9	0	0	0	0	109.9	F1059 A1060 S1064 M1065 N1219 L1231	F1059-V1062 WeakPolarHBondContact CB-O 3.45Å; A1060-V1062 PolarHBondContact O-N 2.93Å; V1062-S1064 PolarHBondContact O-N 2.92Å; V1062-M1065 PolarHBondContact O-N 2.75Å; V1062-N1219 HydrophobicContact CG2-CB 3.75Å; V1062-N1219 WeakPolarHBondContact CG2-OD1 3.4Å; V1062-L1231 HydrophobicContact CG2-CD1 4.18Å
1063	A	49.5	Very low	59.8	Low	28 Å²	28	42.9 Å²	42.9	23%	0.231	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.1	5.6	-174.3	0	0	0	0	0	116.8	C731 F1059	C731-A1063 PolarHBondContact SG-O 3.41Å; F1059-A1063 WeakPolarHBondContact CD1-O 3.33Å; F1059-A1063 WeakPolarHBondContact CE1-O 3.4Å
1064	S	55.5	Low	61.4	Low	15 Å²	15	39.5 Å²	39.5	11%	0.105	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-118.4	-25.9	-173.7	61.2	0	0	0	0	116	P729 G730 V1062	P729-S1064 WeakPolarHBondContact O-CB 3.48Å; P729-S1064 PolarHBondContact O-OG 3.43Å; G730-S1064 VanDerWaalsContact C-CB 3.47Å; V1062-S1064 PolarHBondContact O-N 2.92Å
1065	M	61.5	Low	63.3	Low	10 Å²	10	40.8 Å²	40.8	5%	0.049	23%	0.226	C	C	.	.			trans	-98.6	103.9	-178.6	-80	-157.5	156.8	0	0	111.5	V1062 I1067 R1215 T1217 L1231 E1233	V1062-M1065 PolarHBondContact O-N 2.75Å; M1065-I1067 PolarHBondContact O-N 3.44Å; M1065-R1215 HydrophobicContact CE-CG 4.26Å; M1065-T1217 HydrophobicContact CE-CG2 4.45Å; M1065-L1231 HydrophobicContact SD-CB 3.88Å; M1065-E1233 HydrophobicContact CE-CB 3.89Å
1066	N	65.3	Low	65.3	Low	56 Å²	56	36 Å²	36	30%	0.299	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	108.7	172.3	-72	-21.3	0	0	0	109.1	F1057 F1059 T1086	F1057-N1066 HydrophobicContact CD1-CB 3.72Å; F1057-N1066 HydrophobicContact CE1-CB 4.26Å; F1059-N1066 WeakPolarHBondContact CE1-OD1 3.42Å; N1066-T1086 VanDerWaalsContact O-CG2 3.24Å; N1066-T1086 WeakPolarHBondContact O-CG2 3.39Å
1067	I	67.5	Low	67.7	Low	29 Å²	29	35.1 Å²	35.1	15%	0.149	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	134.3	172.5	-68.8	153.2	0	0	0	108.9	A1060 M1065 Q1069 V1088	A1060-I1067 HydrophobicContact CB-CD1 3.31Å; M1065-I1067 PolarHBondContact O-N 3.44Å; I1067-Q1069 HydrophobicContact CG2-CG 4.3Å; I1067-Q1069 PolarHBondContact O-N 3.48Å; I1067-V1088 HydrophobicContact CG1-CG2 4.36Å
1068	T	72.4	Confident	70	Confident	17 Å²	17	30.9 Å²	30.9	10%	0.104	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.5	118.6	170.9	49.9	0	0	0	0	109.8	R1073 E1076 T1086	T1068-R1073 WeakPolarHBondContact O-CB 3.5Å; T1068-R1073 WeakPolarHBondContact O-CD 3.44Å; T1068-R1073 WeakPolarHBondContact O-CG 3.26Å; T1068-E1076 PolarHBondContact OG1-OE2 2.69Å; T1068-T1086 HydrophobicContact CG2-CG2 4.25Å; T1068-T1086 PolarHBondContact N-OG1 2.98Å; T1068-T1086 PolarHBondContact OG1-OG1 2.84Å
1069	Q	74.2	Confident	72.3	Confident	32 Å²	32	29.5 Å²	29.5	15%	0.15	18%	0.176	C	C	.	.			trans	-121.9	172.3	174.9	-68.5	-161.1	-0.6	0	0	112.2	T1056 H1058 I1067 S1282	T1056-Q1069 PolarHBondContact O-N 3.32Å; H1058-Q1069 HydrophobicContact CB-CG 4.4Å; H1058-Q1069 PolarHBondContact CD2-OE1 3.32Å; I1067-Q1069 HydrophobicContact CG2-CG 4.3Å; I1067-Q1069 PolarHBondContact O-N 3.48Å; Q1069-S1282 PolarHBondContact OE1-OG 2.93Å
1070	G	79.2	Confident	74.4	Confident	2 Å²	2	26.3 Å²	26.3	2%	0.021	17%	0.167	C	C	.	.	S	Bend	trans	72.8	-148.8	179	0	0	0	0	0	113.8	R1073 I1074	G1070-R1073 PolarHBondContact O-N 2.86Å; G1070-I1074 PolarHBondContact O-N 3.38Å
1071	V	82.3	Confident	76.6	Confident	10 Å²	10	26.9 Å²	26.9	6%	0.061	17%	0.166	C	C	.	.	H	α-helix	trans	-57.7	-43.6	-175.3	-176	0	0	0	0	113.1	T857 S1049 M1052 R1073 I1074 R1075	T857-V1071 HydrophobicContact CG2-CG1 4.12Å; T857-V1071 HydrophobicContact CG2-CG2 4.04Å; S1049-V1071 WeakPolarHBondContact O-CG2 3.25Å; M1052-V1071 HydrophobicContact CB-CG2 4.36Å; M1052-V1071 HydrophobicContact CE-CB 4.4Å; M1052-V1071 HydrophobicContact CE-CG2 3.66Å; V1071-R1073 PolarHBondContact O-N 2.95Å; V1071-I1074 PolarHBondContact O-N 2.86Å; V1071-R1075 WeakPolarHBondContact O-CB 3.29Å; V1071-R1075 PolarHBondContact O-N 3.25Å
1072	P	85.1	Confident	78.4	Confident	27 Å²	27	24.6 Å²	24.6	18%	0.175	14%	0.143	C	C	.	.	H	α-helix	trans	-57.4	-38.1	178.5	-27.2	37	0	0	0	113	L1054 T1056 R1075 E1076	L1054-P1072 HydrophobicContact CD2-CG 4.28Å; T1056-P1072 HydrophobicContact CG2-CG 4.18Å; P1072-R1075 WeakPolarHBondContact O-CB 3.37Å; P1072-R1075 PolarHBondContact O-N 3.27Å; P1072-E1076 WeakPolarHBondContact O-CG 3.14Å; P1072-E1076 PolarHBondContact O-N 3.47Å
1073	R	88.4	Confident	80.3	Confident	3 Å²	3	30.6 Å²	30.6	1%	0.011	17%	0.174	C	C	.	.	H	α-helix	trans	-69.1	-47.5	179.8	-178.1	58.6	-177.2	158.5	2.3	112.2	T1068 G1070 V1071 R1075 E1076 I1077 N1254 E1275 T1279	T1068-R1073 WeakPolarHBondContact O-CB 3.5Å; T1068-R1073 WeakPolarHBondContact O-CD 3.44Å; T1068-R1073 WeakPolarHBondContact O-CG 3.26Å; G1070-R1073 PolarHBondContact O-N 2.86Å; V1071-R1073 PolarHBondContact O-N 2.95Å; R1073-R1075 PolarHBondContact O-N 2.73Å; R1073-E1076 IonicContact NH1-OE2 3.99Å; R1073-E1076 PolarHBondContact NH1-OE2 2.99Å; R1073-E1076 WeakPolarHBondContact O-CB 3.45Å; R1073-E1076 PolarHBondContact O-N 3.13Å; R1073-E1076 VanDerWaalsContact O-N 3.11Å; R1073-I1077 HydrophobicContact CG-CD1 4.21Å; R1073-I1077 WeakPolarHBondContact O-CG1 3.47Å; R1073-I1077 PolarHBondContact O-N 3.46Å; R1073-I1077 VanDerWaalsContact O-N 3.1Å; R1073-N1254 PolarHBondContact NH2-O 2.93Å; R1073-E1275 IonicContact CZ-OE2 2.69Å; R1073-E1275 IonicContact NE-OE2 3.19Å; R1073-E1275 IonicContact NH2-OE2 2.94Å; R1073-E1275 PolarHBondContact NH2-OE2 3.31Å; R1073-T1279 HydrophobicContact CB-CG2 4.2Å; R1073-T1279 HydrophobicContact CG-CG2 4.26Å
1074	I	89.1	Confident	82.3	Confident	0 Å²	0	30 Å²	30	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-59.2	-38.6	174.5	-73.1	151.7	0	0	0	110.5	M860 M1052 G1070 V1071 I1077 V1078 I1276 T1279 M1280	M860-I1074 HydrophobicContact CE-CG2 4.2Å; M860-I1074 HydrophobicContact SD-CG2 3.94Å; M1052-I1074 HydrophobicContact CE-CD1 3.24Å; M1052-I1074 HydrophobicContact SD-CD1 3.84Å; G1070-I1074 PolarHBondContact O-N 3.38Å; V1071-I1074 PolarHBondContact O-N 2.86Å; I1074-I1077 PolarHBondContact O-N 2.96Å; I1074-V1078 HydrophobicContact CG2-CG2 4.02Å; I1074-V1078 VanDerWaalsContact O-CB 3.29Å; I1074-V1078 WeakPolarHBondContact O-CB 3.44Å; I1074-V1078 WeakPolarHBondContact O-CG2 3.13Å; I1074-V1078 PolarHBondContact O-N 3.37Å; I1074-I1276 HydrophobicContact CG1-CG2 4.5Å; I1074-T1279 HydrophobicContact CD1-CG2 3.93Å; I1074-T1279 HydrophobicContact CG1-CG2 4.03Å; I1074-M1280 HydrophobicContact CD1-CE 3.35Å; I1074-M1280 HydrophobicContact CD1-CG 4.44Å; I1074-M1280 HydrophobicContact CD1-SD 3.83Å; I1074-M1280 HydrophobicContact CG1-CE 4.34Å
1075	R	89.1	Confident	83.7	Confident	101 Å²	101	33.4 Å²	33.4	38%	0.381	19%	0.191	S	C	.	.	H	α-helix	trans	-63.1	-42	175.4	-176.1	-176.2	71.9	-174.5	1.6	112.5	V1071 P1072 R1073 N1079	V1071-R1075 WeakPolarHBondContact O-CB 3.29Å; V1071-R1075 PolarHBondContact O-N 3.25Å; P1072-R1075 WeakPolarHBondContact O-CB 3.37Å; P1072-R1075 PolarHBondContact O-N 3.27Å; R1073-R1075 PolarHBondContact O-N 2.73Å; R1075-N1079 WeakPolarHBondContact CG-ND2 3.2Å; R1075-N1079 WeakPolarHBondContact O-CB 3.06Å; R1075-N1079 PolarHBondContact O-N 3.33Å; R1075-N1079 PolarHBondContact O-ND2 3.25Å
1076	E	91.5	Very high	84.9	Confident	21 Å²	21	34 Å²	34	10%	0.098	20%	0.195	C	C	.	.	H	α-helix	trans	-59.8	-46.4	176.1	-74.7	178.7	158.9	0	0	111.5	T1068 P1072 R1073 A1080 V1081 I1084 S1085	T1068-E1076 PolarHBondContact OG1-OE2 2.69Å; P1072-E1076 WeakPolarHBondContact O-CG 3.14Å; P1072-E1076 PolarHBondContact O-N 3.47Å; R1073-E1076 IonicContact NH1-OE2 3.99Å; R1073-E1076 PolarHBondContact NH1-OE2 2.99Å; R1073-E1076 WeakPolarHBondContact O-CB 3.45Å; R1073-E1076 PolarHBondContact O-N 3.13Å; R1073-E1076 VanDerWaalsContact O-N 3.11Å; E1076-A1080 PolarHBondContact O-N 2.79Å; E1076-V1081 PolarHBondContact O-N 2.78Å; E1076-I1084 HydrophobicContact CB-CG2 4.43Å; E1076-S1085 PolarHBondContact OE1-N 2.7Å; E1076-S1085 PolarHBondContact OE1-OG 2.93Å
1077	I	93.3	Very high	86.1	Confident	6 Å²	6	31.9 Å²	31.9	3%	0.031	18%	0.184	C	C	.	.	H	α-helix	trans	-65.5	-55.4	-179.6	-60.9	164.6	0	0	0	110	R1073 I1074 N1079 A1080 I1272 E1275 I1276 M1299	R1073-I1077 HydrophobicContact CG-CD1 4.21Å; R1073-I1077 WeakPolarHBondContact O-CG1 3.47Å; R1073-I1077 PolarHBondContact O-N 3.46Å; R1073-I1077 VanDerWaalsContact O-N 3.1Å; I1074-I1077 PolarHBondContact O-N 2.96Å; I1077-N1079 VanDerWaalsContact C-N 3.27Å; I1077-N1079 PolarHBondContact O-N 3.31Å; I1077-A1080 PolarHBondContact O-N 2.79Å; I1077-I1272 HydrophobicContact CG2-CG1 4.35Å; I1077-I1272 HydrophobicContact CG2-CG2 3.97Å; I1077-E1275 HydrophobicContact CD1-CB 3.71Å; I1077-I1276 HydrophobicContact CB-CG1 4.48Å; I1077-I1276 HydrophobicContact CD1-CG1 3.93Å; I1077-I1276 HydrophobicContact CG2-CD1 3.95Å; I1077-I1276 HydrophobicContact CG2-CG1 3.99Å; I1077-M1299 VanDerWaalsContact O-CE 3.27Å; I1077-M1299 WeakPolarHBondContact O-CE 3.45Å
1078	V	91.9	Very high	87.2	Confident	0 Å²	0	31.1 Å²	31.1	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-60.7	-35	-178	170.2	0	0	0	0	112.1	L864 I1074 A1080 L1295 G1307 M1308	L864-V1078 HydrophobicContact CD2-CG1 3.65Å; L864-V1078 HydrophobicContact CD2-CG2 4.31Å; L864-V1078 HydrophobicContact CG-CG1 4.43Å; I1074-V1078 HydrophobicContact CG2-CG2 4.02Å; I1074-V1078 VanDerWaalsContact O-CB 3.29Å; I1074-V1078 WeakPolarHBondContact O-CB 3.44Å; I1074-V1078 WeakPolarHBondContact O-CG2 3.13Å; I1074-V1078 PolarHBondContact O-N 3.37Å; V1078-A1080 VanDerWaalsContact C-N 3.26Å; V1078-A1080 PolarHBondContact O-N 3.48Å; V1078-L1295 HydrophobicContact CG2-CD2 4.25Å; V1078-G1307 CarbonylContact O-C 3.51Å; V1078-G1307 WeakPolarHBondContact O-CA 3.46Å; V1078-M1308 HydrophobicContact CG1-CB 3.72Å; V1078-M1308 HydrophobicContact CG1-CG 4.11Å; V1078-M1308 PolarHBondContact O-N 2.83Å
1079	N	91.8	Very high	88.2	Confident	36 Å²	36	30.3 Å²	30.3	19%	0.193	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-9.7	176.8	-70.5	-13.8	0	0	0	113.5	R863 R1075 I1077 V1081 T1309	R863-N1079 VanDerWaalsContact CZ-OD1 3.26Å; R863-N1079 PolarHBondContact NH1-OD1 3Å; R863-N1079 PolarHBondContact NH2-OD1 2.86Å; R1075-N1079 WeakPolarHBondContact CG-ND2 3.2Å; R1075-N1079 WeakPolarHBondContact O-CB 3.06Å; R1075-N1079 PolarHBondContact O-N 3.33Å; R1075-N1079 PolarHBondContact O-ND2 3.25Å; I1077-N1079 VanDerWaalsContact C-N 3.27Å; I1077-N1079 PolarHBondContact O-N 3.31Å; N1079-V1081 HydrophobicContact CB-CG2 3.79Å; N1079-T1309 HydrophobicContact CB-CG2 3.9Å; N1079-T1309 WeakPolarHBondContact OD1-CG2 3.35Å
1080	A	92.6	Very high	89	Confident	24 Å²	24	31 Å²	31	20%	0.198	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	50.4	57.2	-171.3	0	0	0	0	0	111.8	E1076 I1077 V1078 I1257 M1299 I1305	E1076-A1080 PolarHBondContact O-N 2.79Å; I1077-A1080 PolarHBondContact O-N 2.79Å; V1078-A1080 VanDerWaalsContact C-N 3.26Å; V1078-A1080 PolarHBondContact O-N 3.48Å; A1080-I1257 HydrophobicContact CB-CD1 4.3Å; A1080-I1257 VanDerWaalsContact O-CD1 3.32Å; A1080-I1257 WeakPolarHBondContact O-CD1 3.13Å; A1080-M1299 HydrophobicContact CB-CE 4.42Å; A1080-I1305 HydrophobicContact CB-CG2 3.77Å
1081	V	91.6	Very high	89.7	Confident	55 Å²	55	30.9 Å²	30.9	33%	0.333	18%	0.181	S	C	.	.			trans	-76.2	123.9	179.4	-176.4	0	0	0	0	110.1	E1076 N1079 N1083	E1076-V1081 PolarHBondContact O-N 2.78Å; N1079-V1081 HydrophobicContact CB-CG2 3.79Å; V1081-N1083 WeakPolarHBondContact CG1-O 3.39Å
1082	G	86.6	Confident	90.2	Very high	31 Å²	31	30.8 Å²	30.8	32%	0.32	18%	0.182	S	C	.	.	S	Bend	trans	-65.1	-43.7	-179.8	0	0	0	0	0	114.4	N1255	G1082-N1255 PolarHBondContact O-ND2 3.47Å
1083	N	88.9	Confident	90.6	Very high	140 Å²	140	29.6 Å²	29.6	75%	0.749	17%	0.174	S	C	*	.	S	Bend	trans	-105.4	95.8	178.2	-69.1	-14.6	0	0	0	109.8	V1081	V1081-N1083 WeakPolarHBondContact CG1-O 3.39Å
1084	I	90.1	Very high	90.7	Very high	14 Å²	14	32.9 Å²	32.9	7%	0.072	20%	0.197	C	C	.	.			trans	-80.1	155.7	176.5	60.9	174.5	0	0	0	111.5	E1076 P1087 N1254 N1255	E1076-I1084 HydrophobicContact CB-CG2 4.43Å; I1084-P1087 HydrophobicContact CD1-CB 3.84Å; I1084-P1087 HydrophobicContact CG1-CB 3.73Å; I1084-P1087 HydrophobicContact CG1-CG 4.44Å; I1084-N1254 WeakPolarHBondContact CD1-OD1 3.44Å; I1084-N1255 HydrophobicContact CD1-CB 3.85Å
1085	S	85.7	Confident	90.7	Very high	87 Å²	87	38 Å²	38	61%	0.608	22%	0.221	S	C	*	.	S	Bend	trans	-65.9	-39.5	-176.3	-69.3	0	0	0	0	113.7	E1076	E1076-S1085 PolarHBondContact OE1-N 2.7Å; E1076-S1085 PolarHBondContact OE1-OG 2.93Å
1086	T	86.5	Confident	90.6	Very high	24 Å²	24	35.3 Å²	35.3	15%	0.147	21%	0.213	C	C	.	.	S	Bend	trans	-132.2	78.5	-176.2	56.7	0	0	0	0	110.2	N1066 T1068 V1088 N1254	N1066-T1086 VanDerWaalsContact O-CG2 3.24Å; N1066-T1086 WeakPolarHBondContact O-CG2 3.39Å; T1068-T1086 HydrophobicContact CG2-CG2 4.25Å; T1068-T1086 PolarHBondContact N-OG1 2.98Å; T1068-T1086 PolarHBondContact OG1-OG1 2.84Å; T1086-V1088 PolarHBondContact O-N 3.4Å; T1086-N1254 PolarHBondContact O-ND2 3.24Å
1087	P	90.7	Very high	90.3	Very high	11 Å²	11	42.4 Å²	42.4	7%	0.071	24%	0.243	C	C	.	.			trans	-77	116	178.1	32.2	-33	0	0	0	110.2	I1084 E1233 S1234 N1235 N1254	I1084-P1087 HydrophobicContact CD1-CB 3.84Å; I1084-P1087 HydrophobicContact CG1-CB 3.73Å; I1084-P1087 HydrophobicContact CG1-CG 4.44Å; P1087-E1233 CarbonylContact O-C 3.56Å; P1087-E1233 VanDerWaalsContact O-CA 3.25Å; P1087-E1233 WeakPolarHBondContact O-CA 3.36Å; P1087-S1234 PolarHBondContact O-N 3.34Å; P1087-N1235 WeakPolarHBondContact CB-OD1 3.35Å; P1087-N1254 WeakPolarHBondContact CA-OD1 3.16Å
1088	V	90.1	Very high	90	Very high	12 Å²	12	44 Å²	44	7%	0.073	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	131.4	-177.1	-178.5	0	0	0	0	108.7	I1067 T1086 L1231 A1232 N1254	I1067-V1088 HydrophobicContact CG1-CG2 4.36Å; T1086-V1088 PolarHBondContact O-N 3.4Å; V1088-L1231 HydrophobicContact CG1-CB 4.24Å; V1088-L1231 HydrophobicContact CG1-CD2 4.26Å; V1088-A1232 WeakPolarHBondContact CA-O 3.27Å; V1088-N1254 VanDerWaalsContact N-CG 3.34Å; V1088-N1254 PolarHBondContact N-ND2 3.12Å; V1088-N1254 PolarHBondContact N-OD1 2.8Å; V1088-N1254 PolarHBondContact O-N 2.97Å; V1088-N1254 VanDerWaalsContact O-N 3.1Å; V1088-N1254 PolarHBondContact O-OD1 3.1Å
1089	I	92.8	Very high	89.7	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	118.9	171.5	-56.1	169.3	0	0	0	106.9	V1091 A1232 F1237 V1240 T1251 V1252	I1089-V1091 HydrophobicContact CG2-CG2 4.06Å; I1089-V1091 PolarHBondContact O-N 3.36Å; I1089-A1232 HydrophobicContact CB-CB 4.47Å; I1089-A1232 PolarHBondContact N-O 3.3Å; I1089-A1232 PolarHBondContact O-N 3.41Å; I1089-F1237 HydrophobicContact CD1-CD2 4.27Å; I1089-F1237 HydrophobicContact CG1-CD2 4.48Å; I1089-F1237 HydrophobicContact CG2-CD2 4.05Å; I1089-F1237 HydrophobicContact CG2-CE2 4.14Å; I1089-V1240 HydrophobicContact CD1-CB 4.26Å; I1089-V1240 HydrophobicContact CD1-CG2 3.83Å; I1089-V1240 HydrophobicContact CG2-CG1 4.04Å; I1089-T1251 HydrophobicContact CG2-CG2 3.67Å; I1089-V1252 CarbonylContact C-O 3.6Å; I1089-V1252 WeakPolarHBondContact CA-O 3.33Å; I1089-V1252 WeakPolarHBondContact CG2-O 3.42Å
1090	T	92.2	Very high	89.5	Confident	47 Å²	47	53.9 Å²	53.9	29%	0.288	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	104.7	172.9	-53.7	0	0	0	0	107.9	L1230 L1231 T1251 V1252	T1090-L1230 CarbonylContact C-O 3.38Å; T1090-L1231 HydrophobicContact CG2-CD2 3.94Å; T1090-T1251 WeakPolarHBondContact O-CA 3.5Å; T1090-T1251 WeakPolarHBondContact O-CG2 3.46Å; T1090-V1252 PolarHBondContact N-O 2.9Å; T1090-V1252 PolarHBondContact O-N 3.48Å
1091	V	93.2	Very high	89.4	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	115.8	-175.4	-175.5	0	0	0	0	109.5	I1089 L1109 N1229 L1230 A1232 V1240 V1246 T1251	I1089-V1091 HydrophobicContact CG2-CG2 4.06Å; I1089-V1091 PolarHBondContact O-N 3.36Å; V1091-L1109 HydrophobicContact CG1-CD1 4.24Å; V1091-L1109 HydrophobicContact CG2-CD1 4.22Å; V1091-N1229 WeakPolarHBondContact O-CB 3.44Å; V1091-L1230 HydrophobicContact CB-CB 3.99Å; V1091-L1230 HydrophobicContact CG2-CB 4.49Å; V1091-L1230 PolarHBondContact N-O 3.1Å; V1091-L1230 PolarHBondContact O-N 3.13Å; V1091-A1232 HydrophobicContact CG2-CB 4.24Å; V1091-V1240 HydrophobicContact CG2-CG1 3.8Å; V1091-V1246 HydrophobicContact CG1-CB 4.03Å; V1091-V1246 HydrophobicContact CG1-CG1 3.57Å; V1091-V1246 HydrophobicContact CG1-CG2 3.49Å; V1091-V1246 VanDerWaalsContact CG1-CG2 3.49Å; V1091-T1251 HydrophobicContact CG2-CG2 4.43Å
1092	A	92.8	Very high	89.3	Confident	8 Å²	8	51.8 Å²	51.8	7%	0.066	28%	0.282	C	S	.	.			trans	-79	135.3	169.2	0	0	0	0	0	109.1	D1247 R1250 T1251	A1092-D1247 HydrophobicContact CB-CB 4.15Å; A1092-D1247 PolarHBondContact O-N 3.41Å; A1092-R1250 HydrophobicContact CB-CB 3.52Å; A1092-T1251 PolarHBondContact N-OG1 2.83Å; A1092-T1251 VanDerWaalsContact N-OG1 3.15Å
1093	L	93	Very high	89.4	Confident	2 Å²	2	56.6 Å²	56.6	1%	0.01	29%	0.29	C	S	.	.	B	Isolated β-bridge	trans	-94.2	145.1	179	-64.5	177.1	0	0	0	110	Q1095 E1096 A1102 V1105 L1230	L1093-Q1095 PolarHBondContact O-N 2.79Å; L1093-E1096 WeakPolarHBondContact O-CG 3.49Å; L1093-A1102 HydrophobicContact CD1-CB 3.53Å; L1093-V1105 HydrophobicContact CD2-CB 3.88Å; L1093-V1105 HydrophobicContact CD2-CG1 3.76Å; L1093-V1105 HydrophobicContact CD2-CG2 4.11Å; L1093-L1230 HydrophobicContact CD1-CD2 4.46Å; L1093-L1230 HydrophobicContact CD1-CG 4.3Å; L1093-L1230 HydrophobicContact CD2-CD1 3.77Å; L1093-L1230 HydrophobicContact CD2-CG 3.94Å; L1093-L1230 HydrophobicContact CG-CG 4.31Å
1094	S	91	Very high	89.5	Confident	72 Å²	72	51.7 Å²	51.7	50%	0.503	26%	0.264	S	S	.	.	S	Bend	trans	-65	-27.2	171.5	59.7	0	0	0	0	112.6	F1101 G1245	S1094-F1101 VanDerWaalsContact OG-CE1 3.27Å; S1094-F1101 WeakPolarHBondContact OG-CE1 3.44Å; S1094-F1101 WeakPolarHBondContact OG-CZ 3.42Å; S1094-G1245 PolarHBondContact N-O 3.44Å; S1094-G1245 PolarHBondContact OG-O 3.21Å
1095	Q	90.1	Very high	89.6	Confident	106 Å²	106	51 Å²	51	50%	0.495	26%	0.261	S	S	.	.	S	Bend	trans	-125.3	90.7	173.9	-61.6	-178.6	2.9	0	0	110.2	L1093 K1097 F1101	L1093-Q1095 PolarHBondContact O-N 2.79Å; Q1095-K1097 VanDerWaalsContact C-N 3.35Å; Q1095-K1097 PolarHBondContact O-N 3.5Å; Q1095-F1101 HydrophobicContact CB-CB 4.42Å; Q1095-F1101 HydrophobicContact CB-CD1 3.71Å; Q1095-F1101 HydrophobicContact CB-CE1 4.08Å; Q1095-F1101 HydrophobicContact CB-CG 4.01Å; Q1095-F1101 HydrophobicContact CG-CD1 4.38Å; Q1095-F1101 HydrophobicContact CG-CE1 4.4Å
1096	E	85.9	Confident	89.8	Confident	45 Å²	45	50 Å²	50	21%	0.21	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-24.4	-171.9	-59	-177.1	155.1	0	0	114.3	L1093 T1227 M1228 R1250	L1093-E1096 WeakPolarHBondContact O-CG 3.49Å; E1096-T1227 HydrophobicContact CB-CG2 4.17Å; E1096-T1227 WeakPolarHBondContact OE2-CG2 3.41Å; E1096-M1228 WeakPolarHBondContact O-CB 3.41Å; E1096-M1228 PolarHBondContact O-N 3.48Å; E1096-R1250 IonicContact OE1-CZ 3.96Å; E1096-R1250 IonicContact OE1-NH1 3.02Å; E1096-R1250 PolarHBondContact OE1-NH1 2.86Å; E1096-R1250 IonicContact OE1-NH2 3.82Å; E1096-R1250 PolarHBondContact OE1-NH2 3.31Å; E1096-R1250 IonicContact OE2-NH2 2.99Å
1097	K	86.2	Confident	90	Very high	170 Å²	170	49.3 Å²	49.3	74%	0.739	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.4	-15.5	-175.4	-62.3	-173.4	178.1	-174.6	0	113.7	Q1095	Q1095-K1097 VanDerWaalsContact C-N 3.35Å; Q1095-K1097 PolarHBondContact O-N 3.5Å
1098	S	87.4	Confident	90	Very high	40 Å²	40	50.4 Å²	50.4	28%	0.28	25%	0.246	S	C	.	.			trans	-94.5	112.7	-173.5	177.5	0	0	0	0	111.5	F1101 A1102 M1228	S1098-F1101 PolarHBondContact O-N 3.04Å; S1098-F1101 WeakPolarHBondContact OG-CB 3.34Å; S1098-F1101 PolarHBondContact OG-N 3.34Å; S1098-A1102 PolarHBondContact O-N 3.32Å; S1098-M1228 VanDerWaalsContact C-CE 3.49Å
1099	E	85	Confident	90.1	Very high	98 Å²	98	49.8 Å²	49.8	46%	0.458	24%	0.242	S	C	.	.	H	α-helix	trans	-66.9	-39	177.9	-166.2	-171.1	168.3	0	0	111.7	F1101 A1102 R1103 M1228	E1099-F1101 VanDerWaalsContact C-N 3.27Å; E1099-F1101 PolarHBondContact O-N 2.78Å; E1099-A1102 WeakPolarHBondContact O-CB 3.47Å; E1099-A1102 PolarHBondContact O-N 3.46Å; E1099-R1103 WeakPolarHBondContact O-CG 3.43Å; E1099-R1103 PolarHBondContact O-N 3.44Å; E1099-R1103 IonicContact OE1-CZ 2.93Å; E1099-R1103 VanDerWaalsContact OE1-CZ 3.25Å; E1099-R1103 IonicContact OE1-NE 4Å; E1099-R1103 PolarHBondContact OE1-NE 3.18Å; E1099-R1103 IonicContact OE1-NH2 3.26Å; E1099-R1103 PolarHBondContact OE1-NH2 3.33Å; E1099-R1103 IonicContact OE2-NH2 2.94Å; E1099-M1228 HydrophobicContact CB-CE 3.75Å; E1099-M1228 HydrophobicContact CB-SD 4.25Å; E1099-M1228 HydrophobicContact CG-CE 4.28Å; E1099-M1228 HydrophobicContact CG-SD 4.12Å; E1099-M1228 VanDerWaalsContact N-CE 3.25Å
1100	Q	87	Confident	90	Very high	145 Å²	145	52.3 Å²	52.3	68%	0.678	25%	0.254	S	S	*	.	H	α-helix	trans	-60.8	-41.7	176.6	-66.5	-177.7	-7.3	0	0	110.7	R1103 L1104	Q1100-R1103 PolarHBondContact O-N 2.95Å; Q1100-L1104 PolarHBondContact O-N 3.06Å
1101	F	90.2	Very high	89.9	Confident	35 Å²	35	54.8 Å²	54.8	15%	0.154	26%	0.258	C	S	.	.	H	α-helix	trans	-66.5	-42.6	176.2	-169.4	-99.1	0	0	0	111.9	S1094 Q1095 S1098 E1099 R1103 L1104 V1105	S1094-F1101 VanDerWaalsContact OG-CE1 3.27Å; S1094-F1101 WeakPolarHBondContact OG-CE1 3.44Å; S1094-F1101 WeakPolarHBondContact OG-CZ 3.42Å; Q1095-F1101 HydrophobicContact CB-CB 4.42Å; Q1095-F1101 HydrophobicContact CB-CD1 3.71Å; Q1095-F1101 HydrophobicContact CB-CE1 4.08Å; Q1095-F1101 HydrophobicContact CB-CG 4.01Å; Q1095-F1101 HydrophobicContact CG-CD1 4.38Å; Q1095-F1101 HydrophobicContact CG-CE1 4.4Å; S1098-F1101 PolarHBondContact O-N 3.04Å; S1098-F1101 WeakPolarHBondContact OG-CB 3.34Å; S1098-F1101 PolarHBondContact OG-N 3.34Å; E1099-F1101 VanDerWaalsContact C-N 3.27Å; E1099-F1101 PolarHBondContact O-N 2.78Å; F1101-R1103 VanDerWaalsContact C-N 3.29Å; F1101-R1103 PolarHBondContact O-N 3.03Å; F1101-L1104 WeakPolarHBondContact O-CB 3.24Å; F1101-L1104 PolarHBondContact O-N 2.7Å; F1101-V1105 HydrophobicContact CD1-CG2 4.05Å; F1101-V1105 HydrophobicContact CE1-CG2 3.67Å; F1101-V1105 HydrophobicContact CZ-CG2 3.95Å; F1101-V1105 WeakPolarHBondContact O-CG2 3.38Å; F1101-V1105 PolarHBondContact O-N 2.84Å
1102	A	89.3	Confident	89.9	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-58.7	-40.6	175.1	0	0	0	0	0	112.1	L1093 S1098 E1099 K1106 I1218 M1228 L1230	L1093-A1102 HydrophobicContact CD1-CB 3.53Å; S1098-A1102 PolarHBondContact O-N 3.32Å; E1099-A1102 WeakPolarHBondContact O-CB 3.47Å; E1099-A1102 PolarHBondContact O-N 3.46Å; A1102-K1106 WeakPolarHBondContact O-CB 3.33Å; A1102-K1106 PolarHBondContact O-N 3.33Å; A1102-I1218 HydrophobicContact CB-CD1 4.24Å; A1102-I1218 HydrophobicContact CB-CG2 4.44Å; A1102-M1228 HydrophobicContact CB-CE 4.48Å; A1102-M1228 HydrophobicContact CB-SD 4.48Å; A1102-L1230 HydrophobicContact CB-CD2 4.34Å
1103	R	88.5	Confident	89.8	Confident	132 Å²	132	56.2 Å²	56.2	50%	0.498	27%	0.266	S	S	.	.	H	α-helix	trans	-66.9	-40.7	175.8	-70.8	178	-174.5	-172	2.5	112.6	E1099 Q1100 F1101 K1106 G1107 I1218	E1099-R1103 WeakPolarHBondContact O-CG 3.43Å; E1099-R1103 PolarHBondContact O-N 3.44Å; E1099-R1103 IonicContact OE1-CZ 2.93Å; E1099-R1103 VanDerWaalsContact OE1-CZ 3.25Å; E1099-R1103 IonicContact OE1-NE 4Å; E1099-R1103 PolarHBondContact OE1-NE 3.18Å; E1099-R1103 IonicContact OE1-NH2 3.26Å; E1099-R1103 PolarHBondContact OE1-NH2 3.33Å; E1099-R1103 IonicContact OE2-NH2 2.94Å; Q1100-R1103 PolarHBondContact O-N 2.95Å; F1101-R1103 VanDerWaalsContact C-N 3.29Å; F1101-R1103 PolarHBondContact O-N 3.03Å; R1103-K1106 WeakPolarHBondContact O-CB 3.39Å; R1103-K1106 PolarHBondContact O-N 3.15Å; R1103-G1107 PolarHBondContact O-N 3.05Å; R1103-I1218 HydrophobicContact CG-CD1 3.87Å
1104	L	91.1	Very high	89.7	Confident	38 Å²	38	56.1 Å²	56.1	20%	0.199	27%	0.265	C	S	.	.	H	α-helix	trans	-60.4	-51.7	175.1	179.2	67.4	0	0	0	111.4	Q1100 F1101 K1106 G1107 R1108 Q1145 E1147	Q1100-L1104 PolarHBondContact O-N 3.06Å; F1101-L1104 WeakPolarHBondContact O-CB 3.24Å; F1101-L1104 PolarHBondContact O-N 2.7Å; L1104-K1106 VanDerWaalsContact C-N 3.29Å; L1104-K1106 PolarHBondContact O-N 3.4Å; L1104-G1107 PolarHBondContact O-N 2.89Å; L1104-G1107 VanDerWaalsContact O-N 3.13Å; L1104-R1108 PolarHBondContact O-N 3.2Å; L1104-R1108 VanDerWaalsContact O-N 3.13Å; L1104-Q1145 HydrophobicContact CD1-CB 4.49Å; L1104-E1147 HydrophobicContact CD1-CG 4.41Å
1105	V	91.9	Very high	89.7	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-64.6	-36.2	178.9	-179.8	0	0	0	0	111	L1093 F1101 G1107 R1108 L1109 L1230 V1246	L1093-V1105 HydrophobicContact CD2-CB 3.88Å; L1093-V1105 HydrophobicContact CD2-CG1 3.76Å; L1093-V1105 HydrophobicContact CD2-CG2 4.11Å; F1101-V1105 HydrophobicContact CD1-CG2 4.05Å; F1101-V1105 HydrophobicContact CE1-CG2 3.67Å; F1101-V1105 HydrophobicContact CZ-CG2 3.95Å; F1101-V1105 WeakPolarHBondContact O-CG2 3.38Å; F1101-V1105 PolarHBondContact O-N 2.84Å; V1105-G1107 PolarHBondContact O-N 3.48Å; V1105-R1108 PolarHBondContact O-N 3.32Å; V1105-L1109 HydrophobicContact CG1-CD1 4.07Å; V1105-L1109 WeakPolarHBondContact O-CG 3.36Å; V1105-L1109 PolarHBondContact O-N 3.4Å; V1105-L1109 VanDerWaalsContact O-N 3.13Å; V1105-L1230 HydrophobicContact CB-CD1 4.09Å; V1105-L1230 HydrophobicContact CG1-CD1 3.82Å; V1105-V1246 HydrophobicContact CG1-CG2 3.83Å
1106	K	91.4	Very high	89.6	Confident	64 Å²	64	53.6 Å²	53.6	28%	0.278	25%	0.254	S	S	.	.	H	α-helix	trans	-57.7	-47.1	171.7	179.3	-167	164	-172.9	0	111.4	A1102 R1103 L1104 R1108 L1109 E1110 C1216 I1218 L1230	A1102-K1106 WeakPolarHBondContact O-CB 3.33Å; A1102-K1106 PolarHBondContact O-N 3.33Å; R1103-K1106 WeakPolarHBondContact O-CB 3.39Å; R1103-K1106 PolarHBondContact O-N 3.15Å; L1104-K1106 VanDerWaalsContact C-N 3.29Å; L1104-K1106 PolarHBondContact O-N 3.4Å; K1106-R1108 VanDerWaalsContact C-N 3.28Å; K1106-R1108 PolarHBondContact O-N 3.03Å; K1106-L1109 PolarHBondContact O-N 3.45Å; K1106-L1109 VanDerWaalsContact O-N 3.1Å; K1106-E1110 WeakPolarHBondContact CE-OE2 3.4Å; K1106-E1110 IonicContact NZ-OE2 2.62Å; K1106-E1110 PolarHBondContact NZ-OE2 3.33Å; K1106-E1110 WeakPolarHBondContact O-CB 3.21Å; K1106-E1110 PolarHBondContact O-N 3.06Å; K1106-C1216 VanDerWaalsContact CE-O 3.23Å; K1106-C1216 WeakPolarHBondContact CE-O 2.86Å; K1106-C1216 HydrophobicContact CG-CB 4.02Å; K1106-I1218 HydrophobicContact CD-CD1 4.4Å; K1106-I1218 HydrophobicContact CD-CG1 4.25Å; K1106-L1230 HydrophobicContact CB-CD1 4.27Å; K1106-L1230 HydrophobicContact CB-CD2 4.43Å
1107	G	89.6	Confident	89.8	Confident	10 Å²	10	51.6 Å²	51.6	10%	0.103	25%	0.245	C	C	.	.	H	α-helix	trans	-61.4	-33.9	178.1	0	0	0	0	0	113.5	R1103 L1104 V1105 L1109 H1208	R1103-G1107 PolarHBondContact O-N 3.05Å; L1104-G1107 PolarHBondContact O-N 2.89Å; L1104-G1107 VanDerWaalsContact O-N 3.13Å; V1105-G1107 PolarHBondContact O-N 3.48Å; G1107-L1109 VanDerWaalsContact C-N 3.34Å; G1107-H1208 PolarHBondContact O-CD2 3.33Å
1108	R	91.2	Very high	90	Very high	34 Å²	34	44.3 Å²	44.3	13%	0.128	21%	0.214	C	C	.	.	H	α-helix	trans	-72	-24.5	174.1	-67.7	177.6	176.6	160.3	2	113.9	L1104 V1105 K1106 E1147 G1209 I1243 L1244	L1104-R1108 PolarHBondContact O-N 3.2Å; L1104-R1108 VanDerWaalsContact O-N 3.13Å; V1105-R1108 PolarHBondContact O-N 3.32Å; K1106-R1108 VanDerWaalsContact C-N 3.28Å; K1106-R1108 PolarHBondContact O-N 3.03Å; R1108-E1147 IonicContact CZ-OE1 3.71Å; R1108-E1147 IonicContact CZ-OE2 2.72Å; R1108-E1147 VanDerWaalsContact CZ-OE2 3.3Å; R1108-E1147 IonicContact NE-OE1 3.32Å; R1108-E1147 IonicContact NE-OE2 3.04Å; R1108-E1147 PolarHBondContact NE-OE2 2.92Å; R1108-E1147 VanDerWaalsContact NH2-CD 3.27Å; R1108-E1147 IonicContact NH2-OE1 2.62Å; R1108-E1147 PolarHBondContact NH2-OE1 3.2Å; R1108-E1147 IonicContact NH2-OE2 3.57Å; R1108-E1147 PolarHBondContact NH2-OE2 3Å; R1108-G1209 WeakPolarHBondContact O-CA 3.24Å; R1108-I1243 HydrophobicContact CB-CG2 3.81Å; R1108-L1244 PolarHBondContact NH1-O 3.19Å
1109	L	91.6	Very high	90.2	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-92	-51.3	-179.2	-73.9	168.4	0	0	0	111.8	V1091 V1105 K1106 G1107 R1111 L1210 V1213 L1230 V1240 I1243 V1246	V1091-L1109 HydrophobicContact CG1-CD1 4.24Å; V1091-L1109 HydrophobicContact CG2-CD1 4.22Å; V1105-L1109 HydrophobicContact CG1-CD1 4.07Å; V1105-L1109 WeakPolarHBondContact O-CG 3.36Å; V1105-L1109 PolarHBondContact O-N 3.4Å; V1105-L1109 VanDerWaalsContact O-N 3.13Å; K1106-L1109 PolarHBondContact O-N 3.45Å; K1106-L1109 VanDerWaalsContact O-N 3.1Å; G1107-L1109 VanDerWaalsContact C-N 3.34Å; L1109-R1111 PolarHBondContact O-N 2.88Å; L1109-L1210 HydrophobicContact CD2-CD1 4.05Å; L1109-L1210 PolarHBondContact O-N 3.28Å; L1109-L1210 VanDerWaalsContact O-N 3.08Å; L1109-V1213 WeakPolarHBondContact O-CB 3.29Å; L1109-L1230 HydrophobicContact CD1-CD1 3.87Å; L1109-V1240 HydrophobicContact CD2-CB 4.26Å; L1109-V1240 HydrophobicContact CD2-CG1 3.88Å; L1109-V1240 HydrophobicContact CD2-CG2 4.03Å; L1109-I1243 HydrophobicContact CD2-CB 4.23Å; L1109-I1243 HydrophobicContact CD2-CG1 3.81Å; L1109-I1243 HydrophobicContact CD2-CG2 4.4Å; L1109-I1243 HydrophobicContact CG-CG2 4.45Å; L1109-V1246 HydrophobicContact CD1-CG2 4.41Å
1110	E	90.8	Very high	90.5	Very high	52 Å²	52	43.6 Å²	43.6	24%	0.243	21%	0.211	C	C	.	.	S	Bend	trans	-66.6	125.7	-174.9	-173.1	160.1	-130.8	0	0	111.1	K1106 T1112 C1216	K1106-E1110 WeakPolarHBondContact CE-OE2 3.4Å; K1106-E1110 IonicContact NZ-OE2 2.62Å; K1106-E1110 PolarHBondContact NZ-OE2 3.33Å; K1106-E1110 WeakPolarHBondContact O-CB 3.21Å; K1106-E1110 PolarHBondContact O-N 3.06Å; E1110-T1112 PolarHBondContact O-N 2.95Å; E1110-C1216 HydrophobicContact CB-CB 4.05Å; E1110-C1216 PolarHBondContact OE1-N 2.8Å
1111	R	91.5	Very high	90.6	Very high	100 Å²	100	37.7 Å²	37.7	38%	0.377	19%	0.185	S	C	.	.			trans	-62.2	125.8	178	73.7	-170.6	-175.9	161.7	8	109.7	L1109 V1206 L1210 V1213	L1109-R1111 PolarHBondContact O-N 2.88Å; R1111-V1206 HydrophobicContact CB-CG1 4.26Å; R1111-L1210 WeakPolarHBondContact CB-O 3.48Å; R1111-V1213 WeakPolarHBondContact CB-O 3.31Å; R1111-V1213 WeakPolarHBondContact CD-O 3.42Å; R1111-V1213 VanDerWaalsContact CG-O 3.27Å; R1111-V1213 WeakPolarHBondContact CG-O 3.44Å; R1111-V1213 PolarHBondContact N-O 3.13Å
1112	T	91.6	Very high	90.5	Very high	11 Å²	11	40.9 Å²	40.9	7%	0.067	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	123.9	169.8	-53.5	0	0	0	0	108.5	E1110 E1116 V1117 L1146 V1207 H1208	E1110-T1112 PolarHBondContact O-N 2.95Å; T1112-E1116 WeakPolarHBondContact CA-OE2 3.34Å; T1112-E1116 HydrophobicContact CG2-CB 4.28Å; T1112-V1117 HydrophobicContact CG2-CG1 3.75Å; T1112-L1146 HydrophobicContact CG2-CD1 3.9Å; T1112-V1207 HydrophobicContact CG2-CG2 4.24Å; T1112-V1207 WeakPolarHBondContact O-CG2 3.46Å; T1112-V1207 PolarHBondContact O-N 2.63Å; T1112-H1208 PolarHBondContact N-O 2.87Å; T1112-H1208 PolarHBondContact O-N 3.21Å
1113	T	92	Very high	90.4	Very high	26 Å²	26	42.5 Å²	42.5	16%	0.16	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	155.9	177.8	60.5	0	0	0	0	111.7	G1115 E1116 L1203 I1205	T1113-G1115 PolarHBondContact O-N 3.02Å; T1113-E1116 PolarHBondContact N-OE2 2.94Å; T1113-E1116 PolarHBondContact O-N 2.8Å; T1113-E1116 WeakPolarHBondContact OG1-CG 3.25Å; T1113-E1116 PolarHBondContact OG1-OE2 3.27Å; T1113-L1203 WeakPolarHBondContact CB-O 3.44Å; T1113-I1205 CarbonylContact C-O 3.5Å; T1113-I1205 VanDerWaalsContact CA-O 3.27Å; T1113-I1205 WeakPolarHBondContact CA-O 3.32Å
1114	L	91	Very high	90.2	Very high	0 Å²	0	38 Å²	38	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-57.5	-35.4	177.5	-177.2	56.8	0	0	0	111.2	E1116 V1117 T1118 L1134 I1136 I1153 I1157 L1202 I1205 V1207	L1114-E1116 VanDerWaalsContact C-N 3.26Å; L1114-E1116 PolarHBondContact O-N 2.92Å; L1114-V1117 HydrophobicContact CD1-CG2 4.1Å; L1114-V1117 WeakPolarHBondContact O-CG2 3.39Å; L1114-V1117 PolarHBondContact O-N 2.99Å; L1114-T1118 VanDerWaalsContact O-CB 3.29Å; L1114-T1118 WeakPolarHBondContact O-CB 3.15Å; L1114-T1118 PolarHBondContact O-N 3.02Å; L1114-T1118 VanDerWaalsContact O-N 3.09Å; L1114-T1118 PolarHBondContact O-OG1 3.32Å; L1114-L1134 HydrophobicContact CD1-CD2 4.49Å; L1114-L1134 HydrophobicContact CD2-CD2 3.64Å; L1114-L1134 HydrophobicContact CG-CD2 4.17Å; L1114-I1136 HydrophobicContact CD1-CD1 3.94Å; L1114-I1153 HydrophobicContact CD1-CG2 3.67Å; L1114-I1157 HydrophobicContact CD2-CD1 4.02Å; L1114-I1157 HydrophobicContact CD2-CG1 4.15Å; L1114-L1202 WeakPolarHBondContact CB-O 3.41Å; L1114-L1202 HydrophobicContact CD2-CB 4.44Å; L1114-L1202 WeakPolarHBondContact CD2-O 3.29Å; L1114-I1205 HydrophobicContact CB-CB 4.47Å; L1114-I1205 PolarHBondContact N-O 2.93Å; L1114-V1207 HydrophobicContact CB-CG1 3.78Å; L1114-V1207 HydrophobicContact CD1-CG1 3.88Å; L1114-V1207 HydrophobicContact CG-CG1 4.38Å
1115	G	90.2	Very high	89.8	Confident	30 Å²	30	42.3 Å²	42.3	31%	0.309	21%	0.213	S	C	.	.	H	α-helix	trans	-62.3	-27.9	175.5	0	0	0	0	0	114.7	T1113 L1203	T1113-G1115 PolarHBondContact O-N 3.02Å; G1115-L1203 PolarHBondContact N-O 2.99Å
1116	E	88.8	Confident	89.1	Confident	96 Å²	96	50 Å²	50	45%	0.449	24%	0.242	S	C	.	.	H	α-helix	trans	-79.2	-27.7	178.9	-69.9	163	159.9	0	0	112.4	T1112 T1113 L1114 R1140	T1112-E1116 WeakPolarHBondContact CA-OE2 3.34Å; T1112-E1116 HydrophobicContact CG2-CB 4.28Å; T1113-E1116 PolarHBondContact N-OE2 2.94Å; T1113-E1116 PolarHBondContact O-N 2.8Å; T1113-E1116 WeakPolarHBondContact OG1-CG 3.25Å; T1113-E1116 PolarHBondContact OG1-OE2 3.27Å; L1114-E1116 VanDerWaalsContact C-N 3.26Å; L1114-E1116 PolarHBondContact O-N 2.92Å; E1116-R1140 PolarHBondContact O-NH1 2.9Å
1117	V	90.3	Very high	88.3	Confident	3 Å²	3	57 Å²	57	2%	0.018	27%	0.272	C	S	.	.	H	α-helix	trans	-96.1	-5.2	178	-62.6	0	0	0	0	113.6	T1112 L1114 S1137 I1141 L1146 V1207	T1112-V1117 HydrophobicContact CG2-CG1 3.75Å; L1114-V1117 HydrophobicContact CD1-CG2 4.1Å; L1114-V1117 WeakPolarHBondContact O-CG2 3.39Å; L1114-V1117 PolarHBondContact O-N 2.99Å; V1117-S1137 PolarHBondContact O-N 3.38Å; V1117-I1141 HydrophobicContact CB-CG1 4.33Å; V1117-I1141 HydrophobicContact CG1-CG1 4.1Å; V1117-L1146 HydrophobicContact CG1-CD1 4.05Å; V1117-V1207 HydrophobicContact CG2-CG2 4.06Å
1118	T	90.6	Very high	87.6	Confident	16 Å²	16	63.9 Å²	63.9	10%	0.098	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	130.1	-178.6	-57	0	0	0	0	111.1	L1114 S1120 V1121 L1134 K1135 I1136	L1114-T1118 VanDerWaalsContact O-CB 3.29Å; L1114-T1118 WeakPolarHBondContact O-CB 3.15Å; L1114-T1118 PolarHBondContact O-N 3.02Å; L1114-T1118 VanDerWaalsContact O-N 3.09Å; L1114-T1118 PolarHBondContact O-OG1 3.32Å; T1118-S1120 VanDerWaalsContact CG2-O 3.28Å; T1118-S1120 WeakPolarHBondContact CG2-O 3.41Å; T1118-V1121 HydrophobicContact CG2-CG2 3.61Å; T1118-L1134 HydrophobicContact CG2-CB 4.33Å; T1118-K1135 CarbonylContact C-O 3.58Å; T1118-K1135 WeakPolarHBondContact CA-O 3.33Å; T1118-K1135 WeakPolarHBondContact CG2-O 3.32Å; T1118-I1136 HydrophobicContact CG2-CD1 4.41Å; T1118-I1136 WeakPolarHBondContact OG1-CD1 3.27Å
1119	E	90.5	Very high	87	Confident	86 Å²	86	64.4 Å²	64.4	40%	0.402	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	-47.2	177.2	-58.4	-177	176.9	0	0	111.6	K1135 S1137	E1119-K1135 HydrophobicContact CB-CD 4.35Å; E1119-K1135 HydrophobicContact CB-CG 4.43Å; E1119-K1135 PolarHBondContact N-O 3.46Å; E1119-K1135 WeakPolarHBondContact OE2-CD 3.3Å; E1119-K1135 WeakPolarHBondContact OE2-CE 3.24Å; E1119-K1135 IonicContact OE2-NZ 3.47Å; E1119-K1135 PolarHBondContact OE2-NZ 3.12Å; E1119-S1137 VanDerWaalsContact CG-CB 3.47Å; E1119-S1137 WeakPolarHBondContact OE1-CA 3.29Å; E1119-S1137 VanDerWaalsContact OE1-CB 3.27Å; E1119-S1137 WeakPolarHBondContact OE1-CB 3.47Å; E1119-S1137 PolarHBondContact OE1-OG 3.44Å
1120	S	90.4	Very high	86.4	Confident	38 Å²	38	66.2 Å²	66.2	27%	0.266	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147	149.3	179.4	66.5	0	0	0	0	111.4	T1118 K1135	T1118-S1120 VanDerWaalsContact CG2-O 3.28Å; T1118-S1120 WeakPolarHBondContact CG2-O 3.41Å; S1120-K1135 PolarHBondContact O-N 3.43Å
1121	V	89.7	Confident	86.2	Confident	21 Å²	21	64 Å²	64	13%	0.127	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	109.9	173	-180	0	0	0	0	108.4	T1118 L1132 L1134 R1199 L1203	T1118-V1121 HydrophobicContact CG2-CG2 3.61Å; V1121-L1132 HydrophobicContact CG1-CD2 3.27Å; V1121-L1132 HydrophobicContact CG1-CG 4.17Å; V1121-L1134 HydrophobicContact CG2-CD2 4.44Å; V1121-L1134 HydrophobicContact CG2-CG 4.23Å; V1121-R1199 HydrophobicContact CG1-CG 3.97Å; V1121-L1203 HydrophobicContact CG2-CD2 3.85Å
1122	E	88.8	Confident	86.1	Confident	102 Å²	102	59.2 Å²	59.2	48%	0.477	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	136	-176	-68	172.3	-157.6	0	0	110	L1133	E1122-L1133 HydrophobicContact CB-CB 4.48Å; E1122-L1133 PolarHBondContact N-O 2.9Å; E1122-L1133 PolarHBondContact O-N 3.26Å
1123	C	85.9	Confident	86	Confident	33 Å²	33	60.2 Å²	60.2	22%	0.223	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	112	170.9	-65.5	0	0	0	0	107.6	Y1125	C1123-Y1125 HydrophobicContact CB-CE2 3.87Å
1124	T	84.2	Confident	86	Confident	39 Å²	39	59 Å²	59	24%	0.239	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	121.2	-180	-50.8	0	0	0	0	109.5	R1126 F1131	T1124-R1126 HydrophobicContact CG2-CG 4.2Å; T1124-F1131 HydrophobicContact CG2-CE1 4.14Å; T1124-F1131 HydrophobicContact CG2-CE2 4.45Å; T1124-F1131 HydrophobicContact CG2-CZ 3.84Å; T1124-F1131 PolarHBondContact N-O 3.39Å; T1124-F1131 PolarHBondContact O-N 3.36Å; T1124-F1131 VanDerWaalsContact O-N 3.09Å
1125	Y	82.7	Confident	86.1	Confident	128 Å²	128	61.8 Å²	61.8	50%	0.502	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	107.8	175.3	-54.5	-84.7	0	0	0	108.1	C1123 C1130 A1192 L1195	C1123-Y1125 HydrophobicContact CB-CE2 3.87Å; Y1125-C1130 HydrophobicContact CD1-CB 4.19Å; Y1125-A1192 HydrophobicContact CE1-CB 4.39Å; Y1125-L1195 HydrophobicContact CE1-CD1 4.41Å
1126	R	79	Confident	86.2	Confident	161 Å²	161	60.4 Å²	60.4	61%	0.608	29%	0.292	S	S	*	.			trans	-101	164.3	169.1	-65.2	-172.1	174.8	-169.9	-3.6	109.1	T1124 D1128 T1129 F1131	T1124-R1126 HydrophobicContact CG2-CG 4.2Å; R1126-D1128 PolarHBondContact O-N 3.31Å; R1126-T1129 WeakPolarHBondContact CA-O 3.2Å; R1126-T1129 WeakPolarHBondContact CB-O 3.37Å; R1126-T1129 PolarHBondContact N-O 3.19Å; R1126-F1131 HydrophobicContact CG-CE1 4.46Å
1127	K	74.3	Confident	86.3	Confident	212 Å²	212	56.2 Å²	56.2	92%	0.922	27%	0.273	S	S	*	.	S	Bend	trans	-55.9	-36.2	179.2	-71.5	-174.6	176.8	-178.7	0	112.3
1128	D	74.6	Confident	86.1	Confident	154 Å²	154	58.3 Å²	58.3	82%	0.824	28%	0.284	S	S	*	.	S	Bend	trans	-103.7	-22.6	-173.3	-48.9	-42	0	0	0	113.2	R1126	R1126-D1128 PolarHBondContact O-N 3.31Å
1129	T	78.5	Confident	86	Confident	45 Å²	45	63.4 Å²	63.4	28%	0.276	31%	0.307	S	S	.	.			trans	-146.5	144.8	-173.4	62.3	0	0	0	0	113	R1126 E1182	R1126-T1129 WeakPolarHBondContact CA-O 3.2Å; R1126-T1129 WeakPolarHBondContact CB-O 3.37Å; R1126-T1129 PolarHBondContact N-O 3.19Å; T1129-E1182 WeakPolarHBondContact CB-OE1 3.22Å; T1129-E1182 WeakPolarHBondContact CG2-OE1 3.42Å
1130	C	79.7	Confident	85.8	Confident	38 Å²	38	65.5 Å²	65.5	26%	0.257	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	118.3	173	-62.1	0	0	0	0	108.5	Y1125 L1195	Y1125-C1130 HydrophobicContact CD1-CB 4.19Å; C1130-L1195 HydrophobicContact CB-CD1 3.63Å
1131	F	86.8	Confident	85.7	Confident	4 Å²	4	64.6 Å²	64.6	2%	0.018	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	158.2	-178.9	64.3	-90.6	0	0	0	111.7	T1124 R1126 L1133 I1181 E1182	T1124-F1131 HydrophobicContact CG2-CE1 4.14Å; T1124-F1131 HydrophobicContact CG2-CE2 4.45Å; T1124-F1131 HydrophobicContact CG2-CZ 3.84Å; T1124-F1131 PolarHBondContact N-O 3.39Å; T1124-F1131 PolarHBondContact O-N 3.36Å; T1124-F1131 VanDerWaalsContact O-N 3.09Å; R1126-F1131 HydrophobicContact CG-CE1 4.46Å; F1131-L1133 HydrophobicContact CD2-CB 4.49Å; F1131-L1133 HydrophobicContact CE2-CB 4.29Å; F1131-L1133 HydrophobicContact CE2-CD1 4.46Å; F1131-I1181 CarbonylContact C-O 3.52Å; F1131-I1181 VanDerWaalsContact CA-O 3.26Å; F1131-I1181 WeakPolarHBondContact CA-O 3.31Å; F1131-I1181 WeakPolarHBondContact CB-O 3.23Å; F1131-E1182 HydrophobicContact CB-CB 4.09Å; F1131-E1182 HydrophobicContact CB-CG 4.4Å
1132	L	88.3	Confident	85.6	Confident	1 Å²	1	71.1 Å²	71.1	1%	0.005	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	121.9	179.4	-141	130	0	0	0	107.9	V1121 L1134 S1180 I1181 L1195 R1199 L1202	V1121-L1132 HydrophobicContact CG1-CD2 3.27Å; V1121-L1132 HydrophobicContact CG1-CG 4.17Å; L1132-L1134 HydrophobicContact CD2-CD1 3.83Å; L1132-L1134 HydrophobicContact CD2-CG 4.33Å; L1132-S1180 CarbonylContact O-C 3.49Å; L1132-S1180 VanDerWaalsContact O-CA 3.32Å; L1132-S1180 WeakPolarHBondContact O-CA 3.33Å; L1132-I1181 HydrophobicContact CB-CB 4.25Å; L1132-I1181 PolarHBondContact N-O 2.95Å; L1132-I1181 PolarHBondContact O-N 3.34Å; L1132-L1195 HydrophobicContact CB-CD2 4.22Å; L1132-L1195 HydrophobicContact CD1-CB 4.24Å; L1132-L1195 HydrophobicContact CD1-CD2 3.86Å; L1132-L1195 WeakPolarHBondContact CD1-O 3.2Å; L1132-R1199 HydrophobicContact CD1-CB 4.12Å; L1132-L1202 HydrophobicContact CD2-CD1 3.8Å
1133	L	90.5	Very high	85.4	Confident	32 Å²	32	73.2 Å²	73.2	17%	0.168	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	116	-179.7	-170.6	70.1	0	0	0	109.3	E1122 F1131 Y1178	E1122-L1133 HydrophobicContact CB-CB 4.48Å; E1122-L1133 PolarHBondContact N-O 2.9Å; E1122-L1133 PolarHBondContact O-N 3.26Å; F1131-L1133 HydrophobicContact CD2-CB 4.49Å; F1131-L1133 HydrophobicContact CE2-CB 4.29Å; F1131-L1133 HydrophobicContact CE2-CD1 4.46Å; L1133-Y1178 HydrophobicContact CD1-CD1 4.38Å; L1133-Y1178 HydrophobicContact CD2-CD1 4.23Å; L1133-Y1178 HydrophobicContact CG-CD1 4.19Å
1134	L	91.5	Very high	85.3	Confident	1 Å²	1	76 Å²	76	1%	0.005	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	124.9	176.2	-63.2	87.5	0	0	0	109.2	L1114 T1118 V1121 L1132 I1136 Y1178 I1179 I1181	L1114-L1134 HydrophobicContact CD1-CD2 4.49Å; L1114-L1134 HydrophobicContact CD2-CD2 3.64Å; L1114-L1134 HydrophobicContact CG-CD2 4.17Å; T1118-L1134 HydrophobicContact CG2-CB 4.33Å; V1121-L1134 HydrophobicContact CG2-CD2 4.44Å; V1121-L1134 HydrophobicContact CG2-CG 4.23Å; L1132-L1134 HydrophobicContact CD2-CD1 3.83Å; L1132-L1134 HydrophobicContact CD2-CG 4.33Å; L1134-I1136 HydrophobicContact CB-CD1 4.26Å; L1134-Y1178 CarbonylContact O-C 3.51Å; L1134-Y1178 VanDerWaalsContact O-CA 3.29Å; L1134-Y1178 WeakPolarHBondContact O-CA 3.26Å; L1134-I1179 HydrophobicContact CB-CB 4.44Å; L1134-I1179 PolarHBondContact N-O 2.85Å; L1134-I1179 PolarHBondContact O-N 3.32Å; L1134-I1181 HydrophobicContact CD1-CD1 3.72Å; L1134-I1181 HydrophobicContact CD1-CG1 4.06Å
1135	K	92.7	Very high	85.3	Confident	57 Å²	57	77.9 Å²	77.9	25%	0.248	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	109	173.7	-173.6	-177.7	-174.5	-143.2	0	109.7	T1118 E1119 S1120 Y1178	T1118-K1135 CarbonylContact C-O 3.58Å; T1118-K1135 WeakPolarHBondContact CA-O 3.33Å; T1118-K1135 WeakPolarHBondContact CG2-O 3.32Å; E1119-K1135 HydrophobicContact CB-CD 4.35Å; E1119-K1135 HydrophobicContact CB-CG 4.43Å; E1119-K1135 PolarHBondContact N-O 3.46Å; E1119-K1135 WeakPolarHBondContact OE2-CD 3.3Å; E1119-K1135 WeakPolarHBondContact OE2-CE 3.24Å; E1119-K1135 IonicContact OE2-NZ 3.47Å; E1119-K1135 PolarHBondContact OE2-NZ 3.12Å; S1120-K1135 PolarHBondContact O-N 3.43Å; K1135-Y1178 HydrophobicContact CB-CD1 3.92Å; K1135-Y1178 HydrophobicContact CB-CE1 3.76Å; K1135-Y1178 HydrophobicContact CD-CE1 3.85Å; K1135-Y1178 HydrophobicContact CG-CD1 4.02Å; K1135-Y1178 HydrophobicContact CG-CE1 3.5Å
1136	I	91.4	Very high	85.5	Confident	1 Å²	1	72.5 Å²	72.5	1%	0.005	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	134.3	-176.4	-51.9	-56.7	0	0	0	110.6	L1114 T1118 L1134 I1138 I1141 L1150 I1153 R1177 I1179	L1114-I1136 HydrophobicContact CD1-CD1 3.94Å; T1118-I1136 HydrophobicContact CG2-CD1 4.41Å; T1118-I1136 WeakPolarHBondContact OG1-CD1 3.27Å; L1134-I1136 HydrophobicContact CB-CD1 4.26Å; I1136-I1138 PolarHBondContact O-N 2.77Å; I1136-I1141 HydrophobicContact CG2-CD1 3.83Å; I1136-L1150 HydrophobicContact CB-CD2 3.92Å; I1136-L1150 HydrophobicContact CG1-CD2 3.81Å; I1136-L1150 HydrophobicContact CG2-CD2 4.11Å; I1136-I1153 HydrophobicContact CG2-CD1 3.97Å; I1136-R1177 PolarHBondContact N-O 3.35Å; I1136-I1179 HydrophobicContact CD1-CD1 4.39Å; I1136-I1179 HydrophobicContact CG1-CD1 4.07Å; I1136-I1179 HydrophobicContact CG1-CG1 4.39Å
1137	S	91.2	Very high	85.9	Confident	8 Å²	8	69.7 Å²	69.7	6%	0.056	34%	0.335	C	S	.	.			trans	-87.3	96.4	178.8	-158.3	0	0	0	0	111.9	V1117 E1119 E1139 R1140 I1141	V1117-S1137 PolarHBondContact O-N 3.38Å; E1119-S1137 VanDerWaalsContact CG-CB 3.47Å; E1119-S1137 WeakPolarHBondContact OE1-CA 3.29Å; E1119-S1137 VanDerWaalsContact OE1-CB 3.27Å; E1119-S1137 WeakPolarHBondContact OE1-CB 3.47Å; E1119-S1137 PolarHBondContact OE1-OG 3.44Å; S1137-E1139 PolarHBondContact O-N 2.55Å; S1137-R1140 PolarHBondContact O-N 3.19Å; S1137-I1141 WeakPolarHBondContact O-CG1 3.02Å; S1137-I1141 PolarHBondContact O-N 3.37Å
1138	I	87.1	Confident	86.6	Confident	47 Å²	47	60.4 Å²	60.4	24%	0.241	30%	0.296	C	S	.	.	H	α-helix	trans	-61	-33	175	-56	175.5	0	0	0	111.2	I1136 I1141 K1142 N1176 R1177	I1136-I1138 PolarHBondContact O-N 2.77Å; I1138-I1141 PolarHBondContact O-N 3Å; I1138-K1142 HydrophobicContact CG2-CD 4.25Å; I1138-K1142 HydrophobicContact CG2-CG 4.34Å; I1138-K1142 WeakPolarHBondContact O-CG 3.3Å; I1138-K1142 PolarHBondContact O-N 3.17Å; I1138-N1176 WeakPolarHBondContact CD1-O 3.48Å; I1138-R1177 HydrophobicContact CD1-CG 3.59Å; I1138-R1177 HydrophobicContact CG1-CG 4.09Å
1139	E	88.6	Confident	87.3	Confident	123 Å²	123	56.8 Å²	56.8	58%	0.575	28%	0.28	S	S	*	.	H	α-helix	trans	-64.4	-42.4	-179.2	-70.7	167.6	-151.3	0	0	111.6	S1137 K1142 L1143 R1177	S1137-E1139 PolarHBondContact O-N 2.55Å; E1139-K1142 PolarHBondContact O-N 3.17Å; E1139-L1143 WeakPolarHBondContact O-CB 3.49Å; E1139-L1143 PolarHBondContact O-N 3.45Å; E1139-R1177 IonicContact OE1-NH1 3.56Å
1140	R	86.1	Confident	87.7	Confident	131 Å²	131	56.1 Å²	56.1	49%	0.494	27%	0.274	S	S	.	.	H	α-helix	trans	-65.3	-41	175	-62.6	-165.9	91.5	-171.8	9.4	112.1	E1116 S1137 K1142 L1143 L1144	E1116-R1140 PolarHBondContact O-NH1 2.9Å; S1137-R1140 PolarHBondContact O-N 3.19Å; R1140-K1142 VanDerWaalsContact C-N 3.34Å; R1140-K1142 PolarHBondContact O-N 3.33Å; R1140-L1143 PolarHBondContact O-N 2.68Å; R1140-L1144 WeakPolarHBondContact O-CB 3.03Å; R1140-L1144 WeakPolarHBondContact O-CG 3.39Å; R1140-L1144 PolarHBondContact O-N 3.31Å
1141	I	87.7	Confident	88.2	Confident	18 Å²	18	56.7 Å²	56.7	9%	0.092	28%	0.281	C	S	.	.	H	α-helix	trans	-59.1	-46.7	176.8	-67.2	173.2	0	0	0	110.3	V1117 I1136 S1137 I1138 Q1145 L1146	V1117-I1141 HydrophobicContact CB-CG1 4.33Å; V1117-I1141 HydrophobicContact CG1-CG1 4.1Å; I1136-I1141 HydrophobicContact CG2-CD1 3.83Å; S1137-I1141 WeakPolarHBondContact O-CG1 3.02Å; S1137-I1141 PolarHBondContact O-N 3.37Å; I1138-I1141 PolarHBondContact O-N 3Å; I1141-Q1145 PolarHBondContact O-N 3.05Å; I1141-Q1145 VanDerWaalsContact O-N 3.13Å; I1141-L1146 HydrophobicContact CG2-CB 4.12Å; I1141-L1146 WeakPolarHBondContact CG2-O 3.46Å; I1141-L1146 PolarHBondContact O-N 3.19Å
1142	K	87.3	Confident	88.3	Confident	159 Å²	159	59.6 Å²	59.6	69%	0.691	30%	0.297	S	S	*	.	H	α-helix	trans	-65.7	-44.1	177.5	-73	-177.3	177.9	-174.7	0	112.8	I1138 E1139 R1140 L1144 Q1145	I1138-K1142 HydrophobicContact CG2-CD 4.25Å; I1138-K1142 HydrophobicContact CG2-CG 4.34Å; I1138-K1142 WeakPolarHBondContact O-CG 3.3Å; I1138-K1142 PolarHBondContact O-N 3.17Å; E1139-K1142 PolarHBondContact O-N 3.17Å; R1140-K1142 VanDerWaalsContact C-N 3.34Å; R1140-K1142 PolarHBondContact O-N 3.33Å; K1142-L1144 VanDerWaalsContact C-N 3.34Å; K1142-L1144 PolarHBondContact O-N 3.36Å; K1142-Q1145 PolarHBondContact O-N 3.46Å; K1142-Q1145 VanDerWaalsContact O-N 3.16Å
1143	L	86	Confident	88.4	Confident	146 Å²	146	59.6 Å²	59.6	76%	0.764	30%	0.297	S	S	*	.	H	α-helix	trans	-62.8	-40.9	-179.2	-177	68.5	0	0	0	112.1	E1139 R1140 Q1145	E1139-L1143 WeakPolarHBondContact O-CB 3.49Å; E1139-L1143 PolarHBondContact O-N 3.45Å; R1140-L1143 PolarHBondContact O-N 2.68Å; L1143-Q1145 VanDerWaalsContact C-N 3.26Å
1144	L	83.2	Confident	88.3	Confident	90 Å²	90	58.8 Å²	58.8	47%	0.471	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.7	-0	178.4	-66.3	174.4	0	0	0	113.3	R1140 K1142 L1146	R1140-L1144 WeakPolarHBondContact O-CB 3.03Å; R1140-L1144 WeakPolarHBondContact O-CG 3.39Å; R1140-L1144 PolarHBondContact O-N 3.31Å; K1142-L1144 VanDerWaalsContact C-N 3.34Å; K1142-L1144 PolarHBondContact O-N 3.36Å; L1144-L1146 HydrophobicContact CB-CD1 4.15Å; L1144-L1146 HydrophobicContact CB-CD2 4.23Å; L1144-L1146 HydrophobicContact CB-CG 3.78Å; L1144-L1146 HydrophobicContact CD1-CD1 4.27Å; L1144-L1146 PolarHBondContact O-N 3.47Å
1145	Q	84.9	Confident	88.2	Confident	79 Å²	79	63.3 Å²	63.3	37%	0.369	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.1	38.3	-178.4	-58.3	178.4	-34	0	0	113.1	L1104 I1141 K1142 L1143	L1104-Q1145 HydrophobicContact CD1-CB 4.49Å; I1141-Q1145 PolarHBondContact O-N 3.05Å; I1141-Q1145 VanDerWaalsContact O-N 3.13Å; K1142-Q1145 PolarHBondContact O-N 3.46Å; K1142-Q1145 VanDerWaalsContact O-N 3.16Å; L1143-Q1145 VanDerWaalsContact C-N 3.26Å
1146	L	87	Confident	88	Confident	15 Å²	15	62.1 Å²	62.1	8%	0.079	32%	0.316	C	S	.	.			trans	-78.3	126.5	179.2	-56.9	175.4	0	0	0	109.8	T1112 V1117 I1141 L1144 V1148	T1112-L1146 HydrophobicContact CG2-CD1 3.9Å; V1117-L1146 HydrophobicContact CG1-CD1 4.05Å; I1141-L1146 HydrophobicContact CG2-CB 4.12Å; I1141-L1146 WeakPolarHBondContact CG2-O 3.46Å; I1141-L1146 PolarHBondContact O-N 3.19Å; L1144-L1146 HydrophobicContact CB-CD1 4.15Å; L1144-L1146 HydrophobicContact CB-CD2 4.23Å; L1144-L1146 HydrophobicContact CB-CG 3.78Å; L1144-L1146 HydrophobicContact CD1-CD1 4.27Å; L1144-L1146 PolarHBondContact O-N 3.47Å; L1146-V1148 HydrophobicContact CB-CG2 4.11Å; L1146-V1148 PolarHBondContact O-N 3.43Å
1147	E	87.5	Confident	87.9	Confident	103 Å²	103	62.1 Å²	62.1	48%	0.481	32%	0.316	S	S	.	.			trans	-81.8	61.9	178.2	-64	174.3	139.9	0	0	110.2	L1104 R1108	L1104-E1147 HydrophobicContact CD1-CG 4.41Å; R1108-E1147 IonicContact CZ-OE1 3.71Å; R1108-E1147 IonicContact CZ-OE2 2.72Å; R1108-E1147 VanDerWaalsContact CZ-OE2 3.3Å; R1108-E1147 IonicContact NE-OE1 3.32Å; R1108-E1147 IonicContact NE-OE2 3.04Å; R1108-E1147 PolarHBondContact NE-OE2 2.92Å; R1108-E1147 VanDerWaalsContact NH2-CD 3.27Å; R1108-E1147 IonicContact NH2-OE1 2.62Å; R1108-E1147 PolarHBondContact NH2-OE1 3.2Å; R1108-E1147 IonicContact NH2-OE2 3.57Å; R1108-E1147 PolarHBondContact NH2-OE2 3Å
1148	V	88.3	Confident	87.7	Confident	17 Å²	17	63.4 Å²	63.4	10%	0.103	32%	0.323	C	S	.	.			trans	-130.4	128.6	-173.8	-175.7	0	0	0	0	110.9	L1146 D1152 I1153 H1208	L1146-V1148 HydrophobicContact CB-CG2 4.11Å; L1146-V1148 PolarHBondContact O-N 3.43Å; V1148-D1152 HydrophobicContact CG1-CB 4.24Å; V1148-I1153 HydrophobicContact CG1-CD1 3.98Å; V1148-I1153 HydrophobicContact CG1-CG1 3.53Å; V1148-H1208 HydrophobicContact CG2-CB 3.48Å; V1148-H1208 VanDerWaalsContact CG2-CB 3.48Å; V1148-H1208 VanDerWaalsContact CG2-ND1 3.28Å; V1148-H1208 WeakPolarHBondContact CG2-ND1 3.47Å
1149	T	89.5	Confident	87.7	Confident	77 Å²	77	66.7 Å²	66.7	47%	0.472	35%	0.345	S	S	.	.			trans	-102.4	167.3	170.7	72.2	0	0	0	0	111.5	A1151 D1152 I1153	T1149-A1151 PolarHBondContact O-N 3.06Å; T1149-A1151 PolarHBondContact OG1-N 3.22Å; T1149-D1152 WeakPolarHBondContact CA-OD2 3.4Å; T1149-D1152 WeakPolarHBondContact CB-OD2 3.45Å; T1149-D1152 PolarHBondContact N-OD2 3.27Å; T1149-D1152 PolarHBondContact O-N 3.48Å; T1149-D1152 PolarHBondContact OG1-N 3Å; T1149-D1152 PolarHBondContact OG1-OD2 2.93Å; T1149-I1153 PolarHBondContact O-N 2.91Å
1150	L	86.9	Confident	87.5	Confident	32 Å²	32	62.1 Å²	62.1	17%	0.168	33%	0.328	C	S	.	.	H	α-helix	trans	-62	-30.9	174.9	-72	-179.8	0	0	0	112.8	I1136 I1153 V1154 I1173 N1176 I1179	I1136-L1150 HydrophobicContact CB-CD2 3.92Å; I1136-L1150 HydrophobicContact CG1-CD2 3.81Å; I1136-L1150 HydrophobicContact CG2-CD2 4.11Å; L1150-I1153 HydrophobicContact CD2-CD1 4.43Å; L1150-I1153 PolarHBondContact O-N 3.49Å; L1150-V1154 WeakPolarHBondContact O-CG2 3.4Å; L1150-V1154 PolarHBondContact O-N 3.15Å; L1150-V1154 VanDerWaalsContact O-N 3.13Å; L1150-I1173 HydrophobicContact CB-CD1 4.18Å; L1150-I1173 HydrophobicContact CB-CG2 4.47Å; L1150-I1173 HydrophobicContact CD1-CG2 3.96Å; L1150-N1176 VanDerWaalsContact CD1-C 3.45Å; L1150-N1176 VanDerWaalsContact CD1-O 3.24Å; L1150-N1176 WeakPolarHBondContact CD1-O 3.37Å; L1150-I1179 HydrophobicContact CD2-CD1 4.24Å; L1150-I1179 HydrophobicContact CD2-CG1 4.39Å
1151	A	89.2	Confident	87.2	Confident	49 Å²	49	66.2 Å²	66.2	41%	0.405	35%	0.349	S	S	.	.	H	α-helix	trans	-65.3	-44.5	176.1	0	0	0	0	0	111	T1149 I1153 V1154 D1155	T1149-A1151 PolarHBondContact O-N 3.06Å; T1149-A1151 PolarHBondContact OG1-N 3.22Å; A1151-I1153 VanDerWaalsContact C-N 3.28Å; A1151-I1153 PolarHBondContact O-N 3.24Å; A1151-V1154 WeakPolarHBondContact O-CB 3.3Å; A1151-V1154 PolarHBondContact O-N 3.11Å; A1151-V1154 VanDerWaalsContact O-N 3.08Å; A1151-D1155 PolarHBondContact O-N 3.05Å
1152	D	89.4	Confident	86.7	Confident	66 Å²	66	66.7 Å²	66.7	35%	0.353	35%	0.352	S	S	.	.	H	α-helix	trans	-61	-38.7	177.7	-53.9	-46.2	0	0	0	111.6	V1148 T1149 D1155 C1156	V1148-D1152 HydrophobicContact CG1-CB 4.24Å; T1149-D1152 WeakPolarHBondContact CA-OD2 3.4Å; T1149-D1152 WeakPolarHBondContact CB-OD2 3.45Å; T1149-D1152 PolarHBondContact N-OD2 3.27Å; T1149-D1152 PolarHBondContact O-N 3.48Å; T1149-D1152 PolarHBondContact OG1-N 3Å; T1149-D1152 PolarHBondContact OG1-OD2 2.93Å; D1152-D1155 PolarHBondContact O-N 3.44Å; D1152-C1156 WeakPolarHBondContact O-CB 3.46Å; D1152-C1156 PolarHBondContact O-N 2.9Å; D1152-C1156 PolarHBondContact O-SG 3.18Å
1153	I	89.7	Confident	86.1	Confident	0 Å²	0	65.6 Å²	65.6	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-63.6	-42.7	175.8	-64.5	173.7	0	0	0	110.7	L1114 I1136 V1148 T1149 L1150 A1151 C1156 I1157 I1179 V1207	L1114-I1153 HydrophobicContact CD1-CG2 3.67Å; I1136-I1153 HydrophobicContact CG2-CD1 3.97Å; V1148-I1153 HydrophobicContact CG1-CD1 3.98Å; V1148-I1153 HydrophobicContact CG1-CG1 3.53Å; T1149-I1153 PolarHBondContact O-N 2.91Å; L1150-I1153 HydrophobicContact CD2-CD1 4.43Å; L1150-I1153 PolarHBondContact O-N 3.49Å; A1151-I1153 VanDerWaalsContact C-N 3.28Å; A1151-I1153 PolarHBondContact O-N 3.24Å; I1153-C1156 PolarHBondContact O-N 3.02Å; I1153-I1157 HydrophobicContact CG2-CD1 3.92Å; I1153-I1157 VanDerWaalsContact O-CG1 3.27Å; I1153-I1157 WeakPolarHBondContact O-CG1 3.39Å; I1153-I1157 PolarHBondContact O-N 3.28Å; I1153-I1179 HydrophobicContact CB-CD1 4.12Å; I1153-I1179 HydrophobicContact CG2-CD1 3.61Å; I1153-V1207 HydrophobicContact CG1-CB 4.41Å; I1153-V1207 HydrophobicContact CG1-CG1 4.35Å; I1153-V1207 HydrophobicContact CG2-CG1 4.23Å
1154	V	89.8	Confident	85.5	Confident	15 Å²	15	60.1 Å²	60.1	9%	0.091	32%	0.32	C	S	.	.	H	α-helix	trans	-62.3	-44.1	176.4	169.6	0	0	0	0	110.8	L1150 A1151 C1156 I1157 L1158 V1171 I1173 I1179	L1150-V1154 WeakPolarHBondContact O-CG2 3.4Å; L1150-V1154 PolarHBondContact O-N 3.15Å; L1150-V1154 VanDerWaalsContact O-N 3.13Å; A1151-V1154 WeakPolarHBondContact O-CB 3.3Å; A1151-V1154 PolarHBondContact O-N 3.11Å; A1151-V1154 VanDerWaalsContact O-N 3.08Å; V1154-C1156 VanDerWaalsContact C-N 3.33Å; V1154-C1156 PolarHBondContact O-N 2.65Å; V1154-I1157 WeakPolarHBondContact O-CB 3.36Å; V1154-I1157 PolarHBondContact O-N 2.72Å; V1154-I1157 VanDerWaalsContact O-N 3.13Å; V1154-L1158 HydrophobicContact CG1-CD1 3.91Å; V1154-L1158 HydrophobicContact CG1-CG 4.35Å; V1154-L1158 WeakPolarHBondContact O-CG 3.43Å; V1154-L1158 PolarHBondContact O-N 3.49Å; V1154-V1171 HydrophobicContact CB-CG1 4.34Å; V1154-V1171 HydrophobicContact CG1-CB 4.25Å; V1154-V1171 HydrophobicContact CG1-CG1 3.76Å; V1154-V1171 HydrophobicContact CG2-CG1 3.9Å; V1154-I1173 HydrophobicContact CG2-CD1 4.04Å; V1154-I1173 HydrophobicContact CG2-CG1 3.73Å; V1154-I1179 HydrophobicContact CG2-CD1 4.08Å; V1154-I1179 HydrophobicContact CG2-CG1 4.39Å; V1154-I1179 HydrophobicContact CG2-CG2 4.19Å
1155	D	89	Confident	85.3	Confident	96 Å²	96	66 Å²	66	51%	0.513	34%	0.336	S	S	.	.	H	α-helix	trans	-62.9	-39.5	176.7	-73.9	-18.3	0	0	0	112	A1151 D1152 I1157 L1158 T1159	A1151-D1155 PolarHBondContact O-N 3.05Å; D1152-D1155 PolarHBondContact O-N 3.44Å; D1155-I1157 VanDerWaalsContact C-N 3.33Å; D1155-I1157 PolarHBondContact O-N 3.07Å; D1155-L1158 PolarHBondContact O-N 3.21Å; D1155-T1159 WeakPolarHBondContact O-CB 3.27Å; D1155-T1159 WeakPolarHBondContact O-CG2 3.47Å; D1155-T1159 PolarHBondContact O-N 2.85Å; D1155-T1159 PolarHBondContact O-OG1 3.49Å
1156	C	88.1	Confident	85.1	Confident	32 Å²	32	62.6 Å²	62.6	22%	0.216	32%	0.32	C	S	.	.	H	α-helix	trans	-61.8	-40.2	173	-69.1	0	0	0	0	111.9	D1152 I1153 V1154 T1159 A1160 I1205	D1152-C1156 WeakPolarHBondContact O-CB 3.46Å; D1152-C1156 PolarHBondContact O-N 2.9Å; D1152-C1156 PolarHBondContact O-SG 3.18Å; I1153-C1156 PolarHBondContact O-N 3.02Å; V1154-C1156 VanDerWaalsContact C-N 3.33Å; V1154-C1156 PolarHBondContact O-N 2.65Å; C1156-T1159 PolarHBondContact O-OG1 3.3Å; C1156-A1160 WeakPolarHBondContact O-CB 3.15Å; C1156-A1160 PolarHBondContact O-N 3.47Å; C1156-A1160 VanDerWaalsContact O-N 3.1Å; C1156-I1205 HydrophobicContact CB-CG2 4.47Å
1157	I	88.7	Confident	84.9	Confident	1 Å²	1	65.4 Å²	65.4	1%	0.005	34%	0.335	C	S	.	.	H	α-helix	trans	-66.2	-42	177	-68.9	163.8	0	0	0	111.1	L1114 I1153 V1154 D1155 A1160 L1166 V1171 I1181 L1202 I1205	L1114-I1157 HydrophobicContact CD2-CD1 4.02Å; L1114-I1157 HydrophobicContact CD2-CG1 4.15Å; I1153-I1157 HydrophobicContact CG2-CD1 3.92Å; I1153-I1157 VanDerWaalsContact O-CG1 3.27Å; I1153-I1157 WeakPolarHBondContact O-CG1 3.39Å; I1153-I1157 PolarHBondContact O-N 3.28Å; V1154-I1157 WeakPolarHBondContact O-CB 3.36Å; V1154-I1157 PolarHBondContact O-N 2.72Å; V1154-I1157 VanDerWaalsContact O-N 3.13Å; D1155-I1157 VanDerWaalsContact C-N 3.33Å; D1155-I1157 PolarHBondContact O-N 3.07Å; I1157-A1160 PolarHBondContact O-N 3.01Å; I1157-L1166 HydrophobicContact CG2-CD1 3.73Å; I1157-V1171 HydrophobicContact CG2-CG2 4.32Å; I1157-I1181 HydrophobicContact CD1-CD1 4.44Å; I1157-I1181 HydrophobicContact CG2-CD1 4.19Å; I1157-L1202 HydrophobicContact CG2-CD2 4.01Å; I1157-I1205 HydrophobicContact CG1-CD1 4.25Å
1158	L	88.9	Confident	84.6	Confident	36 Å²	36	65 Å²	65	19%	0.188	34%	0.341	C	S	.	.	H	α-helix	trans	-70.5	-31.3	-178.8	-68.9	173	0	0	0	112.9	V1154 D1155 L1166 P1168 V1171	V1154-L1158 HydrophobicContact CG1-CD1 3.91Å; V1154-L1158 HydrophobicContact CG1-CG 4.35Å; V1154-L1158 WeakPolarHBondContact O-CG 3.43Å; V1154-L1158 PolarHBondContact O-N 3.49Å; D1155-L1158 PolarHBondContact O-N 3.21Å; L1158-L1166 HydrophobicContact CD2-CB 4.31Å; L1158-P1168 HydrophobicContact CD1-CB 4.21Å; L1158-P1168 HydrophobicContact CD1-CG 4.23Å; L1158-V1171 HydrophobicContact CD2-CB 4.4Å; L1158-V1171 HydrophobicContact CD2-CG2 3.87Å
1159	T	86.4	Confident	84.4	Confident	115 Å²	115	73.3 Å²	73.3	71%	0.706	37%	0.371	S	S	*	.	H	α-helix	trans	-86.2	-15.5	178.4	53.8	0	0	0	0	113.6	D1155 C1156	D1155-T1159 WeakPolarHBondContact O-CB 3.27Å; D1155-T1159 WeakPolarHBondContact O-CG2 3.47Å; D1155-T1159 PolarHBondContact O-N 2.85Å; D1155-T1159 PolarHBondContact O-OG1 3.49Å; C1156-T1159 PolarHBondContact O-OG1 3.3Å
1160	A	83.8	Confident	84.1	Confident	27 Å²	27	70.8 Å²	70.8	22%	0.223	35%	0.354	C	S	.	.	S	Bend	trans	-63	138.8	180	0	0	0	0	0	112.7	C1156 I1157 L1162 I1205	C1156-A1160 WeakPolarHBondContact O-CB 3.15Å; C1156-A1160 PolarHBondContact O-N 3.47Å; C1156-A1160 VanDerWaalsContact O-N 3.1Å; I1157-A1160 PolarHBondContact O-N 3.01Å; A1160-L1162 HydrophobicContact CB-CG 4.16Å; A1160-L1162 PolarHBondContact O-N 3.5Å; A1160-I1205 HydrophobicContact CB-CD1 3.71Å; A1160-I1205 HydrophobicContact CB-CG1 3.96Å; A1160-I1205 HydrophobicContact CB-CG2 4.18Å
1161	K	80.3	Confident	84.2	Confident	217 Å²	217	69.8 Å²	69.8	94%	0.943	35%	0.349	S	S	*	.			trans	-78.5	71.9	175.3	-69.5	-177	-179.7	176.8	0	111
1162	L	77.6	Confident	84.1	Confident	29 Å²	29	69.9 Å²	69.9	15%	0.152	35%	0.346	C	S	.	.			trans	-80.9	160.6	175.2	-66.5	170.1	0	0	0	111.5	A1160 V1164 L1166 L1198 L1202 I1205	A1160-L1162 HydrophobicContact CB-CG 4.16Å; A1160-L1162 PolarHBondContact O-N 3.5Å; L1162-V1164 WeakPolarHBondContact CB-O 3.19Å; L1162-V1164 PolarHBondContact O-N 3.47Å; L1162-V1164 VanDerWaalsContact O-N 3.15Å; L1162-L1166 HydrophobicContact CD1-CD1 3.69Å; L1162-L1166 HydrophobicContact CD1-CG 4.21Å; L1162-L1198 HydrophobicContact CD1-CD2 4.15Å; L1162-L1202 HydrophobicContact CD1-CD2 4.01Å; L1162-I1205 HydrophobicContact CD1-CD1 4.28Å; L1162-I1205 HydrophobicContact CD2-CD1 4.2Å; L1162-I1205 HydrophobicContact CG-CD1 4.5Å
1163	F	74.1	Confident	84.1	Confident	135 Å²	135	70.4 Å²	70.4	59%	0.592	35%	0.348	S	S	*	.	S	Bend	trans	-55.3	-30	175.5	179.9	-103.5	0	0	0	112.7	M1189 L1194	F1163-M1189 HydrophobicContact CE1-SD 3.73Å; F1163-M1189 HydrophobicContact CZ-SD 4.26Å; F1163-L1194 HydrophobicContact CD1-CD1 4.32Å
1164	V	74	Confident	83.8	Confident	31 Å²	31	75.1 Å²	75.1	19%	0.188	37%	0.366	C	S	.	.	S	Bend	trans	-124.2	130.4	169.3	177.9	0	0	0	0	108.3	L1162 L1166 T1186 L1194	L1162-V1164 WeakPolarHBondContact CB-O 3.19Å; L1162-V1164 PolarHBondContact O-N 3.47Å; L1162-V1164 VanDerWaalsContact O-N 3.15Å; V1164-L1166 PolarHBondContact O-N 3.04Å; V1164-T1186 HydrophobicContact CG2-CG2 4.32Å; V1164-L1194 HydrophobicContact CB-CD1 4.38Å; V1164-L1194 HydrophobicContact CG2-CD1 3.59Å; V1164-L1194 HydrophobicContact CG2-CD2 4.15Å
1165	R	77.8	Confident	83.5	Confident	215 Å²	215	77 Å²	77	81%	0.811	39%	0.388	S	S	*	.			trans	-71.1	114.9	174.6	-174	177.6	-177.8	-179.6	-0.3	109
1166	L	81.3	Confident	83.2	Confident	7 Å²	7	78.9 Å²	78.9	4%	0.037	40%	0.398	C	S	.	.			trans	-75.1	140.7	175.6	-64.4	172.7	0	0	0	110.2	I1157 L1158 L1162 V1164 V1171 I1181 V1183 L1198	I1157-L1166 HydrophobicContact CG2-CD1 3.73Å; L1158-L1166 HydrophobicContact CD2-CB 4.31Å; L1162-L1166 HydrophobicContact CD1-CD1 3.69Å; L1162-L1166 HydrophobicContact CD1-CG 4.21Å; V1164-L1166 PolarHBondContact O-N 3.04Å; L1166-V1171 HydrophobicContact CB-CG2 4.46Å; L1166-V1171 HydrophobicContact CD1-CG2 4.37Å; L1166-I1181 HydrophobicContact CD1-CG2 4.05Å; L1166-I1181 HydrophobicContact CD2-CG2 4.09Å; L1166-V1183 HydrophobicContact CD2-CG2 4.05Å; L1166-L1198 HydrophobicContact CD2-CD1 4.47Å
1167	L	82.8	Confident	83.2	Confident	74 Å²	74	82 Å²	82	39%	0.387	41%	0.405	S	S	.	.			trans	-94.1	150.8	175.3	-64.8	170	0	0	0	110.2	R1169 Q1170	L1167-R1169 HydrophobicContact CB-CG 4.07Å; L1167-R1169 PolarHBondContact O-N 3.47Å; L1167-R1169 VanDerWaalsContact O-N 3.12Å; L1167-Q1170 HydrophobicContact CB-CG 4.3Å; L1167-Q1170 VanDerWaalsContact O-CB 3.3Å; L1167-Q1170 WeakPolarHBondContact O-CB 3.35Å; L1167-Q1170 PolarHBondContact O-N 3.42Å
1168	P	81.8	Confident	83.3	Confident	94 Å²	94	86.3 Å²	86.3	61%	0.61	42%	0.422	S	S	*	.	G	3₁₀ helix	trans	-52.9	-36.7	177.8	-28.2	34.9	0	0	0	113.9	L1158 Q1170 V1171	L1158-P1168 HydrophobicContact CD1-CB 4.21Å; L1158-P1168 HydrophobicContact CD1-CG 4.23Å; P1168-Q1170 PolarHBondContact O-N 2.92Å; P1168-Q1170 VanDerWaalsContact O-N 3.16Å; P1168-V1171 PolarHBondContact O-N 3.44Å; P1168-V1171 VanDerWaalsContact O-O 3.12Å
1169	R	82.4	Confident	83.4	Confident	192 Å²	192	84.6 Å²	84.6	73%	0.725	41%	0.413	S	S	*	.	G	3₁₀ helix	trans	-62.8	-19.8	176.8	70.5	-177.3	-178.4	170.1	5.1	114.6	L1167	L1167-R1169 HydrophobicContact CB-CG 4.07Å; L1167-R1169 PolarHBondContact O-N 3.47Å; L1167-R1169 VanDerWaalsContact O-N 3.12Å
1170	Q	84.5	Confident	83.6	Confident	24 Å²	24	79.2 Å²	79.2	11%	0.112	38%	0.38	C	S	.	.	G	3₁₀ helix	trans	-90.4	-13.5	-175.9	-70.9	177.2	-43.6	0	0	112.6	L1167 P1168 I1181 E1182	L1167-Q1170 HydrophobicContact CB-CG 4.3Å; L1167-Q1170 VanDerWaalsContact O-CB 3.3Å; L1167-Q1170 WeakPolarHBondContact O-CB 3.35Å; L1167-Q1170 PolarHBondContact O-N 3.42Å; P1168-Q1170 PolarHBondContact O-N 2.92Å; P1168-Q1170 VanDerWaalsContact O-N 3.16Å; Q1170-I1181 CarbonylContact O-C 3.54Å; Q1170-I1181 VanDerWaalsContact O-CA 3.29Å; Q1170-I1181 WeakPolarHBondContact O-CA 3.12Å; Q1170-E1182 WeakPolarHBondContact CB-O 3.27Å; Q1170-E1182 VanDerWaalsContact CG-O 3.27Å; Q1170-E1182 WeakPolarHBondContact CG-O 3.48Å; Q1170-E1182 PolarHBondContact O-N 2.82Å
1171	V	87.8	Confident	83.8	Confident	11 Å²	11	78 Å²	78	7%	0.067	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	115.9	-179	-173	0	0	0	0	108	V1154 I1157 L1158 L1166 P1168 I1179 S1180 I1181	V1154-V1171 HydrophobicContact CB-CG1 4.34Å; V1154-V1171 HydrophobicContact CG1-CB 4.25Å; V1154-V1171 HydrophobicContact CG1-CG1 3.76Å; V1154-V1171 HydrophobicContact CG2-CG1 3.9Å; I1157-V1171 HydrophobicContact CG2-CG2 4.32Å; L1158-V1171 HydrophobicContact CD2-CB 4.4Å; L1158-V1171 HydrophobicContact CD2-CG2 3.87Å; L1166-V1171 HydrophobicContact CB-CG2 4.46Å; L1166-V1171 HydrophobicContact CD1-CG2 4.37Å; P1168-V1171 PolarHBondContact O-N 3.44Å; P1168-V1171 VanDerWaalsContact O-O 3.12Å; V1171-I1179 HydrophobicContact CG1-CG2 3.73Å; V1171-S1180 WeakPolarHBondContact CA-O 3.16Å; V1171-I1181 HydrophobicContact CG1-CG1 4.24Å; V1171-I1181 HydrophobicContact CG2-CG1 4.26Å; V1171-I1181 HydrophobicContact CG2-CG2 4.42Å
1172	S	88.7	Confident	84	Confident	50 Å²	50	71.4 Å²	71.4	35%	0.35	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	139.8	-179.3	46.6	0	0	0	0	111.5	S1180	S1172-S1180 PolarHBondContact N-O 2.9Å; S1172-S1180 PolarHBondContact O-N 2.89Å; S1172-S1180 PolarHBondContact O-OG 3.49Å; S1172-S1180 PolarHBondContact OG-OG 2.8Å
1173	I	88.6	Confident	84	Confident	77 Å²	77	70.5 Å²	70.5	40%	0.395	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	123.4	174.9	-59.1	174.2	0	0	0	107.9	L1150 V1154 G1175	L1150-I1173 HydrophobicContact CB-CD1 4.18Å; L1150-I1173 HydrophobicContact CB-CG2 4.47Å; L1150-I1173 HydrophobicContact CD1-CG2 3.96Å; V1154-I1173 HydrophobicContact CG2-CD1 4.04Å; V1154-I1173 HydrophobicContact CG2-CG1 3.73Å; I1173-G1175 WeakPolarHBondContact CG2-O 3.14Å
1174	R	83.2	Confident	83.9	Confident	100 Å²	100	70.7 Å²	70.7	38%	0.377	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	100.9	177	-67.6	-167.5	-177.8	-174.4	2.1	109.7	Y1178 S1180	R1174-Y1178 PolarHBondContact N-O 3.03Å; R1174-Y1178 VanDerWaalsContact O-CB 3.31Å; R1174-Y1178 WeakPolarHBondContact O-CB 3.47Å; R1174-Y1178 PolarHBondContact O-N 3.5Å; R1174-S1180 WeakPolarHBondContact CD-OG 3.45Å; R1174-S1180 WeakPolarHBondContact CG-OG 3.39Å; R1174-S1180 PolarHBondContact NE-OG 3.48Å
1175	G	84	Confident	83.4	Confident	53 Å²	53	71.4 Å²	71.4	55%	0.546	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.2	-155.6	-176.5	0	0	0	0	0	112.7	I1173	I1173-G1175 WeakPolarHBondContact CG2-O 3.14Å
1176	N	83.2	Confident	82.8	Confident	137 Å²	137	63.9 Å²	63.9	73%	0.733	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.7	-2.1	-171.6	-65.4	-2	0	0	0	114.2	I1138 L1150	I1138-N1176 WeakPolarHBondContact CD1-O 3.48Å; L1150-N1176 VanDerWaalsContact CD1-C 3.45Å; L1150-N1176 VanDerWaalsContact CD1-O 3.24Å; L1150-N1176 WeakPolarHBondContact CD1-O 3.37Å
1177	R	88.2	Confident	82	Confident	97 Å²	97	74.3 Å²	74.3	37%	0.366	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-136.1	-8.4	-173.3	-68.4	-173	-173.8	-155.9	2.9	115.3	I1136 I1138 E1139	I1136-R1177 PolarHBondContact N-O 3.35Å; I1138-R1177 HydrophobicContact CD1-CG 3.59Å; I1138-R1177 HydrophobicContact CG1-CG 4.09Å; E1139-R1177 IonicContact OE1-NH1 3.56Å
1178	Y	90.2	Very high	81.1	Confident	91 Å²	91	80 Å²	80	36%	0.357	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	142.5	-173	-55.1	-87.9	0	0	0	112.7	L1133 L1134 K1135 R1174	L1133-Y1178 HydrophobicContact CD1-CD1 4.38Å; L1133-Y1178 HydrophobicContact CD2-CD1 4.23Å; L1133-Y1178 HydrophobicContact CG-CD1 4.19Å; L1134-Y1178 CarbonylContact O-C 3.51Å; L1134-Y1178 VanDerWaalsContact O-CA 3.29Å; L1134-Y1178 WeakPolarHBondContact O-CA 3.26Å; K1135-Y1178 HydrophobicContact CB-CD1 3.92Å; K1135-Y1178 HydrophobicContact CB-CE1 3.76Å; K1135-Y1178 HydrophobicContact CD-CE1 3.85Å; K1135-Y1178 HydrophobicContact CG-CD1 4.02Å; K1135-Y1178 HydrophobicContact CG-CE1 3.5Å; R1174-Y1178 PolarHBondContact N-O 3.03Å; R1174-Y1178 VanDerWaalsContact O-CB 3.31Å; R1174-Y1178 WeakPolarHBondContact O-CB 3.47Å; R1174-Y1178 PolarHBondContact O-N 3.5Å
1179	I	90.8	Very high	80.4	Confident	0 Å²	0	78.3 Å²	78.3	0%	0	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	126.4	170.3	-59.9	173.7	0	0	0	107.5	L1134 I1136 L1150 I1153 V1154 V1171 I1181	L1134-I1179 HydrophobicContact CB-CB 4.44Å; L1134-I1179 PolarHBondContact N-O 2.85Å; L1134-I1179 PolarHBondContact O-N 3.32Å; I1136-I1179 HydrophobicContact CD1-CD1 4.39Å; I1136-I1179 HydrophobicContact CG1-CD1 4.07Å; I1136-I1179 HydrophobicContact CG1-CG1 4.39Å; L1150-I1179 HydrophobicContact CD2-CD1 4.24Å; L1150-I1179 HydrophobicContact CD2-CG1 4.39Å; I1153-I1179 HydrophobicContact CB-CD1 4.12Å; I1153-I1179 HydrophobicContact CG2-CD1 3.61Å; V1154-I1179 HydrophobicContact CG2-CD1 4.08Å; V1154-I1179 HydrophobicContact CG2-CG1 4.39Å; V1154-I1179 HydrophobicContact CG2-CG2 4.19Å; V1171-I1179 HydrophobicContact CG1-CG2 3.73Å; I1179-I1181 HydrophobicContact CG2-CG1 4.42Å
1180	S	89.8	Confident	80	Confident	2 Å²	2	77.5 Å²	77.5	1%	0.014	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	129.7	174.3	50.8	0	0	0	0	111.8	L1132 V1171 S1172 R1174	L1132-S1180 CarbonylContact O-C 3.49Å; L1132-S1180 VanDerWaalsContact O-CA 3.32Å; L1132-S1180 WeakPolarHBondContact O-CA 3.33Å; V1171-S1180 WeakPolarHBondContact CA-O 3.16Å; S1172-S1180 PolarHBondContact N-O 2.9Å; S1172-S1180 PolarHBondContact O-N 2.89Å; S1172-S1180 PolarHBondContact O-OG 3.49Å; S1172-S1180 PolarHBondContact OG-OG 2.8Å; R1174-S1180 WeakPolarHBondContact CD-OG 3.45Å; R1174-S1180 WeakPolarHBondContact CG-OG 3.39Å; R1174-S1180 PolarHBondContact NE-OG 3.48Å
1181	I	89.1	Confident	79.4	Confident	1 Å²	1	77.7 Å²	77.7	1%	0.005	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	116	177.9	-55.6	175.7	0	0	0	109.3	F1131 L1132 L1134 I1157 L1166 Q1170 V1171 I1179 V1183 L1202	F1131-I1181 CarbonylContact C-O 3.52Å; F1131-I1181 VanDerWaalsContact CA-O 3.26Å; F1131-I1181 WeakPolarHBondContact CA-O 3.31Å; F1131-I1181 WeakPolarHBondContact CB-O 3.23Å; L1132-I1181 HydrophobicContact CB-CB 4.25Å; L1132-I1181 PolarHBondContact N-O 2.95Å; L1132-I1181 PolarHBondContact O-N 3.34Å; L1134-I1181 HydrophobicContact CD1-CD1 3.72Å; L1134-I1181 HydrophobicContact CD1-CG1 4.06Å; I1157-I1181 HydrophobicContact CD1-CD1 4.44Å; I1157-I1181 HydrophobicContact CG2-CD1 4.19Å; L1166-I1181 HydrophobicContact CD1-CG2 4.05Å; L1166-I1181 HydrophobicContact CD2-CG2 4.09Å; Q1170-I1181 CarbonylContact O-C 3.54Å; Q1170-I1181 VanDerWaalsContact O-CA 3.29Å; Q1170-I1181 WeakPolarHBondContact O-CA 3.12Å; V1171-I1181 HydrophobicContact CG1-CG1 4.24Å; V1171-I1181 HydrophobicContact CG2-CG1 4.26Å; V1171-I1181 HydrophobicContact CG2-CG2 4.42Å; I1179-I1181 HydrophobicContact CG2-CG1 4.42Å; I1181-V1183 HydrophobicContact CG2-CG2 3.93Å; I1181-L1202 HydrophobicContact CD1-CD1 3.61Å; I1181-L1202 HydrophobicContact CD1-CD2 3.85Å; I1181-L1202 HydrophobicContact CD1-CG 4.41Å
1182	E	85.1	Confident	78.8	Confident	79 Å²	79	79.2 Å²	79.2	37%	0.369	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	129.1	-178.1	-173	167.6	-174	0	0	110.8	T1129 F1131 Q1170	T1129-E1182 WeakPolarHBondContact CB-OE1 3.22Å; T1129-E1182 WeakPolarHBondContact CG2-OE1 3.42Å; F1131-E1182 HydrophobicContact CB-CB 4.09Å; F1131-E1182 HydrophobicContact CB-CG 4.4Å; Q1170-E1182 WeakPolarHBondContact CB-O 3.27Å; Q1170-E1182 VanDerWaalsContact CG-O 3.27Å; Q1170-E1182 WeakPolarHBondContact CG-O 3.48Å; Q1170-E1182 PolarHBondContact O-N 2.82Å
1183	V	77.1	Confident	78.3	Confident	10 Å²	10	79.5 Å²	79.5	6%	0.061	41%	0.408	C	S	.	.			trans	-136	134.4	-170.9	-158.6	0	0	0	0	111.7	L1166 I1181 L1194 L1195 L1198	L1166-V1183 HydrophobicContact CD2-CG2 4.05Å; I1181-V1183 HydrophobicContact CG2-CG2 3.93Å; V1183-L1194 HydrophobicContact CB-CD2 4.41Å; V1183-L1194 HydrophobicContact CG1-CD2 3.45Å; V1183-L1194 VanDerWaalsContact CG1-CD2 3.45Å; V1183-L1194 HydrophobicContact CG1-CG 4.33Å; V1183-L1195 HydrophobicContact CB-CD2 4.49Å; V1183-L1195 HydrophobicContact CG2-CD2 4.12Å; V1183-L1198 HydrophobicContact CB-CD1 4.47Å; V1183-L1198 HydrophobicContact CG1-CD1 4.37Å; V1183-L1198 HydrophobicContact CG2-CD1 3.69Å
1184	E	70.9	Confident	78	Confident	139 Å²	139	75.9 Å²	75.9	65%	0.65	39%	0.389	S	S	*	.	P	Polyproline II helix	trans	-89.6	147.4	174.2	-66.1	172.5	-170.5	0	0	110.8
1185	G	65	Low	77.9	Confident	47 Å²	47	71.1 Å²	71.1	49%	0.485	37%	0.371	S	S	.	.	P	Polyproline II helix	trans	-63.2	148.1	178.5	0	0	0	0	0	112.9
1186	T	64.5	Low	77.9	Confident	56 Å²	56	73.2 Å²	73.2	34%	0.344	37%	0.369	S	S	.	.	B	Isolated β-bridge	trans	-99.8	161.4	174.4	66.1	0	0	0	0	110.5	V1164 K1188 M1189	V1164-T1186 HydrophobicContact CG2-CG2 4.32Å; T1186-K1188 PolarHBondContact O-N 3.41Å; T1186-M1189 PolarHBondContact N-O 3.13Å; T1186-M1189 PolarHBondContact O-N 3.47Å; T1186-M1189 VanDerWaalsContact O-O 3.04Å; T1186-M1189 PolarHBondContact OG1-N 2.99Å
1187	K	64.3	Low	77.8	Confident	226 Å²	226	70.4 Å²	70.4	98%	0.983	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.2	-17.9	175.6	-71.7	-173.2	177.7	-177	0	114.6
1188	K	63.3	Low	77.7	Confident	194 Å²	194	65.9 Å²	65.9	84%	0.843	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.6	-19.3	-179	-66.4	-175.2	178.1	-178.1	0	114.2	T1186	T1186-K1188 PolarHBondContact O-N 3.41Å
1189	M	68.3	Low	77.4	Confident	58 Å²	58	67.5 Å²	67.5	29%	0.286	34%	0.339	S	S	.	.	B	Isolated β-bridge	trans	-147.9	132.8	-174.4	-70.8	-174.1	71.1	0	0	112.2	F1163 T1186	F1163-M1189 HydrophobicContact CE1-SD 3.73Å; F1163-M1189 HydrophobicContact CZ-SD 4.26Å; T1186-M1189 PolarHBondContact N-O 3.13Å; T1186-M1189 PolarHBondContact O-N 3.47Å; T1186-M1189 VanDerWaalsContact O-O 3.04Å; T1186-M1189 PolarHBondContact OG1-N 2.99Å
1190	F	73.5	Confident	77.1	Confident	176 Å²	176	74.9 Å²	74.9	77%	0.772	37%	0.372	S	S	*	.			trans	-62.9	149.6	171.8	-72.3	-81.1	0	0	0	112	A1192 S1193 L1194	F1190-A1192 VanDerWaalsContact C-N 3.31Å; F1190-A1192 PolarHBondContact O-N 3.22Å; F1190-S1193 PolarHBondContact O-N 3.38Å; F1190-S1193 VanDerWaalsContact O-N 3.15Å; F1190-L1194 PolarHBondContact O-N 3.04Å
1191	A	72.3	Confident	76.9	Confident	27 Å²	27	76.1 Å²	76.1	22%	0.223	38%	0.381	C	S	.	.	H	α-helix	trans	-56.1	-41.1	-176.6	0	0	0	0	0	113	S1193 L1194 L1195	A1191-S1193 PolarHBondContact O-N 3.34Å; A1191-L1194 PolarHBondContact O-N 3.37Å; A1191-L1195 WeakPolarHBondContact O-CG 3.4Å; A1191-L1195 PolarHBondContact O-N 2.96Å
1192	A	74.7	Confident	76.8	Confident	44 Å²	44	76.2 Å²	76.2	36%	0.364	38%	0.381	S	S	.	.	H	α-helix	trans	-63	-43.5	177.7	0	0	0	0	0	112.9	Y1125 F1190 L1194 L1195 I1196	Y1125-A1192 HydrophobicContact CE1-CB 4.39Å; F1190-A1192 VanDerWaalsContact C-N 3.31Å; F1190-A1192 PolarHBondContact O-N 3.22Å; A1192-L1194 VanDerWaalsContact C-N 3.31Å; A1192-L1194 PolarHBondContact O-N 2.74Å; A1192-L1195 PolarHBondContact O-N 3.18Å; A1192-I1196 WeakPolarHBondContact O-CG1 3.42Å; A1192-I1196 PolarHBondContact O-N 3.49Å; A1192-I1196 VanDerWaalsContact O-N 3.07Å
1193	S	79.1	Confident	76.9	Confident	56 Å²	56	75.4 Å²	75.4	39%	0.392	38%	0.379	S	S	.	.	H	α-helix	trans	-66.3	-35.9	176.6	-52.2	0	0	0	0	111.9	F1190 A1191 I1196 H1197	F1190-S1193 PolarHBondContact O-N 3.38Å; F1190-S1193 VanDerWaalsContact O-N 3.15Å; A1191-S1193 PolarHBondContact O-N 3.34Å; S1193-I1196 PolarHBondContact O-N 3.45Å; S1193-H1197 PolarHBondContact O-N 3.33Å; S1193-H1197 VanDerWaalsContact O-N 3.13Å
1194	L	80.6	Confident	77.5	Confident	0 Å²	0	82.4 Å²	82.4	0%	0	41%	0.411	C	S	.	.	H	α-helix	trans	-66.6	-42.5	175.4	-175.6	61.3	0	0	0	111.5	F1163 V1164 V1183 F1190 A1191 A1192 I1196 H1197 L1198	F1163-L1194 HydrophobicContact CD1-CD1 4.32Å; V1164-L1194 HydrophobicContact CB-CD1 4.38Å; V1164-L1194 HydrophobicContact CG2-CD1 3.59Å; V1164-L1194 HydrophobicContact CG2-CD2 4.15Å; V1183-L1194 HydrophobicContact CB-CD2 4.41Å; V1183-L1194 HydrophobicContact CG1-CD2 3.45Å; V1183-L1194 VanDerWaalsContact CG1-CD2 3.45Å; V1183-L1194 HydrophobicContact CG1-CG 4.33Å; F1190-L1194 PolarHBondContact O-N 3.04Å; A1191-L1194 PolarHBondContact O-N 3.37Å; A1192-L1194 VanDerWaalsContact C-N 3.31Å; A1192-L1194 PolarHBondContact O-N 2.74Å; L1194-I1196 PolarHBondContact O-N 2.9Å; L1194-H1197 PolarHBondContact O-N 3.37Å; L1194-L1198 HydrophobicContact CD1-CD1 4.48Å; L1194-L1198 HydrophobicContact CD1-CG 4.46Å; L1194-L1198 HydrophobicContact CG-CD1 4.07Å; L1194-L1198 HydrophobicContact CG-CG 4.48Å; L1194-L1198 WeakPolarHBondContact O-CB 3.07Å; L1194-L1198 WeakPolarHBondContact O-CG 3.42Å; L1194-L1198 PolarHBondContact O-N 3.49Å
1195	L	82.1	Confident	78.4	Confident	0 Å²	0	76.5 Å²	76.5	0%	0	38%	0.384	C	S	.	.	H	α-helix	trans	-62.4	-39.3	175.2	-72.9	170.9	0	0	0	112.1	Y1125 C1130 L1132 V1183 A1191 A1192 H1197 L1198 R1199	Y1125-L1195 HydrophobicContact CE1-CD1 4.41Å; C1130-L1195 HydrophobicContact CB-CD1 3.63Å; L1132-L1195 HydrophobicContact CB-CD2 4.22Å; L1132-L1195 HydrophobicContact CD1-CB 4.24Å; L1132-L1195 HydrophobicContact CD1-CD2 3.86Å; L1132-L1195 WeakPolarHBondContact CD1-O 3.2Å; V1183-L1195 HydrophobicContact CB-CD2 4.49Å; V1183-L1195 HydrophobicContact CG2-CD2 4.12Å; A1191-L1195 WeakPolarHBondContact O-CG 3.4Å; A1191-L1195 PolarHBondContact O-N 2.96Å; A1192-L1195 PolarHBondContact O-N 3.18Å; L1195-H1197 VanDerWaalsContact C-N 3.34Å; L1195-H1197 PolarHBondContact O-N 2.87Å; L1195-L1198 PolarHBondContact O-N 3.2Å; L1195-R1199 WeakPolarHBondContact O-CB 3.38Å; L1195-R1199 PolarHBondContact O-N 3.21Å
1196	I	83	Confident	79.6	Confident	98 Å²	98	76.2 Å²	76.2	50%	0.503	37%	0.372	S	S	.	.	H	α-helix	trans	-63.2	-41.2	174.8	-67.2	166.3	0	0	0	111.3	A1192 S1193 L1194	A1192-I1196 WeakPolarHBondContact O-CG1 3.42Å; A1192-I1196 PolarHBondContact O-N 3.49Å; A1192-I1196 VanDerWaalsContact O-N 3.07Å; S1193-I1196 PolarHBondContact O-N 3.45Å; L1194-I1196 PolarHBondContact O-N 2.9Å
1197	H	82.9	Confident	80.8	Confident	78 Å²	78	74 Å²	74	36%	0.361	36%	0.359	S	S	.	.	H	α-helix	trans	-69.3	-41.9	177.9	-171.1	71.9	0	0	0	112.1	S1193 L1194 L1195 K1200 S1201	S1193-H1197 PolarHBondContact O-N 3.33Å; S1193-H1197 VanDerWaalsContact O-N 3.13Å; L1194-H1197 PolarHBondContact O-N 3.37Å; L1195-H1197 VanDerWaalsContact C-N 3.34Å; L1195-H1197 PolarHBondContact O-N 2.87Å; H1197-K1200 PolarHBondContact O-N 3.28Å; H1197-S1201 PolarHBondContact O-N 2.98Å; H1197-S1201 PolarHBondContact O-OG 3.49Å
1198	L	84.1	Confident	82	Confident	1 Å²	1	65 Å²	65	1%	0.005	32%	0.32	C	S	.	.	H	α-helix	trans	-64	-41.1	175.1	-75.7	172.5	0	0	0	111.4	L1162 L1166 V1183 L1194 L1195 K1200 S1201 L1202	L1162-L1198 HydrophobicContact CD1-CD2 4.15Å; L1166-L1198 HydrophobicContact CD2-CD1 4.47Å; V1183-L1198 HydrophobicContact CB-CD1 4.47Å; V1183-L1198 HydrophobicContact CG1-CD1 4.37Å; V1183-L1198 HydrophobicContact CG2-CD1 3.69Å; L1194-L1198 HydrophobicContact CD1-CD1 4.48Å; L1194-L1198 HydrophobicContact CD1-CG 4.46Å; L1194-L1198 HydrophobicContact CG-CD1 4.07Å; L1194-L1198 HydrophobicContact CG-CG 4.48Å; L1194-L1198 WeakPolarHBondContact O-CB 3.07Å; L1194-L1198 WeakPolarHBondContact O-CG 3.42Å; L1194-L1198 PolarHBondContact O-N 3.49Å; L1195-L1198 PolarHBondContact O-N 3.2Å; L1198-K1200 PolarHBondContact O-N 3.48Å; L1198-S1201 PolarHBondContact O-N 2.99Å; L1198-S1201 VanDerWaalsContact O-N 3.14Å; L1198-L1202 HydrophobicContact CB-CD1 4.15Å; L1198-L1202 HydrophobicContact CB-CG 4.46Å; L1198-L1202 VanDerWaalsContact O-CB 3.22Å; L1198-L1202 WeakPolarHBondContact O-CB 3.44Å; L1198-L1202 WeakPolarHBondContact O-CD1 3.31Å; L1198-L1202 WeakPolarHBondContact O-CG 3.11Å; L1198-L1202 PolarHBondContact O-N 3.32Å
1199	R	84.7	Confident	83.2	Confident	125 Å²	125	56.7 Å²	56.7	47%	0.472	29%	0.29	S	S	.	.	H	α-helix	trans	-51.6	-41.7	176.1	-176.2	177.9	175.2	-170	-1.3	112.4	V1121 L1132 L1195 L1203	V1121-R1199 HydrophobicContact CG1-CG 3.97Å; L1132-R1199 HydrophobicContact CD1-CB 4.12Å; L1195-R1199 WeakPolarHBondContact O-CB 3.38Å; L1195-R1199 PolarHBondContact O-N 3.21Å; R1199-L1203 WeakPolarHBondContact O-CG 3.26Å
1200	K	83.8	Confident	84.3	Confident	155 Å²	155	54.9 Å²	54.9	67%	0.674	28%	0.281	S	S	*	.	H	α-helix	trans	-75.8	-46.4	177.2	-68.5	-173.5	178.4	-176.1	0	111.9	H1197 L1198 L1202 L1203	H1197-K1200 PolarHBondContact O-N 3.28Å; L1198-K1200 PolarHBondContact O-N 3.48Å; K1200-L1202 PolarHBondContact O-N 3.16Å; K1200-L1203 PolarHBondContact O-N 2.8Å
1201	S	86.5	Confident	85	Confident	29 Å²	29	49.8 Å²	49.8	20%	0.203	27%	0.265	C	S	.	.	H	α-helix	trans	-70.6	-32.1	-173.8	-51.3	0	0	0	0	113.3	H1197 L1198 L1203 E1204	H1197-S1201 PolarHBondContact O-N 2.98Å; H1197-S1201 PolarHBondContact O-OG 3.49Å; L1198-S1201 PolarHBondContact O-N 2.99Å; L1198-S1201 VanDerWaalsContact O-N 3.14Å; S1201-L1203 VanDerWaalsContact C-N 3.32Å; S1201-L1203 PolarHBondContact O-N 3.04Å; S1201-E1204 PolarHBondContact O-N 3.34Å
1202	L	87.4	Confident	85.8	Confident	2 Å²	2	50.4 Å²	50.4	1%	0.01	27%	0.268	C	S	.	.	H	α-helix	trans	-64.5	-37.1	179.4	-75.8	167	0	0	0	111.7	L1114 L1132 I1157 L1162 I1181 L1198 K1200 E1204 I1205	L1114-L1202 WeakPolarHBondContact CB-O 3.41Å; L1114-L1202 HydrophobicContact CD2-CB 4.44Å; L1114-L1202 WeakPolarHBondContact CD2-O 3.29Å; L1132-L1202 HydrophobicContact CD2-CD1 3.8Å; I1157-L1202 HydrophobicContact CG2-CD2 4.01Å; L1162-L1202 HydrophobicContact CD1-CD2 4.01Å; I1181-L1202 HydrophobicContact CD1-CD1 3.61Å; I1181-L1202 HydrophobicContact CD1-CD2 3.85Å; I1181-L1202 HydrophobicContact CD1-CG 4.41Å; L1198-L1202 HydrophobicContact CB-CD1 4.15Å; L1198-L1202 HydrophobicContact CB-CG 4.46Å; L1198-L1202 VanDerWaalsContact O-CB 3.22Å; L1198-L1202 WeakPolarHBondContact O-CB 3.44Å; L1198-L1202 WeakPolarHBondContact O-CD1 3.31Å; L1198-L1202 WeakPolarHBondContact O-CG 3.11Å; L1198-L1202 PolarHBondContact O-N 3.32Å; K1200-L1202 PolarHBondContact O-N 3.16Å; L1202-E1204 PolarHBondContact O-N 2.89Å; L1202-I1205 HydrophobicContact CD2-CD1 3.71Å; L1202-I1205 WeakPolarHBondContact O-CB 3.45Å; L1202-I1205 WeakPolarHBondContact O-CG1 3.45Å; L1202-I1205 PolarHBondContact O-N 3.25Å
1203	L	87.8	Confident	86.5	Confident	62 Å²	62	48.3 Å²	48.3	33%	0.325	25%	0.251	S	S	.	.	H	α-helix	trans	-65.8	-23.7	-177.6	-66.1	172.7	0	0	0	112.9	T1113 G1115 V1121 R1199 K1200 S1201	T1113-L1203 WeakPolarHBondContact CB-O 3.44Å; G1115-L1203 PolarHBondContact N-O 2.99Å; V1121-L1203 HydrophobicContact CG2-CD2 3.85Å; R1199-L1203 WeakPolarHBondContact O-CG 3.26Å; K1200-L1203 PolarHBondContact O-N 2.8Å; S1201-L1203 VanDerWaalsContact C-N 3.32Å; S1201-L1203 PolarHBondContact O-N 3.04Å
1204	E	88.2	Confident	86.6	Confident	157 Å²	157	51.8 Å²	51.8	73%	0.734	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.1	-5.6	179.8	-62	-175.7	173.6	0	0	113.5	S1201 L1202 V1206	S1201-E1204 PolarHBondContact O-N 3.34Å; L1202-E1204 PolarHBondContact O-N 2.89Å; E1204-V1206 PolarHBondContact O-N 3.23Å
1205	I	90	Very high	86.7	Confident	16 Å²	16	56.7 Å²	56.7	8%	0.082	28%	0.277	C	S	.	.			trans	-65.4	131.8	179.2	-63	175.1	0	0	0	109.5	T1113 L1114 C1156 I1157 A1160 L1162 L1202 V1207	T1113-I1205 CarbonylContact C-O 3.5Å; T1113-I1205 VanDerWaalsContact CA-O 3.27Å; T1113-I1205 WeakPolarHBondContact CA-O 3.32Å; L1114-I1205 HydrophobicContact CB-CB 4.47Å; L1114-I1205 PolarHBondContact N-O 2.93Å; C1156-I1205 HydrophobicContact CB-CG2 4.47Å; I1157-I1205 HydrophobicContact CG1-CD1 4.25Å; A1160-I1205 HydrophobicContact CB-CD1 3.71Å; A1160-I1205 HydrophobicContact CB-CG1 3.96Å; A1160-I1205 HydrophobicContact CB-CG2 4.18Å; L1162-I1205 HydrophobicContact CD1-CD1 4.28Å; L1162-I1205 HydrophobicContact CD2-CD1 4.2Å; L1162-I1205 HydrophobicContact CG-CD1 4.5Å; L1202-I1205 HydrophobicContact CD2-CD1 3.71Å; L1202-I1205 WeakPolarHBondContact O-CB 3.45Å; L1202-I1205 WeakPolarHBondContact O-CG1 3.45Å; L1202-I1205 PolarHBondContact O-N 3.25Å; I1205-V1207 PolarHBondContact O-N 3.39Å
1206	V	90.4	Very high	87	Confident	41 Å²	41	56.7 Å²	56.7	25%	0.248	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	118.5	173.9	-177.6	0	0	0	0	108.6	R1111 E1204 H1208 P1211	R1111-V1206 HydrophobicContact CB-CG1 4.26Å; E1204-V1206 PolarHBondContact O-N 3.23Å; V1206-H1208 WeakPolarHBondContact CG1-O 3.17Å; V1206-P1211 HydrophobicContact CB-CG 4.38Å; V1206-P1211 HydrophobicContact CG1-CG 4.23Å; V1206-P1211 HydrophobicContact CG2-CB 4.21Å; V1206-P1211 HydrophobicContact CG2-CG 4.36Å
1207	V	89.7	Confident	87.1	Confident	9 Å²	9	52.4 Å²	52.4	6%	0.055	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	-25.2	-179.6	-66.5	0	0	0	0	112.8	T1112 L1114 V1117 I1153 I1205	T1112-V1207 HydrophobicContact CG2-CG2 4.24Å; T1112-V1207 WeakPolarHBondContact O-CG2 3.46Å; T1112-V1207 PolarHBondContact O-N 2.63Å; L1114-V1207 HydrophobicContact CB-CG1 3.78Å; L1114-V1207 HydrophobicContact CD1-CG1 3.88Å; L1114-V1207 HydrophobicContact CG-CG1 4.38Å; V1117-V1207 HydrophobicContact CG2-CG2 4.06Å; I1153-V1207 HydrophobicContact CG1-CB 4.41Å; I1153-V1207 HydrophobicContact CG1-CG1 4.35Å; I1153-V1207 HydrophobicContact CG2-CG1 4.23Å; I1205-V1207 PolarHBondContact O-N 3.39Å
1208	H	89.5	Confident	87.3	Confident	37 Å²	37	50.6 Å²	50.6	17%	0.171	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	159.3	177.4	-158.1	65.5	0	0	0	110.4	G1107 T1112 V1148 V1206	G1107-H1208 PolarHBondContact O-CD2 3.33Å; T1112-H1208 PolarHBondContact N-O 2.87Å; T1112-H1208 PolarHBondContact O-N 3.21Å; V1148-H1208 HydrophobicContact CG2-CB 3.48Å; V1148-H1208 VanDerWaalsContact CG2-CB 3.48Å; V1148-H1208 VanDerWaalsContact CG2-ND1 3.28Å; V1148-H1208 WeakPolarHBondContact CG2-ND1 3.47Å; V1206-H1208 WeakPolarHBondContact CG1-O 3.17Å
1209	G	89.8	Confident	87.3	Confident	20 Å²	20	52 Å²	52	21%	0.206	26%	0.256	C	S	.	.	S	Bend	trans	78.8	-178.8	-178	0	0	0	0	0	114.3	R1108	R1108-G1209 WeakPolarHBondContact O-CA 3.24Å
1210	L	90.4	Very high	87	Confident	19 Å²	19	48.9 Å²	48.9	10%	0.099	26%	0.257	C	S	.	.			trans	-89.8	123.3	-177.2	-67.2	178.2	0	0	0	110.7	L1109 R1111 S1212 V1213 R1239 V1240 I1243	L1109-L1210 HydrophobicContact CD2-CD1 4.05Å; L1109-L1210 PolarHBondContact O-N 3.28Å; L1109-L1210 VanDerWaalsContact O-N 3.08Å; R1111-L1210 WeakPolarHBondContact CB-O 3.48Å; L1210-S1212 PolarHBondContact O-N 3.23Å; L1210-V1213 HydrophobicContact CB-CB 4.27Å; L1210-V1213 HydrophobicContact CB-CG2 3.78Å; L1210-V1213 HydrophobicContact CD1-CG2 4.07Å; L1210-V1213 PolarHBondContact O-N 3.02Å; L1210-R1239 HydrophobicContact CD1-CB 3.92Å; L1210-R1239 HydrophobicContact CD2-CB 3.92Å; L1210-V1240 HydrophobicContact CD1-CG2 3.79Å; L1210-I1243 HydrophobicContact CD1-CD1 4.47Å; L1210-I1243 HydrophobicContact CD1-CG1 4.17Å; L1210-I1243 HydrophobicContact CD2-CD1 4.33Å; L1210-I1243 HydrophobicContact CG-CD1 4.4Å
1211	P	88.5	Confident	86.3	Confident	69 Å²	69	44.5 Å²	44.5	45%	0.448	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57	-25.7	-179	-26.6	33.8	0	0	0	114.7	V1206	V1206-P1211 HydrophobicContact CB-CG 4.38Å; V1206-P1211 HydrophobicContact CG1-CG 4.23Å; V1206-P1211 HydrophobicContact CG2-CB 4.21Å; V1206-P1211 HydrophobicContact CG2-CG 4.36Å
1212	S	88.2	Confident	85.2	Confident	40 Å²	40	52.3 Å²	52.3	28%	0.28	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-26.3	179.4	48.1	0	0	0	0	113.5	L1210 K1214 S1234 D1236	L1210-S1212 PolarHBondContact O-N 3.23Å; S1212-K1214 PolarHBondContact O-N 3.19Å; S1212-S1234 WeakPolarHBondContact CB-OG 3.25Å; S1212-S1234 PolarHBondContact O-OG 3.44Å; S1212-S1234 PolarHBondContact OG-OG 2.89Å; S1212-D1236 WeakPolarHBondContact OG-CB 3.41Å; S1212-D1236 PolarHBondContact OG-OD2 3.01Å
1213	V	89.4	Confident	83.9	Confident	0 Å²	0	61.6 Å²	61.6	0%	0	31%	0.314	C	S	.	.			trans	-86.8	106.1	-179.1	-179.6	0	0	0	0	109	L1109 R1111 L1210 C1216 A1232 V1240	L1109-V1213 WeakPolarHBondContact O-CB 3.29Å; R1111-V1213 WeakPolarHBondContact CB-O 3.31Å; R1111-V1213 WeakPolarHBondContact CD-O 3.42Å; R1111-V1213 VanDerWaalsContact CG-O 3.27Å; R1111-V1213 WeakPolarHBondContact CG-O 3.44Å; R1111-V1213 PolarHBondContact N-O 3.13Å; L1210-V1213 HydrophobicContact CB-CB 4.27Å; L1210-V1213 HydrophobicContact CB-CG2 3.78Å; L1210-V1213 HydrophobicContact CD1-CG2 4.07Å; L1210-V1213 PolarHBondContact O-N 3.02Å; V1213-C1216 HydrophobicContact CG1-CB 4.48Å; V1213-A1232 HydrophobicContact CG1-CB 4.14Å; V1213-V1240 HydrophobicContact CG2-CG2 4.17Å
1214	K	82	Confident	82.6	Confident	129 Å²	129	63.8 Å²	63.8	56%	0.561	33%	0.33	S	S	*	.			trans	-75.1	-36.6	-179.3	-70.5	-178.1	-176.6	172.3	0	113	S1212 E1233	S1212-K1214 PolarHBondContact O-N 3.19Å; K1214-E1233 PolarHBondContact N-O 3.44Å
1215	R	83.2	Confident	81	Confident	103 Å²	103	58.3 Å²	58.3	39%	0.389	32%	0.316	S	S	.	.			trans	-153.4	142.8	-172.6	-179.2	179.3	-72.4	-163	-4.9	109.4	G730 M1065 T1217 E1233	G730-R1215 PolarHBondContact O-NH1 3.19Å; M1065-R1215 HydrophobicContact CE-CG 4.26Å; R1215-T1217 HydrophobicContact CG-CG2 4.46Å; R1215-E1233 PolarHBondContact O-N 3.05Å
1216	C	87.4	Confident	80.1	Confident	1 Å²	1	65.5 Å²	65.5	1%	0.007	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	130.5	173.4	-168.6	0	0	0	0	110.5	K1106 E1110 V1213 L1231	K1106-C1216 VanDerWaalsContact CE-O 3.23Å; K1106-C1216 WeakPolarHBondContact CE-O 2.86Å; K1106-C1216 HydrophobicContact CG-CB 4.02Å; E1110-C1216 HydrophobicContact CB-CB 4.05Å; E1110-C1216 PolarHBondContact OE1-N 2.8Å; V1213-C1216 HydrophobicContact CG1-CB 4.48Å; C1216-L1231 WeakPolarHBondContact CA-O 3.37Å
1217	T	85.9	Confident	79.8	Confident	7 Å²	7	64.9 Å²	64.9	4%	0.043	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	144.5	178.5	55.3	0	0	0	0	111.4	M1065 R1215 L1230 L1231	M1065-T1217 HydrophobicContact CE-CG2 4.45Å; R1215-T1217 HydrophobicContact CG-CG2 4.46Å; T1217-L1230 CarbonylContact O-C 3.55Å; T1217-L1230 WeakPolarHBondContact O-CA 3.39Å; T1217-L1231 PolarHBondContact N-O 3.28Å; T1217-L1231 PolarHBondContact O-N 3.35Å
1218	I	87.1	Confident	79.5	Confident	40 Å²	40	65.7 Å²	65.7	21%	0.205	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	127.6	172.5	-55.1	173.4	0	0	0	107.1	A1102 R1103 K1106 M1228 L1230	A1102-I1218 HydrophobicContact CB-CD1 4.24Å; A1102-I1218 HydrophobicContact CB-CG2 4.44Å; R1103-I1218 HydrophobicContact CG-CD1 3.87Å; K1106-I1218 HydrophobicContact CD-CD1 4.4Å; K1106-I1218 HydrophobicContact CD-CG1 4.25Å; I1218-M1228 HydrophobicContact CG2-CB 4.13Å; I1218-M1228 HydrophobicContact CG2-CG 4.09Å; I1218-M1228 HydrophobicContact CG2-SD 3.79Å; I1218-L1230 HydrophobicContact CB-CD2 4.16Å; I1218-L1230 HydrophobicContact CG1-CD2 3.57Å; I1218-L1230 HydrophobicContact CG2-CD2 4.35Å
1219	N	83.2	Confident	79.5	Confident	31 Å²	31	65.9 Å²	65.9	17%	0.166	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	129.3	176.4	173.2	54.8	0	0	0	109.1	V1062 M1228 N1229 L1231	V1062-N1219 HydrophobicContact CG2-CB 3.75Å; V1062-N1219 WeakPolarHBondContact CG2-OD1 3.4Å; N1219-M1228 WeakPolarHBondContact O-CA 3.32Å; N1219-N1229 WeakPolarHBondContact CB-OD1 3.2Å; N1219-N1229 PolarHBondContact N-O 2.96Å; N1219-N1229 PolarHBondContact ND2-OD1 3.3Å; N1219-N1229 PolarHBondContact O-N 3.04Å; N1219-N1229 PolarHBondContact O-OD1 2.97Å; N1219-L1231 HydrophobicContact CB-CD1 4.05Å; N1219-L1231 HydrophobicContact CB-CG 4.18Å
1220	A	78.6	Confident	79.5	Confident	59 Å²	59	64.9 Å²	64.9	49%	0.488	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	122.1	178.8	0	0	0	0	0	108.5	E1222 M1228	A1220-E1222 PolarHBondContact O-N 3.46Å; A1220-M1228 HydrophobicContact CB-CG 4.25Å
1221	D	68.9	Low	79.5	Confident	63 Å²	63	64.5 Å²	64.5	34%	0.337	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	106.6	178.3	-165.8	-19.9	0	0	0	110.3	K1223 T1227	D1221-K1223 PolarHBondContact O-N 3.14Å; D1221-K1223 WeakPolarHBondContact OD1-CB 3.27Å; D1221-K1223 PolarHBondContact OD1-N 3.23Å; D1221-T1227 PolarHBondContact N-O 3.26Å; D1221-T1227 VanDerWaalsContact N-O 3.13Å
1222	E	64	Low	79.6	Confident	193 Å²	193	61.2 Å²	61.2	90%	0.902	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-20.4	178.9	-65.6	-176.5	172	0	0	113	A1220	A1220-E1222 PolarHBondContact O-N 3.46Å
1223	K	60.8	Low	79.7	Confident	197 Å²	197	62 Å²	62	86%	0.857	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.7	-30.2	-172.3	-65.5	-177.2	-179.4	177.5	0	114.1	D1221	D1221-K1223 PolarHBondContact O-N 3.14Å; D1221-K1223 WeakPolarHBondContact OD1-CB 3.27Å; D1221-K1223 PolarHBondContact OD1-N 3.23Å
1224	V	59.7	Low	79.7	Confident	108 Å²	108	62.1 Å²	62.1	66%	0.655	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103	-11.4	-172	-171.9	0	0	0	0	112.2
1225	G	55	Low	79.9	Confident	43 Å²	43	58.2 Å²	58.2	44%	0.443	30%	0.303	S	S	.	.	S	Bend	trans	89	120.3	179.5	0	0	0	0	0	111.9	T1227	G1225-T1227 PolarHBondContact O-N 2.93Å
1226	E	71.2	Confident	80.3	Confident	166 Å²	166	55.1 Å²	55.1	78%	0.776	30%	0.295	S	S	*	.	S	Bend	trans	32.9	21.8	171.8	-61.7	-171.9	173.2	0	0	119.6
1227	T	82.7	Confident	80.5	Confident	29 Å²	29	55.2 Å²	55.2	18%	0.178	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	125.6	171.7	53.7	0	0	0	0	109.6	E1096 D1221 G1225	E1096-T1227 HydrophobicContact CB-CG2 4.17Å; E1096-T1227 WeakPolarHBondContact OE2-CG2 3.41Å; D1221-T1227 PolarHBondContact N-O 3.26Å; D1221-T1227 VanDerWaalsContact N-O 3.13Å; G1225-T1227 PolarHBondContact O-N 2.93Å
1228	M	85.1	Confident	80.9	Confident	25 Å²	25	60.4 Å²	60.4	12%	0.123	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	137.8	176.1	-70.2	178.2	-74.2	0	0	111.4	E1096 S1098 E1099 A1102 I1218 N1219 A1220	E1096-M1228 WeakPolarHBondContact O-CB 3.41Å; E1096-M1228 PolarHBondContact O-N 3.48Å; S1098-M1228 VanDerWaalsContact C-CE 3.49Å; E1099-M1228 HydrophobicContact CB-CE 3.75Å; E1099-M1228 HydrophobicContact CB-SD 4.25Å; E1099-M1228 HydrophobicContact CG-CE 4.28Å; E1099-M1228 HydrophobicContact CG-SD 4.12Å; E1099-M1228 VanDerWaalsContact N-CE 3.25Å; A1102-M1228 HydrophobicContact CB-CE 4.48Å; A1102-M1228 HydrophobicContact CB-SD 4.48Å; I1218-M1228 HydrophobicContact CG2-CB 4.13Å; I1218-M1228 HydrophobicContact CG2-CG 4.09Å; I1218-M1228 HydrophobicContact CG2-SD 3.79Å; N1219-M1228 WeakPolarHBondContact O-CA 3.32Å; A1220-M1228 HydrophobicContact CB-CG 4.25Å
1229	N	89	Confident	81.2	Confident	41 Å²	41	65 Å²	65	22%	0.219	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	162.8	166.1	59.6	11.6	0	0	0	110.1	V1091 N1219	V1091-N1229 WeakPolarHBondContact O-CB 3.44Å; N1219-N1229 WeakPolarHBondContact CB-OD1 3.2Å; N1219-N1229 PolarHBondContact N-O 2.96Å; N1219-N1229 PolarHBondContact ND2-OD1 3.3Å; N1219-N1229 PolarHBondContact O-N 3.04Å; N1219-N1229 PolarHBondContact O-OD1 2.97Å
1230	L	90	Very high	81.7	Confident	0 Å²	0	63.5 Å²	63.5	0%	0	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	143.6	174.9	-46.8	174.7	0	0	0	110.6	T1090 V1091 L1093 A1102 V1105 K1106 L1109 T1217 I1218	T1090-L1230 CarbonylContact C-O 3.38Å; V1091-L1230 HydrophobicContact CB-CB 3.99Å; V1091-L1230 HydrophobicContact CG2-CB 4.49Å; V1091-L1230 PolarHBondContact N-O 3.1Å; V1091-L1230 PolarHBondContact O-N 3.13Å; L1093-L1230 HydrophobicContact CD1-CD2 4.46Å; L1093-L1230 HydrophobicContact CD1-CG 4.3Å; L1093-L1230 HydrophobicContact CD2-CD1 3.77Å; L1093-L1230 HydrophobicContact CD2-CG 3.94Å; L1093-L1230 HydrophobicContact CG-CG 4.31Å; A1102-L1230 HydrophobicContact CB-CD2 4.34Å; V1105-L1230 HydrophobicContact CB-CD1 4.09Å; V1105-L1230 HydrophobicContact CG1-CD1 3.82Å; K1106-L1230 HydrophobicContact CB-CD1 4.27Å; K1106-L1230 HydrophobicContact CB-CD2 4.43Å; L1109-L1230 HydrophobicContact CD1-CD1 3.87Å; T1217-L1230 CarbonylContact O-C 3.55Å; T1217-L1230 WeakPolarHBondContact O-CA 3.39Å; I1218-L1230 HydrophobicContact CB-CD2 4.16Å; I1218-L1230 HydrophobicContact CG1-CD2 3.57Å; I1218-L1230 HydrophobicContact CG2-CD2 4.35Å
1231	L	90.1	Very high	82.4	Confident	11 Å²	11	62 Å²	62	6%	0.058	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	108.4	171.4	-57.8	175.9	0	0	0	108.2	V1062 M1065 V1088 T1090 C1216 T1217 N1219	V1062-L1231 HydrophobicContact CG2-CD1 4.18Å; M1065-L1231 HydrophobicContact SD-CB 3.88Å; V1088-L1231 HydrophobicContact CG1-CB 4.24Å; V1088-L1231 HydrophobicContact CG1-CD2 4.26Å; T1090-L1231 HydrophobicContact CG2-CD2 3.94Å; C1216-L1231 WeakPolarHBondContact CA-O 3.37Å; T1217-L1231 PolarHBondContact N-O 3.28Å; T1217-L1231 PolarHBondContact O-N 3.35Å; N1219-L1231 HydrophobicContact CB-CD1 4.05Å; N1219-L1231 HydrophobicContact CB-CG 4.18Å
1232	A	90.2	Very high	83.5	Confident	0 Å²	0	62.1 Å²	62.1	0%	0	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	126.9	-179.6	0	0	0	0	0	110.9	V1088 I1089 V1091 V1213 S1234	V1088-A1232 WeakPolarHBondContact CA-O 3.27Å; I1089-A1232 HydrophobicContact CB-CB 4.47Å; I1089-A1232 PolarHBondContact N-O 3.3Å; I1089-A1232 PolarHBondContact O-N 3.41Å; V1091-A1232 HydrophobicContact CG2-CB 4.24Å; V1213-A1232 HydrophobicContact CG1-CB 4.14Å; A1232-S1234 PolarHBondContact O-N 3.42Å
1233	E	89.8	Confident	84.9	Confident	55 Å²	55	54.6 Å²	54.6	26%	0.257	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	96.3	176.2	-167.9	-170	153.7	0	0	110.4	M1065 P1087 K1214 R1215	M1065-E1233 HydrophobicContact CE-CB 3.89Å; P1087-E1233 CarbonylContact O-C 3.56Å; P1087-E1233 VanDerWaalsContact O-CA 3.25Å; P1087-E1233 WeakPolarHBondContact O-CA 3.36Å; K1214-E1233 PolarHBondContact N-O 3.44Å; R1215-E1233 PolarHBondContact O-N 3.05Å
1234	S	89.3	Confident	86.3	Confident	3 Å²	3	51.4 Å²	51.4	2%	0.021	29%	0.286	C	S	.	.			trans	-162.6	152.8	-178.4	-174.2	0	0	0	0	112.6	P1087 S1212 A1232 D1236	P1087-S1234 PolarHBondContact O-N 3.34Å; S1212-S1234 WeakPolarHBondContact CB-OG 3.25Å; S1212-S1234 PolarHBondContact O-OG 3.44Å; S1212-S1234 PolarHBondContact OG-OG 2.89Å; A1232-S1234 PolarHBondContact O-N 3.42Å; S1234-D1236 PolarHBondContact OG-N 3.2Å
1235	N	87.8	Confident	87.8	Confident	47 Å²	47	46.7 Å²	46.7	25%	0.251	26%	0.259	S	S	.	.	S	Bend	trans	-93.1	-8.1	167.6	-79.4	-47.2	0	0	0	113	P1087 F1237 N1255 E1258	P1087-N1235 WeakPolarHBondContact CB-OD1 3.35Å; N1235-F1237 PolarHBondContact O-N 3.4Å; N1235-F1237 VanDerWaalsContact O-N 3.14Å; N1235-N1255 PolarHBondContact OD1-ND2 3.42Å; N1235-E1258 HydrophobicContact CB-CG 4.46Å; N1235-E1258 VanDerWaalsContact O-CG 3.26Å; N1235-E1258 WeakPolarHBondContact O-CG 3.33Å
1236	D	90.2	Very high	89.6	Confident	39 Å²	39	45.2 Å²	45.2	21%	0.209	24%	0.242	C	C	.	.			trans	-90.3	78.3	-173.4	-167.3	-11.1	0	0	0	111.2	S1212 S1234 R1239 V1240	S1212-D1236 WeakPolarHBondContact OG-CB 3.41Å; S1212-D1236 PolarHBondContact OG-OD2 3.01Å; S1234-D1236 PolarHBondContact OG-N 3.2Å; D1236-R1239 WeakPolarHBondContact OD1-CG 3.41Å; D1236-R1239 PolarHBondContact OD1-N 3.22Å; D1236-R1239 WeakPolarHBondContact OD2-CD 3.5Å; D1236-R1239 IonicContact OD2-CZ 3.9Å; D1236-R1239 IonicContact OD2-NE 2.89Å; D1236-R1239 IonicContact OD2-NH1 2.75Å; D1236-V1240 WeakPolarHBondContact O-CG2 3.36Å
1237	F	92.6	Very high	90.7	Very high	2 Å²	2	39 Å²	39	1%	0.009	21%	0.213	C	C	.	.	H	α-helix	trans	-68.2	-41.7	-172.8	-173.4	-143.6	0	0	0	112.8	I1089 N1235 R1239 V1240 L1241 T1251 E1258 V1259 T1262 L1263	I1089-F1237 HydrophobicContact CD1-CD2 4.27Å; I1089-F1237 HydrophobicContact CG1-CD2 4.48Å; I1089-F1237 HydrophobicContact CG2-CD2 4.05Å; I1089-F1237 HydrophobicContact CG2-CE2 4.14Å; N1235-F1237 PolarHBondContact O-N 3.4Å; N1235-F1237 VanDerWaalsContact O-N 3.14Å; F1237-R1239 PolarHBondContact O-N 3.24Å; F1237-V1240 PolarHBondContact O-N 2.7Å; F1237-L1241 HydrophobicContact CD1-CD1 4.25Å; F1237-L1241 HydrophobicContact CD2-CD1 4.29Å; F1237-L1241 HydrophobicContact CD2-CD2 4.5Å; F1237-L1241 HydrophobicContact CD2-CG 4.14Å; F1237-L1241 HydrophobicContact CE1-CD1 3.96Å; F1237-L1241 HydrophobicContact CE2-CD1 3.98Å; F1237-L1241 HydrophobicContact CE2-CD2 3.75Å; F1237-L1241 HydrophobicContact CE2-CG 3.84Å; F1237-L1241 HydrophobicContact CG-CD1 4.41Å; F1237-L1241 HydrophobicContact CZ-CD1 3.81Å; F1237-L1241 HydrophobicContact CZ-CD2 3.98Å; F1237-L1241 HydrophobicContact CZ-CG 4.14Å; F1237-L1241 WeakPolarHBondContact O-CG 3.27Å; F1237-L1241 PolarHBondContact O-N 3.49Å; F1237-T1251 HydrophobicContact CE2-CG2 3.93Å; F1237-E1258 HydrophobicContact CB-CB 4.45Å; F1237-V1259 HydrophobicContact CD1-CG2 4.35Å; F1237-V1259 HydrophobicContact CE1-CG2 4.22Å; F1237-T1262 HydrophobicContact CD1-CG2 3.96Å; F1237-T1262 HydrophobicContact CE1-CG2 4.46Å; F1237-L1263 HydrophobicContact CE1-CD1 3.7Å; F1237-L1263 HydrophobicContact CE1-CG 3.97Å; F1237-L1263 HydrophobicContact CZ-CD1 4.18Å
1238	L	93.9	Very high	91.1	Very high	116 Å²	116	40.8 Å²	40.8	61%	0.607	23%	0.226	S	C	*	.	H	α-helix	trans	-58	-45.9	-178.3	178.1	64.6	0	0	0	112.4	L1241 G1242 T1262	L1238-L1241 PolarHBondContact O-N 3.32Å; L1238-G1242 PolarHBondContact O-N 3.47Å; L1238-T1262 HydrophobicContact CB-CG2 4.01Å; L1238-T1262 HydrophobicContact CD1-CG2 3.98Å
1239	R	92.3	Very high	91.4	Very high	137 Å²	137	46.6 Å²	46.6	52%	0.517	26%	0.258	S	S	.	.	H	α-helix	trans	-68.6	-35.5	-178.9	-69.9	-167.4	-173.2	162.8	-7.6	112.7	L1210 D1236 F1237 L1241 G1242	L1210-R1239 HydrophobicContact CD1-CB 3.92Å; L1210-R1239 HydrophobicContact CD2-CB 3.92Å; D1236-R1239 WeakPolarHBondContact OD1-CG 3.41Å; D1236-R1239 PolarHBondContact OD1-N 3.22Å; D1236-R1239 WeakPolarHBondContact OD2-CD 3.5Å; D1236-R1239 IonicContact OD2-CZ 3.9Å; D1236-R1239 IonicContact OD2-NE 2.89Å; D1236-R1239 IonicContact OD2-NH1 2.75Å; F1237-R1239 PolarHBondContact O-N 3.24Å; R1239-L1241 VanDerWaalsContact C-N 3.34Å; R1239-G1242 PolarHBondContact O-N 3.23Å
1240	V	94.1	Very high	91.5	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-63.7	-41	177.6	172.3	0	0	0	0	111.1	I1089 V1091 L1109 L1210 V1213 D1236 F1237 G1242 I1243	I1089-V1240 HydrophobicContact CD1-CB 4.26Å; I1089-V1240 HydrophobicContact CD1-CG2 3.83Å; I1089-V1240 HydrophobicContact CG2-CG1 4.04Å; V1091-V1240 HydrophobicContact CG2-CG1 3.8Å; L1109-V1240 HydrophobicContact CD2-CB 4.26Å; L1109-V1240 HydrophobicContact CD2-CG1 3.88Å; L1109-V1240 HydrophobicContact CD2-CG2 4.03Å; L1210-V1240 HydrophobicContact CD1-CG2 3.79Å; V1213-V1240 HydrophobicContact CG2-CG2 4.17Å; D1236-V1240 WeakPolarHBondContact O-CG2 3.36Å; F1237-V1240 PolarHBondContact O-N 2.7Å; V1240-G1242 PolarHBondContact O-N 2.89Å; V1240-I1243 PolarHBondContact O-N 2.94Å
1241	L	93.7	Very high	91.7	Very high	26 Å²	26	51.8 Å²	51.8	14%	0.136	28%	0.275	C	S	.	.	H	α-helix	trans	-64.2	-27	176.6	-65.8	173.1	0	0	0	113.2	F1237 L1238 R1239 I1243 P1248 T1251 T1262 L1263	F1237-L1241 HydrophobicContact CD1-CD1 4.25Å; F1237-L1241 HydrophobicContact CD2-CD1 4.29Å; F1237-L1241 HydrophobicContact CD2-CD2 4.5Å; F1237-L1241 HydrophobicContact CD2-CG 4.14Å; F1237-L1241 HydrophobicContact CE1-CD1 3.96Å; F1237-L1241 HydrophobicContact CE2-CD1 3.98Å; F1237-L1241 HydrophobicContact CE2-CD2 3.75Å; F1237-L1241 HydrophobicContact CE2-CG 3.84Å; F1237-L1241 HydrophobicContact CG-CD1 4.41Å; F1237-L1241 HydrophobicContact CZ-CD1 3.81Å; F1237-L1241 HydrophobicContact CZ-CD2 3.98Å; F1237-L1241 HydrophobicContact CZ-CG 4.14Å; F1237-L1241 WeakPolarHBondContact O-CG 3.27Å; F1237-L1241 PolarHBondContact O-N 3.49Å; L1238-L1241 PolarHBondContact O-N 3.32Å; R1239-L1241 VanDerWaalsContact C-N 3.34Å; L1241-I1243 VanDerWaalsContact C-N 3.35Å; L1241-P1248 HydrophobicContact CB-CB 4.45Å; L1241-P1248 HydrophobicContact CD2-CB 4.11Å; L1241-T1251 HydrophobicContact CD2-CG2 3.88Å; L1241-T1262 HydrophobicContact CD1-CG2 3.84Å; L1241-L1263 HydrophobicContact CD1-CD2 4.43Å
1242	G	91.9	Very high	91.9	Very high	67 Å²	67	55.2 Å²	55.2	69%	0.691	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.9	-3.5	179.5	0	0	0	0	0	115.1	L1238 R1239 V1240	L1238-G1242 PolarHBondContact O-N 3.47Å; R1239-G1242 PolarHBondContact O-N 3.23Å; V1240-G1242 PolarHBondContact O-N 2.89Å
1243	I	92.6	Very high	92	Very high	35 Å²	35	55.6 Å²	55.6	18%	0.179	30%	0.299	C	S	.	.	S	Bend	trans	-78.6	133.4	-179	-66.5	-60.8	0	0	0	111	R1108 L1109 L1210 V1240 L1241 G1245 V1246	R1108-I1243 HydrophobicContact CB-CG2 3.81Å; L1109-I1243 HydrophobicContact CD2-CB 4.23Å; L1109-I1243 HydrophobicContact CD2-CG1 3.81Å; L1109-I1243 HydrophobicContact CD2-CG2 4.4Å; L1109-I1243 HydrophobicContact CG-CG2 4.45Å; L1210-I1243 HydrophobicContact CD1-CD1 4.47Å; L1210-I1243 HydrophobicContact CD1-CG1 4.17Å; L1210-I1243 HydrophobicContact CD2-CD1 4.33Å; L1210-I1243 HydrophobicContact CG-CD1 4.4Å; V1240-I1243 PolarHBondContact O-N 2.94Å; L1241-I1243 VanDerWaalsContact C-N 3.35Å; I1243-G1245 PolarHBondContact O-N 3.08Å; I1243-V1246 HydrophobicContact CB-CG2 4.01Å; I1243-V1246 HydrophobicContact CG2-CG2 4.16Å; I1243-V1246 WeakPolarHBondContact O-CB 3.42Å; I1243-V1246 PolarHBondContact O-N 2.62Å
1244	L	91.8	Very high	92.2	Very high	130 Å²	130	53.5 Å²	53.5	68%	0.681	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	125.1	177.2	-175.8	68.2	0	0	0	111.3	R1108	R1108-L1244 PolarHBondContact NH1-O 3.19Å
1245	G	90	Very high	92.4	Very high	9 Å²	9	53.4 Å²	53.4	9%	0.093	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	99.3	-7.7	-179.3	0	0	0	0	0	114.7	S1094 I1243	S1094-G1245 PolarHBondContact N-O 3.44Å; S1094-G1245 PolarHBondContact OG-O 3.21Å; I1243-G1245 PolarHBondContact O-N 3.08Å
1246	V	93.6	Very high	92.7	Very high	12 Å²	12	51.8 Å²	51.8	7%	0.073	28%	0.28	C	S	.	.	B	Isolated β-bridge	trans	-82.7	134.4	166.1	176.5	0	0	0	0	109.1	V1091 V1105 L1109 I1243 P1248 T1251	V1091-V1246 HydrophobicContact CG1-CB 4.03Å; V1091-V1246 HydrophobicContact CG1-CG1 3.57Å; V1091-V1246 HydrophobicContact CG1-CG2 3.49Å; V1091-V1246 VanDerWaalsContact CG1-CG2 3.49Å; V1105-V1246 HydrophobicContact CG1-CG2 3.83Å; L1109-V1246 HydrophobicContact CD1-CG2 4.41Å; I1243-V1246 HydrophobicContact CB-CG2 4.01Å; I1243-V1246 HydrophobicContact CG2-CG2 4.16Å; I1243-V1246 WeakPolarHBondContact O-CB 3.42Å; I1243-V1246 PolarHBondContact O-N 2.62Å; V1246-P1248 VanDerWaalsContact O-CD 3.28Å; V1246-P1248 WeakPolarHBondContact O-CD 3.49Å; V1246-T1251 HydrophobicContact CG1-CG2 4.5Å; V1246-T1251 WeakPolarHBondContact CG1-OG1 3.49Å
1247	D	93.5	Very high	92.9	Very high	34 Å²	34	51.6 Å²	51.6	18%	0.182	28%	0.279	C	S	.	.			trans	-85.3	109.3	168.3	179.9	-1.9	0	0	0	109.4	A1092 N1249 R1250 T1251	A1092-D1247 HydrophobicContact CB-CB 4.15Å; A1092-D1247 PolarHBondContact O-N 3.41Å; D1247-N1249 VanDerWaalsContact C-N 3.27Å; D1247-N1249 PolarHBondContact O-N 3.15Å; D1247-N1249 WeakPolarHBondContact OD1-CB 3.33Å; D1247-N1249 PolarHBondContact OD1-N 3.45Å; D1247-R1250 WeakPolarHBondContact OD2-CD 3.4Å; D1247-T1251 WeakPolarHBondContact O-CB 3.3Å; D1247-T1251 PolarHBondContact O-N 3.26Å; D1247-T1251 PolarHBondContact O-OG1 2.99Å
1248	P	91.5	Very high	92.9	Very high	67 Å²	67	53.2 Å²	53.2	44%	0.435	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-20.7	-176.6	29.7	-35.7	0	0	0	113.4	L1241 V1246	L1241-P1248 HydrophobicContact CB-CB 4.45Å; L1241-P1248 HydrophobicContact CD2-CB 4.11Å; V1246-P1248 VanDerWaalsContact O-CD 3.28Å; V1246-P1248 WeakPolarHBondContact O-CD 3.49Å
1249	N	91.8	Very high	93	Very high	148 Å²	148	48 Å²	48	79%	0.791	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.4	-23.4	-176.4	-63.4	-48.2	0	0	0	112.8	D1247	D1247-N1249 VanDerWaalsContact C-N 3.27Å; D1247-N1249 PolarHBondContact O-N 3.15Å; D1247-N1249 WeakPolarHBondContact OD1-CB 3.33Å; D1247-N1249 PolarHBondContact OD1-N 3.45Å
1250	R	91.2	Very high	93.1	Very high	142 Å²	142	42.8 Å²	42.8	54%	0.536	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-113.7	-8.9	-175.1	-68.8	175.6	61.3	-144.7	-2.9	113.8	A1092 E1096 D1247	A1092-R1250 HydrophobicContact CB-CB 3.52Å; E1096-R1250 IonicContact OE1-CZ 3.96Å; E1096-R1250 IonicContact OE1-NH1 3.02Å; E1096-R1250 PolarHBondContact OE1-NH1 2.86Å; E1096-R1250 IonicContact OE1-NH2 3.82Å; E1096-R1250 PolarHBondContact OE1-NH2 3.31Å; E1096-R1250 IonicContact OE2-NH2 2.99Å; D1247-R1250 WeakPolarHBondContact OD2-CD 3.4Å
1251	T	93.8	Very high	93.1	Very high	7 Å²	7	49.6 Å²	49.6	4%	0.043	28%	0.276	C	S	.	.			trans	-74.7	132	177.7	-66	0	0	0	0	110.8	I1089 T1090 V1091 A1092 F1237 L1241 V1246 D1247	I1089-T1251 HydrophobicContact CG2-CG2 3.67Å; T1090-T1251 WeakPolarHBondContact O-CA 3.5Å; T1090-T1251 WeakPolarHBondContact O-CG2 3.46Å; V1091-T1251 HydrophobicContact CG2-CG2 4.43Å; A1092-T1251 PolarHBondContact N-OG1 2.83Å; A1092-T1251 VanDerWaalsContact N-OG1 3.15Å; F1237-T1251 HydrophobicContact CE2-CG2 3.93Å; L1241-T1251 HydrophobicContact CD2-CG2 3.88Å; V1246-T1251 HydrophobicContact CG1-CG2 4.5Å; V1246-T1251 WeakPolarHBondContact CG1-OG1 3.49Å; D1247-T1251 WeakPolarHBondContact O-CB 3.3Å; D1247-T1251 PolarHBondContact O-N 3.26Å; D1247-T1251 PolarHBondContact O-OG1 2.99Å
1252	V	94.2	Very high	93.2	Very high	84 Å²	84	50.2 Å²	50.2	51%	0.509	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	149.1	-176.9	-63.3	0	0	0	0	111.9	I1089 T1090	I1089-V1252 CarbonylContact C-O 3.6Å; I1089-V1252 WeakPolarHBondContact CA-O 3.33Å; I1089-V1252 WeakPolarHBondContact CG2-O 3.42Å; T1090-V1252 PolarHBondContact N-O 2.9Å; T1090-V1252 PolarHBondContact O-N 3.48Å
1253	S	93.2	Very high	93.3	Very high	7 Å²	7	51.8 Å²	51.8	5%	0.049	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	141.2	174.9	178.3	0	0	0	0	110.4	N1255	S1253-N1255 VanDerWaalsContact C-N 3.28Å; S1253-N1255 PolarHBondContact O-N 2.96Å; S1253-N1255 PolarHBondContact OG-N 3.23Å
1254	N	92.4	Very high	93.4	Very high	12 Å²	12	51.5 Å²	51.5	6%	0.064	28%	0.278	C	S	.	.	S	Bend	trans	-82.5	0.8	176.2	78.5	-15.2	0	0	0	113.3	R1073 I1084 T1086 P1087 V1088 P1256	R1073-N1254 PolarHBondContact NH2-O 2.93Å; I1084-N1254 WeakPolarHBondContact CD1-OD1 3.44Å; T1086-N1254 PolarHBondContact O-ND2 3.24Å; P1087-N1254 WeakPolarHBondContact CA-OD1 3.16Å; V1088-N1254 VanDerWaalsContact N-CG 3.34Å; V1088-N1254 PolarHBondContact N-ND2 3.12Å; V1088-N1254 PolarHBondContact N-OD1 2.8Å; V1088-N1254 PolarHBondContact O-N 2.97Å; V1088-N1254 VanDerWaalsContact O-N 3.1Å; V1088-N1254 PolarHBondContact O-OD1 3.1Å; N1254-P1256 WeakPolarHBondContact O-CD 3.45Å
1255	N	93.8	Very high	93.6	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	26%	0.259	C	S	.	.			trans	-103.5	101.3	177.1	-172.2	-17.9	0	0	0	110.9	G1082 I1084 N1235 S1253 I1257 E1258 V1259	G1082-N1255 PolarHBondContact O-ND2 3.47Å; I1084-N1255 HydrophobicContact CD1-CB 3.85Å; N1235-N1255 PolarHBondContact OD1-ND2 3.42Å; S1253-N1255 VanDerWaalsContact C-N 3.28Å; S1253-N1255 PolarHBondContact O-N 2.96Å; S1253-N1255 PolarHBondContact OG-N 3.23Å; N1255-I1257 PolarHBondContact O-N 3.49Å; N1255-I1257 VanDerWaalsContact O-N 3.15Å; N1255-I1257 PolarHBondContact OD1-N 3.48Å; N1255-I1257 VanDerWaalsContact OD1-N 3.16Å; N1255-E1258 HydrophobicContact CB-CB 4.27Å; N1255-E1258 HydrophobicContact CB-CG 4.34Å; N1255-E1258 PolarHBondContact O-N 3.17Å; N1255-E1258 VanDerWaalsContact O-N 3.15Å; N1255-V1259 WeakPolarHBondContact O-CG2 3.1Å; N1255-V1259 PolarHBondContact O-N 3.24Å
1256	P	94.1	Very high	93.9	Very high	13 Å²	13	52.7 Å²	52.7	8%	0.084	28%	0.279	C	S	.	.	H	α-helix	trans	-59.9	-30.8	-176.3	-25.6	35.3	0	0	0	113.9	N1254 V1259 A1260 A1268 I1272 I1305	N1254-P1256 WeakPolarHBondContact O-CD 3.45Å; P1256-V1259 PolarHBondContact O-N 3.3Å; P1256-A1260 PolarHBondContact O-N 2.95Å; P1256-A1268 WeakPolarHBondContact O-CB 3.26Å; P1256-I1272 HydrophobicContact CB-CD1 4.38Å; P1256-I1272 HydrophobicContact CB-CG1 3.81Å; P1256-I1272 HydrophobicContact CG-CG1 3.86Å; P1256-I1305 VanDerWaalsContact C-CD1 3.42Å; P1256-I1305 HydrophobicContact CB-CD1 3.81Å; P1256-I1305 WeakPolarHBondContact O-CD1 3.5Å
1257	I	94.2	Very high	94	Very high	35 Å²	35	53.7 Å²	53.7	18%	0.179	29%	0.289	C	S	.	.	H	α-helix	trans	-68.5	-39.6	-179.1	-69.3	168.6	0	0	0	111	A1080 N1255 A1260 K1261 I1305	A1080-I1257 HydrophobicContact CB-CD1 4.3Å; A1080-I1257 VanDerWaalsContact O-CD1 3.32Å; A1080-I1257 WeakPolarHBondContact O-CD1 3.13Å; N1255-I1257 PolarHBondContact O-N 3.49Å; N1255-I1257 VanDerWaalsContact O-N 3.15Å; N1255-I1257 PolarHBondContact OD1-N 3.48Å; N1255-I1257 VanDerWaalsContact OD1-N 3.16Å; I1257-A1260 PolarHBondContact O-N 3.44Å; I1257-K1261 WeakPolarHBondContact O-CG 3.46Å; I1257-K1261 PolarHBondContact O-N 3.38Å; I1257-K1261 VanDerWaalsContact O-N 3.12Å; I1257-I1305 HydrophobicContact CG1-CD1 4.05Å
1258	E	94	Very high	94.1	Very high	36 Å²	36	52.1 Å²	52.1	17%	0.168	28%	0.28	C	S	.	.	H	α-helix	trans	-73.3	-34.3	176.2	-66.2	-59.4	137.6	0	0	111.4	N1235 F1237 N1255 K1261 T1262	N1235-E1258 HydrophobicContact CB-CG 4.46Å; N1235-E1258 VanDerWaalsContact O-CG 3.26Å; N1235-E1258 WeakPolarHBondContact O-CG 3.33Å; F1237-E1258 HydrophobicContact CB-CB 4.45Å; N1255-E1258 HydrophobicContact CB-CB 4.27Å; N1255-E1258 HydrophobicContact CB-CG 4.34Å; N1255-E1258 PolarHBondContact O-N 3.17Å; N1255-E1258 VanDerWaalsContact O-N 3.15Å; E1258-K1261 PolarHBondContact O-N 3.4Å; E1258-K1261 IonicContact OE1-NZ 2.89Å; E1258-K1261 PolarHBondContact OE1-NZ 2.98Å; E1258-K1261 IonicContact OE2-NZ 3.43Å; E1258-T1262 WeakPolarHBondContact O-CB 3.44Å; E1258-T1262 PolarHBondContact O-N 3.34Å; E1258-T1262 PolarHBondContact O-OG1 2.84Å
1259	V	95.1	Very high	94.4	Very high	7 Å²	7	50.7 Å²	50.7	4%	0.042	27%	0.266	C	S	.	.	H	α-helix	trans	-60.2	-45	168.8	177.5	0	0	0	0	110.7	F1237 N1255 P1256 K1261 T1262 L1263 G1264 A1267 A1268	F1237-V1259 HydrophobicContact CD1-CG2 4.35Å; F1237-V1259 HydrophobicContact CE1-CG2 4.22Å; N1255-V1259 WeakPolarHBondContact O-CG2 3.1Å; N1255-V1259 PolarHBondContact O-N 3.24Å; P1256-V1259 PolarHBondContact O-N 3.3Å; V1259-K1261 VanDerWaalsContact C-N 3.33Å; V1259-K1261 PolarHBondContact O-N 3.32Å; V1259-T1262 PolarHBondContact O-N 2.93Å; V1259-L1263 HydrophobicContact CG1-CB 4.41Å; V1259-L1263 HydrophobicContact CG1-CD1 4.37Å; V1259-L1263 PolarHBondContact O-N 3.41Å; V1259-G1264 PolarHBondContact O-N 3.19Å; V1259-A1267 HydrophobicContact CG1-CB 3.81Å; V1259-A1268 HydrophobicContact CB-CB 4.46Å; V1259-A1268 HydrophobicContact CG1-CB 4.27Å
1260	A	95.1	Very high	94.5	Very high	27 Å²	27	50.8 Å²	50.8	22%	0.223	26%	0.255	C	S	.	.	H	α-helix	trans	-62.7	-38	178.5	0	0	0	0	0	113.2	P1256 I1257 T1262 G1264 A1268 I1305	P1256-A1260 PolarHBondContact O-N 2.95Å; I1257-A1260 PolarHBondContact O-N 3.44Å; A1260-T1262 VanDerWaalsContact C-N 3.33Å; A1260-G1264 WeakPolarHBondContact CA-O 3.32Å; A1260-G1264 VanDerWaalsContact O-CA 3.26Å; A1260-G1264 WeakPolarHBondContact O-CA 3.41Å; A1260-G1264 PolarHBondContact O-N 3.18Å; A1260-A1268 HydrophobicContact CB-CB 3.66Å; A1260-I1305 HydrophobicContact CB-CD1 3.82Å; A1260-I1305 HydrophobicContact CB-CG1 4.1Å
1261	K	94.4	Very high	94.7	Very high	144 Å²	144	44.5 Å²	44.5	63%	0.626	23%	0.233	S	C	*	.	H	α-helix	trans	-68.6	-32.6	176.7	-71	172.8	-172.9	170.1	0	112.8	I1257 E1258 V1259	I1257-K1261 WeakPolarHBondContact O-CG 3.46Å; I1257-K1261 PolarHBondContact O-N 3.38Å; I1257-K1261 VanDerWaalsContact O-N 3.12Å; E1258-K1261 PolarHBondContact O-N 3.4Å; E1258-K1261 IonicContact OE1-NZ 2.89Å; E1258-K1261 PolarHBondContact OE1-NZ 2.98Å; E1258-K1261 IonicContact OE2-NZ 3.43Å; V1259-K1261 VanDerWaalsContact C-N 3.33Å; V1259-K1261 PolarHBondContact O-N 3.32Å
1262	T	94.4	Very high	94.8	Very high	38 Å²	38	44.2 Å²	44.2	23%	0.233	23%	0.231	C	C	.	.	H	α-helix	trans	-95.4	-48.1	-170.9	-49.9	0	0	0	0	112.5	F1237 L1238 L1241 E1258 V1259 A1260	F1237-T1262 HydrophobicContact CD1-CG2 3.96Å; F1237-T1262 HydrophobicContact CE1-CG2 4.46Å; L1238-T1262 HydrophobicContact CB-CG2 4.01Å; L1238-T1262 HydrophobicContact CD1-CG2 3.98Å; L1241-T1262 HydrophobicContact CD1-CG2 3.84Å; E1258-T1262 WeakPolarHBondContact O-CB 3.44Å; E1258-T1262 PolarHBondContact O-N 3.34Å; E1258-T1262 PolarHBondContact O-OG1 2.84Å; V1259-T1262 PolarHBondContact O-N 2.93Å; A1260-T1262 VanDerWaalsContact C-N 3.33Å
1263	L	95.1	Very high	94.9	Very high	100 Å²	100	40.3 Å²	40.3	52%	0.524	21%	0.208	S	C	.	.	H	α-helix	trans	-110.6	-8.9	-173.9	-60.1	-178.1	0	0	0	113.5	F1237 L1241 V1259 A1267	F1237-L1263 HydrophobicContact CE1-CD1 3.7Å; F1237-L1263 HydrophobicContact CE1-CG 3.97Å; F1237-L1263 HydrophobicContact CZ-CD1 4.18Å; L1241-L1263 HydrophobicContact CD1-CD2 4.43Å; V1259-L1263 HydrophobicContact CG1-CB 4.41Å; V1259-L1263 HydrophobicContact CG1-CD1 4.37Å; V1259-L1263 PolarHBondContact O-N 3.41Å; L1263-A1267 HydrophobicContact CB-CB 3.56Å; L1263-A1267 HydrophobicContact CD1-CB 4.24Å
1264	G	95.4	Very high	94.9	Very high	30 Å²	30	42.3 Å²	42.3	31%	0.309	22%	0.222	S	C	.	.			trans	95	175.6	-178.9	0	0	0	0	0	114.6	V1259 A1260 E1266 A1268	V1259-G1264 PolarHBondContact O-N 3.19Å; A1260-G1264 WeakPolarHBondContact CA-O 3.32Å; A1260-G1264 VanDerWaalsContact O-CA 3.26Å; A1260-G1264 WeakPolarHBondContact O-CA 3.41Å; A1260-G1264 PolarHBondContact O-N 3.18Å; G1264-E1266 PolarHBondContact O-N 3.42Å; G1264-A1268 PolarHBondContact O-N 3.26Å
1265	I	96	Very high	94.9	Very high	52 Å²	52	43.9 Å²	43.9	27%	0.267	23%	0.229	S	C	.	.	H	α-helix	trans	-69.4	-32.7	-166.7	-164.8	63.9	0	0	0	113.7	A1268 R1269 T1300 I1305	I1265-A1268 WeakPolarHBondContact O-CB 3.22Å; I1265-A1268 PolarHBondContact O-N 3.04Å; I1265-R1269 PolarHBondContact O-N 2.88Å; I1265-T1300 HydrophobicContact CD1-CG2 3.8Å; I1265-T1300 HydrophobicContact CG1-CG2 3.96Å; I1265-I1305 HydrophobicContact CD1-CG1 3.81Å
1266	E	95.8	Very high	94.8	Very high	112 Å²	112	43.9 Å²	43.9	52%	0.523	23%	0.229	S	C	.	.	H	α-helix	trans	-72.5	-37.3	-178.6	-166.7	57.5	-151.7	0	0	112	G1264 A1268 R1269 R1270	G1264-E1266 PolarHBondContact O-N 3.42Å; E1266-A1268 VanDerWaalsContact C-N 3.3Å; E1266-A1268 PolarHBondContact O-N 3.12Å; E1266-R1269 WeakPolarHBondContact O-CB 3.35Å; E1266-R1269 PolarHBondContact O-N 3.2Å; E1266-R1269 VanDerWaalsContact OE1-CD 3.22Å; E1266-R1269 WeakPolarHBondContact OE1-CD 3.4Å; E1266-R1269 IonicContact OE1-CZ 2.63Å; E1266-R1269 IonicContact OE1-NE 3.66Å; E1266-R1269 IonicContact OE1-NH1 2.89Å; E1266-R1269 PolarHBondContact OE1-NH1 3Å; E1266-R1270 PolarHBondContact O-N 2.93Å; E1266-R1270 VanDerWaalsContact O-N 3.07Å
1267	A	95.5	Very high	94.7	Very high	33 Å²	33	47.4 Å²	47.4	27%	0.273	24%	0.244	S	C	.	.	H	α-helix	trans	-62.9	-40	171.2	0	0	0	0	0	111.1	V1259 L1263 R1270 S1271	V1259-A1267 HydrophobicContact CG1-CB 3.81Å; L1263-A1267 HydrophobicContact CB-CB 3.56Å; L1263-A1267 HydrophobicContact CD1-CB 4.24Å; A1267-R1270 PolarHBondContact O-N 3.41Å; A1267-S1271 PolarHBondContact O-N 3.21Å
1268	A	96.1	Very high	94.4	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-66.6	-38.7	176.3	0	0	0	0	0	112.7	P1256 V1259 A1260 G1264 I1265 E1266 R1270 S1271 I1272 I1305	P1256-A1268 WeakPolarHBondContact O-CB 3.26Å; V1259-A1268 HydrophobicContact CB-CB 4.46Å; V1259-A1268 HydrophobicContact CG1-CB 4.27Å; A1260-A1268 HydrophobicContact CB-CB 3.66Å; G1264-A1268 PolarHBondContact O-N 3.26Å; I1265-A1268 WeakPolarHBondContact O-CB 3.22Å; I1265-A1268 PolarHBondContact O-N 3.04Å; E1266-A1268 VanDerWaalsContact C-N 3.3Å; E1266-A1268 PolarHBondContact O-N 3.12Å; A1268-R1270 PolarHBondContact O-N 3.11Å; A1268-S1271 WeakPolarHBondContact O-CB 3.44Å; A1268-S1271 PolarHBondContact O-N 3.41Å; A1268-I1272 WeakPolarHBondContact O-CG1 3.47Å; A1268-I1272 PolarHBondContact O-N 2.94Å; A1268-I1305 HydrophobicContact CB-CD1 3.78Å; A1268-I1305 HydrophobicContact CB-CG1 4.39Å
1269	R	96.2	Very high	94.1	Very high	38 Å²	38	47.3 Å²	47.3	14%	0.143	25%	0.254	C	S	.	.	H	α-helix	trans	-56.3	-49.1	172.4	-176.2	-156.6	168	-126.4	1.6	111	I1265 E1266 S1271 I1272 I1273 A1296 D1297 T1300	I1265-R1269 PolarHBondContact O-N 2.88Å; E1266-R1269 WeakPolarHBondContact O-CB 3.35Å; E1266-R1269 PolarHBondContact O-N 3.2Å; E1266-R1269 VanDerWaalsContact OE1-CD 3.22Å; E1266-R1269 WeakPolarHBondContact OE1-CD 3.4Å; E1266-R1269 IonicContact OE1-CZ 2.63Å; E1266-R1269 IonicContact OE1-NE 3.66Å; E1266-R1269 IonicContact OE1-NH1 2.89Å; E1266-R1269 PolarHBondContact OE1-NH1 3Å; R1269-S1271 VanDerWaalsContact C-N 3.33Å; R1269-S1271 PolarHBondContact O-N 3.17Å; R1269-I1272 PolarHBondContact O-N 3.37Å; R1269-I1273 WeakPolarHBondContact O-CG1 3.31Å; R1269-I1273 PolarHBondContact O-N 3.41Å; R1269-A1296 HydrophobicContact CG-CB 3.89Å; R1269-D1297 WeakPolarHBondContact CD-OD1 3.4Å; R1269-D1297 IonicContact CZ-OD1 2.72Å; R1269-D1297 VanDerWaalsContact CZ-OD1 3.32Å; R1269-D1297 IonicContact CZ-OD2 2.75Å; R1269-D1297 IonicContact NE-OD1 4Å; R1269-D1297 PolarHBondContact NE-OD1 3.36Å; R1269-D1297 IonicContact NE-OD2 3.29Å; R1269-D1297 IonicContact NH2-OD1 3.07Å; R1269-D1297 PolarHBondContact NH2-OD1 2.99Å; R1269-D1297 IonicContact NH2-OD2 3.2Å; R1269-D1297 PolarHBondContact NH2-OD2 3.24Å; R1269-T1300 HydrophobicContact CB-CG2 3.93Å; R1269-T1300 HydrophobicContact CG-CG2 4.4Å
1270	R	95.6	Very high	93.6	Very high	149 Å²	149	47 Å²	47	56%	0.562	25%	0.252	S	S	*	.	H	α-helix	trans	-61.5	-41.5	177.1	-177.2	60.2	175.1	176.9	0.3	112	E1266 A1267 A1268 I1272 I1273 S1274	E1266-R1270 PolarHBondContact O-N 2.93Å; E1266-R1270 VanDerWaalsContact O-N 3.07Å; A1267-R1270 PolarHBondContact O-N 3.41Å; A1268-R1270 PolarHBondContact O-N 3.11Å; R1270-I1272 PolarHBondContact O-N 2.92Å; R1270-I1273 PolarHBondContact O-N 3.24Å; R1270-S1274 PolarHBondContact O-N 3.25Å; R1270-S1274 PolarHBondContact O-OG 3.43Å
1271	S	94.9	Very high	93.1	Very high	11 Å²	11	48.7 Å²	48.7	8%	0.077	27%	0.266	C	S	.	.	H	α-helix	trans	-59.3	-42.5	175.7	176.1	0	0	0	0	112.1	A1267 A1268 R1269 I1273 S1274 E1275	A1267-S1271 PolarHBondContact O-N 3.21Å; A1268-S1271 WeakPolarHBondContact O-CB 3.44Å; A1268-S1271 PolarHBondContact O-N 3.41Å; R1269-S1271 VanDerWaalsContact C-N 3.33Å; R1269-S1271 PolarHBondContact O-N 3.17Å; S1271-I1273 PolarHBondContact O-N 2.89Å; S1271-S1274 PolarHBondContact O-N 3.39Å; S1271-S1274 PolarHBondContact O-OG 3.12Å; S1271-S1274 VanDerWaalsContact O-OG 3.06Å; S1271-E1275 VanDerWaalsContact O-CB 3.28Å; S1271-E1275 WeakPolarHBondContact O-CB 3.05Å; S1271-E1275 WeakPolarHBondContact O-CG 3.03Å; S1271-E1275 PolarHBondContact O-N 3.44Å
1272	I	96	Very high	92.4	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-59.7	-46.2	175.8	-68.2	164.2	0	0	0	111	I1077 P1256 A1268 R1269 R1270 I1276 A1296 M1299 T1300 I1305	I1077-I1272 HydrophobicContact CG2-CG1 4.35Å; I1077-I1272 HydrophobicContact CG2-CG2 3.97Å; P1256-I1272 HydrophobicContact CB-CD1 4.38Å; P1256-I1272 HydrophobicContact CB-CG1 3.81Å; P1256-I1272 HydrophobicContact CG-CG1 3.86Å; A1268-I1272 WeakPolarHBondContact O-CG1 3.47Å; A1268-I1272 PolarHBondContact O-N 2.94Å; R1269-I1272 PolarHBondContact O-N 3.37Å; R1270-I1272 PolarHBondContact O-N 2.92Å; I1272-I1276 HydrophobicContact CG2-CD1 3.87Å; I1272-I1276 WeakPolarHBondContact O-CG1 3.24Å; I1272-I1276 PolarHBondContact O-N 3.48Å; I1272-I1276 VanDerWaalsContact O-N 3.14Å; I1272-A1296 HydrophobicContact CB-CB 4.33Å; I1272-A1296 HydrophobicContact CG2-CB 4.04Å; I1272-M1299 HydrophobicContact CD1-CB 4.38Å; I1272-M1299 HydrophobicContact CD1-CE 4.11Å; I1272-M1299 HydrophobicContact CD1-SD 4.35Å; I1272-M1299 HydrophobicContact CG2-SD 4.29Å; I1272-T1300 HydrophobicContact CD1-CG2 4.37Å; I1272-I1305 HydrophobicContact CD1-CG2 4.33Å
1273	I	95.3	Very high	91.6	Very high	3 Å²	3	44.7 Å²	44.7	2%	0.015	25%	0.253	C	S	.	.	H	α-helix	trans	-62.6	-51.1	-179.5	-62.8	167.2	0	0	0	110.3	R1269 R1270 S1271 E1275 I1276 Q1277 I1289 L1292 M1293 A1296	R1269-I1273 WeakPolarHBondContact O-CG1 3.31Å; R1269-I1273 PolarHBondContact O-N 3.41Å; R1270-I1273 PolarHBondContact O-N 3.24Å; S1271-I1273 PolarHBondContact O-N 2.89Å; I1273-E1275 PolarHBondContact O-N 3.08Å; I1273-I1276 PolarHBondContact O-N 2.75Å; I1273-Q1277 VanDerWaalsContact O-CB 3.24Å; I1273-Q1277 WeakPolarHBondContact O-CB 3.47Å; I1273-Q1277 PolarHBondContact O-N 3.36Å; I1273-I1289 HydrophobicContact CG2-CD1 4.29Å; I1273-I1289 HydrophobicContact CG2-CG1 4.04Å; I1273-L1292 HydrophobicContact CG2-CB 4.19Å; I1273-L1292 HydrophobicContact CG2-CD1 4.49Å; I1273-M1293 HydrophobicContact CD1-CG 3.97Å; I1273-A1296 HydrophobicContact CD1-CB 4.02Å; I1273-A1296 HydrophobicContact CG1-CB 3.59Å
1274	S	93.8	Very high	90.8	Very high	49 Å²	49	43.3 Å²	43.3	34%	0.343	26%	0.263	S	S	.	.	H	α-helix	trans	-64	-40.2	-177.2	58.4	0	0	0	0	112.5	R1270 S1271 A1278	R1270-S1274 PolarHBondContact O-N 3.25Å; R1270-S1274 PolarHBondContact O-OG 3.43Å; S1271-S1274 PolarHBondContact O-N 3.39Å; S1271-S1274 PolarHBondContact O-OG 3.12Å; S1271-S1274 VanDerWaalsContact O-OG 3.06Å; S1274-A1278 VanDerWaalsContact O-CB 3.23Å; S1274-A1278 WeakPolarHBondContact O-CB 3.08Å; S1274-A1278 PolarHBondContact O-N 3Å
1275	E	92.4	Very high	90	Very high	44 Å²	44	42.7 Å²	42.7	21%	0.206	25%	0.252	C	S	.	.	H	α-helix	trans	-68	-43.5	-179.1	-75	-67.5	131.8	0	0	112.4	R1073 I1077 S1271 I1273 T1279	R1073-E1275 IonicContact CZ-OE2 2.69Å; R1073-E1275 IonicContact NE-OE2 3.19Å; R1073-E1275 IonicContact NH2-OE2 2.94Å; R1073-E1275 PolarHBondContact NH2-OE2 3.31Å; I1077-E1275 HydrophobicContact CD1-CB 3.71Å; S1271-E1275 VanDerWaalsContact O-CB 3.28Å; S1271-E1275 WeakPolarHBondContact O-CB 3.05Å; S1271-E1275 WeakPolarHBondContact O-CG 3.03Å; S1271-E1275 PolarHBondContact O-N 3.44Å; I1273-E1275 PolarHBondContact O-N 3.08Å; E1275-T1279 WeakPolarHBondContact O-CB 3.47Å; E1275-T1279 PolarHBondContact O-N 2.89Å; E1275-T1279 PolarHBondContact O-OG1 3.28Å
1276	I	91.8	Very high	89.2	Confident	1 Å²	1	41.9 Å²	41.9	1%	0.005	26%	0.257	C	S	.	.	H	α-helix	trans	-68.1	-42.8	177	-62.2	173.3	0	0	0	110	I1074 I1077 I1272 I1273 T1279 M1280 L1292 L1295	I1074-I1276 HydrophobicContact CG1-CG2 4.5Å; I1077-I1276 HydrophobicContact CB-CG1 4.48Å; I1077-I1276 HydrophobicContact CD1-CG1 3.93Å; I1077-I1276 HydrophobicContact CG2-CD1 3.95Å; I1077-I1276 HydrophobicContact CG2-CG1 3.99Å; I1272-I1276 HydrophobicContact CG2-CD1 3.87Å; I1272-I1276 WeakPolarHBondContact O-CG1 3.24Å; I1272-I1276 PolarHBondContact O-N 3.48Å; I1272-I1276 VanDerWaalsContact O-N 3.14Å; I1273-I1276 PolarHBondContact O-N 2.75Å; I1276-T1279 PolarHBondContact O-N 2.62Å; I1276-M1280 HydrophobicContact CG2-CG 4.32Å; I1276-M1280 WeakPolarHBondContact O-CG 3.48Å; I1276-M1280 PolarHBondContact O-N 3.06Å; I1276-L1292 HydrophobicContact CB-CD2 3.98Å; I1276-L1292 HydrophobicContact CG2-CD1 4.46Å; I1276-L1292 HydrophobicContact CG2-CD2 3.41Å; I1276-L1292 VanDerWaalsContact CG2-CD2 3.41Å; I1276-L1295 HydrophobicContact CD1-CD2 3.77Å
1277	Q	90.9	Very high	88.8	Confident	86 Å²	86	37.7 Å²	37.7	40%	0.402	24%	0.238	S	C	.	.	H	α-helix	trans	-61.3	-46.3	178	-173	175.1	-3.3	0	0	111.7	I1273 T1279 M1280 A1281 L1292	I1273-Q1277 VanDerWaalsContact O-CB 3.24Å; I1273-Q1277 WeakPolarHBondContact O-CB 3.47Å; I1273-Q1277 PolarHBondContact O-N 3.36Å; Q1277-T1279 VanDerWaalsContact C-N 3.32Å; Q1277-T1279 PolarHBondContact O-N 3.37Å; Q1277-M1280 PolarHBondContact O-N 3.03Å; Q1277-A1281 WeakPolarHBondContact O-CB 3.4Å; Q1277-A1281 PolarHBondContact O-N 3.4Å; Q1277-L1292 HydrophobicContact CB-CD1 3.77Å; Q1277-L1292 HydrophobicContact CG-CD1 4.44Å
1278	A	88.8	Confident	88.7	Confident	61 Å²	61	36.8 Å²	36.8	50%	0.504	23%	0.228	S	C	.	.	H	α-helix	trans	-61.9	-40.7	176.5	0	0	0	0	0	111.8	S1274 S1282	S1274-A1278 VanDerWaalsContact O-CB 3.23Å; S1274-A1278 WeakPolarHBondContact O-CB 3.08Å; S1274-A1278 PolarHBondContact O-N 3Å; A1278-S1282 PolarHBondContact O-N 2.84Å; A1278-S1282 VanDerWaalsContact O-N 3.09Å
1279	T	87.1	Confident	88.5	Confident	8 Å²	8	39.5 Å²	39.5	5%	0.049	24%	0.243	C	C	.	.	H	α-helix	trans	-65	-39.6	177.4	-55.5	0	0	0	0	111.9	R1073 I1074 E1275 I1276 Q1277 S1282 H1283	R1073-T1279 HydrophobicContact CB-CG2 4.2Å; R1073-T1279 HydrophobicContact CG-CG2 4.26Å; I1074-T1279 HydrophobicContact CD1-CG2 3.93Å; I1074-T1279 HydrophobicContact CG1-CG2 4.03Å; E1275-T1279 WeakPolarHBondContact O-CB 3.47Å; E1275-T1279 PolarHBondContact O-N 2.89Å; E1275-T1279 PolarHBondContact O-OG1 3.28Å; I1276-T1279 PolarHBondContact O-N 2.62Å; Q1277-T1279 VanDerWaalsContact C-N 3.32Å; Q1277-T1279 PolarHBondContact O-N 3.37Å; T1279-S1282 PolarHBondContact O-OG 3Å; T1279-H1283 PolarHBondContact O-CD2 3.31Å
1280	M	85.8	Confident	88.4	Confident	2 Å²	2	38.4 Å²	38.4	1%	0.01	24%	0.238	C	C	.	.	H	α-helix	trans	-74.7	-40.7	177.9	-68.5	-66.5	-168.9	0	0	112	I1045 M1052 I1074 I1276 Q1277 S1282 H1283 I1285	I1045-M1280 HydrophobicContact CG2-CE 4.26Å; M1052-M1280 HydrophobicContact CE-CE 4.33Å; M1052-M1280 HydrophobicContact CE-SD 4.17Å; M1052-M1280 HydrophobicContact SD-SD 3.76Å; I1074-M1280 HydrophobicContact CD1-CE 3.35Å; I1074-M1280 HydrophobicContact CD1-CG 4.44Å; I1074-M1280 HydrophobicContact CD1-SD 3.83Å; I1074-M1280 HydrophobicContact CG1-CE 4.34Å; I1276-M1280 HydrophobicContact CG2-CG 4.32Å; I1276-M1280 WeakPolarHBondContact O-CG 3.48Å; I1276-M1280 PolarHBondContact O-N 3.06Å; Q1277-M1280 PolarHBondContact O-N 3.03Å; M1280-S1282 VanDerWaalsContact C-N 3.32Å; M1280-S1282 PolarHBondContact O-N 3.32Å; M1280-H1283 PolarHBondContact O-N 3.29Å; M1280-H1283 VanDerWaalsContact O-N 3.14Å; M1280-I1285 HydrophobicContact CB-CB 4.46Å; M1280-I1285 PolarHBondContact O-N 3.37Å; M1280-I1285 HydrophobicContact SD-CD1 4.45Å
1281	A	84.6	Confident	88.3	Confident	62 Å²	62	31.5 Å²	31.5	51%	0.512	21%	0.213	S	C	.	.	H	α-helix	trans	-64.9	-33.8	-179.3	0	0	0	0	0	112.5	Q1277 H1283 G1284	Q1277-A1281 WeakPolarHBondContact O-CB 3.4Å; Q1277-A1281 PolarHBondContact O-N 3.4Å; A1281-H1283 PolarHBondContact O-N 3.02Å; A1281-G1284 PolarHBondContact O-N 3.05Å
1282	S	79.2	Confident	88.3	Confident	56 Å²	56	31.1 Å²	31.1	39%	0.392	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-24.9	175.9	72	0	0	0	0	113.1	Q1069 A1278 T1279 M1280	Q1069-S1282 PolarHBondContact OE1-OG 2.93Å; A1278-S1282 PolarHBondContact O-N 2.84Å; A1278-S1282 VanDerWaalsContact O-N 3.09Å; T1279-S1282 PolarHBondContact O-OG 3Å; M1280-S1282 VanDerWaalsContact C-N 3.32Å; M1280-S1282 PolarHBondContact O-N 3.32Å
1283	H	78	Confident	88.2	Confident	41 Å²	41	32.6 Å²	32.6	19%	0.19	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.9	5.9	174.2	-70.9	-76.7	0	0	0	113.6	M1052 T1279 M1280 A1281 I1285	M1052-H1283 HydrophobicContact CG-CB 4.11Å; T1279-H1283 PolarHBondContact O-CD2 3.31Å; M1280-H1283 PolarHBondContact O-N 3.29Å; M1280-H1283 VanDerWaalsContact O-N 3.14Å; A1281-H1283 PolarHBondContact O-N 3.02Å; H1283-I1285 VanDerWaalsContact C-N 3.28Å; H1283-I1285 HydrophobicContact CB-CD1 4.02Å; H1283-I1285 HydrophobicContact CB-CG1 4.28Å; H1283-I1285 PolarHBondContact O-N 2.93Å
1284	G	77.1	Confident	88.2	Confident	72 Å²	72	32.6 Å²	32.6	74%	0.742	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	72.4	19.4	-179.6	0	0	0	0	0	114	A1281	A1281-G1284 PolarHBondContact O-N 3.05Å
1285	I	78.9	Confident	88.3	Confident	16 Å²	16	30.3 Å²	30.3	8%	0.082	20%	0.201	C	C	.	.			trans	-93.7	114.4	-178.6	-63.4	167.7	0	0	0	108.8	P1048 M1052 M1280 H1283 L1287	P1048-I1285 HydrophobicContact CB-CB 4.44Å; P1048-I1285 HydrophobicContact CB-CD1 3.79Å; P1048-I1285 HydrophobicContact CB-CG1 4.35Å; P1048-I1285 HydrophobicContact CB-CG2 3.39Å; P1048-I1285 HydrophobicContact CG-CG2 3.9Å; M1052-I1285 HydrophobicContact CG-CD1 3.54Å; M1052-I1285 HydrophobicContact SD-CD1 4.45Å; M1280-I1285 HydrophobicContact CB-CB 4.46Å; M1280-I1285 PolarHBondContact O-N 3.37Å; M1280-I1285 HydrophobicContact SD-CD1 4.45Å; H1283-I1285 VanDerWaalsContact C-N 3.28Å; H1283-I1285 HydrophobicContact CB-CD1 4.02Å; H1283-I1285 HydrophobicContact CB-CG1 4.28Å; H1283-I1285 PolarHBondContact O-N 2.93Å; I1285-L1287 PolarHBondContact O-N 3.46Å
1286	G	80	Confident	88.4	Confident	35 Å²	35	28.2 Å²	28.2	36%	0.361	19%	0.191	S	C	.	.			trans	-78.5	115.1	171.4	0	0	0	0	0	111.4	R524 N525	R524-G1286 PolarHBondContact NE-O 3.38Å; N525-G1286 PolarHBondContact ND2-O 3.26Å
1287	L	87.9	Confident	88.5	Confident	24 Å²	24	29 Å²	29	13%	0.126	20%	0.195	C	C	.	.			trans	-121.6	131.8	173	178.7	66.2	0	0	0	109	R524 I1045 I1285 H1291 L1292	R524-L1287 HydrophobicContact CG-CD1 3.65Å; I1045-L1287 HydrophobicContact CG1-CD2 3.96Å; I1285-L1287 PolarHBondContact O-N 3.46Å; L1287-H1291 HydrophobicContact CD1-CB 4.23Å; L1287-L1292 HydrophobicContact CD2-CD1 4.07Å; L1287-L1292 HydrophobicContact CD2-CD2 3.43Å; L1287-L1292 VanDerWaalsContact CD2-CD2 3.43Å; L1287-L1292 HydrophobicContact CD2-CG 3.65Å; L1287-L1292 HydrophobicContact CG-CG 4.38Å
1288	D	91.7	Very high	88.6	Confident	14 Å²	14	25.4 Å²	25.4	8%	0.075	18%	0.178	C	C	.	.			trans	-66.8	137.3	174.5	-167.3	-81.4	0	0	0	111.2	R524 P898 R1290 H1291	R524-D1288 VanDerWaalsContact O-CB 3.3Å; R524-D1288 WeakPolarHBondContact O-CB 3.41Å; R524-D1288 PolarHBondContact O-N 2.88Å; P898-D1288 HydrophobicContact CB-CB 3.92Å; P898-D1288 HydrophobicContact CG-CB 4.34Å; D1288-R1290 VanDerWaalsContact CG-NH1 3.25Å; D1288-R1290 PolarHBondContact O-N 2.95Å; D1288-R1290 VanDerWaalsContact OD1-CB 3.29Å; D1288-R1290 WeakPolarHBondContact OD1-CB 3.05Å; D1288-R1290 VanDerWaalsContact OD1-CG 3.25Å; D1288-R1290 WeakPolarHBondContact OD1-CG 3.5Å; D1288-R1290 IonicContact OD1-CZ 3.01Å; D1288-R1290 PolarHBondContact OD1-N 3.24Å; D1288-R1290 IonicContact OD1-NH1 3.74Å; D1288-R1290 PolarHBondContact OD1-NH1 2.86Å; D1288-R1290 IonicContact OD2-NH1 2.96Å; D1288-R1290 PolarHBondContact OD2-NH1 2.95Å; D1288-H1291 PolarHBondContact O-N 3Å
1289	I	92.6	Very high	88.8	Confident	58 Å²	58	22.5 Å²	22.5	30%	0.297	16%	0.155	S	C	.	.	H	α-helix	trans	-61.5	-29.5	-176.1	-166.8	171	0	0	0	112.7	I1273 H1291 L1292 M1293	I1273-I1289 HydrophobicContact CG2-CD1 4.29Å; I1273-I1289 HydrophobicContact CG2-CG1 4.04Å; I1289-H1291 VanDerWaalsContact C-N 3.27Å; I1289-H1291 PolarHBondContact O-N 3.35Å; I1289-L1292 WeakPolarHBondContact O-CA 3.44Å; I1289-L1292 WeakPolarHBondContact O-CB 3.35Å; I1289-L1292 PolarHBondContact O-N 3.38Å; I1289-M1293 HydrophobicContact CG1-CG 4.3Å; I1289-M1293 HydrophobicContact CG1-SD 4.39Å; I1289-M1293 WeakPolarHBondContact O-CG 3.48Å; I1289-M1293 PolarHBondContact O-N 3.06Å
1290	R	93.4	Very high	89.1	Confident	14 Å²	14	22.7 Å²	22.7	5%	0.053	16%	0.155	C	C	.	.	H	α-helix	trans	-64.2	-33.4	-176.2	-61.3	174.6	-169.2	82.6	-5.8	111.9	D894 I896 P898 M901 D1288 L1292 M1293 I1294	D894-R1290 IonicContact OD1-CZ 3.85Å; D894-R1290 IonicContact OD1-NE 3.77Å; D894-R1290 PolarHBondContact OD1-NE 2.93Å; D894-R1290 IonicContact OD2-CZ 3.93Å; D894-R1290 IonicContact OD2-NE 2.93Å; D894-R1290 PolarHBondContact OD2-NE 2.99Å; D894-R1290 IonicContact OD2-NH2 2.78Å; D894-R1290 PolarHBondContact OD2-NH2 3.43Å; I896-R1290 WeakPolarHBondContact O-CD 3.33Å; I896-R1290 PolarHBondContact O-NE 3.35Å; P898-R1290 HydrophobicContact CG-CB 4.1Å; M901-R1290 PolarHBondContact SD-NH2 3.37Å; D1288-R1290 VanDerWaalsContact CG-NH1 3.25Å; D1288-R1290 PolarHBondContact O-N 2.95Å; D1288-R1290 VanDerWaalsContact OD1-CB 3.29Å; D1288-R1290 WeakPolarHBondContact OD1-CB 3.05Å; D1288-R1290 VanDerWaalsContact OD1-CG 3.25Å; D1288-R1290 WeakPolarHBondContact OD1-CG 3.5Å; D1288-R1290 IonicContact OD1-CZ 3.01Å; D1288-R1290 PolarHBondContact OD1-N 3.24Å; D1288-R1290 IonicContact OD1-NH1 3.74Å; D1288-R1290 PolarHBondContact OD1-NH1 2.86Å; D1288-R1290 IonicContact OD2-NH1 2.96Å; D1288-R1290 PolarHBondContact OD2-NH1 2.95Å; R1290-L1292 VanDerWaalsContact C-N 3.34Å; R1290-L1292 PolarHBondContact O-N 3.44Å; R1290-M1293 PolarHBondContact O-N 3.42Å; R1290-I1294 VanDerWaalsContact O-CG1 3.32Å; R1290-I1294 WeakPolarHBondContact O-CG1 3.26Å; R1290-I1294 PolarHBondContact O-N 3.33Å; R1290-I1294 VanDerWaalsContact O-N 3.11Å
1291	H	94.4	Very high	89.3	Confident	5 Å²	5	25.1 Å²	25.1	2%	0.023	17%	0.172	C	C	.	.	H	α-helix	trans	-64.8	-39.2	173.5	-64.4	-51.5	0	0	0	111.9	P523 R524 A1041 L1287 D1288 I1289 L1295	P523-H1291 PolarHBondContact O-NE2 3.13Å; R524-H1291 PolarHBondContact O-CD2 3.28Å; A1041-H1291 WeakPolarHBondContact CA-ND1 3.39Å; A1041-H1291 HydrophobicContact CB-CB 4.03Å; L1287-H1291 HydrophobicContact CD1-CB 4.23Å; D1288-H1291 PolarHBondContact O-N 3Å; I1289-H1291 VanDerWaalsContact C-N 3.27Å; I1289-H1291 PolarHBondContact O-N 3.35Å; H1291-L1295 PolarHBondContact O-N 3.38Å
1292	L	94	Very high	89.4	Confident	3 Å²	3	25.1 Å²	25.1	2%	0.016	17%	0.166	C	C	.	.	H	α-helix	trans	-70.6	-36.9	176.5	-64	-179.9	0	0	0	111.9	I1045 I1273 I1276 Q1277 L1287 I1289 R1290 L1295 A1296	I1045-L1292 HydrophobicContact CD1-CD2 4.13Å; I1045-L1292 HydrophobicContact CG1-CD2 4.25Å; I1273-L1292 HydrophobicContact CG2-CB 4.19Å; I1273-L1292 HydrophobicContact CG2-CD1 4.49Å; I1276-L1292 HydrophobicContact CB-CD2 3.98Å; I1276-L1292 HydrophobicContact CG2-CD1 4.46Å; I1276-L1292 HydrophobicContact CG2-CD2 3.41Å; I1276-L1292 VanDerWaalsContact CG2-CD2 3.41Å; Q1277-L1292 HydrophobicContact CB-CD1 3.77Å; Q1277-L1292 HydrophobicContact CG-CD1 4.44Å; L1287-L1292 HydrophobicContact CD2-CD1 4.07Å; L1287-L1292 HydrophobicContact CD2-CD2 3.43Å; L1287-L1292 VanDerWaalsContact CD2-CD2 3.43Å; L1287-L1292 HydrophobicContact CD2-CG 3.65Å; L1287-L1292 HydrophobicContact CG-CG 4.38Å; I1289-L1292 WeakPolarHBondContact O-CA 3.44Å; I1289-L1292 WeakPolarHBondContact O-CB 3.35Å; I1289-L1292 PolarHBondContact O-N 3.38Å; R1290-L1292 VanDerWaalsContact C-N 3.34Å; R1290-L1292 PolarHBondContact O-N 3.44Å; L1292-L1295 PolarHBondContact O-N 3Å; L1292-A1296 WeakPolarHBondContact O-CB 3.4Å; L1292-A1296 PolarHBondContact O-N 3.3Å
1293	M	95.4	Very high	89.7	Confident	30 Å²	30	25.1 Å²	25.1	15%	0.148	18%	0.175	C	C	.	.	H	α-helix	trans	-59.5	-48.1	174.8	-68.8	172	71.2	0	0	110.7	G892 I1273 I1289 R1290 L1295 A1296 D1297	G892-M1293 VanDerWaalsContact O-CE 3.27Å; G892-M1293 WeakPolarHBondContact O-CE 3.16Å; I1273-M1293 HydrophobicContact CD1-CG 3.97Å; I1289-M1293 HydrophobicContact CG1-CG 4.3Å; I1289-M1293 HydrophobicContact CG1-SD 4.39Å; I1289-M1293 WeakPolarHBondContact O-CG 3.48Å; I1289-M1293 PolarHBondContact O-N 3.06Å; R1290-M1293 PolarHBondContact O-N 3.42Å; M1293-L1295 VanDerWaalsContact C-N 3.33Å; M1293-L1295 PolarHBondContact O-N 3.32Å; M1293-A1296 PolarHBondContact O-N 3.08Å; M1293-D1297 VanDerWaalsContact O-CB 3.27Å; M1293-D1297 WeakPolarHBondContact O-CB 3.42Å; M1293-D1297 PolarHBondContact O-N 3.17Å
1294	I	94.9	Very high	90.3	Very high	4 Å²	4	25.6 Å²	25.6	2%	0.021	18%	0.183	C	C	.	.	H	α-helix	trans	-58.9	-44.6	178	-64	160.7	0	0	0	111.5	L871 F891 V1037 A1041 R1290 M1298	L871-I1294 HydrophobicContact CD1-CG2 3.81Å; F891-I1294 HydrophobicContact CD2-CD1 4.34Å; F891-I1294 HydrophobicContact CE2-CD1 3.54Å; F891-I1294 HydrophobicContact CE2-CG1 4.32Å; F891-I1294 HydrophobicContact CZ-CD1 4.37Å; V1037-I1294 HydrophobicContact CB-CD1 4.13Å; V1037-I1294 HydrophobicContact CG2-CD1 4.42Å; A1041-I1294 HydrophobicContact CB-CB 4.39Å; A1041-I1294 HydrophobicContact CB-CD1 4.12Å; A1041-I1294 HydrophobicContact CB-CG2 4.39Å; R1290-I1294 VanDerWaalsContact O-CG1 3.32Å; R1290-I1294 WeakPolarHBondContact O-CG1 3.26Å; R1290-I1294 PolarHBondContact O-N 3.33Å; R1290-I1294 VanDerWaalsContact O-N 3.11Å; I1294-M1298 WeakPolarHBondContact O-CB 3.42Å; I1294-M1298 PolarHBondContact O-N 2.95Å
1295	L	94.8	Very high	91	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-62.1	-48.2	177.2	174.6	63.9	0	0	0	111.1	L864 L868 I1045 V1078 I1276 H1291 L1292 M1293 M1298 M1299 M1308	L864-L1295 HydrophobicContact CD2-CD1 3.88Å; L868-L1295 HydrophobicContact CD1-CD1 4.23Å; I1045-L1295 HydrophobicContact CD1-CB 3.99Å; I1045-L1295 HydrophobicContact CD1-CD2 3.77Å; I1045-L1295 HydrophobicContact CD1-CG 4.45Å; V1078-L1295 HydrophobicContact CG2-CD2 4.25Å; I1276-L1295 HydrophobicContact CD1-CD2 3.77Å; H1291-L1295 PolarHBondContact O-N 3.38Å; L1292-L1295 PolarHBondContact O-N 3Å; M1293-L1295 VanDerWaalsContact C-N 3.33Å; M1293-L1295 PolarHBondContact O-N 3.32Å; L1295-M1298 PolarHBondContact O-N 3.21Å; L1295-M1299 HydrophobicContact CD1-CG 4.43Å; L1295-M1299 HydrophobicContact CD1-SD 4.25Å; L1295-M1299 HydrophobicContact CG-SD 4.24Å; L1295-M1299 WeakPolarHBondContact O-CG 3.24Å; L1295-M1299 PolarHBondContact O-N 2.78Å; L1295-M1308 HydrophobicContact CD1-CG 4.28Å
1296	A	95.2	Very high	91.6	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-63.2	-44.9	-179.2	0	0	0	0	0	111.3	R1269 I1272 I1273 L1292 M1293 M1298 M1299 T1300	R1269-A1296 HydrophobicContact CG-CB 3.89Å; I1272-A1296 HydrophobicContact CB-CB 4.33Å; I1272-A1296 HydrophobicContact CG2-CB 4.04Å; I1273-A1296 HydrophobicContact CD1-CB 4.02Å; I1273-A1296 HydrophobicContact CG1-CB 3.59Å; L1292-A1296 WeakPolarHBondContact O-CB 3.4Å; L1292-A1296 PolarHBondContact O-N 3.3Å; M1293-A1296 PolarHBondContact O-N 3.08Å; A1296-M1298 VanDerWaalsContact C-N 3.34Å; A1296-M1298 PolarHBondContact O-N 2.91Å; A1296-M1299 CarbonylContact O-C 3.54Å; A1296-M1299 WeakPolarHBondContact O-CA 3.35Å; A1296-M1299 WeakPolarHBondContact O-CB 3.06Å; A1296-M1299 PolarHBondContact O-N 3.49Å; A1296-T1300 PolarHBondContact O-N 3.09Å; A1296-T1300 PolarHBondContact O-OG1 3.19Å
1297	D	94.5	Very high	92.2	Very high	19 Å²	19	21.4 Å²	21.4	10%	0.102	14%	0.137	C	C	.	.	H	α-helix	trans	-60.8	-42	177.3	-73.7	-41.2	0	0	0	111.6	Q888 R1269 M1293 M1299 T1300 C1301	Q888-D1297 HydrophobicContact CG-CB 4.09Å; Q888-D1297 WeakPolarHBondContact CG-OD2 3.26Å; Q888-D1297 PolarHBondContact NE2-OD2 2.82Å; R1269-D1297 WeakPolarHBondContact CD-OD1 3.4Å; R1269-D1297 IonicContact CZ-OD1 2.72Å; R1269-D1297 VanDerWaalsContact CZ-OD1 3.32Å; R1269-D1297 IonicContact CZ-OD2 2.75Å; R1269-D1297 IonicContact NE-OD1 4Å; R1269-D1297 PolarHBondContact NE-OD1 3.36Å; R1269-D1297 IonicContact NE-OD2 3.29Å; R1269-D1297 IonicContact NH2-OD1 3.07Å; R1269-D1297 PolarHBondContact NH2-OD1 2.99Å; R1269-D1297 IonicContact NH2-OD2 3.2Å; R1269-D1297 PolarHBondContact NH2-OD2 3.24Å; M1293-D1297 VanDerWaalsContact O-CB 3.27Å; M1293-D1297 WeakPolarHBondContact O-CB 3.42Å; M1293-D1297 PolarHBondContact O-N 3.17Å; D1297-M1299 VanDerWaalsContact C-N 3.29Å; D1297-M1299 PolarHBondContact O-N 3.42Å; D1297-T1300 PolarHBondContact O-N 2.98Å; D1297-T1300 PolarHBondContact O-OG1 3.18Å; D1297-C1301 VanDerWaalsContact O-CB 3.24Å; D1297-C1301 WeakPolarHBondContact O-CB 3.44Å; D1297-C1301 PolarHBondContact O-N 3.15Å
1298	M	92.3	Very high	92.3	Very high	9 Å²	9	20.4 Å²	20.4	4%	0.044	13%	0.132	C	C	.	.	H	α-helix	trans	-65.3	-33.1	174.3	-172.2	59.9	145.3	0	0	112.8	C867 L868 L871 I1294 L1295 A1296 T1300 C1301 M1308 V1316	C867-M1298 WeakPolarHBondContact O-CE 3.23Å; L868-M1298 HydrophobicContact CD2-CB 3.76Å; L868-M1298 HydrophobicContact CD2-CG 3.71Å; L871-M1298 HydrophobicContact CD1-CB 4.31Å; L871-M1298 HydrophobicContact CD1-CE 4.21Å; L871-M1298 HydrophobicContact CD1-CG 4.35Å; L871-M1298 HydrophobicContact CD1-SD 4.21Å; L871-M1298 HydrophobicContact CD2-CE 4.33Å; L871-M1298 HydrophobicContact CD2-SD 4.39Å; L871-M1298 HydrophobicContact CG-CE 4.25Å; I1294-M1298 WeakPolarHBondContact O-CB 3.42Å; I1294-M1298 PolarHBondContact O-N 2.95Å; L1295-M1298 PolarHBondContact O-N 3.21Å; A1296-M1298 VanDerWaalsContact C-N 3.34Å; A1296-M1298 PolarHBondContact O-N 2.91Å; M1298-T1300 VanDerWaalsContact C-N 3.32Å; M1298-C1301 PolarHBondContact O-SG 3.46Å; M1298-M1308 HydrophobicContact CG-CE 4.03Å; M1298-V1316 HydrophobicContact CE-CG1 3.14Å; M1298-V1316 HydrophobicContact CG-CG1 4.41Å; M1298-V1316 HydrophobicContact SD-CG1 3.48Å; M1298-V1316 WeakPolarHBondContact SD-CG1 3.4Å
1299	M	93.7	Very high	92.3	Very high	1 Å²	1	21 Å²	21	1%	0.005	14%	0.136	C	C	.	.	H	α-helix	trans	-72.7	-25.2	175.5	-70.8	179.4	69.1	0	0	112.6	I1077 A1080 I1272 L1295 A1296 D1297 S1304 I1305 T1306 M1308	I1077-M1299 VanDerWaalsContact O-CE 3.27Å; I1077-M1299 WeakPolarHBondContact O-CE 3.45Å; A1080-M1299 HydrophobicContact CB-CE 4.42Å; I1272-M1299 HydrophobicContact CD1-CB 4.38Å; I1272-M1299 HydrophobicContact CD1-CE 4.11Å; I1272-M1299 HydrophobicContact CD1-SD 4.35Å; I1272-M1299 HydrophobicContact CG2-SD 4.29Å; L1295-M1299 HydrophobicContact CD1-CG 4.43Å; L1295-M1299 HydrophobicContact CD1-SD 4.25Å; L1295-M1299 HydrophobicContact CG-SD 4.24Å; L1295-M1299 WeakPolarHBondContact O-CG 3.24Å; L1295-M1299 PolarHBondContact O-N 2.78Å; A1296-M1299 CarbonylContact O-C 3.54Å; A1296-M1299 WeakPolarHBondContact O-CA 3.35Å; A1296-M1299 WeakPolarHBondContact O-CB 3.06Å; A1296-M1299 PolarHBondContact O-N 3.49Å; D1297-M1299 VanDerWaalsContact C-N 3.29Å; D1297-M1299 PolarHBondContact O-N 3.42Å; M1299-S1304 VanDerWaalsContact O-O 3.05Å; M1299-I1305 HydrophobicContact CE-CG2 3.99Å; M1299-I1305 WeakPolarHBondContact O-CA 3.31Å; M1299-T1306 PolarHBondContact O-N 3.27Å; M1299-M1308 HydrophobicContact CB-CE 4.3Å; M1299-M1308 HydrophobicContact CG-CE 3.47Å; M1299-M1308 VanDerWaalsContact CG-CE 3.47Å; M1299-M1308 HydrophobicContact CG-CG 4.47Å
1300	T	94	Very high	91.8	Very high	11 Å²	11	23.3 Å²	23.3	7%	0.067	14%	0.141	C	C	.	.	H	α-helix	trans	-111.5	-13.3	-172.4	56.3	0	0	0	0	115.3	I1265 R1269 I1272 A1296 D1297 M1298 T1302 G1303	I1265-T1300 HydrophobicContact CD1-CG2 3.8Å; I1265-T1300 HydrophobicContact CG1-CG2 3.96Å; R1269-T1300 HydrophobicContact CB-CG2 3.93Å; R1269-T1300 HydrophobicContact CG-CG2 4.4Å; I1272-T1300 HydrophobicContact CD1-CG2 4.37Å; A1296-T1300 PolarHBondContact O-N 3.09Å; A1296-T1300 PolarHBondContact O-OG1 3.19Å; D1297-T1300 PolarHBondContact O-N 2.98Å; D1297-T1300 PolarHBondContact O-OG1 3.18Å; M1298-T1300 VanDerWaalsContact C-N 3.32Å; T1300-T1302 PolarHBondContact O-N 3.08Å; T1300-G1303 PolarHBondContact O-N 3.41Å
1301	C	89.4	Confident	91.4	Very high	53 Å²	53	29.7 Å²	29.7	36%	0.358	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-25.8	-174.8	64.7	0	0	0	0	114.6	D1297 M1298 G1303	D1297-C1301 VanDerWaalsContact O-CB 3.24Å; D1297-C1301 WeakPolarHBondContact O-CB 3.44Å; D1297-C1301 PolarHBondContact O-N 3.15Å; M1298-C1301 PolarHBondContact O-SG 3.46Å; C1301-G1303 PolarHBondContact O-N 2.96Å
1302	T	85.4	Confident	91	Very high	62 Å²	62	29.7 Å²	29.7	38%	0.38	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.8	-1.8	178.3	64.9	0	0	0	0	113.9	T1300 S1304 T1306	T1300-T1302 PolarHBondContact O-N 3.08Å; T1302-S1304 VanDerWaalsContact C-N 3.25Å; T1302-S1304 PolarHBondContact O-N 3.5Å; T1302-S1304 PolarHBondContact OG1-O 3.49Å; T1302-S1304 VanDerWaalsContact OG1-O 3.09Å; T1302-T1306 PolarHBondContact OG1-OG1 3.31Å
1303	G	87	Confident	90.5	Very high	56 Å²	56	29.7 Å²	29.7	58%	0.577	17%	0.173	S	C	*	.	S	Bend	trans	80.2	1.9	-173.4	0	0	0	0	0	114.2	T1300 C1301	T1300-G1303 PolarHBondContact O-N 3.41Å; C1301-G1303 PolarHBondContact O-N 2.96Å
1304	S	89.8	Confident	89.9	Confident	51 Å²	51	29.3 Å²	29.3	36%	0.357	17%	0.172	S	C	.	.	S	Bend	trans	-139.8	148.5	172.4	70.7	0	0	0	0	110	M1299 T1302 T1306	M1299-S1304 VanDerWaalsContact O-O 3.05Å; T1302-S1304 VanDerWaalsContact C-N 3.25Å; T1302-S1304 PolarHBondContact O-N 3.5Å; T1302-S1304 PolarHBondContact OG1-O 3.49Å; T1302-S1304 VanDerWaalsContact OG1-O 3.09Å; S1304-T1306 PolarHBondContact O-N 3.24Å; S1304-T1306 PolarHBondContact O-OG1 3.39Å
1305	I	92.9	Very high	89.3	Confident	26 Å²	26	34.4 Å²	34.4	13%	0.133	20%	0.195	C	C	.	.			trans	-66.2	113.3	178.4	-52.3	-176.6	0	0	0	109.4	A1080 P1256 I1257 A1260 I1265 A1268 I1272 M1299	A1080-I1305 HydrophobicContact CB-CG2 3.77Å; P1256-I1305 VanDerWaalsContact C-CD1 3.42Å; P1256-I1305 HydrophobicContact CB-CD1 3.81Å; P1256-I1305 WeakPolarHBondContact O-CD1 3.5Å; I1257-I1305 HydrophobicContact CG1-CD1 4.05Å; A1260-I1305 HydrophobicContact CB-CD1 3.82Å; A1260-I1305 HydrophobicContact CB-CG1 4.1Å; I1265-I1305 HydrophobicContact CD1-CG1 3.81Å; A1268-I1305 HydrophobicContact CB-CD1 3.78Å; A1268-I1305 HydrophobicContact CB-CG1 4.39Å; I1272-I1305 HydrophobicContact CD1-CG2 4.33Å; M1299-I1305 HydrophobicContact CE-CG2 3.99Å; M1299-I1305 WeakPolarHBondContact O-CA 3.31Å
1306	T	91.3	Very high	88.5	Confident	1 Å²	1	35.3 Å²	35.3	1%	0.006	20%	0.2	C	C	.	.			trans	-105.5	116.7	-179.6	-58.2	0	0	0	0	109.3	M1299 T1302 S1304 M1308 G1312 K1315 V1316	M1299-T1306 PolarHBondContact O-N 3.27Å; T1302-T1306 PolarHBondContact OG1-OG1 3.31Å; S1304-T1306 PolarHBondContact O-N 3.24Å; S1304-T1306 PolarHBondContact O-OG1 3.39Å; T1306-M1308 WeakPolarHBondContact O-CE 3.26Å; T1306-G1312 WeakPolarHBondContact CG2-O 3.36Å; T1306-K1315 HydrophobicContact CG2-CB 4.12Å; T1306-K1315 HydrophobicContact CG2-CD 4.19Å; T1306-V1316 HydrophobicContact CG2-CG2 3.73Å
1307	G	92	Very high	87.7	Confident	9 Å²	9	35.7 Å²	35.7	9%	0.093	20%	0.202	C	C	.	.			trans	-73.5	144.3	176.8	0	0	0	0	0	112.3	V1078 T1309 G1312	V1078-G1307 CarbonylContact O-C 3.51Å; V1078-G1307 WeakPolarHBondContact O-CA 3.46Å; G1307-T1309 PolarHBondContact O-N 2.89Å; G1307-G1312 VanDerWaalsContact O-CA 3.31Å; G1307-G1312 WeakPolarHBondContact O-CA 3.2Å
1308	M	90.7	Very high	87	Confident	2 Å²	2	36.3 Å²	36.3	1%	0.01	21%	0.205	C	C	.	.	S	Bend	trans	-77.7	56.7	178.9	-58.4	-63.5	132.6	0	0	111.7	L864 C867 V1078 L1295 M1298 M1299 T1306	L864-M1308 HydrophobicContact CD2-CB 4.4Å; L864-M1308 HydrophobicContact CD2-CG 4.29Å; C867-M1308 HydrophobicContact CB-CB 4.49Å; C867-M1308 HydrophobicContact CB-CG 4.42Å; C867-M1308 HydrophobicContact CB-SD 3.31Å; C867-M1308 WeakPolarHBondContact CB-SD 3.33Å; V1078-M1308 HydrophobicContact CG1-CB 3.72Å; V1078-M1308 HydrophobicContact CG1-CG 4.11Å; V1078-M1308 PolarHBondContact O-N 2.83Å; L1295-M1308 HydrophobicContact CD1-CG 4.28Å; M1298-M1308 HydrophobicContact CG-CE 4.03Å; M1299-M1308 HydrophobicContact CB-CE 4.3Å; M1299-M1308 HydrophobicContact CG-CE 3.47Å; M1299-M1308 VanDerWaalsContact CG-CE 3.47Å; M1299-M1308 HydrophobicContact CG-CG 4.47Å; T1306-M1308 WeakPolarHBondContact O-CE 3.26Å
1309	T	90.1	Very high	86.9	Confident	28 Å²	28	36 Å²	36	17%	0.172	20%	0.204	C	C	.	.	S	Bend	trans	-123.1	173.5	-178.6	72.9	0	0	0	0	110.2	N1079 G1307 Q1311 G1312 L1313	N1079-T1309 HydrophobicContact CB-CG2 3.9Å; N1079-T1309 WeakPolarHBondContact OD1-CG2 3.35Å; G1307-T1309 PolarHBondContact O-N 2.89Å; T1309-Q1311 PolarHBondContact O-N 3.39Å; T1309-Q1311 PolarHBondContact OG1-N 2.87Å; T1309-G1312 PolarHBondContact O-N 2.89Å; T1309-L1313 PolarHBondContact O-N 3.35Å
1310	R	83.9	Confident	86.7	Confident	106 Å²	106	36 Å²	36	40%	0.4	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-23.4	176.8	74.5	-172.8	-177.9	-171.8	-5	114	P1314 F1326 E1327	R1310-P1314 WeakPolarHBondContact O-CD 3.43Å; R1310-F1326 HydrophobicContact CB-CD1 4.17Å; R1310-F1326 HydrophobicContact CB-CE1 3.89Å; R1310-E1327 HydrophobicContact CB-CB 4.45Å; R1310-E1327 VanDerWaalsContact CD-OE2 3.24Å; R1310-E1327 WeakPolarHBondContact CD-OE2 3.42Å; R1310-E1327 IonicContact NH1-OE2 3.71Å
1311	Q	84.5	Confident	86.6	Confident	147 Å²	147	36 Å²	36	69%	0.687	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.9	-25.3	179.7	-68	179.9	-14.1	0	0	112.1	T1309	T1309-Q1311 PolarHBondContact O-N 3.39Å; T1309-Q1311 PolarHBondContact OG1-N 2.87Å
1312	G	84.7	Confident	86.7	Confident	5 Å²	5	33.6 Å²	33.6	5%	0.052	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.1	-34.2	177.7	0	0	0	0	0	113.5	T1306 G1307 T1309 P1314 K1315 V1316	T1306-G1312 WeakPolarHBondContact CG2-O 3.36Å; G1307-G1312 VanDerWaalsContact O-CA 3.31Å; G1307-G1312 WeakPolarHBondContact O-CA 3.2Å; T1309-G1312 PolarHBondContact O-N 2.89Å; G1312-P1314 VanDerWaalsContact C-CD 3.48Å; G1312-P1314 VanDerWaalsContact C-N 3.34Å; G1312-K1315 WeakPolarHBondContact O-CB 3.41Å; G1312-K1315 PolarHBondContact O-N 3.29Å; G1312-V1316 PolarHBondContact O-N 3.3Å
1313	L	85	Confident	86.9	Confident	4 Å²	4	30.8 Å²	30.8	2%	0.021	17%	0.169	C	C	.	.	H	α-helix	trans	-51.4	-44.5	178.9	-175.9	71.1	0	0	0	113.3	C867 T1309 K1315 V1316 K1317 L1322 Q1323 F1326	C867-L1313 HydrophobicContact CB-CD1 4.21Å; T1309-L1313 PolarHBondContact O-N 3.35Å; L1313-K1315 PolarHBondContact O-N 3.32Å; L1313-K1315 VanDerWaalsContact O-N 3.14Å; L1313-V1316 PolarHBondContact O-N 3Å; L1313-K1317 PolarHBondContact O-N 2.9Å; L1313-L1322 HydrophobicContact CD1-CD2 4.31Å; L1313-L1322 HydrophobicContact CD2-CG 4.37Å; L1313-Q1323 HydrophobicContact CD2-CG 4.43Å; L1313-F1326 HydrophobicContact CD2-CB 4.13Å; L1313-F1326 HydrophobicContact CD2-CD1 4.05Å; L1313-F1326 HydrophobicContact CD2-CG 4.12Å
1314	P	82.4	Confident	87	Confident	21 Å²	21	28.1 Å²	28.1	14%	0.136	14%	0.142	C	C	.	.	H	α-helix	trans	-68.9	-6.8	177	-19.3	33.7	0	0	0	115.5	S137 R1310 G1312 Q1323	S137-P1314 WeakPolarHBondContact CB-O 3.36Å; S137-P1314 PolarHBondContact OG-O 3.34Å; R1310-P1314 WeakPolarHBondContact O-CD 3.43Å; G1312-P1314 VanDerWaalsContact C-CD 3.48Å; G1312-P1314 VanDerWaalsContact C-N 3.34Å; P1314-Q1323 HydrophobicContact CG-CG 4.31Å
1315	K	81.1	Confident	87	Confident	112 Å²	112	25.8 Å²	25.8	49%	0.487	13%	0.126	S	C	.	.	H	α-helix	trans	-88.9	-22.5	171.3	-62.6	-174.5	176.8	-175.1	0	112.1	T1306 G1312 L1313	T1306-K1315 HydrophobicContact CG2-CB 4.12Å; T1306-K1315 HydrophobicContact CG2-CD 4.19Å; G1312-K1315 WeakPolarHBondContact O-CB 3.41Å; G1312-K1315 PolarHBondContact O-N 3.29Å; L1313-K1315 PolarHBondContact O-N 3.32Å; L1313-K1315 VanDerWaalsContact O-N 3.14Å
1316	V	78.5	Confident	86.7	Confident	18 Å²	18	25 Å²	25	11%	0.109	12%	0.121	C	C	.	.	H	α-helix	trans	-97.3	-38.3	-174.9	-175	0	0	0	0	111.1	M1298 T1306 G1312 L1313	M1298-V1316 HydrophobicContact CE-CG1 3.14Å; M1298-V1316 HydrophobicContact CG-CG1 4.41Å; M1298-V1316 HydrophobicContact SD-CG1 3.48Å; M1298-V1316 WeakPolarHBondContact SD-CG1 3.4Å; T1306-V1316 HydrophobicContact CG2-CG2 3.73Å; G1312-V1316 PolarHBondContact O-N 3.3Å; L1313-V1316 PolarHBondContact O-N 3Å
1317	K	78.9	Confident	86.4	Confident	9 Å²	9	27 Å²	27	4%	0.039	13%	0.13	C	C	.	.			trans	-135.7	135.4	179.3	-177.6	158.8	173.3	-150.5	0	112.3	D870 S882 L1313 L1322 Q1323 E1350	D870-K1317 IonicContact OD1-NZ 2.63Å; D870-K1317 WeakPolarHBondContact OD2-CD 3.4Å; D870-K1317 WeakPolarHBondContact OD2-CE 3.4Å; D870-K1317 IonicContact OD2-NZ 3.55Å; D870-K1317 PolarHBondContact OD2-NZ 3.15Å; S882-K1317 VanDerWaalsContact OG-CE 3.32Å; S882-K1317 WeakPolarHBondContact OG-CE 3.28Å; L1313-K1317 PolarHBondContact O-N 2.9Å; K1317-L1322 HydrophobicContact CB-CD2 4.37Å; K1317-L1322 HydrophobicContact CD-CD2 3.51Å; K1317-L1322 HydrophobicContact CG-CD2 4.1Å; K1317-Q1323 PolarHBondContact O-NE2 3.39Å; K1317-E1350 WeakPolarHBondContact CE-OE1 3.36Å; K1317-E1350 VanDerWaalsContact NZ-CD 3.29Å; K1317-E1350 IonicContact NZ-OE1 3.53Å; K1317-E1350 PolarHBondContact NZ-OE1 3.49Å; K1317-E1350 IonicContact NZ-OE2 3.61Å; K1317-E1350 PolarHBondContact NZ-OE2 3.03Å; K1317-E1350 VanDerWaalsContact NZ-OE2 3.08Å
1318	D	80.5	Confident	86.1	Confident	31 Å²	31	31.6 Å²	31.6	17%	0.166	15%	0.148	C	C	.	.			trans	-87.8	-4.4	-175.9	-85.9	-11	0	0	0	114.2	T135 Y136 S137 V1320 H1341	T135-D1318 VanDerWaalsContact CA-OD2 3.26Å; T135-D1318 WeakPolarHBondContact CA-OD2 3.22Å; T135-D1318 WeakPolarHBondContact CB-OD2 3.5Å; Y136-D1318 PolarHBondContact N-OD2 2.77Å; S137-D1318 PolarHBondContact N-OD1 3.21Å; D1318-V1320 PolarHBondContact O-N 3.2Å; D1318-H1341 PolarHBondContact O-NE2 2.81Å
1319	S	88.9	Confident	86.1	Confident	3 Å²	3	31.9 Å²	31.9	2%	0.021	15%	0.15	C	C	.	.			trans	-69.6	128.4	-179.8	-178.8	0	0	0	0	113.7	Q1323 D1343	S1319-Q1323 WeakPolarHBondContact O-CG 3.07Å; S1319-Q1323 PolarHBondContact O-N 3.06Å; S1319-Q1323 PolarHBondContact O-NE2 3.31Å; S1319-D1343 WeakPolarHBondContact CA-OD1 3.44Å; S1319-D1343 VanDerWaalsContact CB-OD1 3.24Å; S1319-D1343 WeakPolarHBondContact CB-OD1 3.46Å; S1319-D1343 PolarHBondContact OG-OD1 3.11Å; S1319-D1343 PolarHBondContact OG-OD2 2.94Å; S1319-D1343 VanDerWaalsContact OG-OD2 3.09Å
1320	V	90.7	Very high	86.1	Confident	0 Å²	0	31.6 Å²	31.6	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-79.4	-39.8	-178.2	176	0	0	0	0	110.5	F20 Y136 D1318 L1322 Q1323 A1324 H1332 L1333 A1336 H1341 D1343	F20-V1320 HydrophobicContact CE2-CB 4.09Å; F20-V1320 HydrophobicContact CE2-CG1 4.28Å; F20-V1320 HydrophobicContact CZ-CG1 4.36Å; Y136-V1320 HydrophobicContact CE1-CG2 4.12Å; D1318-V1320 PolarHBondContact O-N 3.2Å; V1320-L1322 VanDerWaalsContact C-N 3.34Å; V1320-L1322 PolarHBondContact O-N 3.28Å; V1320-Q1323 PolarHBondContact O-N 2.94Å; V1320-A1324 VanDerWaalsContact O-CB 3.23Å; V1320-A1324 WeakPolarHBondContact O-CB 3.48Å; V1320-A1324 PolarHBondContact O-N 3.4Å; V1320-H1332 HydrophobicContact CG1-CB 4.49Å; V1320-L1333 HydrophobicContact CG1-CD2 4.17Å; V1320-A1336 HydrophobicContact CB-CB 4.16Å; V1320-A1336 HydrophobicContact CG1-CB 3.58Å; V1320-A1336 HydrophobicContact CG2-CB 3.57Å; V1320-H1341 VanDerWaalsContact CG2-CD2 3.49Å; V1320-H1341 WeakPolarHBondContact CG2-CD2 3.4Å; V1320-D1343 WeakPolarHBondContact CA-OD2 3.34Å; V1320-D1343 WeakPolarHBondContact CB-OD2 3.48Å; V1320-D1343 PolarHBondContact N-OD2 3.06Å
1321	I	91.8	Very high	86.4	Confident	12 Å²	12	30.6 Å²	30.6	6%	0.062	15%	0.151	C	C	.	.	H	α-helix	trans	-62.8	-43.2	179.3	-68.2	178.6	0	0	0	110.6	I18 F20 F343 A1324 S1325 D1343 E1350 I1353	I18-I1321 HydrophobicContact CD1-CD1 3.63Å; F20-I1321 HydrophobicContact CZ-CG1 4.15Å; F343-I1321 HydrophobicContact CE1-CG2 4.47Å; I1321-A1324 PolarHBondContact O-N 3.21Å; I1321-S1325 WeakPolarHBondContact O-CB 3.5Å; I1321-S1325 PolarHBondContact O-N 2.87Å; I1321-D1343 PolarHBondContact N-OD2 3.35Å; I1321-E1350 HydrophobicContact CB-CB 4.18Å; I1321-E1350 HydrophobicContact CD1-CB 4.47Å; I1321-E1350 HydrophobicContact CG2-CB 4.05Å; I1321-I1353 HydrophobicContact CG2-CB 4.43Å; I1321-I1353 HydrophobicContact CG2-CD1 3.46Å; I1321-I1353 VanDerWaalsContact CG2-CD1 3.46Å; I1321-I1353 HydrophobicContact CG2-CG2 4.33Å
1322	L	90.4	Very high	86.7	Confident	2 Å²	2	25 Å²	25	1%	0.01	13%	0.125	C	C	.	.	H	α-helix	trans	-58.5	-52	173.7	174.4	64.7	0	0	0	111	K866 E869 L1313 K1317 V1320 A1324 S1325 F1326 S1349	K866-L1322 HydrophobicContact CD-CD1 3.86Å; E869-L1322 WeakPolarHBondContact OE1-CD1 3.38Å; L1313-L1322 HydrophobicContact CD1-CD2 4.31Å; L1313-L1322 HydrophobicContact CD2-CG 4.37Å; K1317-L1322 HydrophobicContact CB-CD2 4.37Å; K1317-L1322 HydrophobicContact CD-CD2 3.51Å; K1317-L1322 HydrophobicContact CG-CD2 4.1Å; V1320-L1322 VanDerWaalsContact C-N 3.34Å; V1320-L1322 PolarHBondContact O-N 3.28Å; L1322-A1324 VanDerWaalsContact C-N 3.3Å; L1322-A1324 PolarHBondContact O-N 2.92Å; L1322-S1325 PolarHBondContact O-N 3.1Å; L1322-S1325 PolarHBondContact O-OG 2.91Å; L1322-F1326 PolarHBondContact O-N 3.25Å; L1322-S1349 VanDerWaalsContact CD1-OG 3.3Å; L1322-S1349 WeakPolarHBondContact CD1-OG 3.41Å
1323	Q	89.8	Confident	87.1	Confident	3 Å²	3	26.6 Å²	26.6	1%	0.014	13%	0.132	C	C	.	.	H	α-helix	trans	-58.6	-42.4	179.4	-70.3	170.4	24.2	0	0	111.6	L1313 P1314 K1317 S1319 V1320 S1325 F1326 E1327 H1332	L1313-Q1323 HydrophobicContact CD2-CG 4.43Å; P1314-Q1323 HydrophobicContact CG-CG 4.31Å; K1317-Q1323 PolarHBondContact O-NE2 3.39Å; S1319-Q1323 WeakPolarHBondContact O-CG 3.07Å; S1319-Q1323 PolarHBondContact O-N 3.06Å; S1319-Q1323 PolarHBondContact O-NE2 3.31Å; V1320-Q1323 PolarHBondContact O-N 2.94Å; Q1323-S1325 VanDerWaalsContact C-N 3.33Å; Q1323-S1325 PolarHBondContact O-N 3.46Å; Q1323-F1326 WeakPolarHBondContact O-CB 3.41Å; Q1323-F1326 PolarHBondContact O-N 3.4Å; Q1323-F1326 VanDerWaalsContact O-N 3.15Å; Q1323-E1327 PolarHBondContact O-N 3.44Å; Q1323-H1332 HydrophobicContact CB-CB 4.46Å; Q1323-H1332 PolarHBondContact OE1-CE1 3.22Å; Q1323-H1332 PolarHBondContact OE1-ND1 3.01Å
1324	A	89.9	Confident	87.5	Confident	0 Å²	0	29.1 Å²	29.1	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-67.3	-33	180	0	0	0	0	0	112.7	F343 V1320 I1321 L1322 F1326 T1329 H1332 L1333	F343-A1324 HydrophobicContact CE1-CB 4.09Å; F343-A1324 HydrophobicContact CZ-CB 4.12Å; V1320-A1324 VanDerWaalsContact O-CB 3.23Å; V1320-A1324 WeakPolarHBondContact O-CB 3.48Å; V1320-A1324 PolarHBondContact O-N 3.4Å; I1321-A1324 PolarHBondContact O-N 3.21Å; L1322-A1324 VanDerWaalsContact C-N 3.3Å; L1322-A1324 PolarHBondContact O-N 2.92Å; A1324-F1326 VanDerWaalsContact C-N 3.27Å; A1324-F1326 PolarHBondContact O-N 3.19Å; A1324-T1329 HydrophobicContact CB-CG2 4.08Å; A1324-T1329 WeakPolarHBondContact O-CA 3.44Å; A1324-T1329 WeakPolarHBondContact O-CB 3.41Å; A1324-T1329 WeakPolarHBondContact O-CG2 3.46Å; A1324-T1329 PolarHBondContact O-OG1 3.03Å; A1324-H1332 HydrophobicContact CB-CB 4.47Å; A1324-L1333 HydrophobicContact CB-CD2 4.31Å; A1324-L1333 HydrophobicContact CB-CG 4.25Å
1325	S	89.1	Confident	87.9	Confident	3 Å²	3	28.8 Å²	28.8	2%	0.021	14%	0.14	C	C	.	.	H	α-helix	trans	-71.5	-22	174.3	82.4	0	0	0	0	113.4	R862 I1321 L1322 Q1323	R862-S1325 PolarHBondContact NH2-O 3.31Å; R862-S1325 VanDerWaalsContact NH2-O 3.14Å; I1321-S1325 WeakPolarHBondContact O-CB 3.5Å; I1321-S1325 PolarHBondContact O-N 2.87Å; L1322-S1325 PolarHBondContact O-N 3.1Å; L1322-S1325 PolarHBondContact O-OG 2.91Å; Q1323-S1325 VanDerWaalsContact C-N 3.33Å; Q1323-S1325 PolarHBondContact O-N 3.46Å
1326	F	85.9	Confident	88.4	Confident	8 Å²	8	23.5 Å²	23.5	4%	0.035	12%	0.117	C	C	.	.	H	α-helix	trans	-81.5	-68.7	-176.6	-175.2	-119.2	0	0	0	111.9	R862 R863 K866 R1310 L1313 L1322 Q1323 A1324	R862-F1326 PolarHBondContact NH2-O 3.01Å; R863-F1326 HydrophobicContact CB-CE2 4.09Å; R863-F1326 HydrophobicContact CB-CZ 4.02Å; R863-F1326 HydrophobicContact CG-CE2 3.72Å; R863-F1326 HydrophobicContact CG-CZ 3.57Å; K866-F1326 HydrophobicContact CB-CD2 3.95Å; K866-F1326 HydrophobicContact CB-CE2 4.25Å; K866-F1326 HydrophobicContact CG-CD2 4.04Å; R1310-F1326 HydrophobicContact CB-CD1 4.17Å; R1310-F1326 HydrophobicContact CB-CE1 3.89Å; L1313-F1326 HydrophobicContact CD2-CB 4.13Å; L1313-F1326 HydrophobicContact CD2-CD1 4.05Å; L1313-F1326 HydrophobicContact CD2-CG 4.12Å; L1322-F1326 PolarHBondContact O-N 3.25Å; Q1323-F1326 WeakPolarHBondContact O-CB 3.41Å; Q1323-F1326 PolarHBondContact O-N 3.4Å; Q1323-F1326 VanDerWaalsContact O-N 3.15Å; A1324-F1326 VanDerWaalsContact C-N 3.27Å; A1324-F1326 PolarHBondContact O-N 3.19Å
1327	E	85.3	Confident	89	Confident	44 Å²	44	23.2 Å²	23.2	21%	0.206	12%	0.117	C	C	.	.	S	Bend	trans	-154.6	163.4	178.8	-69.8	-165.7	173.4	0	0	111.6	Y859 R1310 Q1323 T1329 H1332	Y859-E1327 PolarHBondContact OH-OE1 3.32Å; R1310-E1327 HydrophobicContact CB-CB 4.45Å; R1310-E1327 VanDerWaalsContact CD-OE2 3.24Å; R1310-E1327 WeakPolarHBondContact CD-OE2 3.42Å; R1310-E1327 IonicContact NH1-OE2 3.71Å; Q1323-E1327 PolarHBondContact O-N 3.44Å; E1327-T1329 PolarHBondContact O-N 3.37Å; E1327-H1332 PolarHBondContact O-CD2 3.21Å
1328	K	86.7	Confident	89.6	Confident	105 Å²	105	22.9 Å²	22.9	46%	0.457	12%	0.115	S	C	.	.			trans	49.9	42.3	177.2	-66.6	-169.7	165.4	-155.4	0	114.2	T1330 D1331 H1332	K1328-T1330 VanDerWaalsContact C-N 3.29Å; K1328-T1330 PolarHBondContact O-N 3.27Å; K1328-T1330 VanDerWaalsContact O-N 3.08Å; K1328-D1331 HydrophobicContact CB-CB 4.34Å; K1328-D1331 PolarHBondContact O-N 3.45Å; K1328-H1332 PolarHBondContact O-CD2 2.93Å; K1328-H1332 VanDerWaalsContact O-CD2 3.32Å; K1328-H1332 PolarHBondContact O-N 3.37Å
1329	T	89.2	Confident	90.1	Very high	9 Å²	9	21.7 Å²	21.7	6%	0.055	11%	0.109	C	C	.	.	H	α-helix	trans	-40.4	-51.8	-174.9	-50.7	0	0	0	0	114.2	L336 F343 A1324 E1327 L1333	L336-T1329 HydrophobicContact CB-CG2 4.37Å; F343-T1329 HydrophobicContact CD2-CG2 3.24Å; F343-T1329 HydrophobicContact CE2-CG2 3.28Å; F343-T1329 HydrophobicContact CG-CG2 4.06Å; F343-T1329 HydrophobicContact CZ-CG2 4.12Å; A1324-T1329 HydrophobicContact CB-CG2 4.08Å; A1324-T1329 WeakPolarHBondContact O-CA 3.44Å; A1324-T1329 WeakPolarHBondContact O-CB 3.41Å; A1324-T1329 WeakPolarHBondContact O-CG2 3.46Å; A1324-T1329 PolarHBondContact O-OG1 3.03Å; E1327-T1329 PolarHBondContact O-N 3.37Å; T1329-L1333 HydrophobicContact CG2-CD1 4.24Å; T1329-L1333 WeakPolarHBondContact O-CG 3.32Å; T1329-L1333 PolarHBondContact O-N 3.1Å
1330	T	90.8	Very high	90	Very high	21 Å²	21	22.1 Å²	22.1	13%	0.129	11%	0.114	C	C	.	.	H	α-helix	trans	-67.7	-38.9	-176	49.9	0	0	0	0	113.3	A333 K1328 H1332 L1333 Y1334	A333-T1330 HydrophobicContact CB-CG2 3.7Å; K1328-T1330 VanDerWaalsContact C-N 3.29Å; K1328-T1330 PolarHBondContact O-N 3.27Å; K1328-T1330 VanDerWaalsContact O-N 3.08Å; T1330-H1332 VanDerWaalsContact C-N 3.33Å; T1330-H1332 PolarHBondContact O-N 3.24Å; T1330-L1333 PolarHBondContact O-N 2.93Å; T1330-Y1334 WeakPolarHBondContact O-CD2 3.36Å; T1330-Y1334 PolarHBondContact O-N 3.24Å
1331	D	90.3	Very high	89.9	Confident	86 Å²	86	23.4 Å²	23.4	46%	0.46	12%	0.12	S	C	.	.	H	α-helix	trans	-65.7	-39.5	-176.1	-63.3	-10.5	0	0	0	110.8	K1328 A1335	K1328-D1331 HydrophobicContact CB-CB 4.34Å; K1328-D1331 PolarHBondContact O-N 3.45Å; D1331-A1335 VanDerWaalsContact O-CB 3.29Å; D1331-A1335 WeakPolarHBondContact O-CB 3.12Å; D1331-A1335 PolarHBondContact O-N 3.15Å
1332	H	91.3	Very high	89.8	Confident	30 Å²	30	26.6 Å²	26.6	14%	0.139	14%	0.137	C	C	.	.	H	α-helix	trans	-66.9	-43.2	177.8	-72	-78.4	0	0	0	111.8	V1320 Q1323 A1324 E1327 K1328 T1330 A1335 A1336	V1320-H1332 HydrophobicContact CG1-CB 4.49Å; Q1323-H1332 HydrophobicContact CB-CB 4.46Å; Q1323-H1332 PolarHBondContact OE1-CE1 3.22Å; Q1323-H1332 PolarHBondContact OE1-ND1 3.01Å; A1324-H1332 HydrophobicContact CB-CB 4.47Å; E1327-H1332 PolarHBondContact O-CD2 3.21Å; K1328-H1332 PolarHBondContact O-CD2 2.93Å; K1328-H1332 VanDerWaalsContact O-CD2 3.32Å; K1328-H1332 PolarHBondContact O-N 3.37Å; T1330-H1332 VanDerWaalsContact C-N 3.33Å; T1330-H1332 PolarHBondContact O-N 3.24Å; H1332-A1335 PolarHBondContact O-N 3.44Å; H1332-A1336 VanDerWaalsContact O-CB 3.31Å; H1332-A1336 WeakPolarHBondContact O-CB 3.5Å; H1332-A1336 PolarHBondContact O-N 3.35Å
1333	L	93	Very high	89.7	Confident	38 Å²	38	26.8 Å²	26.8	20%	0.199	14%	0.138	C	C	.	.	H	α-helix	trans	-64.7	-45.9	178.8	-66.6	172	0	0	0	112	F20 F343 V1320 A1324 T1329 T1330 A1336 A1337	F20-L1333 HydrophobicContact CE1-CD2 3.94Å; F20-L1333 HydrophobicContact CZ-CD2 4.39Å; F343-L1333 HydrophobicContact CE2-CD1 4.12Å; F343-L1333 HydrophobicContact CZ-CD1 4.16Å; V1320-L1333 HydrophobicContact CG1-CD2 4.17Å; A1324-L1333 HydrophobicContact CB-CD2 4.31Å; A1324-L1333 HydrophobicContact CB-CG 4.25Å; T1329-L1333 HydrophobicContact CG2-CD1 4.24Å; T1329-L1333 WeakPolarHBondContact O-CG 3.32Å; T1329-L1333 PolarHBondContact O-N 3.1Å; T1330-L1333 PolarHBondContact O-N 2.93Å; L1333-A1336 PolarHBondContact O-N 3.32Å; L1333-A1337 WeakPolarHBondContact O-CB 3.26Å; L1333-A1337 PolarHBondContact O-N 3.15Å
1334	Y	92.8	Very high	89.6	Confident	57 Å²	57	29.5 Å²	29.5	22%	0.224	16%	0.157	C	C	.	.	H	α-helix	trans	-66.1	-40	177.5	-70.6	-55.7	0	0	0	112.4	H94 F97 T1330 A1336 A1337 Y1338	H94-Y1334 AromaticContact CE1-CE1 3.43Å; H94-Y1334 VanDerWaalsContact CE1-CE1 3.43Å; H94-Y1334 WeakPolarHBondContact CE1-CE1 3.33Å; H94-Y1334 AromaticContact CE1-CZ 3.82Å; F97-Y1334 HydrophobicContact CE1-CD1 4.19Å; F97-Y1334 WeakPolarHBondContact CE1-O 3.38Å; F97-Y1334 HydrophobicContact CE2-CD1 4.45Å; F97-Y1334 HydrophobicContact CZ-CD1 4.04Å; T1330-Y1334 WeakPolarHBondContact O-CD2 3.36Å; T1330-Y1334 PolarHBondContact O-N 3.24Å; Y1334-A1336 VanDerWaalsContact C-N 3.35Å; Y1334-A1337 PolarHBondContact O-N 3.2Å; Y1334-Y1338 WeakPolarHBondContact O-CB 3.13Å; Y1334-Y1338 PolarHBondContact O-N 3.16Å
1335	A	90.8	Very high	89.6	Confident	14 Å²	14	30.3 Å²	30.3	12%	0.116	16%	0.162	C	C	.	.	H	α-helix	trans	-64.1	-40.9	175.7	0	0	0	0	0	111.8	D1331 H1332 Y1338 H1339	D1331-A1335 VanDerWaalsContact O-CB 3.29Å; D1331-A1335 WeakPolarHBondContact O-CB 3.12Å; D1331-A1335 PolarHBondContact O-N 3.15Å; H1332-A1335 PolarHBondContact O-N 3.44Å; A1335-Y1338 PolarHBondContact O-N 3.41Å; A1335-H1339 PolarHBondContact O-CD2 2.92Å; A1335-H1339 PolarHBondContact O-N 3.46Å; A1335-H1339 VanDerWaalsContact O-N 3.07Å
1336	A	91.1	Very high	89.5	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-64.2	-44.4	177.2	0	0	0	0	0	112.1	F20 Y136 V1320 H1332 L1333 Y1334 H1339 G1340 H1341	F20-A1336 HydrophobicContact CB-CB 4.12Å; F20-A1336 HydrophobicContact CD2-CB 4.17Å; F20-A1336 HydrophobicContact CG-CB 4.09Å; Y136-A1336 WeakPolarHBondContact OH-CA 3.44Å; Y136-A1336 PolarHBondContact OH-N 3.25Å; V1320-A1336 HydrophobicContact CB-CB 4.16Å; V1320-A1336 HydrophobicContact CG1-CB 3.58Å; V1320-A1336 HydrophobicContact CG2-CB 3.57Å; H1332-A1336 VanDerWaalsContact O-CB 3.31Å; H1332-A1336 WeakPolarHBondContact O-CB 3.5Å; H1332-A1336 PolarHBondContact O-N 3.35Å; L1333-A1336 PolarHBondContact O-N 3.32Å; Y1334-A1336 VanDerWaalsContact C-N 3.35Å; A1336-H1339 PolarHBondContact O-N 3.39Å; A1336-G1340 PolarHBondContact O-N 3.18Å; A1336-H1341 HydrophobicContact CB-CB 4.31Å; A1336-H1341 PolarHBondContact O-N 3.01Å
1337	A	92	Very high	89.7	Confident	13 Å²	13	32.2 Å²	32.2	11%	0.107	18%	0.175	C	C	.	.	H	α-helix	trans	-59.2	-49.2	174.5	0	0	0	0	0	111	F20 P22 F97 L1333 Y1334 H1339 G1340	F20-A1337 HydrophobicContact CB-CB 4.48Å; P22-A1337 WeakPolarHBondContact CD-O 3.2Å; F97-A1337 HydrophobicContact CE1-CB 4.16Å; F97-A1337 HydrophobicContact CZ-CB 4.08Å; L1333-A1337 WeakPolarHBondContact O-CB 3.26Å; L1333-A1337 PolarHBondContact O-N 3.15Å; Y1334-A1337 PolarHBondContact O-N 3.2Å; A1337-H1339 VanDerWaalsContact C-N 3.33Å; A1337-H1339 PolarHBondContact O-N 3.42Å; A1337-G1340 PolarHBondContact O-N 3.18Å; A1337-G1340 VanDerWaalsContact O-N 3.1Å
1338	Y	92.2	Very high	90	Very high	1 Å²	1	30.9 Å²	30.9	0%	0.004	17%	0.169	C	C	.	.	H	α-helix	trans	-54.7	-46.8	178.5	172.3	-94.4	0	0	0	112.6	H100 I104 Y143 L231 M233 L243 Y1334 A1335 G1340	H100-Y1338 HydrophobicContact CB-CD2 3.58Å; H100-Y1338 HydrophobicContact CB-CE2 3.58Å; H100-Y1338 HydrophobicContact CB-CG 4.14Å; H100-Y1338 AromaticContact CD2-CD1 3.4Å; H100-Y1338 VanDerWaalsContact CD2-CD1 3.4Å; H100-Y1338 WeakPolarHBondContact CD2-CD1 3.26Å; H100-Y1338 AromaticContact CD2-CD2 3.87Å; H100-Y1338 AromaticContact CD2-CE1 3.77Å; H100-Y1338 AromaticContact CD2-CG 3.48Å; H100-Y1338 VanDerWaalsContact CD2-CG 3.48Å; H100-Y1338 AromaticContact CG-CD2 3.79Å; H100-Y1338 AromaticContact CG-CG 3.81Å; I104-Y1338 HydrophobicContact CD1-CE2 3.82Å; Y143-Y1338 HydrophobicContact CE1-CE1 4.48Å; Y143-Y1338 PolarHBondContact OH-OH 3.11Å; L231-Y1338 PolarHBondContact O-OH 2.91Å; M233-Y1338 HydrophobicContact CG-CE1 4.35Å; M233-Y1338 HydrophobicContact CG-CE2 4.1Å; M233-Y1338 HydrophobicContact SD-CE2 4Å; L243-Y1338 HydrophobicContact CD1-CD2 4.03Å; L243-Y1338 HydrophobicContact CD1-CE2 3.81Å; L243-Y1338 HydrophobicContact CD2-CD2 3.82Å; L243-Y1338 HydrophobicContact CD2-CE2 4.44Å; Y1334-Y1338 WeakPolarHBondContact O-CB 3.13Å; Y1334-Y1338 PolarHBondContact O-N 3.16Å; A1335-Y1338 PolarHBondContact O-N 3.41Å; Y1338-G1340 VanDerWaalsContact C-N 3.29Å; Y1338-G1340 PolarHBondContact O-N 3.37Å
1339	H	89.4	Confident	90.3	Very high	7 Å²	7	26.1 Å²	26.1	3%	0.032	15%	0.149	C	C	.	.	H	α-helix	trans	-76.5	-14.7	-178.4	-69.7	-55.9	0	0	0	113.8	Y136 V232 A1335 A1336 A1337	Y136-H1339 HydrophobicContact CE2-CB 4.03Å; Y136-H1339 AromaticContact CE2-CD2 3.76Å; V232-H1339 PolarHBondContact O-ND1 3.03Å; A1335-H1339 PolarHBondContact O-CD2 2.92Å; A1335-H1339 PolarHBondContact O-N 3.46Å; A1335-H1339 VanDerWaalsContact O-N 3.07Å; A1336-H1339 PolarHBondContact O-N 3.39Å; A1337-H1339 VanDerWaalsContact C-N 3.33Å; A1337-H1339 PolarHBondContact O-N 3.42Å
1340	G	88.5	Confident	90.4	Very high	12 Å²	12	25.7 Å²	25.7	12%	0.124	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	74.7	31.9	-175.2	0	0	0	0	0	113.1	F20 A1336 A1337 Y1338	F20-G1340 CarbonylContact O-C 3.37Å; F20-G1340 WeakPolarHBondContact O-CA 2.93Å; A1336-G1340 PolarHBondContact O-N 3.18Å; A1337-G1340 PolarHBondContact O-N 3.18Å; A1337-G1340 VanDerWaalsContact O-N 3.1Å; Y1338-G1340 VanDerWaalsContact C-N 3.29Å; Y1338-G1340 PolarHBondContact O-N 3.37Å
1341	H	87.9	Confident	90.5	Very high	27 Å²	27	24.8 Å²	24.8	13%	0.125	14%	0.141	C	C	.	.			trans	-68	137.4	-170.6	-172.8	62.2	0	0	0	112	F20 Y136 D1318 V1320 A1336	F20-H1341 PolarHBondContact N-O 3.21Å; Y136-H1341 HydrophobicContact CD2-CB 4.32Å; Y136-H1341 AromaticContact CD2-CG 3.99Å; Y136-H1341 AromaticContact CD2-ND1 3.63Å; Y136-H1341 HydrophobicContact CE2-CB 4.14Å; Y136-H1341 AromaticContact CG-CE1 3.91Å; Y136-H1341 AromaticContact CG-ND1 3.78Å; D1318-H1341 PolarHBondContact O-NE2 2.81Å; V1320-H1341 VanDerWaalsContact CG2-CD2 3.49Å; V1320-H1341 WeakPolarHBondContact CG2-CD2 3.4Å; A1336-H1341 HydrophobicContact CB-CB 4.31Å; A1336-H1341 PolarHBondContact O-N 3.01Å
1342	N	88.8	Confident	90.6	Very high	79 Å²	79	25.2 Å²	25.2	42%	0.422	14%	0.142	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	113.4	171.5	-166.9	25	0	0	0	109.3	S17 I18 K19	S17-N1342 WeakPolarHBondContact CB-OD1 3.43Å; S17-N1342 PolarHBondContact OG-ND2 2.76Å; S17-N1342 PolarHBondContact OG-OD1 3.17Å; I18-N1342 VanDerWaalsContact C-OD1 3.3Å; I18-N1342 PolarHBondContact O-OD1 2.69Å; K19-N1342 PolarHBondContact N-OD1 3.22Å
1343	D	89.2	Confident	90.6	Very high	6 Å²	6	25 Å²	25	3%	0.032	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	114.8	-176.6	-165.8	0.1	0	0	0	109.7	S17 I18 F20 S1319 V1320 I1321	S17-D1343 CarbonylContact C-O 3.46Å; S17-D1343 VanDerWaalsContact CA-O 3.28Å; S17-D1343 WeakPolarHBondContact CA-O 3.48Å; S17-D1343 WeakPolarHBondContact CB-O 3.45Å; I18-D1343 PolarHBondContact N-O 3.18Å; I18-D1343 PolarHBondContact O-N 3.34Å; F20-D1343 HydrophobicContact CD2-CB 4.39Å; F20-D1343 HydrophobicContact CE2-CB 3.8Å; S1319-D1343 WeakPolarHBondContact CA-OD1 3.44Å; S1319-D1343 VanDerWaalsContact CB-OD1 3.24Å; S1319-D1343 WeakPolarHBondContact CB-OD1 3.46Å; S1319-D1343 PolarHBondContact OG-OD1 3.11Å; S1319-D1343 PolarHBondContact OG-OD2 2.94Å; S1319-D1343 VanDerWaalsContact OG-OD2 3.09Å; V1320-D1343 WeakPolarHBondContact CA-OD2 3.34Å; V1320-D1343 WeakPolarHBondContact CB-OD2 3.48Å; V1320-D1343 PolarHBondContact N-OD2 3.06Å; I1321-D1343 PolarHBondContact N-OD2 3.35Å
1344	S	88.5	Confident	90.6	Very high	60 Å²	60	26 Å²	26	42%	0.42	15%	0.147	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76	134.5	178.5	-60.4	0	0	0	0	110.8	T1346	S1344-T1346 VanDerWaalsContact C-N 3.27Å; S1344-T1346 PolarHBondContact O-N 2.92Å
1345	V	88.7	Confident	90.4	Very high	16 Å²	16	26.5 Å²	26.5	10%	0.097	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.9	65.2	179.9	-171	0	0	0	0	110	I15 E16 I18 E1350 L1354	I15-V1345 HydrophobicContact CG2-CG2 4.11Å; E16-V1345 PolarHBondContact O-N 3.38Å; I18-V1345 HydrophobicContact CD1-CG2 4.42Å; I18-V1345 HydrophobicContact CG1-CG2 4.37Å; V1345-E1350 HydrophobicContact CG1-CB 4.39Å; V1345-E1350 HydrophobicContact CG1-CG 4.21Å; V1345-L1354 HydrophobicContact CB-CD1 4.21Å; V1345-L1354 HydrophobicContact CG1-CD1 3.62Å; V1345-L1354 HydrophobicContact CG2-CD1 3.45Å; V1345-L1354 VanDerWaalsContact CG2-CD1 3.45Å
1346	T	87.5	Confident	90.3	Very high	52 Å²	52	26.8 Å²	26.8	32%	0.319	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-109.5	-28.8	-178.2	53.9	0	0	0	0	113.6	S882 S1344 S1359	S882-T1346 PolarHBondContact O-OG1 3.24Å; S1344-T1346 VanDerWaalsContact C-N 3.27Å; S1344-T1346 PolarHBondContact O-N 2.92Å; T1346-S1359 PolarHBondContact O-OG 2.78Å
1347	G	89.8	Confident	90.1	Very high	0 Å²	0	31 Å²	31	0%	0	20%	0.199	C	C	.	.	S	Bend	trans	-87.1	176	-179.2	0	0	0	0	0	114.5	D870 E1350 S1351	D870-G1347 WeakPolarHBondContact OD1-CA 3.09Å; G1347-E1350 WeakPolarHBondContact CA-OE1 3.25Å; G1347-E1350 PolarHBondContact N-OE1 2.61Å; G1347-E1350 WeakPolarHBondContact O-CG 3.3Å; G1347-S1351 VanDerWaalsContact O-CB 3.3Å; G1347-S1351 WeakPolarHBondContact O-CB 3.44Å; G1347-S1351 PolarHBondContact O-N 3.21Å; G1347-S1351 PolarHBondContact O-OG 2.85Å
1348	V	92.5	Very high	90	Very high	16 Å²	16	32.9 Å²	32.9	10%	0.097	21%	0.207	C	C	.	.	H	α-helix	trans	-70.6	-51.1	-166.6	-167.4	0	0	0	0	111.8	E869 D870 E1350 S1351 I1352 I1358 L1360	E869-V1348 HydrophobicContact CB-CG2 4.29Å; E869-V1348 HydrophobicContact CG-CB 4.47Å; E869-V1348 HydrophobicContact CG-CG2 4.4Å; E869-V1348 VanDerWaalsContact O-CG2 3.31Å; E869-V1348 WeakPolarHBondContact O-CG2 3.19Å; D870-V1348 WeakPolarHBondContact OD1-CG2 3.25Å; D870-V1348 PolarHBondContact OD1-N 3.34Å; V1348-E1350 PolarHBondContact O-N 2.69Å; V1348-S1351 PolarHBondContact O-N 3.48Å; V1348-I1352 HydrophobicContact CG1-CD1 3.77Å; V1348-I1352 HydrophobicContact CG1-CG1 4.45Å; V1348-I1352 WeakPolarHBondContact O-CG1 3.33Å; V1348-I1352 PolarHBondContact O-N 3.12Å; V1348-I1358 HydrophobicContact CG1-CG2 4.05Å; V1348-L1360 HydrophobicContact CB-CD2 4.18Å; V1348-L1360 HydrophobicContact CG1-CD2 4.32Å; V1348-L1360 HydrophobicContact CG2-CD1 4.34Å; V1348-L1360 HydrophobicContact CG2-CD2 3.19Å; V1348-L1360 HydrophobicContact CG2-CG 4.39Å
1349	S	91.7	Very high	89.6	Confident	4 Å²	4	35.8 Å²	35.8	3%	0.028	23%	0.227	C	C	.	.	H	α-helix	trans	-59.5	-50.3	-175.4	-80.3	0	0	0	0	112.7	K866 E869 L1322 I1352 I1353	K866-S1349 PolarHBondContact NZ-OG 3.01Å; E869-S1349 VanDerWaalsContact OE1-CB 3.28Å; E869-S1349 WeakPolarHBondContact OE1-CB 2.96Å; E869-S1349 PolarHBondContact OE1-N 3.44Å; E869-S1349 PolarHBondContact OE1-OG 2.9Å; E869-S1349 PolarHBondContact OE2-OG 3.41Å; L1322-S1349 VanDerWaalsContact CD1-OG 3.3Å; L1322-S1349 WeakPolarHBondContact CD1-OG 3.41Å; S1349-I1352 PolarHBondContact O-N 3.38Å; S1349-I1353 WeakPolarHBondContact O-CB 3.5Å; S1349-I1353 WeakPolarHBondContact O-CD1 3.44Å; S1349-I1353 WeakPolarHBondContact O-CG1 3.39Å; S1349-I1353 PolarHBondContact O-N 3.05Å
1350	E	91.9	Very high	89.6	Confident	1 Å²	1	36.5 Å²	36.5	1%	0.005	23%	0.231	C	C	.	.	H	α-helix	trans	-65	-39.2	-179.6	53.2	-87	-154.1	0	0	111.8	K1317 I1321 V1345 G1347 V1348 I1353 L1354	K1317-E1350 WeakPolarHBondContact CE-OE1 3.36Å; K1317-E1350 VanDerWaalsContact NZ-CD 3.29Å; K1317-E1350 IonicContact NZ-OE1 3.53Å; K1317-E1350 PolarHBondContact NZ-OE1 3.49Å; K1317-E1350 IonicContact NZ-OE2 3.61Å; K1317-E1350 PolarHBondContact NZ-OE2 3.03Å; K1317-E1350 VanDerWaalsContact NZ-OE2 3.08Å; I1321-E1350 HydrophobicContact CB-CB 4.18Å; I1321-E1350 HydrophobicContact CD1-CB 4.47Å; I1321-E1350 HydrophobicContact CG2-CB 4.05Å; V1345-E1350 HydrophobicContact CG1-CB 4.39Å; V1345-E1350 HydrophobicContact CG1-CG 4.21Å; G1347-E1350 WeakPolarHBondContact CA-OE1 3.25Å; G1347-E1350 PolarHBondContact N-OE1 2.61Å; G1347-E1350 WeakPolarHBondContact O-CG 3.3Å; V1348-E1350 PolarHBondContact O-N 2.69Å; E1350-I1353 PolarHBondContact O-N 3.44Å; E1350-L1354 WeakPolarHBondContact O-CB 3.45Å; E1350-L1354 WeakPolarHBondContact O-CG 3.25Å; E1350-L1354 PolarHBondContact O-N 2.95Å
1351	S	92.2	Very high	89.7	Confident	2 Å²	2	37.5 Å²	37.5	1%	0.014	24%	0.242	C	C	.	.	H	α-helix	trans	-61.3	-47.9	174.6	-60.7	0	0	0	0	111.5	G1347 V1348 I1353 L1354 G1355 A1356	G1347-S1351 VanDerWaalsContact O-CB 3.3Å; G1347-S1351 WeakPolarHBondContact O-CB 3.44Å; G1347-S1351 PolarHBondContact O-N 3.21Å; G1347-S1351 PolarHBondContact O-OG 2.85Å; V1348-S1351 PolarHBondContact O-N 3.48Å; S1351-I1353 PolarHBondContact O-N 2.93Å; S1351-L1354 PolarHBondContact O-N 3.31Å; S1351-G1355 PolarHBondContact O-N 3.44Å; S1351-A1356 CarbonylContact C-O 3.51Å; S1351-A1356 PolarHBondContact O-N 2.91Å
1352	I	92.7	Very high	89.9	Confident	94 Å²	94	39.9 Å²	39.9	48%	0.482	26%	0.258	S	S	.	.	H	α-helix	trans	-62.8	-42.7	177.7	-67.7	171.7	0	0	0	111.4	V1348 S1349 L1354 G1355 I1358	V1348-I1352 HydrophobicContact CG1-CD1 3.77Å; V1348-I1352 HydrophobicContact CG1-CG1 4.45Å; V1348-I1352 WeakPolarHBondContact O-CG1 3.33Å; V1348-I1352 PolarHBondContact O-N 3.12Å; S1349-I1352 PolarHBondContact O-N 3.38Å; I1352-L1354 VanDerWaalsContact C-N 3.31Å; I1352-L1354 PolarHBondContact O-N 2.99Å; I1352-G1355 PolarHBondContact O-N 3.28Å; I1352-I1358 HydrophobicContact CG1-CG2 4.05Å
1353	I	92.4	Very high	89.9	Confident	27 Å²	27	37.7 Å²	37.7	14%	0.138	25%	0.254	C	S	.	.	H	α-helix	trans	-63.5	-38.9	-178.7	-73.7	166.9	0	0	0	111.3	F343 L347 I1321 S1349 E1350 S1351	F343-I1353 HydrophobicContact CD1-CD1 4.41Å; L347-I1353 HydrophobicContact CB-CG1 4.12Å; L347-I1353 HydrophobicContact CB-CG2 4.37Å; L347-I1353 HydrophobicContact CD1-CG2 4.01Å; L347-I1353 HydrophobicContact CD2-CG2 4.43Å; I1321-I1353 HydrophobicContact CG2-CB 4.43Å; I1321-I1353 HydrophobicContact CG2-CD1 3.46Å; I1321-I1353 VanDerWaalsContact CG2-CD1 3.46Å; I1321-I1353 HydrophobicContact CG2-CG2 4.33Å; S1349-I1353 WeakPolarHBondContact O-CB 3.5Å; S1349-I1353 WeakPolarHBondContact O-CD1 3.44Å; S1349-I1353 WeakPolarHBondContact O-CG1 3.39Å; S1349-I1353 PolarHBondContact O-N 3.05Å; E1350-I1353 PolarHBondContact O-N 3.44Å; S1351-I1353 PolarHBondContact O-N 2.93Å
1354	L	91.3	Very high	89.9	Confident	58 Å²	58	39.7 Å²	39.7	30%	0.304	26%	0.264	S	S	.	.	H	α-helix	trans	-87.5	-9.6	-179.6	-63.5	169.9	0	0	0	113.5	I15 I18 V1345 E1350 S1351 I1352	I15-L1354 HydrophobicContact CG2-CD1 4.35Å; I18-L1354 HydrophobicContact CD1-CD1 3.53Å; I18-L1354 HydrophobicContact CD1-CD2 3.83Å; I18-L1354 HydrophobicContact CD1-CG 4.28Å; I18-L1354 HydrophobicContact CG1-CD1 4.5Å; V1345-L1354 HydrophobicContact CB-CD1 4.21Å; V1345-L1354 HydrophobicContact CG1-CD1 3.62Å; V1345-L1354 HydrophobicContact CG2-CD1 3.45Å; V1345-L1354 VanDerWaalsContact CG2-CD1 3.45Å; E1350-L1354 WeakPolarHBondContact O-CB 3.45Å; E1350-L1354 WeakPolarHBondContact O-CG 3.25Å; E1350-L1354 PolarHBondContact O-N 2.95Å; S1351-L1354 PolarHBondContact O-N 3.31Å; I1352-L1354 VanDerWaalsContact C-N 3.31Å; I1352-L1354 PolarHBondContact O-N 2.99Å
1355	G	90.1	Very high	89.9	Confident	68 Å²	68	40.7 Å²	40.7	70%	0.701	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	74	26.2	-175.6	0	0	0	0	0	113.5	S1351 I1352	S1351-G1355 PolarHBondContact O-N 3.44Å; I1352-G1355 PolarHBondContact O-N 3.28Å
1356	A	87.5	Confident	89.9	Confident	19 Å²	19	46.4 Å²	46.4	16%	0.157	29%	0.294	C	S	.	.	P	Polyproline II helix	trans	-88.8	149.3	171.5	0	0	0	0	0	110.6	S1351 I1358	S1351-A1356 CarbonylContact C-O 3.51Å; S1351-A1356 PolarHBondContact O-N 2.91Å; A1356-I1358 PolarHBondContact O-N 2.89Å
1357	P	86.3	Confident	90	Very high	88 Å²	88	51.4 Å²	51.4	57%	0.571	32%	0.318	S	S	*	.	P	Polyproline II helix	trans	-63.2	136.6	173.1	27.1	-33.5	0	0	0	110.1
1358	I	90.9	Very high	90	Very high	54 Å²	54	60.1 Å²	60.1	28%	0.277	36%	0.356	S	S	.	.	P	Polyproline II helix	trans	-69.9	147.4	178.4	58.5	175.7	0	0	0	110.5	V1348 I1352 A1356 L1360 G1363	V1348-I1358 HydrophobicContact CG1-CG2 4.05Å; I1352-I1358 HydrophobicContact CG1-CG2 4.05Å; A1356-I1358 PolarHBondContact O-N 2.89Å; I1358-L1360 VanDerWaalsContact C-N 3.28Å; I1358-L1360 HydrophobicContact CB-CD2 3.99Å; I1358-L1360 HydrophobicContact CB-CG 4.25Å; I1358-L1360 HydrophobicContact CD1-CD1 4.07Å; I1358-L1360 HydrophobicContact CD1-CD2 4.42Å; I1358-L1360 HydrophobicContact CD1-CG 3.92Å; I1358-L1360 HydrophobicContact CG1-CG 4.24Å; I1358-L1360 PolarHBondContact O-N 3.3Å; I1358-G1363 WeakPolarHBondContact O-CA 3.29Å
1359	S	84.7	Confident	89.8	Confident	61 Å²	61	68.5 Å²	68.5	43%	0.427	39%	0.387	S	S	.	.	S	Bend	trans	-84.4	8	-176.9	54.5	0	0	0	0	114.8	T1346	T1346-S1359 PolarHBondContact O-OG 2.78Å
1360	L	89.2	Confident	89.7	Confident	22 Å²	22	77.5 Å²	77.5	12%	0.115	43%	0.426	C	S	.	.	S	Bend	trans	-122.4	162.6	-175.5	55.1	132	0	0	0	111.5	C872 A1036 V1348 I1358 T1362 G1363	C872-L1360 HydrophobicContact CB-CB 4.38Å; A1036-L1360 HydrophobicContact CB-CD1 3.92Å; V1348-L1360 HydrophobicContact CB-CD2 4.18Å; V1348-L1360 HydrophobicContact CG1-CD2 4.32Å; V1348-L1360 HydrophobicContact CG2-CD1 4.34Å; V1348-L1360 HydrophobicContact CG2-CD2 3.19Å; V1348-L1360 HydrophobicContact CG2-CG 4.39Å; I1358-L1360 VanDerWaalsContact C-N 3.28Å; I1358-L1360 HydrophobicContact CB-CD2 3.99Å; I1358-L1360 HydrophobicContact CB-CG 4.25Å; I1358-L1360 HydrophobicContact CD1-CD1 4.07Å; I1358-L1360 HydrophobicContact CD1-CD2 4.42Å; I1358-L1360 HydrophobicContact CD1-CG 3.92Å; I1358-L1360 HydrophobicContact CG1-CG 4.24Å; I1358-L1360 PolarHBondContact O-N 3.3Å; L1360-T1362 PolarHBondContact O-N 2.91Å; L1360-G1363 PolarHBondContact O-N 3.38Å
1361	G	90.2	Very high	89.4	Confident	34 Å²	34	82.4 Å²	82.4	35%	0.351	46%	0.456	S	S	.	.	G	3₁₀ helix	trans	61.7	-128.5	-178.5	0	0	0	0	0	111.2	G1034 G1363 M1364	G1034-G1361 WeakPolarHBondContact O-CA 3.3Å; G1034-G1361 PolarHBondContact O-N 3.41Å; G1361-G1363 PolarHBondContact O-N 3.23Å; G1361-M1364 WeakPolarHBondContact O-CB 3.28Å; G1361-M1364 PolarHBondContact O-N 2.93Å
1362	T	92	Very high	89.1	Confident	76 Å²	76	86.4 Å²	86.4	47%	0.466	48%	0.482	S	S	.	.	G	3₁₀ helix	trans	-65.8	-22.8	-179.3	52.5	0	0	0	0	113.4	E509 L513 L1360 M1364	E509-T1362 HydrophobicContact CG-CG2 4.34Å; E509-T1362 VanDerWaalsContact OE1-CB 3.27Å; E509-T1362 WeakPolarHBondContact OE1-CB 3.33Å; E509-T1362 WeakPolarHBondContact OE1-CG2 3.47Å; E509-T1362 PolarHBondContact OE1-OG1 3.1Å; L513-T1362 HydrophobicContact CD1-CG2 3.96Å; L1360-T1362 PolarHBondContact O-N 2.91Å; T1362-M1364 VanDerWaalsContact C-N 3.33Å
1363	G	89.5	Confident	88.6	Confident	33 Å²	33	91 Å²	91	34%	0.34	50%	0.502	S	S	.	.	G	3₁₀ helix	trans	-86.3	3.7	177.9	0	0	0	0	0	115.1	I1358 L1360 G1361 I1365	I1358-G1363 WeakPolarHBondContact O-CA 3.29Å; L1360-G1363 PolarHBondContact O-N 3.38Å; G1361-G1363 PolarHBondContact O-N 3.23Å; G1363-I1365 VanDerWaalsContact C-N 3.33Å
1364	M	88.9	Confident	87.9	Confident	48 Å²	48	96 Å²	96	24%	0.236	53%	0.527	C	S	.	.	G	3₁₀ helix	trans	-75	-23.6	177.3	-170.6	174	-170.1	0	0	113	H874 Y875 G1361 T1362	H874-M1364 HydrophobicContact CB-CE 4.14Å; H874-M1364 WeakPolarHBondContact ND1-CE 3.41Å; Y875-M1364 HydrophobicContact CD2-CE 4.04Å; Y875-M1364 HydrophobicContact CD2-SD 4.32Å; Y875-M1364 HydrophobicContact CE2-CE 4.37Å; Y875-M1364 HydrophobicContact CE2-CG 4.41Å; Y875-M1364 HydrophobicContact CE2-SD 4.09Å; G1361-M1364 WeakPolarHBondContact O-CB 3.28Å; G1361-M1364 PolarHBondContact O-N 2.93Å; T1362-M1364 VanDerWaalsContact C-N 3.33Å
1365	I	88.2	Confident	87.1	Confident	81 Å²	81	102.6 Å²	102.6	42%	0.415	55%	0.553	S	S	.	*	S	Bend	trans	-119	144.5	-178.2	59	170.6	0	0	0	111.5	Y875 G1363 L1367	Y875-I1365 HydrophobicContact CE2-CG2 3.81Å; Y875-I1365 WeakPolarHBondContact OH-CG2 3.4Å; G1363-I1365 VanDerWaalsContact C-N 3.33Å; I1365-L1367 HydrophobicContact CD1-CD2 4.28Å
1366	D	87.8	Confident	86.4	Confident	136 Å²	136	106.9 Å²	106.9	73%	0.727	56%	0.559	S	S	*	*	P	Polyproline II helix	trans	-98.1	137.8	168.2	-67.7	-42.3	0	0	0	109.8	F1368	D1366-F1368 HydrophobicContact CB-CE2 3.9Å; D1366-F1368 HydrophobicContact CB-CZ 4.22Å
1367	L	89.5	Confident	85.8	Confident	158 Å²	158	115.3 Å²	115.3	83%	0.827	59%	0.592	S	S	*	*	P	Polyproline II helix	trans	-99.2	119.6	178	-64.6	176.7	0	0	0	110.3	I1365	I1365-L1367 HydrophobicContact CD1-CD2 4.28Å
1368	F	89.5	Confident	85.4	Confident	183 Å²	183	120.6 Å²	120.6	80%	0.803	61%	0.606	S	S	*	*	P	Polyproline II helix	trans	-102.1	129.6	174.3	-64.1	-85.3	0	0	0	110.5	D1366 K1370	D1366-F1368 HydrophobicContact CB-CE2 3.9Å; D1366-F1368 HydrophobicContact CB-CZ 4.22Å; F1368-K1370 PolarHBondContact O-N 3.16Å
1369	Y	89.7	Confident	84.7	Confident	191 Å²	191	128.6 Å²	128.6	75%	0.749	63%	0.633	S	S	*	*	P	Polyproline II helix	trans	-71	119.6	171.4	-179.2	-103.9	0	0	0	109.5	V1371	Y1369-V1371 VanDerWaalsContact C-N 3.35Å; Y1369-V1371 HydrophobicContact CD1-CG2 3.91Å; Y1369-V1371 HydrophobicContact CE1-CG2 4.38Å; Y1369-V1371 PolarHBondContact O-N 2.82Å
1370	K	89.1	Confident	84.1	Confident	193 Å²	193	131.4 Å²	131.4	84%	0.839	65%	0.65	S	S	*	*			trans	-72.5	90.5	175.9	-170.2	175.5	-176.8	176.9	0	109.4	F1368	F1368-K1370 PolarHBondContact O-N 3.16Å
1371	V	86.5	Confident	83.4	Confident	104 Å²	104	135.8 Å²	135.8	63%	0.63	67%	0.672	S	S	*	*			trans	-60.6	126.2	174.7	-175	0	0	0	0	107.9	Y1369 E1373	Y1369-V1371 VanDerWaalsContact C-N 3.35Å; Y1369-V1371 HydrophobicContact CD1-CG2 3.91Å; Y1369-V1371 HydrophobicContact CE1-CG2 4.38Å; Y1369-V1371 PolarHBondContact O-N 2.82Å; V1371-E1373 PolarHBondContact O-N 3.43Å
1372	P	86.1	Confident	82.4	Confident	87 Å²	87	141 Å²	141	57%	0.565	69%	0.686	S	S	*	*			trans	-56.4	130.8	174.2	-7.9	13.1	0	0	0	109.3	I1374	P1372-I1374 VanDerWaalsContact C-N 3.33Å; P1372-I1374 PolarHBondContact O-N 2.82Å
1373	E	80.4	Confident	81.3	Confident	191 Å²	191	144.7 Å²	144.7	89%	0.893	70%	0.696	S	S	*	*			trans	-65.2	92.7	176.1	-79.4	-173.2	165.2	0	0	109.9	V1371 K1375	V1371-E1373 PolarHBondContact O-N 3.43Å; E1373-K1375 PolarHBondContact O-N 3.17Å
1374	I	78.4	Confident	80.1	Confident	132 Å²	132	148.2 Å²	148.2	68%	0.677	71%	0.707	S	S	*	*			trans	-76.5	110	167.2	-58.2	172.2	0	0	0	105.8	P1372 L1376	P1372-I1374 VanDerWaalsContact C-N 3.33Å; P1372-I1374 PolarHBondContact O-N 2.82Å; I1374-L1376 PolarHBondContact O-N 2.96Å
1375	K	75.4	Confident	78.8	Confident	196 Å²	196	149.6 Å²	149.6	85%	0.852	72%	0.721	S	S	*	*			trans	-60.9	91.1	166.9	-77	-174.4	178.1	179.6	0	108.2	E1373 K1377	E1373-K1375 PolarHBondContact O-N 3.17Å; K1375-K1377 PolarHBondContact O-N 3.36Å
1376	L	74.1	Confident	77.2	Confident	158 Å²	158	153 Å²	153	83%	0.827	73%	0.729	S	S	*	*			trans	-62.8	98.7	173.4	-72.7	166.6	0	0	0	107.4	I1374 K1378	I1374-L1376 PolarHBondContact O-N 2.96Å; L1376-K1378 PolarHBondContact O-N 3.35Å; L1376-K1378 VanDerWaalsContact O-N 3.07Å
1377	K	75.8	Confident	75.5	Confident	195 Å²	195	151.1 Å²	151.1	85%	0.848	72%	0.722	S	S	*	*	P	Polyproline II helix	trans	-58.3	116.5	165.1	-80	-174	176.6	-178.4	0	106.3	K1375 R1379	K1375-K1377 PolarHBondContact O-N 3.36Å; K1377-R1379 PolarHBondContact O-N 3.5Å
1378	K	78.3	Confident	73.8	Confident	199 Å²	199	147.5 Å²	147.5	87%	0.865	71%	0.71	S	S	*	*	P	Polyproline II helix	trans	-50.5	119.8	166.9	-87.7	-174.8	174.6	-179.1	0	106.3	L1376	L1376-K1378 PolarHBondContact O-N 3.35Å; L1376-K1378 VanDerWaalsContact O-N 3.07Å
1379	R	74.8	Confident	72	Confident	223 Å²	223	145.6 Å²	145.6	84%	0.842	71%	0.708	S	S	*	*	P	Polyproline II helix	trans	-60.2	127.4	171.5	-67.5	-174.6	76.9	169.3	3.7	105.8	K1377 L1381	K1377-R1379 PolarHBondContact O-N 3.5Å; R1379-L1381 PolarHBondContact O-N 3.03Å
1380	P	73.7	Confident	70.2	Confident	119 Å²	119	145.5 Å²	145.5	77%	0.773	71%	0.712	S	S	*	*	P	Polyproline II helix	trans	-55	127.5	174	21.6	-30.2	0	0	0	107.6	F1382	P1380-F1382 PolarHBondContact O-N 3.35Å
1381	L	74.7	Confident	68.4	Low	114 Å²	114	141.7 Å²	141.7	60%	0.597	71%	0.705	S	S	*	*	P	Polyproline II helix	trans	-66.6	130.7	174.9	-66.7	169.8	0	0	0	106.4	R1379 F1383 D1384	R1379-L1381 PolarHBondContact O-N 3.03Å; L1381-F1383 PolarHBondContact O-N 3Å; L1381-D1384 HydrophobicContact CB-CB 4.42Å; L1381-D1384 PolarHBondContact O-N 3.27Å
1382	F	68.4	Low	66	Low	145 Å²	145	146.2 Å²	146.2	64%	0.636	74%	0.738	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.2	-19	179.7	-168.1	-94.7	0	0	0	112.8	P1380 S1385	P1380-F1382 PolarHBondContact O-N 3.35Å; F1382-S1385 PolarHBondContact O-OG 2.98Å
1383	F	67.7	Low	65	Low	153 Å²	153	149.2 Å²	149.2	67%	0.671	75%	0.747	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.8	-18	177.8	-63.4	-76.1	0	0	0	114.5	L1381 S1385 R1386 T1387	L1381-F1383 PolarHBondContact O-N 3Å; F1383-S1385 PolarHBondContact O-N 3.05Å; F1383-R1386 PolarHBondContact O-N 2.71Å; F1383-T1387 PolarHBondContact O-N 2.93Å; F1383-T1387 PolarHBondContact O-OG1 2.99Å
1384	D	65.7	Low	64.2	Low	107 Å²	107	146.9 Å²	146.9	57%	0.572	74%	0.739	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.2	-21.2	177.9	-77.1	-18.9	0	0	0	112.2	L1381	L1381-D1384 HydrophobicContact CB-CB 4.42Å; L1381-D1384 PolarHBondContact O-N 3.27Å
1385	S	60.2	Low	63.4	Low	76 Å²	76	147.8 Å²	147.8	53%	0.531	74%	0.743	S	S	.	*	T	Hydrogen-bonded Turn	trans	-92.2	-9.4	176.2	56.4	0	0	0	0	114.5	F1382 F1383	F1382-S1385 PolarHBondContact O-OG 2.98Å; F1383-S1385 PolarHBondContact O-N 3.05Å
1386	R	54.6	Low	62.7	Low	153 Å²	153	144.9 Å²	144.9	58%	0.577	74%	0.736	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.1	-18.9	-180	-79.5	-168.6	175.5	-170.4	-1.2	114	F1383	F1383-R1386 PolarHBondContact O-N 2.71Å
1387	T	53.9	Low	62	Low	97 Å²	97	144.1 Å²	144.1	60%	0.595	73%	0.731	S	S	*	*	G	3₁₀ helix	trans	-76.9	-19.1	176.5	29.9	0	0	0	0	113.8	F1383 L1389	F1383-T1387 PolarHBondContact O-N 2.93Å; F1383-T1387 PolarHBondContact O-OG1 2.99Å; T1387-L1389 VanDerWaalsContact C-N 3.31Å; T1387-L1389 PolarHBondContact O-N 2.89Å
1388	S	53.2	Low	61	Low	82 Å²	82	140.7 Å²	140.7	57%	0.573	72%	0.723	S	S	*	*	G	3₁₀ helix	trans	-78.5	-8.5	174.1	51.8	0	0	0	0	114.6
1389	L	51	Low	59.8	Low	143 Å²	143	136.6 Å²	136.6	75%	0.749	71%	0.713	S	S	*	*	G	3₁₀ helix	trans	-96.1	-3.3	177.7	-89.8	153.8	0	0	0	113.8	T1387	T1387-L1389 VanDerWaalsContact C-N 3.31Å; T1387-L1389 PolarHBondContact O-N 2.89Å
1390	F	53.5	Low	58.6	Low	189 Å²	189	129.9 Å²	129.9	83%	0.829	70%	0.703	S	S	*	*	S	Bend	trans	-105.7	12.9	175.7	-82.4	-82.6	0	0	0	113.5
1391	T	49.9	Very low	57.4	Low	113 Å²	113	130.8 Å²	130.8	69%	0.693	70%	0.697	S	S	*	*			trans	-123.1	49.2	175.1	51.6	0	0	0	0	112.2
1392	C	36	Very low	55.8	Low	198 Å²	198	132.4 Å²	132.4	100%	1.338	71%	0.706	S	S	*	*			trans	-133.4	0	161.9	-91.7	0	0	0	0	109

Retrieved 1,392 of 1,392 residues in 979.1 ms (Link to these results)

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