A0A5K4FEJ4_SCHMA Loading...

LLGL domain-containing protein AlphaSync

AlphaFold DB , UniProt , Accession A0A5K4FEJ4, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,327 aa.

						>A0A5K4FEJ4_SCHMA|A0A5K4FEJ4
MAAKSKRLLKVIDGIRSWNISSSQPNSSPKSAIEIDEYLKSEHFQVGKISVHGFPYQPTCIAFDPVQRIVAVGTKSGFIRIFGKPGVDCSICHPSASAVLQIFFLVNEGGLVSICGDDVAHLWNIRQKNPEIVHSLQFKREHLTCGHLPVGSSWLYLGTDKGNVNFISVQRFTTSGYVINWNKAIDLSQSSHPGKVIQIAENPQDSNKILIGYSSGFLVLWDLKTKQGDARFKHTDSLYSVVWHWDGKSFLTSHNHGLLATWLIRQPQRPVSVICPHAPSETVPDDYAFYEPIRLVEWLPTRNGEPFIIFSGGGRSPAAQTVIHSSVATTNVSSTSLLNSDQSESDPNLSSCMVSSNHMLTIKRGKKLVVLQLDHKLVQFTTLCVSPYISETMDPYAVAILLQEDLVVIDLLSPNFATFENPYPMDLHSSPVTSCLYLVDCPGDLIPAFYSVSSRRNRTQSGTCAEPDVFSSREWPITGGEWRLSSQQVPELIITGHADGSVRFWDASEVSLTPLYKFRTSKLFANPPTNTSNPVETGSTSLSDAKDINAQYSSILLTTESDPLAIHFMHFCSDSRKLLTASSTHTCLLHFSRREINLETSVLDINMAYDGLDDIGFAYSTGDTFSDDHLNTAENVFGNVTKDTVQQSLPHVSSGSVSSYQSASPTDRDLRVFVPVRQGSHHWPPGYQPLLVCRVGILGLSFESNLKSSTDPTASCLIPPPSITAISMSSAFGLMAIGSEFGIAVVDYVHKFCLLSISSSDLLSRGPINLTGSSASGEVKFCDQNNSSAGSTSLANTCIINNQTAMKNVHSNSDAVQSSESSSTGYTTRYVLTRATTVKSELKRAKSQEKCSDLSQFSHPGSLTASSSSLDNLNCETIKTILFSEWISPRQDLHFVPNLWIGTSRGCVLALNLKYRVLNNVPINQSYCIASLYRLRGDIIHISLLDNTGDILPSPSERWDDSYISKGGTASELSKQASLISCSSICSEGTSIHTNADAYSSTDTGFKSCGGGGSVRALKESVMRQNTITTHTSLTSTSGHSSTILSNTMSGGGSTFQSSGTTGLDSPTTSKGFIECDRQLLVLCSEKQARVVALPSQNCLYKVKITETSQVVRASVQRLRPSHNSGTSTASFLACYLANGHFVAFSLPSLRLLMDVDYLPYTECVSRSFAFGQYGQSVYLVSPSELAKVTWASDVCANLRDMQGEIFLPSNMPEPPKKNFFKNLLSGTLVSSLDRDELFGEASSGKGTPGATTLLPNARIEKLSGQTGAASSEIARARNAAIERGERLQQLDLQTQEMADQAKGFGRSAAILAAKYEKKDKRWGLPF
					

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters 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	40.8	Very low	62.5	Low	210 Å²	210	130.4 Å²	130.4	100%	1.034	67%	0.667	S	S	*	*				0	-60	0	-75.5	-81.4	-115	0	0	112.1	A3 K4 S5	M1-A3 PolarHBondContact O-N 2.86Å; M1-K4 PolarHBondContact O-N 3.27Å; M1-K4 VanDerWaalsContact O-N 3.15Å; M1-S5 PolarHBondContact O-N 3.18Å
2	A	51.4	Low	62.5	Low	74 Å²	74	124.8 Å²	124.8	61%	0.612	64%	0.639	S	S	*	*	H	α-helix	trans	-55.6	-41.6	-177.2	0	0	0	0	0	115.3	S5 K6	A2-S5 WeakPolarHBondContact O-CB 3.49Å; A2-S5 PolarHBondContact O-N 2.95Å; A2-K6 PolarHBondContact O-N 3.41Å
3	A	52.4	Low	62.8	Low	75 Å²	75	121.2 Å²	121.2	62%	0.62	62%	0.622	S	S	*	*	H	α-helix	trans	-67.3	-36.9	178	0	0	0	0	0	113.5	M1 K6 R7	M1-A3 PolarHBondContact O-N 2.86Å; A3-K6 PolarHBondContact O-N 3.09Å; A3-R7 PolarHBondContact O-N 3.5Å
4	K	58.5	Low	62.5	Low	176 Å²	176	114.7 Å²	114.7	77%	0.765	60%	0.6	S	S	*	*	H	α-helix	trans	-67.2	-39	172	-75.9	-172.5	176.9	-177.4	0	110.7	M1 R7 L8	M1-K4 PolarHBondContact O-N 3.27Å; M1-K4 VanDerWaalsContact O-N 3.15Å; K4-R7 PolarHBondContact O-N 2.91Å; K4-L8 PolarHBondContact O-N 3.23Å
5	S	64.2	Low	61.6	Low	69 Å²	69	112.9 Å²	112.9	48%	0.483	59%	0.59	S	S	.	*	H	α-helix	trans	-62.7	-42.3	175.6	-152.1	0	0	0	0	112.2	M1 A2 R7 L8 L9	M1-S5 PolarHBondContact O-N 3.18Å; A2-S5 WeakPolarHBondContact O-CB 3.49Å; A2-S5 PolarHBondContact O-N 2.95Å; S5-R7 PolarHBondContact O-N 2.84Å; S5-L8 PolarHBondContact O-N 2.95Å; S5-L9 WeakPolarHBondContact O-CB 3.42Å; S5-L9 PolarHBondContact O-N 3.07Å
6	K	71.8	Confident	60.3	Low	160 Å²	160	115.8 Å²	115.8	70%	0.696	59%	0.591	S	S	*	*	H	α-helix	trans	-63.6	-38	174.7	-75	-172.6	178	-174.5	0	113.4	A2 A3 L9 K10	A2-K6 PolarHBondContact O-N 3.41Å; A3-K6 PolarHBondContact O-N 3.09Å; K6-L9 PolarHBondContact O-N 2.84Å; K6-K10 PolarHBondContact O-N 3.25Å
7	R	71	Confident	59.6	Low	203 Å²	203	113.4 Å²	113.4	77%	0.766	59%	0.587	S	S	*	*	H	α-helix	trans	-66.4	-42.6	173.2	-83.2	-172.8	178.9	177.4	0.2	111.6	A3 K4 S5 L9 K10 V11	A3-R7 PolarHBondContact O-N 3.5Å; K4-R7 PolarHBondContact O-N 2.91Å; S5-R7 PolarHBondContact O-N 2.84Å; R7-L9 VanDerWaalsContact C-N 3.33Å; R7-K10 PolarHBondContact O-N 3.12Å; R7-V11 WeakPolarHBondContact O-CG2 3.38Å; R7-V11 PolarHBondContact O-N 3.16Å
8	L	70.9	Confident	58.5	Low	109 Å²	109	117.6 Å²	117.6	57%	0.571	59%	0.594	S	S	*	*	H	α-helix	trans	-63	-41	175.7	-162.1	81.1	0	0	0	111.1	K4 S5 V11 I12	K4-L8 PolarHBondContact O-N 3.23Å; S5-L8 PolarHBondContact O-N 2.95Å; L8-V11 PolarHBondContact O-N 2.97Å; L8-I12 HydrophobicContact CD2-CD1 4.12Å; L8-I12 HydrophobicContact CG-CD1 3.99Å; L8-I12 WeakPolarHBondContact O-CB 3.41Å; L8-I12 VanDerWaalsContact O-CG1 3.25Å; L8-I12 WeakPolarHBondContact O-CG1 3.29Å; L8-I12 PolarHBondContact O-N 3.31Å
9	L	67	Low	57	Low	101 Å²	101	117.2 Å²	117.2	53%	0.529	59%	0.593	S	S	.	*	H	α-helix	trans	-62.3	-44.5	175.7	-147.5	82	0	0	0	111.4	S5 K6 R7 V11 I12 D13	S5-L9 WeakPolarHBondContact O-CB 3.42Å; S5-L9 PolarHBondContact O-N 3.07Å; K6-L9 PolarHBondContact O-N 2.84Å; R7-L9 VanDerWaalsContact C-N 3.33Å; L9-V11 VanDerWaalsContact C-N 3.32Å; L9-V11 PolarHBondContact O-N 3.32Å; L9-I12 CarbonylContact O-C 3.46Å; L9-I12 PolarHBondContact O-N 2.94Å; L9-D13 WeakPolarHBondContact O-CB 3.45Å; L9-D13 VanDerWaalsContact O-CG 3.3Å; L9-D13 PolarHBondContact O-N 3.48Å
10	K	69.3	Low	56	Low	171 Å²	171	118.7 Å²	118.7	74%	0.743	60%	0.601	S	S	*	*	H	α-helix	trans	-60.2	-38.9	172.8	-87.2	-167.4	173.2	-167.1	0	113	K6 R7 G14	K6-K10 PolarHBondContact O-N 3.25Å; R7-K10 PolarHBondContact O-N 3.12Å; K10-G14 PolarHBondContact O-N 3.46Å
11	V	70	Confident	55	Low	86 Å²	86	117.5 Å²	117.5	52%	0.521	60%	0.604	S	S	.	*	H	α-helix	trans	-67.7	-42.7	175.4	172.6	0	0	0	0	110.5	R7 L8 L9 G14 I15	R7-V11 WeakPolarHBondContact O-CG2 3.38Å; R7-V11 PolarHBondContact O-N 3.16Å; L8-V11 PolarHBondContact O-N 2.97Å; L9-V11 VanDerWaalsContact C-N 3.32Å; L9-V11 PolarHBondContact O-N 3.32Å; V11-G14 PolarHBondContact O-N 3.37Å; V11-I15 HydrophobicContact CG1-CD1 3.87Å; V11-I15 VanDerWaalsContact O-CG1 3.24Å; V11-I15 WeakPolarHBondContact O-CG1 3.49Å; V11-I15 PolarHBondContact O-N 3.14Å
12	I	62.4	Low	54.4	Low	63 Å²	63	111.7 Å²	111.7	32%	0.323	58%	0.584	S	S	.	*	H	α-helix	trans	-65.9	-41.7	177.5	-69.4	166.1	0	0	0	111.1	L8 L9 G14 I15 R16	L8-I12 HydrophobicContact CD2-CD1 4.12Å; L8-I12 HydrophobicContact CG-CD1 3.99Å; L8-I12 WeakPolarHBondContact O-CB 3.41Å; L8-I12 VanDerWaalsContact O-CG1 3.25Å; L8-I12 WeakPolarHBondContact O-CG1 3.29Å; L8-I12 PolarHBondContact O-N 3.31Å; L9-I12 CarbonylContact O-C 3.46Å; L9-I12 PolarHBondContact O-N 2.94Å; I12-G14 VanDerWaalsContact C-N 3.33Å; I12-I15 CarbonylContact O-C 3.57Å; I12-I15 PolarHBondContact O-N 3.06Å; I12-R16 HydrophobicContact CG2-CG 4.44Å; I12-R16 WeakPolarHBondContact O-CB 3.41Å; I12-R16 WeakPolarHBondContact O-CG 3.46Å; I12-R16 PolarHBondContact O-N 2.9Å
13	D	67.2	Low	53.6	Low	78 Å²	78	113.2 Å²	113.2	42%	0.417	59%	0.591	S	S	.	*	H	α-helix	trans	-67.6	-36.2	175.4	-70.2	-25.8	0	0	0	110.9	L9 R16 S17	L9-D13 WeakPolarHBondContact O-CB 3.45Å; L9-D13 VanDerWaalsContact O-CG 3.3Å; L9-D13 PolarHBondContact O-N 3.48Å; D13-R16 PolarHBondContact O-N 3.43Å; D13-S17 WeakPolarHBondContact O-CB 3.44Å; D13-S17 PolarHBondContact O-N 2.94Å; D13-S17 PolarHBondContact O-OG 2.84Å
14	G	58.1	Low	52.6	Low	31 Å²	31	117.6 Å²	117.6	32%	0.32	60%	0.598	S	S	.	*	H	α-helix	trans	-58.7	-46.4	167.7	0	0	0	0	0	112.3	K10 V11 I12 S17 W18	K10-G14 PolarHBondContact O-N 3.46Å; V11-G14 PolarHBondContact O-N 3.37Å; I12-G14 VanDerWaalsContact C-N 3.33Å; G14-S17 PolarHBondContact O-N 2.92Å; G14-S17 PolarHBondContact O-OG 3.29Å; G14-W18 PolarHBondContact O-N 3.08Å
15	I	48.5	Very low	51.2	Low	88 Å²	88	115.4 Å²	115.4	45%	0.451	60%	0.602	S	S	.	*	H	α-helix	trans	-67.6	-37.5	176.9	-66.1	161.9	0	0	0	111.5	V11 I12 W18 N19	V11-I15 HydrophobicContact CG1-CD1 3.87Å; V11-I15 VanDerWaalsContact O-CG1 3.24Å; V11-I15 WeakPolarHBondContact O-CG1 3.49Å; V11-I15 PolarHBondContact O-N 3.14Å; I12-I15 CarbonylContact O-C 3.57Å; I12-I15 PolarHBondContact O-N 3.06Å; I15-W18 WeakPolarHBondContact O-CB 3.42Å; I15-W18 PolarHBondContact O-N 3.35Å; I15-N19 PolarHBondContact O-N 3.28Å
16	R	41.8	Very low	49.7	Very low	159 Å²	159	119 Å²	119	60%	0.6	62%	0.616	S	S	*	*	H	α-helix	trans	-67.4	-37.4	174.8	-75.7	177	174.7	-173	-2.9	111.4	I12 D13 W18 N19 I20	I12-R16 HydrophobicContact CG2-CG 4.44Å; I12-R16 WeakPolarHBondContact O-CB 3.41Å; I12-R16 WeakPolarHBondContact O-CG 3.46Å; I12-R16 PolarHBondContact O-N 2.9Å; D13-R16 PolarHBondContact O-N 3.43Å; R16-W18 VanDerWaalsContact C-N 3.29Å; R16-W18 PolarHBondContact O-N 2.94Å; R16-N19 PolarHBondContact O-N 2.96Å; R16-I20 VanDerWaalsContact O-CG1 3.3Å; R16-I20 WeakPolarHBondContact O-CG1 3.41Å; R16-I20 PolarHBondContact O-N 2.8Å
17	S	47.9	Very low	47.6	Very low	75 Å²	75	117.6 Å²	117.6	52%	0.524	63%	0.626	S	S	.	*	H	α-helix	trans	-65.4	-33.3	172.4	77.1	0	0	0	0	112	D13 G14	D13-S17 WeakPolarHBondContact O-CB 3.44Å; D13-S17 PolarHBondContact O-N 2.94Å; D13-S17 PolarHBondContact O-OG 2.84Å; G14-S17 PolarHBondContact O-N 2.92Å; G14-S17 PolarHBondContact O-OG 3.29Å
18	W	39.1	Very low	45.8	Very low	189 Å²	189	112.1 Å²	112.1	72%	0.716	62%	0.619	S	S	*	*	H	α-helix	trans	-67.5	-46.8	170.2	-88.4	38.3	0	0	0	112.2	G14 I15 R16 I20 S21	G14-W18 PolarHBondContact O-N 3.08Å; I15-W18 WeakPolarHBondContact O-CB 3.42Å; I15-W18 PolarHBondContact O-N 3.35Å; R16-W18 VanDerWaalsContact C-N 3.29Å; R16-W18 PolarHBondContact O-N 2.94Å; W18-I20 VanDerWaalsContact C-N 3.35Å; W18-I20 PolarHBondContact O-N 3.31Å; W18-S21 PolarHBondContact O-N 2.81Å; W18-S21 VanDerWaalsContact O-N 3.15Å; W18-S21 PolarHBondContact O-OG 2.75Å
19	N	31	Very low	44.1	Very low	109 Å²	109	113.1 Å²	113.1	58%	0.583	63%	0.632	S	S	*	*	H	α-helix	trans	-75.6	-17.3	-174.7	-79.7	-14.3	0	0	0	114.6	I15 R16 S21 S22	I15-N19 PolarHBondContact O-N 3.28Å; R16-N19 PolarHBondContact O-N 2.96Å; N19-S21 PolarHBondContact O-N 3.26Å; N19-S22 PolarHBondContact O-OG 3.02Å
20	I	37.3	Very low	42.7	Very low	147 Å²	147	117.2 Å²	117.2	75%	0.754	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.2	-11.8	172.1	-66.7	166.2	0	0	0	111.4	R16 W18	R16-I20 VanDerWaalsContact O-CG1 3.3Å; R16-I20 WeakPolarHBondContact O-CG1 3.41Å; R16-I20 PolarHBondContact O-N 2.8Å; W18-I20 VanDerWaalsContact C-N 3.35Å; W18-I20 PolarHBondContact O-N 3.31Å
21	S	35.3	Very low	41.5	Very low	95 Å²	95	111.2 Å²	111.2	66%	0.664	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.5	-2	174.6	63.1	0	0	0	0	115.1	W18 N19 S23	W18-S21 PolarHBondContact O-N 2.81Å; W18-S21 VanDerWaalsContact O-N 3.15Å; W18-S21 PolarHBondContact O-OG 2.75Å; N19-S21 PolarHBondContact O-N 3.26Å; S21-S23 PolarHBondContact O-N 3.24Å
22	S	27.5	Very low	40.9	Very low	87 Å²	87	109.9 Å²	109.9	61%	0.608	62%	0.623	S	S	*	*			trans	-92	67	168.7	67.5	0	0	0	0	111	N19 Q24	N19-S22 PolarHBondContact O-OG 3.02Å; S22-Q24 PolarHBondContact O-N 2.88Å
23	S	34.7	Very low	41	Very low	107 Å²	107	108.2 Å²	108.2	75%	0.748	61%	0.614	S	S	*	*			trans	-64.5	126	161	52.3	0	0	0	0	108.7	S21	S21-S23 PolarHBondContact O-N 3.24Å
24	Q	30.5	Very low	41.3	Very low	167 Å²	167	112.4 Å²	112.4	78%	0.78	63%	0.632	S	S	*	*			trans	-49.1	144.2	176.7	-72.9	-171.1	-35	0	0	112.1	S22 N26	S22-Q24 PolarHBondContact O-N 2.88Å; Q24-N26 VanDerWaalsContact C-N 3.35Å; Q24-N26 PolarHBondContact O-N 2.99Å
25	P	30.8	Very low	42.4	Very low	130 Å²	130	112.2 Å²	112.2	84%	0.844	62%	0.623	S	S	*	*			trans	-74.2	89.9	178.9	31.2	-31.4	0	0	0	108.9	S27	P25-S27 PolarHBondContact O-N 3.12Å
26	N	32.2	Very low	43.9	Very low	145 Å²	145	113.2 Å²	113.2	78%	0.775	63%	0.629	S	S	*	*			trans	-66.2	119.7	160.8	-89.5	-10.4	0	0	0	107.7	Q24 S28	Q24-N26 VanDerWaalsContact C-N 3.35Å; Q24-N26 PolarHBondContact O-N 2.99Å; N26-S28 VanDerWaalsContact C-N 3.34Å; N26-S28 PolarHBondContact O-N 2.77Å
27	S	27.4	Very low	45.9	Very low	129 Å²	129	108.2 Å²	108.2	90%	0.902	61%	0.612	S	S	*	*			trans	-67.5	85.1	177.8	54.7	0	0	0	0	110.9	P25	P25-S27 PolarHBondContact O-N 3.12Å
28	S	32.2	Very low	47.8	Very low	89 Å²	89	110.5 Å²	110.5	62%	0.622	61%	0.61	S	S	*	*			trans	-119.5	147	157.8	57.1	0	0	0	0	108.6	N26 K30	N26-S28 VanDerWaalsContact C-N 3.34Å; N26-S28 PolarHBondContact O-N 2.77Å; S28-K30 PolarHBondContact O-N 3.39Å; S28-K30 VanDerWaalsContact O-N 3.14Å
29	P	36.5	Very low	50.3	Low	129 Å²	129	101.7 Å²	101.7	84%	0.838	58%	0.578	S	S	*	*			trans	-65.7	118.1	-166.8	25.2	-31.6	0	0	0	110.6	S31	P29-S31 PolarHBondContact O-N 3.46Å; P29-S31 VanDerWaalsContact O-N 3.09Å
30	K	36.5	Very low	53.2	Low	188 Å²	188	101.7 Å²	101.7	82%	0.817	57%	0.572	S	S	*	*			trans	-65.5	100.9	179	-68.9	179.4	175.1	-175	0	110.7	S28 A32	S28-K30 PolarHBondContact O-N 3.39Å; S28-K30 VanDerWaalsContact O-N 3.14Å; K30-A32 VanDerWaalsContact C-N 3.25Å
31	S	44.7	Very low	55.9	Low	44 Å²	44	98.7 Å²	98.7	31%	0.308	56%	0.564	S	S	.	*			trans	-95.2	27.6	154.4	54.8	0	0	0	0	111.2	P29 I33	P29-S31 PolarHBondContact O-N 3.46Å; P29-S31 VanDerWaalsContact O-N 3.09Å; S31-I33 PolarHBondContact O-N 2.97Å
32	A	56.5	Low	58.6	Low	59 Å²	59	99.6 Å²	99.6	49%	0.488	56%	0.558	S	S	.	*			trans	-68.8	128.8	-171.9	0	0	0	0	0	111.2	K30 E34	K30-A32 VanDerWaalsContact C-N 3.25Å; A32-E34 PolarHBondContact O-N 3.36Å
33	I	66.5	Low	61.8	Low	27 Å²	27	96.5 Å²	96.5	14%	0.138	53%	0.534	C	S	.	.			trans	-61.5	107.2	168.7	-53	178.1	0	0	0	107.6	S31 I35 N947 D1077 L1080	S31-I33 PolarHBondContact O-N 2.97Å; I33-I35 HydrophobicContact CG2-CD1 4.04Å; I33-I35 HydrophobicContact CG2-CG1 3.65Å; I33-I35 PolarHBondContact O-N 3.41Å; I33-N947 HydrophobicContact CG2-CB 4.14Å; I33-N947 WeakPolarHBondContact CG2-O 3.22Å; I33-D1077 HydrophobicContact CD1-CB 3.87Å; I33-D1077 WeakPolarHBondContact CD1-O 3.37Å; I33-D1077 HydrophobicContact CG1-CB 3.98Å; I33-D1077 VanDerWaalsContact CG1-O 3.3Å; I33-D1077 WeakPolarHBondContact CG1-O 3.35Å; I33-L1080 HydrophobicContact CD1-CD2 3.84Å; I33-L1080 HydrophobicContact CD1-CG 4.14Å
34	E	72.4	Confident	64.6	Low	167 Å²	167	92.2 Å²	92.2	78%	0.78	50%	0.502	S	S	*	.			trans	-84.7	94.8	172.4	-74.2	-174.6	168.5	0	0	108.7	A32	A32-E34 PolarHBondContact O-N 3.36Å
35	I	81.2	Confident	67.7	Low	27 Å²	27	89 Å²	89	14%	0.138	49%	0.487	C	S	.	.			trans	-94	122.1	170.3	-59	172.6	0	0	0	107.5	I33 E37 L1080 P1148	I33-I35 HydrophobicContact CG2-CD1 4.04Å; I33-I35 HydrophobicContact CG2-CG1 3.65Å; I33-I35 PolarHBondContact O-N 3.41Å; I35-E37 PolarHBondContact O-N 2.83Å; I35-L1080 HydrophobicContact CD1-CD1 3.34Å; I35-L1080 HydrophobicContact CD1-CG 4.42Å; I35-P1148 HydrophobicContact CB-CG 4.26Å; I35-P1148 HydrophobicContact CD1-CG 4.23Å
36	D	79.3	Confident	70.7	Confident	108 Å²	108	84 Å²	84	58%	0.578	45%	0.453	S	S	*	.			trans	-71.6	124.6	176.8	-69.9	-35.4	0	0	0	111.9	Y38	D36-Y38 HydrophobicContact CB-CD2 4.09Å; D36-Y38 HydrophobicContact CB-CE1 4.23Å; D36-Y38 HydrophobicContact CB-CE2 3.21Å; D36-Y38 VanDerWaalsContact CB-OH 3.24Å; D36-Y38 WeakPolarHBondContact CB-OH 3.35Å; D36-Y38 PolarHBondContact OD2-OH 2.83Å
37	E	84.8	Confident	73.6	Confident	54 Å²	54	77.5 Å²	77.5	25%	0.252	42%	0.421	S	S	.	.			trans	-99.8	103.2	178	-72.8	-172.7	-157.2	0	0	112.6	I35 S1146 L1147 P1148 S1149 R1151	I35-E37 PolarHBondContact O-N 2.83Å; E37-S1146 VanDerWaalsContact OE2-CB 3.24Å; E37-S1146 WeakPolarHBondContact OE2-CB 3.25Å; E37-S1146 PolarHBondContact OE2-OG 2.95Å; E37-L1147 WeakPolarHBondContact CG-O 3.39Å; E37-P1148 VanDerWaalsContact OE1-CD 3.28Å; E37-P1148 WeakPolarHBondContact OE1-CD 3.32Å; E37-S1149 WeakPolarHBondContact OE1-CA 3.42Å; E37-S1149 WeakPolarHBondContact OE1-CB 3.42Å; E37-S1149 PolarHBondContact OE1-N 2.81Å; E37-S1149 PolarHBondContact OE1-OG 3.31Å; E37-S1149 PolarHBondContact OE2-OG 2.83Å; E37-R1151 IonicContact OE2-NE 2.85Å; E37-R1151 IonicContact OE2-NH2 3.58Å; E37-R1151 PolarHBondContact OE2-NH2 2.87Å
38	Y	86.7	Confident	76.5	Confident	123 Å²	123	75.4 Å²	75.4	48%	0.482	40%	0.396	S	S	.	.			trans	-96.5	-8.1	178.1	-54.6	-76.3	0	0	0	113.8	D36 H43	D36-Y38 HydrophobicContact CB-CD2 4.09Å; D36-Y38 HydrophobicContact CB-CE1 4.23Å; D36-Y38 HydrophobicContact CB-CE2 3.21Å; D36-Y38 VanDerWaalsContact CB-OH 3.24Å; D36-Y38 WeakPolarHBondContact CB-OH 3.35Å; D36-Y38 PolarHBondContact OD2-OH 2.83Å; Y38-H43 PolarHBondContact O-CE1 2.79Å; Y38-H43 VanDerWaalsContact O-CE1 3.26Å
39	L	91.7	Very high	79.2	Confident	5 Å²	5	73 Å²	73	3%	0.026	38%	0.375	C	S	.	.			trans	-72.3	132.8	178.3	-66.5	179.5	0	0	0	112	F44 L1119 P1121 A1130 F1132 R1151 L1153	L39-F44 HydrophobicContact CB-CE2 4.42Å; L39-F44 HydrophobicContact CD1-CZ 4.33Å; L39-L1119 HydrophobicContact CD2-CB 4.14Å; L39-L1119 HydrophobicContact CD2-CD2 3.89Å; L39-L1119 HydrophobicContact CD2-CG 4.5Å; L39-P1121 HydrophobicContact CD2-CG 4.26Å; L39-A1130 HydrophobicContact CD1-CB 3.78Å; L39-A1130 HydrophobicContact CD2-CB 3.99Å; L39-A1130 HydrophobicContact CG-CB 3.56Å; L39-F1132 HydrophobicContact CD1-CB 3.87Å; L39-F1132 HydrophobicContact CD1-CD1 4.22Å; L39-F1132 HydrophobicContact CD1-CG 4.42Å; L39-R1151 PolarHBondContact O-NH2 3.14Å; L39-L1153 HydrophobicContact CB-CD1 3.85Å; L39-L1153 HydrophobicContact CB-CD2 4.42Å; L39-L1153 HydrophobicContact CD1-CD1 4.32Å; L39-L1153 WeakPolarHBondContact O-CD2 3.15Å
40	K	92.8	Very high	81.5	Confident	109 Å²	109	67.8 Å²	67.8	47%	0.474	34%	0.342	S	S	.	.			trans	-130.7	161.7	179.6	-66.4	175.1	-178.4	176	0	109.3	E42 H43 F44	K40-E42 HydrophobicContact CB-CG 3.99Å; K40-E42 WeakPolarHBondContact CD-OE1 3.34Å; K40-E42 IonicContact NZ-OE1 3.46Å; K40-E42 PolarHBondContact O-N 2.89Å; K40-H43 PolarHBondContact N-ND1 2.93Å; K40-H43 WeakPolarHBondContact O-CB 3.45Å; K40-H43 PolarHBondContact O-N 3.42Å; K40-F44 WeakPolarHBondContact O-CD2 3.36Å
41	S	93.5	Very high	84	Confident	83 Å²	83	59.4 Å²	59.4	58%	0.58	31%	0.307	S	S	*	.	G	3₁₀ helix	trans	-58.4	-29.4	179.1	54.3	0	0	0	0	113.5	H43 F44 L1153	S41-H43 PolarHBondContact O-N 3.48Å; S41-F44 PolarHBondContact O-N 3.42Å; S41-F44 VanDerWaalsContact O-N 3.14Å; S41-L1153 WeakPolarHBondContact CA-O 3.41Å; S41-L1153 VanDerWaalsContact CB-O 3.25Å; S41-L1153 WeakPolarHBondContact CB-O 3.49Å
42	E	92.6	Very high	86	Confident	115 Å²	115	57.8 Å²	57.8	54%	0.537	30%	0.295	S	S	.	.	G	3₁₀ helix	trans	-67	-18.7	176.8	67.2	-166.1	164.8	0	0	114.1	K40 F44 S1193	K40-E42 HydrophobicContact CB-CG 3.99Å; K40-E42 WeakPolarHBondContact CD-OE1 3.34Å; K40-E42 IonicContact NZ-OE1 3.46Å; K40-E42 PolarHBondContact O-N 2.89Å; E42-F44 PolarHBondContact O-N 3.11Å; E42-S1193 WeakPolarHBondContact O-CB 2.96Å
43	H	93.6	Very high	87.4	Confident	21 Å²	21	55.2 Å²	55.2	10%	0.097	27%	0.273	C	S	.	.	G	3₁₀ helix	trans	-78.8	-8	174.7	-57	151.9	0	0	0	112.7	Y38 K40 S41 L1119 S1193	Y38-H43 PolarHBondContact O-CE1 2.79Å; Y38-H43 VanDerWaalsContact O-CE1 3.26Å; K40-H43 PolarHBondContact N-ND1 2.93Å; K40-H43 WeakPolarHBondContact O-CB 3.45Å; K40-H43 PolarHBondContact O-N 3.42Å; S41-H43 PolarHBondContact O-N 3.48Å; H43-L1119 HydrophobicContact CB-CD2 3.94Å; H43-S1193 WeakPolarHBondContact O-CB 3.37Å; H43-S1193 PolarHBondContact O-N 2.72Å
44	F	95.4	Very high	88.4	Confident	18 Å²	18	54 Å²	54	8%	0.079	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	127.6	-175.1	-67.8	-94.2	0	0	0	112	L39 K40 S41 E42 L1119 F1132 A1144 L1153 M1154 W1191	L39-F44 HydrophobicContact CB-CE2 4.42Å; L39-F44 HydrophobicContact CD1-CZ 4.33Å; K40-F44 WeakPolarHBondContact O-CD2 3.36Å; S41-F44 PolarHBondContact O-N 3.42Å; S41-F44 VanDerWaalsContact O-N 3.14Å; E42-F44 PolarHBondContact O-N 3.11Å; F44-L1119 HydrophobicContact CE1-CD2 4.14Å; F44-L1119 HydrophobicContact CE2-CD2 4.07Å; F44-L1119 HydrophobicContact CZ-CD2 3.84Å; F44-F1132 HydrophobicContact CE1-CD1 4.35Å; F44-F1132 AromaticContact CE1-CD2 3.91Å; F44-F1132 HydrophobicContact CE1-CD2 3.91Å; F44-F1132 HydrophobicContact CE1-CE1 4.21Å; F44-F1132 AromaticContact CE1-CE2 3.75Å; F44-F1132 HydrophobicContact CE1-CE2 3.75Å; F44-F1132 HydrophobicContact CE1-CG 4.2Å; F44-F1132 AromaticContact CE1-CZ 3.91Å; F44-F1132 HydrophobicContact CE1-CZ 3.91Å; F44-F1132 HydrophobicContact CZ-CB 4.5Å; F44-F1132 HydrophobicContact CZ-CD1 4.22Å; F44-F1132 HydrophobicContact CZ-CD2 4.16Å; F44-F1132 HydrophobicContact CZ-CE1 4.49Å; F44-F1132 HydrophobicContact CZ-CE2 4.41Å; F44-F1132 HydrophobicContact CZ-CG 4.05Å; F44-A1144 HydrophobicContact CD1-CB 4.09Å; F44-A1144 HydrophobicContact CE1-CB 3.79Å; F44-A1144 HydrophobicContact CZ-CB 4.35Å; F44-L1153 HydrophobicContact CD2-CB 3.97Å; F44-L1153 HydrophobicContact CE2-CB 3.77Å; F44-L1153 HydrophobicContact CE2-CD1 3.58Å; F44-L1153 HydrophobicContact CE2-CG 4.19Å; F44-L1153 HydrophobicContact CZ-CB 4.25Å; F44-L1153 HydrophobicContact CZ-CD1 3.7Å; F44-M1154 HydrophobicContact CB-CB 3.9Å; F44-M1154 HydrophobicContact CB-CG 4.14Å; F44-M1154 HydrophobicContact CB-SD 3.77Å; F44-M1154 HydrophobicContact CD1-CB 4.26Å; F44-M1154 HydrophobicContact CD1-SD 4.29Å; F44-M1154 HydrophobicContact CG-CB 4.1Å; F44-M1154 HydrophobicContact CG-SD 4.45Å; F44-W1191 CarbonylContact C-O 3.56Å; F44-W1191 VanDerWaalsContact CA-O 3.25Å; F44-W1191 WeakPolarHBondContact CA-O 3.34Å
45	Q	94.6	Very high	89.2	Confident	99 Å²	99	46.1 Å²	46.1	46%	0.463	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-153	132.6	169.5	-174.9	177.9	-5.7	0	0	107.7	W1191 S1193 C1196	Q45-W1191 PolarHBondContact N-O 2.87Å; Q45-W1191 CarbonylContact O-C 3.54Å; Q45-W1191 VanDerWaalsContact O-CA 3.25Å; Q45-W1191 WeakPolarHBondContact O-CA 3.45Å; Q45-W1191 VanDerWaalsContact O-O 3.1Å; Q45-S1193 PolarHBondContact OE1-OG 3.46Å; Q45-C1196 HydrophobicContact CB-CB 4.13Å; Q45-C1196 HydrophobicContact CG-CB 4.08Å; Q45-C1196 PolarHBondContact O-SG 2.89Å
46	V	94.6	Very high	89.6	Confident	24 Å²	24	49.1 Å²	49.1	15%	0.145	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	127.4	176.2	-170.7	0	0	0	0	109.4	F1142 M1154 V1156 Y1158 T1190	V46-F1142 HydrophobicContact CG1-CD2 3.89Å; V46-F1142 HydrophobicContact CG1-CE2 3.95Å; V46-F1142 HydrophobicContact CG2-CD2 3.98Å; V46-M1154 HydrophobicContact CG2-CE 3.86Å; V46-M1154 HydrophobicContact CG2-SD 3.63Å; V46-V1156 HydrophobicContact CG2-CB 4.26Å; V46-V1156 HydrophobicContact CG2-CG1 4.28Å; V46-V1156 HydrophobicContact CG2-CG2 4.44Å; V46-Y1158 HydrophobicContact CB-CD2 4.08Å; V46-Y1158 HydrophobicContact CB-CE2 4.27Å; V46-Y1158 HydrophobicContact CB-CG 4.48Å; V46-Y1158 HydrophobicContact CG1-CD1 3.84Å; V46-Y1158 HydrophobicContact CG1-CD2 3.54Å; V46-Y1158 HydrophobicContact CG1-CE1 3.86Å; V46-Y1158 HydrophobicContact CG1-CE2 3.54Å; V46-Y1158 HydrophobicContact CG1-CG 3.7Å; V46-T1190 CarbonylContact C-O 3.43Å; V46-T1190 VanDerWaalsContact CA-O 3.29Å; V46-T1190 WeakPolarHBondContact CA-O 3.37Å
47	G	91.4	Very high	90.2	Very high	10 Å²	10	47 Å²	47	10%	0.103	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	143.1	178.7	0	0	0	0	0	112	V1189 T1190	G47-V1189 CarbonylContact O-C 3.46Å; G47-V1189 VanDerWaalsContact O-CA 3.28Å; G47-V1189 WeakPolarHBondContact O-CA 3.1Å; G47-T1190 PolarHBondContact N-O 3.11Å; G47-T1190 PolarHBondContact O-N 3.41Å
48	K	90	Very high	90.7	Very high	85 Å²	85	44.6 Å²	44.6	37%	0.37	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	125.9	173.6	-171.9	-177	-68.8	-174.5	0	109.8	V51	K48-V51 HydrophobicContact CD-CG2 3.7Å; K48-V51 HydrophobicContact CG-CG2 4.47Å
49	I	87.6	Confident	91.2	Very high	37 Å²	37	40.9 Å²	40.9	19%	0.19	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	-55.6	-179.1	-55	179.8	0	0	0	109.9	K1188 T1190 V1195 L1199	I49-K1188 HydrophobicContact CB-CB 4.27Å; I49-K1188 HydrophobicContact CB-CD 4.24Å; I49-K1188 HydrophobicContact CB-CG 4.11Å; I49-K1188 HydrophobicContact CD1-CD 4.18Å; I49-K1188 HydrophobicContact CD1-CG 3.96Å; I49-K1188 HydrophobicContact CG1-CG 4.45Å; I49-K1188 HydrophobicContact CG2-CD 4.13Å; I49-K1188 PolarHBondContact N-O 3.19Å; I49-T1190 HydrophobicContact CD1-CG2 4.17Å; I49-T1190 HydrophobicContact CG1-CG2 4Å; I49-V1195 HydrophobicContact CD1-CG1 4.36Å; I49-L1199 HydrophobicContact CB-CD2 4.2Å; I49-L1199 HydrophobicContact CG1-CD2 3.9Å; I49-L1199 HydrophobicContact CG2-CD2 4.38Å
50	S	86.3	Confident	91.5	Very high	20 Å²	20	40.6 Å²	40.6	14%	0.14	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.3	162	-177	56.6	0	0	0	0	111.2	H52 A1187 K1188	S50-H52 PolarHBondContact OG-CE1 3.47Å; S50-H52 PolarHBondContact OG-NE2 2.91Å; S50-A1187 WeakPolarHBondContact O-CA 3.35Å; S50-K1188 PolarHBondContact N-O 3.45Å; S50-K1188 PolarHBondContact O-N 3.49Å; S50-K1188 WeakPolarHBondContact OG-CB 3.48Å
51	V	88.1	Confident	91.8	Very high	12 Å²	12	35.7 Å²	35.7	7%	0.073	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	126	166.8	-175.8	0	0	0	0	107.5	K48 R80 V1181 E1185 L1186 A1187	K48-V51 HydrophobicContact CD-CG2 3.7Å; K48-V51 HydrophobicContact CG-CG2 4.47Å; V51-R80 PolarHBondContact O-NH2 3.29Å; V51-V1181 HydrophobicContact CG1-CG1 4.44Å; V51-E1185 HydrophobicContact CG1-CB 3.98Å; V51-E1185 HydrophobicContact CG1-CG 4.49Å; V51-L1186 CarbonylContact C-O 3.54Å; V51-L1186 WeakPolarHBondContact CA-O 3.34Å; V51-A1187 HydrophobicContact CG2-CB 4.36Å
52	H	87.3	Confident	92	Very high	11 Å²	11	32.1 Å²	32.1	5%	0.051	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	157.1	179.1	-50.2	-74.5	0	0	0	110.2	S50 V510 L512 E1185 L1186	S50-H52 PolarHBondContact OG-CE1 3.47Å; S50-H52 PolarHBondContact OG-NE2 2.91Å; H52-V510 PolarHBondContact CE1-O 3.43Å; H52-V510 PolarHBondContact ND1-O 3.36Å; H52-L512 HydrophobicContact CB-CB 3.8Å; H52-L512 HydrophobicContact CB-CD2 3.87Å; H52-L512 HydrophobicContact CB-CG 4.43Å; H52-E1185 CarbonylContact O-C 3.52Å; H52-E1185 VanDerWaalsContact O-CA 3.22Å; H52-E1185 WeakPolarHBondContact O-CA 3.37Å; H52-L1186 PolarHBondContact N-O 2.89Å; H52-L1186 PolarHBondContact O-N 3.22Å
53	G	85.5	Confident	92.2	Very high	4 Å²	4	27.9 Å²	27.9	4%	0.041	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	107.5	-161	179.1	0	0	0	0	0	114.3	R80 S1184	G53-R80 PolarHBondContact O-NH1 3.27Å; G53-S1184 WeakPolarHBondContact CA-O 3.31Å
54	F	86.3	Confident	92.3	Very high	3 Å²	3	27 Å²	27	1%	0.013	14%	0.135	C	C	.	.			trans	-106.6	136.2	179.4	-174.1	-127.3	0	0	0	111.4	Y56 P58 L401 L402 E404 D405 L406 M425 S1184 E1185	F54-Y56 PolarHBondContact O-N 3.38Å; F54-Y56 VanDerWaalsContact O-N 3.11Å; F54-P58 HydrophobicContact CE1-CB 4.49Å; F54-P58 HydrophobicContact CE1-CG 3.63Å; F54-P58 HydrophobicContact CZ-CB 4.28Å; F54-P58 HydrophobicContact CZ-CG 3.69Å; F54-L401 HydrophobicContact CE2-CD1 3.92Å; F54-L401 HydrophobicContact CZ-CD1 3.64Å; F54-L402 WeakPolarHBondContact CZ-O 3.43Å; F54-E404 WeakPolarHBondContact CD1-O 3.33Å; F54-D405 VanDerWaalsContact CE1-N 3.26Å; F54-D405 VanDerWaalsContact CZ-O 3.26Å; F54-D405 WeakPolarHBondContact CZ-O 3.27Å; F54-L406 HydrophobicContact CE2-CB 4.07Å; F54-M425 HydrophobicContact CB-CB 4.32Å; F54-M425 HydrophobicContact CB-CE 3.54Å; F54-M425 HydrophobicContact CB-SD 4.46Å; F54-M425 HydrophobicContact CD2-CE 3.05Å; F54-M425 HydrophobicContact CE2-CE 4Å; F54-M425 HydrophobicContact CG-CE 3.65Å; F54-S1184 PolarHBondContact N-O 2.87Å; F54-S1184 WeakPolarHBondContact O-CB 3.41Å; F54-S1184 PolarHBondContact O-OG 2.81Å; F54-E1185 WeakPolarHBondContact O-CG 3.46Å
55	P	89.7	Confident	92.3	Very high	1 Å²	1	27 Å²	27	1%	0.006	14%	0.137	C	C	.	.			trans	-47.8	119.4	172.8	-31.1	38	0	0	0	112.2	Q57 P58 V72 T74 R80 F82	P55-Q57 PolarHBondContact O-N 2.85Å; P55-P58 WeakPolarHBondContact O-CD 3.45Å; P55-V72 HydrophobicContact CB-CG1 4.16Å; P55-V72 HydrophobicContact CG-CB 4.39Å; P55-V72 HydrophobicContact CG-CG1 4.18Å; P55-T74 HydrophobicContact CB-CG2 3.57Å; P55-R80 HydrophobicContact CG-CB 3.69Å; P55-R80 HydrophobicContact CG-CG 4.28Å; P55-F82 HydrophobicContact CG-CE2 4.21Å; P55-F82 HydrophobicContact CG-CZ 4.02Å
56	Y	89.2	Confident	92.3	Very high	89 Å²	89	23.2 Å²	23.2	35%	0.349	12%	0.121	S	C	.	.	S	Bend	trans	-71.5	127.9	-176.2	-175.2	-113.4	0	0	0	111.6	F54 S1182 P1183 S1184 E1185	F54-Y56 PolarHBondContact O-N 3.38Å; F54-Y56 VanDerWaalsContact O-N 3.11Å; Y56-S1182 WeakPolarHBondContact CB-OG 3.26Å; Y56-P1183 HydrophobicContact CD2-CB 4.42Å; Y56-P1183 HydrophobicContact CD2-CG 4.35Å; Y56-P1183 HydrophobicContact CE1-CG 4.48Å; Y56-P1183 HydrophobicContact CE2-CB 4.06Å; Y56-P1183 HydrophobicContact CE2-CG 3.82Å; Y56-S1184 WeakPolarHBondContact CB-OG 3.38Å; Y56-E1185 PolarHBondContact N-OE2 3.38Å
57	Q	92.8	Very high	92.3	Very high	64 Å²	64	22.4 Å²	22.4	30%	0.299	12%	0.115	S	C	.	.	S	Bend	trans	55.2	65.1	-177.2	-61	-179.9	-13.9	0	0	112.9	P55 T74 K75	P55-Q57 PolarHBondContact O-N 2.85Å; Q57-T74 WeakPolarHBondContact O-CA 3.44Å; Q57-K75 HydrophobicContact CB-CB 4.04Å; Q57-K75 PolarHBondContact O-N 3.31Å
58	P	95.9	Very high	92.5	Very high	4 Å²	4	26.9 Å²	26.9	3%	0.026	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	150.2	179.2	36.5	-39.5	0	0	0	110.6	F54 P55 V72 G73 V378 L401 L402 Q403	F54-P58 HydrophobicContact CE1-CB 4.49Å; F54-P58 HydrophobicContact CE1-CG 3.63Å; F54-P58 HydrophobicContact CZ-CB 4.28Å; F54-P58 HydrophobicContact CZ-CG 3.69Å; P55-P58 WeakPolarHBondContact O-CD 3.45Å; P58-V72 HydrophobicContact CB-CG1 3.71Å; P58-G73 CarbonylContact C-O 3.59Å; P58-G73 WeakPolarHBondContact CA-O 3.31Å; P58-V378 HydrophobicContact CG-CG2 4.41Å; P58-L401 HydrophobicContact CB-CD1 3.84Å; P58-L401 HydrophobicContact CB-CD2 3.95Å; P58-L401 HydrophobicContact CB-CG 4.11Å; P58-L401 HydrophobicContact CG-CD1 4.06Å; P58-L401 HydrophobicContact CG-CD2 4.48Å; P58-L401 HydrophobicContact CG-CG 4.22Å; P58-L402 VanDerWaalsContact CG-O 3.24Å; P58-L402 WeakPolarHBondContact CG-O 3.09Å; P58-Q403 VanDerWaalsContact CD-O 3.32Å; P58-Q403 WeakPolarHBondContact CD-O 3.35Å
59	T	97.5	Very high	92.8	Very high	44 Å²	44	22.9 Å²	22.9	27%	0.27	11%	0.112	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	-27.4	-173.3	47	0	0	0	0	113.4	G73 K75 V99	T59-G73 PolarHBondContact N-O 3.36Å; T59-G73 PolarHBondContact OG1-O 3.39Å; T59-K75 HydrophobicContact CG2-CB 3.95Å; T59-V99 VanDerWaalsContact CB-O 3.24Å; T59-V99 WeakPolarHBondContact CB-O 3.36Å; T59-V99 PolarHBondContact OG1-O 3.09Å
60	C	97.8	Very high	93.2	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.4	159.7	177.6	58.5	0	0	0	0	112.2	V72 G73 V99 L100 Q379	C60-V72 WeakPolarHBondContact O-CA 3.44Å; C60-G73 PolarHBondContact O-N 3.27Å; C60-V99 PolarHBondContact SG-O 2.87Å; C60-V99 VanDerWaalsContact SG-O 3.37Å; C60-L100 WeakPolarHBondContact CB-O 3.45Å; C60-Q379 VanDerWaalsContact CA-OE1 3.27Å
61	I	97.8	Very high	93.7	Very high	6 Å²	6	20.1 Å²	20.1	3%	0.031	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	145	175.4	-168.5	168.3	0	0	0	110.7	V70 A71 V72 Q379 T381 A399 L401 L406	I61-V70 HydrophobicContact CD1-CG1 3.67Å; I61-V70 HydrophobicContact CG1-CG1 3.61Å; I61-A71 CarbonylContact C-O 3.56Å; I61-A71 WeakPolarHBondContact CA-O 3.36Å; I61-V72 HydrophobicContact CG1-CG2 4.32Å; I61-Q379 HydrophobicContact CG2-CB 3.96Å; I61-Q379 HydrophobicContact CG2-CG 3.87Å; I61-Q379 VanDerWaalsContact N-OE1 3.1Å; I61-Q379 PolarHBondContact O-NE2 3.01Å; I61-T381 HydrophobicContact CD1-CG2 4.2Å; I61-T381 HydrophobicContact CG1-CG2 4.28Å; I61-T381 HydrophobicContact CG2-CG2 4.19Å; I61-A399 HydrophobicContact CD1-CB 4.41Å; I61-L401 HydrophobicContact CB-CB 4.2Å; I61-L401 HydrophobicContact CB-CD2 3.95Å; I61-L401 HydrophobicContact CD1-CB 4.22Å; I61-L401 HydrophobicContact CG2-CB 4.26Å; I61-L401 HydrophobicContact CG2-CD2 4.49Å; I61-L406 HydrophobicContact CD1-CD1 3.91Å
62	A	97.5	Very high	94.2	Very high	8 Å²	8	19.6 Å²	19.6	7%	0.066	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138	150.8	171.7	0	0	0	0	0	110.6	V70 A71 I102 F104	A62-V70 CarbonylContact O-C 3.53Å; A62-V70 VanDerWaalsContact O-CA 3.28Å; A62-V70 WeakPolarHBondContact O-CA 3.29Å; A62-A71 PolarHBondContact N-O 3.41Å; A62-A71 PolarHBondContact O-N 3.06Å; A62-I102 HydrophobicContact CB-CB 3.81Å; A62-I102 HydrophobicContact CB-CG2 3.71Å; A62-I102 WeakPolarHBondContact CB-O 3.22Å; A62-F104 HydrophobicContact CB-CD2 4.04Å; A62-F104 HydrophobicContact CB-CE2 4.05Å
63	F	97	Very high	94.7	Very high	25 Å²	25	19 Å²	19	11%	0.11	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	133.7	-179.9	176.2	-122.4	0	0	0	110.4	P65 I69 V70 T381 L383	F63-P65 HydrophobicContact CD1-CB 4.27Å; F63-P65 VanDerWaalsContact CE1-CA 3.43Å; F63-P65 HydrophobicContact CE1-CB 3.8Å; F63-I69 VanDerWaalsContact CD2-O 3.29Å; F63-I69 WeakPolarHBondContact CD2-O 3.48Å; F63-V70 HydrophobicContact CB-CG2 4.37Å; F63-V70 HydrophobicContact CD2-CG2 3.64Å; F63-V70 HydrophobicContact CE2-CG2 4.43Å; F63-V70 HydrophobicContact CG-CG2 4.43Å; F63-T381 HydrophobicContact CB-CG2 4.11Å; F63-L383 HydrophobicContact CB-CD2 4.4Å; F63-L383 HydrophobicContact CD1-CD2 3.65Å; F63-L383 HydrophobicContact CD2-CD2 3.88Å; F63-L383 HydrophobicContact CE1-CB 4.18Å; F63-L383 HydrophobicContact CE1-CD2 3.75Å; F63-L383 HydrophobicContact CE2-CD2 3.98Å; F63-L383 HydrophobicContact CG-CD2 3.72Å; F63-L383 HydrophobicContact CZ-CB 4.42Å; F63-L383 HydrophobicContact CZ-CD2 3.92Å
64	D	96.4	Very high	95.2	Very high	2 Å²	2	19 Å²	19	1%	0.011	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	111	165.3	-174.1	-39.1	0	0	0	108.5	V66 Q67 R68 I69 F104 N107	D64-V66 VanDerWaalsContact C-N 3.27Å; D64-V66 PolarHBondContact O-N 3.28Å; D64-V66 PolarHBondContact OD1-N 3Å; D64-Q67 HydrophobicContact CB-CB 4.06Å; D64-Q67 PolarHBondContact OD1-N 3.02Å; D64-R68 WeakPolarHBondContact O-CA 3.45Å; D64-R68 PolarHBondContact O-N 2.81Å; D64-I69 HydrophobicContact CB-CG1 3.84Å; D64-I69 PolarHBondContact N-O 3.49Å; D64-I69 PolarHBondContact O-N 3.37Å; D64-F104 HydrophobicContact CB-CB 4.03Å; D64-F104 HydrophobicContact CB-CD1 4.21Å; D64-F104 HydrophobicContact CB-CD2 3.94Å; D64-F104 HydrophobicContact CB-CE2 4.42Å; D64-F104 HydrophobicContact CB-CG 3.81Å; D64-N107 PolarHBondContact OD2-N 3.26Å
65	P	94.8	Very high	95.7	Very high	18 Å²	18	24.9 Å²	24.9	12%	0.117	12%	0.115	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-21.5	-176.3	28.5	-35.9	0	0	0	114.2	F63 V106 C384 P387	F63-P65 HydrophobicContact CD1-CB 4.27Å; F63-P65 VanDerWaalsContact CE1-CA 3.43Å; F63-P65 HydrophobicContact CE1-CB 3.8Å; P65-V106 HydrophobicContact CG-CG1 4.31Å; P65-C384 WeakPolarHBondContact CB-O 3Å; P65-P387 HydrophobicContact CG-CB 3.73Å
66	V	95.3	Very high	95.8	Very high	21 Å²	21	26.9 Å²	26.9	13%	0.127	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.5	-47.7	-178.5	-177.5	0	0	0	0	110.3	D64 R68 V106 N107 P387 M1212 P1213	D64-V66 VanDerWaalsContact C-N 3.27Å; D64-V66 PolarHBondContact O-N 3.28Å; D64-V66 PolarHBondContact OD1-N 3Å; V66-R68 VanDerWaalsContact C-N 3.28Å; V66-V106 HydrophobicContact CB-CG1 4.38Å; V66-V106 HydrophobicContact CG2-CG1 3.76Å; V66-N107 HydrophobicContact CB-CB 3.93Å; V66-N107 HydrophobicContact CG1-CB 3.82Å; V66-N107 HydrophobicContact CG2-CB 4.33Å; V66-P387 HydrophobicContact CG2-CG 4.38Å; V66-M1212 HydrophobicContact CG2-SD 3.96Å; V66-P1213 HydrophobicContact CG2-CG 4.25Å
67	Q	95.2	Very high	96.1	Very high	6 Å²	6	22.7 Å²	22.7	3%	0.028	11%	0.112	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-18.5	176.4	-68.4	-66.8	-45.6	0	0	112.7	D64 I69 N107 G479 F1207 L1208 S1210	D64-Q67 HydrophobicContact CB-CB 4.06Å; D64-Q67 PolarHBondContact OD1-N 3.02Å; Q67-I69 VanDerWaalsContact C-N 3.3Å; Q67-I69 HydrophobicContact CB-CD1 4.06Å; Q67-I69 HydrophobicContact CB-CG1 3.85Å; Q67-I69 HydrophobicContact CB-CG2 4.45Å; Q67-I69 PolarHBondContact O-N 3.23Å; Q67-N107 PolarHBondContact NE2-OD1 2.76Å; Q67-G479 WeakPolarHBondContact O-CA 3.38Å; Q67-F1207 VanDerWaalsContact CD-CE2 3.49Å; Q67-F1207 HydrophobicContact CG-CD2 3.84Å; Q67-F1207 HydrophobicContact CG-CE2 3.75Å; Q67-L1208 PolarHBondContact NE2-O 2.86Å; Q67-L1208 PolarHBondContact OE1-O 3.05Å; Q67-S1210 PolarHBondContact NE2-OG 3.13Å
68	R	95.4	Very high	96.2	Very high	105 Å²	105	22.6 Å²	22.6	40%	0.396	11%	0.111	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.4	43.5	-176.2	-58.2	-176.4	177.7	-176.4	0	113.1	D64 V66 I477 T478 G479	D64-R68 WeakPolarHBondContact O-CA 3.45Å; D64-R68 PolarHBondContact O-N 2.81Å; V66-R68 VanDerWaalsContact C-N 3.28Å; R68-I477 VanDerWaalsContact O-CG2 3.25Å; R68-I477 WeakPolarHBondContact O-CG2 3.26Å; R68-T478 WeakPolarHBondContact CD-OG1 3.38Å; R68-T478 PolarHBondContact NH1-OG1 3.26Å; R68-T478 PolarHBondContact O-N 2.84Å; R68-G479 WeakPolarHBondContact O-CA 2.96Å; R68-G479 PolarHBondContact O-N 3.41Å
69	I	95.6	Very high	96.2	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	149.3	176.2	58.9	177.3	0	0	0	110.2	F63 D64 Q67 I81 F82 F104 I125 I1206	F63-I69 VanDerWaalsContact CD2-O 3.29Å; F63-I69 WeakPolarHBondContact CD2-O 3.48Å; D64-I69 HydrophobicContact CB-CG1 3.84Å; D64-I69 PolarHBondContact N-O 3.49Å; D64-I69 PolarHBondContact O-N 3.37Å; Q67-I69 VanDerWaalsContact C-N 3.3Å; Q67-I69 HydrophobicContact CB-CD1 4.06Å; Q67-I69 HydrophobicContact CB-CG1 3.85Å; Q67-I69 HydrophobicContact CB-CG2 4.45Å; Q67-I69 PolarHBondContact O-N 3.23Å; I69-I81 HydrophobicContact CB-CG2 4.28Å; I69-I81 HydrophobicContact CD1-CG2 4.25Å; I69-F82 CarbonylContact C-O 3.43Å; I69-F82 VanDerWaalsContact CA-O 3.29Å; I69-F82 WeakPolarHBondContact CA-O 3.32Å; I69-F104 HydrophobicContact CD1-CD1 4.23Å; I69-F104 HydrophobicContact CD1-CE1 3.51Å; I69-F104 HydrophobicContact CD1-CZ 3.93Å; I69-F104 HydrophobicContact CG1-CE1 3.93Å; I69-F104 HydrophobicContact CG1-CZ 3.87Å; I69-I125 HydrophobicContact CD1-CD1 3.9Å; I69-I1206 HydrophobicContact CD1-CG2 3.84Å; I69-I1206 HydrophobicContact CG2-CG2 4.23Å
70	V	96.4	Very high	95.9	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	136.8	177.2	167.1	0	0	0	0	109.5	I61 A62 F63 V72 I81 F82 I477	I61-V70 HydrophobicContact CD1-CG1 3.67Å; I61-V70 HydrophobicContact CG1-CG1 3.61Å; A62-V70 CarbonylContact O-C 3.53Å; A62-V70 VanDerWaalsContact O-CA 3.28Å; A62-V70 WeakPolarHBondContact O-CA 3.29Å; F63-V70 HydrophobicContact CB-CG2 4.37Å; F63-V70 HydrophobicContact CD2-CG2 3.64Å; F63-V70 HydrophobicContact CE2-CG2 4.43Å; F63-V70 HydrophobicContact CG-CG2 4.43Å; V70-V72 HydrophobicContact CG1-CG2 4.16Å; V70-I81 CarbonylContact O-C 3.56Å; V70-I81 VanDerWaalsContact O-CA 3.26Å; V70-I81 WeakPolarHBondContact O-CA 3.32Å; V70-F82 PolarHBondContact N-O 2.82Å; V70-F82 PolarHBondContact O-N 3.27Å; V70-I477 HydrophobicContact CB-CD1 4.12Å; V70-I477 HydrophobicContact CB-CG2 4.48Å; V70-I477 HydrophobicContact CG2-CD1 3.51Å; V70-I477 HydrophobicContact CG2-CG1 3.96Å; V70-I477 HydrophobicContact CG2-CG2 4.18Å
71	A	97.2	Very high	95.8	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	133.4	169.7	0	0	0	0	0	110.3	I61 A62 I79 R80 I81 I102 F104 L111	I61-A71 CarbonylContact C-O 3.56Å; I61-A71 WeakPolarHBondContact CA-O 3.36Å; A62-A71 PolarHBondContact N-O 3.41Å; A62-A71 PolarHBondContact O-N 3.06Å; A71-I79 HydrophobicContact CB-CG2 4.05Å; A71-R80 CarbonylContact C-O 3.55Å; A71-R80 WeakPolarHBondContact CA-O 3.45Å; A71-I81 HydrophobicContact CB-CG1 4.2Å; A71-I102 HydrophobicContact CB-CD1 4.19Å; A71-I102 HydrophobicContact CB-CG2 4.02Å; A71-F104 HydrophobicContact CB-CE2 3.73Å; A71-F104 HydrophobicContact CB-CZ 3.52Å; A71-L111 HydrophobicContact CB-CD1 3.88Å
72	V	97.1	Very high	95.5	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	120.4	175.9	177.9	0	0	0	0	108.7	P55 P58 C60 I61 V70 I79 R80 F82 L401	P55-V72 HydrophobicContact CB-CG1 4.16Å; P55-V72 HydrophobicContact CG-CB 4.39Å; P55-V72 HydrophobicContact CG-CG1 4.18Å; P58-V72 HydrophobicContact CB-CG1 3.71Å; C60-V72 WeakPolarHBondContact O-CA 3.44Å; I61-V72 HydrophobicContact CG1-CG2 4.32Å; V70-V72 HydrophobicContact CG1-CG2 4.16Å; V72-I79 CarbonylContact O-C 3.51Å; V72-I79 VanDerWaalsContact O-CA 3.28Å; V72-I79 WeakPolarHBondContact O-CA 3.49Å; V72-R80 PolarHBondContact N-O 3.02Å; V72-R80 PolarHBondContact O-N 3.2Å; V72-F82 HydrophobicContact CB-CE2 4.32Å; V72-F82 HydrophobicContact CG2-CD2 4.25Å; V72-F82 HydrophobicContact CG2-CE2 3.94Å; V72-L401 HydrophobicContact CG1-CD1 3.77Å; V72-L401 HydrophobicContact CG1-CD2 4.27Å; V72-L401 HydrophobicContact CG2-CD1 4.13Å
73	G	97.5	Very high	95.2	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	152.5	173.1	0	0	0	0	0	111.8	P58 T59 C60 F78	P58-G73 CarbonylContact C-O 3.59Å; P58-G73 WeakPolarHBondContact CA-O 3.31Å; T59-G73 PolarHBondContact N-O 3.36Å; T59-G73 PolarHBondContact OG1-O 3.39Å; C60-G73 PolarHBondContact O-N 3.27Å; G73-F78 CarbonylContact C-O 3.58Å; G73-F78 WeakPolarHBondContact CA-O 3.1Å
74	T	96.8	Very high	94.8	Very high	2 Å²	2	21.7 Å²	21.7	1%	0.012	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	165.8	179.1	74.7	0	0	0	0	113.3	P55 Q57 S76 G77 F78 V99	P55-T74 HydrophobicContact CB-CG2 3.57Å; Q57-T74 WeakPolarHBondContact O-CA 3.44Å; T74-S76 PolarHBondContact O-N 2.82Å; T74-S76 PolarHBondContact OG1-N 3.46Å; T74-S76 PolarHBondContact OG1-OG 3.1Å; T74-G77 PolarHBondContact O-N 2.72Å; T74-G77 PolarHBondContact OG1-N 2.77Å; T74-F78 HydrophobicContact CG2-CB 4.24Å; T74-F78 PolarHBondContact N-O 3.39Å; T74-F78 PolarHBondContact OG1-N 2.88Å; T74-F78 PolarHBondContact OG1-O 2.94Å; T74-V99 PolarHBondContact O-N 3.29Å
75	K	96	Very high	94.1	Very high	128 Å²	128	24.3 Å²	24.3	56%	0.557	12%	0.118	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-23.9	173.6	-168.8	176	177.5	-174.6	0	113.5	Q57 T59 G77 A98	Q57-K75 HydrophobicContact CB-CB 4.04Å; Q57-K75 PolarHBondContact O-N 3.31Å; T59-K75 HydrophobicContact CG2-CB 3.95Å; K75-G77 VanDerWaalsContact C-N 3.34Å; K75-A98 HydrophobicContact CG-CB 4.18Å; K75-A98 VanDerWaalsContact O-CA 3.26Å; K75-A98 WeakPolarHBondContact O-CA 3.45Å; K75-A98 PolarHBondContact O-N 3.25Å
76	S	93.1	Very high	93.4	Very high	43 Å²	43	23.7 Å²	23.7	30%	0.301	12%	0.115	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.1	8	178.1	48.7	0	0	0	0	113.6	T74 F78 A96	T74-S76 PolarHBondContact O-N 2.82Å; T74-S76 PolarHBondContact OG1-N 3.46Å; T74-S76 PolarHBondContact OG1-OG 3.1Å; S76-F78 VanDerWaalsContact C-N 3.34Å; S76-F78 PolarHBondContact O-N 2.86Å; S76-F78 WeakPolarHBondContact OG-CD2 3.41Å; S76-A96 CarbonylContact C-O 3.5Å; S76-A96 VanDerWaalsContact C-O 3.24Å; S76-A96 CarbonylContact O-C 3.58Å; S76-A96 VanDerWaalsContact O-CA 3.3Å; S76-A96 WeakPolarHBondContact O-CA 3.41Å; S76-A96 WeakPolarHBondContact O-CB 3.28Å
77	G	94.6	Very high	93.1	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	11%	0.109	C	C	.	.	S	Bend	trans	77.5	16.8	177.7	0	0	0	0	0	114.7	T74 K75 C92 H93 S97	T74-G77 PolarHBondContact O-N 2.72Å; T74-G77 PolarHBondContact OG1-N 2.77Å; K75-G77 VanDerWaalsContact C-N 3.34Å; G77-C92 CarbonylContact O-C 3.58Å; G77-C92 WeakPolarHBondContact O-CA 3.46Å; G77-H93 PolarHBondContact O-CD2 3.35Å; G77-H93 PolarHBondContact O-N 2.89Å; G77-S97 WeakPolarHBondContact CA-O 3.31Å; G77-S97 PolarHBondContact N-O 3.28Å
78	F	94.6	Very high	92.7	Very high	63 Å²	63	24.4 Å²	24.4	28%	0.276	12%	0.118	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	144.6	168.3	-70	-93.7	0	0	0	110	G73 T74 S76 I91 C92	G73-F78 CarbonylContact C-O 3.58Å; G73-F78 WeakPolarHBondContact CA-O 3.1Å; T74-F78 HydrophobicContact CG2-CB 4.24Å; T74-F78 PolarHBondContact N-O 3.39Å; T74-F78 PolarHBondContact OG1-N 2.88Å; T74-F78 PolarHBondContact OG1-O 2.94Å; S76-F78 VanDerWaalsContact C-N 3.34Å; S76-F78 PolarHBondContact O-N 2.86Å; S76-F78 WeakPolarHBondContact OG-CD2 3.41Å; F78-I91 CarbonylContact C-O 3.58Å; F78-I91 VanDerWaalsContact CA-O 3.3Å; F78-I91 WeakPolarHBondContact CA-O 2.95Å; F78-C92 HydrophobicContact CD1-CB 3.67Å; F78-C92 HydrophobicContact CE1-CB 3.59Å; F78-C92 HydrophobicContact CG-CB 4.3Å; F78-C92 HydrophobicContact CZ-CB 4.15Å
79	I	95.6	Very high	92.3	Very high	1 Å²	1	20.3 Å²	20.3	1%	0.005	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	123.3	165.4	-58.1	175.1	0	0	0	106.8	A71 V72 I81 S90 I91 H93 V99 I102 L111	A71-I79 HydrophobicContact CB-CG2 4.05Å; V72-I79 CarbonylContact O-C 3.51Å; V72-I79 VanDerWaalsContact O-CA 3.28Å; V72-I79 WeakPolarHBondContact O-CA 3.49Å; I79-I81 HydrophobicContact CG2-CG1 4.26Å; I79-S90 WeakPolarHBondContact O-CA 3.33Å; I79-I91 HydrophobicContact CB-CD1 4.11Å; I79-I91 HydrophobicContact CB-CG1 3.71Å; I79-I91 HydrophobicContact CD1-CD1 4.48Å; I79-I91 HydrophobicContact CG2-CD1 4.43Å; I79-I91 HydrophobicContact CG2-CG1 4.39Å; I79-I91 PolarHBondContact N-O 3.2Å; I79-I91 WeakPolarHBondContact O-CG1 3.27Å; I79-I91 PolarHBondContact O-N 2.86Å; I79-H93 WeakPolarHBondContact CD1-NE2 3.17Å; I79-V99 HydrophobicContact CD1-CG1 4.3Å; I79-V99 HydrophobicContact CG1-CG1 4.33Å; I79-V99 HydrophobicContact CG1-CG2 3.97Å; I79-I102 HydrophobicContact CB-CD1 4.49Å; I79-I102 HydrophobicContact CD1-CD1 4.06Å; I79-I102 HydrophobicContact CD1-CG1 4.29Å; I79-I102 HydrophobicContact CG1-CD1 4.02Å; I79-I102 HydrophobicContact CG2-CD1 3.79Å; I79-L111 HydrophobicContact CD1-CD2 4.09Å
80	R	92.6	Very high	91.9	Very high	7 Å²	7	22.5 Å²	22.5	3%	0.026	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	125.4	173.6	-164.1	161.7	-179.1	-151.2	-9.8	110.1	V51 G53 P55 A71 V72 F82 D88 C89	V51-R80 PolarHBondContact O-NH2 3.29Å; G53-R80 PolarHBondContact O-NH1 3.27Å; P55-R80 HydrophobicContact CG-CB 3.69Å; P55-R80 HydrophobicContact CG-CG 4.28Å; A71-R80 CarbonylContact C-O 3.55Å; A71-R80 WeakPolarHBondContact CA-O 3.45Å; V72-R80 PolarHBondContact N-O 3.02Å; V72-R80 PolarHBondContact O-N 3.2Å; R80-F82 HydrophobicContact CB-CE2 4.07Å; R80-F82 HydrophobicContact CB-CZ 4.14Å; R80-F82 VanDerWaalsContact CD-CZ 3.48Å; R80-F82 HydrophobicContact CG-CE1 3.96Å; R80-F82 HydrophobicContact CG-CE2 3.92Å; R80-F82 HydrophobicContact CG-CZ 3.59Å; R80-D88 IonicContact CZ-OD2 3.73Å; R80-D88 IonicContact NE-OD2 2.66Å; R80-D88 PolarHBondContact NE-OD2 2.48Å; R80-D88 IonicContact NH2-OD2 3.3Å; R80-D88 PolarHBondContact NH2-OD2 3.19Å; R80-C89 CarbonylContact C-O 3.59Å; R80-C89 WeakPolarHBondContact CA-O 3.21Å; R80-C89 WeakPolarHBondContact CG-O 3.49Å
81	I	94.3	Very high	91.7	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	125.6	-179.9	-51.3	179.5	0	0	0	108.1	I69 V70 A71 I79 D88 C89 F104 L111 I125 I1206	I69-I81 HydrophobicContact CB-CG2 4.28Å; I69-I81 HydrophobicContact CD1-CG2 4.25Å; V70-I81 CarbonylContact O-C 3.56Å; V70-I81 VanDerWaalsContact O-CA 3.26Å; V70-I81 WeakPolarHBondContact O-CA 3.32Å; A71-I81 HydrophobicContact CB-CG1 4.2Å; I79-I81 HydrophobicContact CG2-CG1 4.26Å; I81-D88 CarbonylContact O-C 3.59Å; I81-D88 WeakPolarHBondContact O-CA 3.35Å; I81-D88 WeakPolarHBondContact O-CB 3.12Å; I81-C89 PolarHBondContact N-O 2.88Å; I81-C89 PolarHBondContact O-N 3.23Å; I81-F104 HydrophobicContact CG2-CZ 4.5Å; I81-L111 HydrophobicContact CD1-CD1 4.2Å; I81-I125 HydrophobicContact CD1-CG2 3.92Å; I81-I1206 HydrophobicContact CB-CD1 4.43Å; I81-I1206 HydrophobicContact CG2-CG2 3.89Å
82	F	91.5	Very high	91.4	Very high	1 Å²	1	25.6 Å²	25.6	0%	0.004	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	132.1	179.7	-59.5	-78.9	0	0	0	110.2	P55 I69 V70 V72 R80 D88 Y423	P55-F82 HydrophobicContact CG-CE2 4.21Å; P55-F82 HydrophobicContact CG-CZ 4.02Å; I69-F82 CarbonylContact C-O 3.43Å; I69-F82 VanDerWaalsContact CA-O 3.29Å; I69-F82 WeakPolarHBondContact CA-O 3.32Å; V70-F82 PolarHBondContact N-O 2.82Å; V70-F82 PolarHBondContact O-N 3.27Å; V72-F82 HydrophobicContact CB-CE2 4.32Å; V72-F82 HydrophobicContact CG2-CD2 4.25Å; V72-F82 HydrophobicContact CG2-CE2 3.94Å; R80-F82 HydrophobicContact CB-CE2 4.07Å; R80-F82 HydrophobicContact CB-CZ 4.14Å; R80-F82 VanDerWaalsContact CD-CZ 3.48Å; R80-F82 HydrophobicContact CG-CE1 3.96Å; R80-F82 HydrophobicContact CG-CE2 3.92Å; R80-F82 HydrophobicContact CG-CZ 3.59Å; F82-D88 HydrophobicContact CD1-CB 4.19Å; F82-Y423 HydrophobicContact CB-CE2 4.42Å; F82-Y423 HydrophobicContact CD1-CD1 4.39Å; F82-Y423 AromaticContact CD1-CE1 3.96Å; F82-Y423 HydrophobicContact CD1-CE1 3.96Å; F82-Y423 HydrophobicContact CD1-CE2 4.1Å; F82-Y423 AromaticContact CD1-CZ 3.81Å
83	G	91.6	Very high	91	Very high	1 Å²	1	25.8 Å²	25.8	1%	0.01	14%	0.141	C	C	.	.			trans	-111.2	-138.3	167.7	0	0	0	0	0	110.8	V87 Y423 I477 G479	G83-V87 PolarHBondContact N-O 3.46Å; G83-Y423 PolarHBondContact O-OH 3.45Å; G83-I477 CarbonylContact C-O 3.45Å; G83-I477 WeakPolarHBondContact O-CG2 3.48Å; G83-G479 CarbonylContact C-O 3.59Å; G83-G479 WeakPolarHBondContact CA-O 3.45Å
84	K	89.2	Confident	90.5	Very high	58 Å²	58	30.9 Å²	30.9	25%	0.252	17%	0.174	S	C	.	.	S	Bend	trans	-63.6	162.6	167.2	71	-177.7	-174.3	-168.6	0	110.9	G86 V87 Y423 I477 G479 G480 W482	K84-G86 PolarHBondContact O-N 2.85Å; K84-V87 HydrophobicContact CD-CG2 4.3Å; K84-V87 HydrophobicContact CG-CB 4.17Å; K84-V87 HydrophobicContact CG-CG2 3.54Å; K84-V87 WeakPolarHBondContact O-CB 3.15Å; K84-V87 PolarHBondContact O-N 2.84Å; K84-Y423 PolarHBondContact O-OH 3.29Å; K84-I477 WeakPolarHBondContact CA-O 3.38Å; K84-I477 PolarHBondContact N-O 3.45Å; K84-G479 PolarHBondContact N-O 3.4Å; K84-G480 VanDerWaalsContact CD-O 3.3Å; K84-G480 WeakPolarHBondContact CD-O 3.48Å; K84-G480 VanDerWaalsContact CE-O 3.22Å; K84-G480 WeakPolarHBondContact CE-O 3.47Å; K84-G480 PolarHBondContact NZ-O 2.92Å; K84-W482 VanDerWaalsContact CE-CD1 3.47Å
85	P	82.7	Confident	90	Very high	57 Å²	57	33.5 Å²	33.5	37%	0.37	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50.4	128.1	173	-27.7	36.3	0	0	0	111.8	P422 W482	P85-P422 HydrophobicContact CB-CB 4.24Å; P85-P422 HydrophobicContact CG-CB 3.66Å; P85-P422 HydrophobicContact CG-CG 3.69Å; P85-W482 PolarHBondContact O-NE1 3.37Å
86	G	80.1	Confident	89.7	Confident	4 Å²	4	30 Å²	30	4%	0.041	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	87	-6.2	-173.8	0	0	0	0	0	115.6	K84 V510	K84-G86 PolarHBondContact O-N 2.85Å; G86-V510 WeakPolarHBondContact O-CG1 3.28Å
87	V	87.2	Confident	89.8	Confident	0 Å²	0	29.2 Å²	29.2	0%	0	18%	0.182	C	C	.	.			trans	-106.6	103.3	170.4	-177.7	0	0	0	0	109.2	G83 K84 W482 I1206	G83-V87 PolarHBondContact N-O 3.46Å; K84-V87 HydrophobicContact CD-CG2 4.3Å; K84-V87 HydrophobicContact CG-CB 4.17Å; K84-V87 HydrophobicContact CG-CG2 3.54Å; K84-V87 WeakPolarHBondContact O-CB 3.15Å; K84-V87 PolarHBondContact O-N 2.84Å; V87-W482 HydrophobicContact CG2-CB 4.05Å; V87-W482 HydrophobicContact CG2-CG 4.38Å; V87-I1206 HydrophobicContact CG1-CG1 3.89Å
88	D	87.2	Confident	89.9	Confident	43 Å²	43	30.4 Å²	30.4	23%	0.23	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	156.8	168.9	73.5	-54.8	0	0	0	112.3	R80 I81 F82	R80-D88 IonicContact CZ-OD2 3.73Å; R80-D88 IonicContact NE-OD2 2.66Å; R80-D88 PolarHBondContact NE-OD2 2.48Å; R80-D88 IonicContact NH2-OD2 3.3Å; R80-D88 PolarHBondContact NH2-OD2 3.19Å; I81-D88 CarbonylContact O-C 3.59Å; I81-D88 WeakPolarHBondContact O-CA 3.35Å; I81-D88 WeakPolarHBondContact O-CB 3.12Å; F82-D88 HydrophobicContact CD1-CB 4.19Å
89	C	87.6	Confident	90.1	Very high	19 Å²	19	27.4 Å²	27.4	13%	0.128	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	158.1	163.4	77	0	0	0	0	111.1	R80 I81 I1206	R80-C89 CarbonylContact C-O 3.59Å; R80-C89 WeakPolarHBondContact CA-O 3.21Å; R80-C89 WeakPolarHBondContact CG-O 3.49Å; I81-C89 PolarHBondContact N-O 2.88Å; I81-C89 PolarHBondContact O-N 3.23Å; C89-I1206 HydrophobicContact CB-CD1 3.4Å; C89-I1206 WeakPolarHBondContact SG-CD1 3.25Å
90	S	88	Confident	90.2	Very high	45 Å²	45	30.9 Å²	30.9	32%	0.315	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	129.1	172.7	-179.5	0	0	0	0	109.3	I79	I79-S90 WeakPolarHBondContact O-CA 3.33Å
91	I	91.1	Very high	90.4	Very high	15 Å²	15	33.1 Å²	33.1	8%	0.077	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	154.9	172.9	58.2	-178.8	0	0	0	109.3	F78 I79 W123 P130	F78-I91 CarbonylContact C-O 3.58Å; F78-I91 VanDerWaalsContact CA-O 3.3Å; F78-I91 WeakPolarHBondContact CA-O 2.95Å; I79-I91 HydrophobicContact CB-CD1 4.11Å; I79-I91 HydrophobicContact CB-CG1 3.71Å; I79-I91 HydrophobicContact CD1-CD1 4.48Å; I79-I91 HydrophobicContact CG2-CD1 4.43Å; I79-I91 HydrophobicContact CG2-CG1 4.39Å; I79-I91 PolarHBondContact N-O 3.2Å; I79-I91 WeakPolarHBondContact O-CG1 3.27Å; I79-I91 PolarHBondContact O-N 2.86Å; I91-W123 HydrophobicContact CB-CH2 4.15Å; I91-W123 HydrophobicContact CB-CZ3 3.95Å; I91-W123 HydrophobicContact CD1-CD2 3.76Å; I91-W123 HydrophobicContact CD1-CE3 3.65Å; I91-W123 HydrophobicContact CD1-CG 4.33Å; I91-W123 HydrophobicContact CD1-CH2 4.13Å; I91-W123 HydrophobicContact CD1-CZ2 4.24Å; I91-W123 HydrophobicContact CD1-CZ3 3.84Å; I91-W123 HydrophobicContact CG1-CH2 4.31Å; I91-W123 HydrophobicContact CG1-CZ3 4.27Å; I91-W123 HydrophobicContact CG2-CZ3 4.4Å; I91-P130 HydrophobicContact CG2-CB 3.86Å; I91-P130 HydrophobicContact CG2-CG 3.85Å
92	C	90.3	Very high	90.6	Very high	51 Å²	51	33.4 Å²	33.4	35%	0.345	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	136.1	-178.6	-172.1	0	0	0	0	110.6	G77 F78	G77-C92 CarbonylContact O-C 3.58Å; G77-C92 WeakPolarHBondContact O-CA 3.46Å; F78-C92 HydrophobicContact CD1-CB 3.67Å; F78-C92 HydrophobicContact CE1-CB 3.59Å; F78-C92 HydrophobicContact CG-CB 4.3Å; F78-C92 HydrophobicContact CZ-CB 4.15Å
93	H	90.4	Very high	90.9	Very high	3 Å²	3	34.8 Å²	34.8	1%	0.014	22%	0.215	C	C	.	.			trans	-62.4	140.4	169.3	-73.5	-68.2	0	0	0	111	G77 I79 S95 A96 S113 C115 H121 W123	G77-H93 PolarHBondContact O-CD2 3.35Å; G77-H93 PolarHBondContact O-N 2.89Å; I79-H93 WeakPolarHBondContact CD1-NE2 3.17Å; H93-S95 PolarHBondContact O-N 3.03Å; H93-A96 PolarHBondContact O-N 2.86Å; H93-A96 VanDerWaalsContact O-N 3.08Å; H93-S113 PolarHBondContact CE1-OG 2.92Å; H93-C115 PolarHBondContact CE1-SG 3.38Å; H93-C115 PolarHBondContact NE2-SG 3.46Å; H93-H121 AromaticContact CE1-CD2 3.33Å; H93-H121 PolarHBondContact CE1-CD2 3.46Å; H93-H121 AromaticContact CE1-CG 3.89Å; H93-H121 AromaticContact ND1-CD2 3.08Å; H93-H121 PolarHBondContact ND1-CD2 3.03Å; H93-H121 AromaticContact ND1-CG 3.76Å; H93-H121 AromaticContact ND1-NE2 3.31Å; H93-H121 PolarHBondContact ND1-NE2 3.5Å; H93-W123 AromaticContact CE1-CE2 3.84Å; H93-W123 AromaticContact CE1-CZ2 3.47Å; H93-W123 VanDerWaalsContact CE1-CZ2 3.47Å; H93-W123 WeakPolarHBondContact CE1-CZ2 3.19Å; H93-W123 AromaticContact CE1-NE1 3.61Å; H93-W123 AromaticContact ND1-CZ2 3.63Å
94	P	85.3	Confident	91.1	Very high	107 Å²	107	35.4 Å²	35.4	70%	0.695	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-30.9	176.6	-25.7	34.5	0	0	0	113.8	I132	P94-I132 HydrophobicContact CG-CD1 3.81Å
95	S	87	Confident	91.5	Very high	58 Å²	58	33.6 Å²	33.6	41%	0.406	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.7	-10.3	179.4	56.8	0	0	0	0	114	H93 S97 D117	H93-S95 PolarHBondContact O-N 3.03Å; S95-S97 PolarHBondContact O-N 2.96Å; S95-S97 VanDerWaalsContact O-N 3.08Å; S95-D117 WeakPolarHBondContact CB-OD2 3.47Å; S95-D117 PolarHBondContact OG-OD2 3.39Å
96	A	90.3	Very high	92	Very high	55 Å²	55	31.8 Å²	31.8	46%	0.455	20%	0.199	S	C	.	.			trans	50.6	27.4	-171.4	0	0	0	0	0	113.7	S76 H93	S76-A96 CarbonylContact C-O 3.5Å; S76-A96 VanDerWaalsContact C-O 3.24Å; S76-A96 CarbonylContact O-C 3.58Å; S76-A96 VanDerWaalsContact O-CA 3.3Å; S76-A96 WeakPolarHBondContact O-CA 3.41Å; S76-A96 WeakPolarHBondContact O-CB 3.28Å; H93-A96 PolarHBondContact O-N 2.86Å; H93-A96 VanDerWaalsContact O-N 3.08Å
97	S	95.3	Very high	92.7	Very high	26 Å²	26	32.7 Å²	32.7	18%	0.182	20%	0.202	C	C	.	.			trans	-81.3	152.1	178.7	-171.3	0	0	0	0	111.5	G77 S95 V99 D117	G77-S97 WeakPolarHBondContact CA-O 3.31Å; G77-S97 PolarHBondContact N-O 3.28Å; S95-S97 PolarHBondContact O-N 2.96Å; S95-S97 VanDerWaalsContact O-N 3.08Å; S97-V99 PolarHBondContact O-N 3.32Å; S97-D117 PolarHBondContact OG-N 3.17Å
98	A	97.2	Very high	93	Very high	24 Å²	24	37.1 Å²	37.1	20%	0.198	22%	0.223	C	C	.	.			trans	-56.7	132	-177.6	0	0	0	0	0	112.2	K75 L100 C115 G116	K75-A98 HydrophobicContact CG-CB 4.18Å; K75-A98 VanDerWaalsContact O-CA 3.26Å; K75-A98 WeakPolarHBondContact O-CA 3.45Å; K75-A98 PolarHBondContact O-N 3.25Å; A98-L100 PolarHBondContact O-N 2.77Å; A98-C115 CarbonylContact O-C 3.58Å; A98-C115 VanDerWaalsContact O-CA 3.3Å; A98-C115 WeakPolarHBondContact O-CA 3.38Å; A98-G116 PolarHBondContact O-N 3.41Å
99	V	97.7	Very high	93.3	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	111.8	176.1	-168.8	0	0	0	0	109.2	T59 C60 T74 I79 S97 I102	T59-V99 VanDerWaalsContact CB-O 3.24Å; T59-V99 WeakPolarHBondContact CB-O 3.36Å; T59-V99 PolarHBondContact OG1-O 3.09Å; C60-V99 PolarHBondContact SG-O 2.87Å; C60-V99 VanDerWaalsContact SG-O 3.37Å; T74-V99 PolarHBondContact O-N 3.29Å; I79-V99 HydrophobicContact CD1-CG1 4.3Å; I79-V99 HydrophobicContact CG1-CG1 4.33Å; I79-V99 HydrophobicContact CG1-CG2 3.97Å; S97-V99 PolarHBondContact O-N 3.32Å; V99-I102 HydrophobicContact CG1-CD1 4.02Å; V99-I102 HydrophobicContact CG1-CG1 3.68Å
100	L	96.8	Very high	93.6	Very high	75 Å²	75	34.6 Å²	34.6	39%	0.393	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80	-41	-176.6	-57.8	-177.4	0	0	0	112.5	C60 A98 I114	C60-L100 WeakPolarHBondContact CB-O 3.45Å; A98-L100 PolarHBondContact O-N 2.77Å; L100-I114 HydrophobicContact CB-CG2 4.45Å; L100-I114 WeakPolarHBondContact CB-O 3.5Å; L100-I114 HydrophobicContact CD1-CG2 4.41Å; L100-I114 PolarHBondContact N-O 2.75Å
101	Q	97.8	Very high	94	Very high	54 Å²	54	32.5 Å²	32.5	25%	0.252	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.5	147.3	-177.9	-162.6	170.8	6.3	0	0	110.9	F103 S113 I114 G146	Q101-F103 HydrophobicContact CB-CE2 4.34Å; Q101-F103 HydrophobicContact CG-CE1 4.3Å; Q101-F103 HydrophobicContact CG-CE2 3.84Å; Q101-F103 HydrophobicContact CG-CZ 3.65Å; Q101-S113 WeakPolarHBondContact O-CA 3.39Å; Q101-I114 HydrophobicContact CB-CD1 4.39Å; Q101-I114 PolarHBondContact N-O 2.87Å; Q101-I114 PolarHBondContact O-N 3.46Å; Q101-G146 PolarHBondContact NE2-O 3.19Å
102	I	98.1	Very high	94.3	Very high	6 Å²	6	31.8 Å²	31.8	3%	0.031	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	142.9	177.5	-62.8	168	0	0	0	109.2	A62 A71 I79 V99 L111 V112	A62-I102 HydrophobicContact CB-CB 3.81Å; A62-I102 HydrophobicContact CB-CG2 3.71Å; A62-I102 WeakPolarHBondContact CB-O 3.22Å; A71-I102 HydrophobicContact CB-CD1 4.19Å; A71-I102 HydrophobicContact CB-CG2 4.02Å; I79-I102 HydrophobicContact CB-CD1 4.49Å; I79-I102 HydrophobicContact CD1-CD1 4.06Å; I79-I102 HydrophobicContact CD1-CG1 4.29Å; I79-I102 HydrophobicContact CG1-CD1 4.02Å; I79-I102 HydrophobicContact CG2-CD1 3.79Å; V99-I102 HydrophobicContact CG1-CD1 4.02Å; V99-I102 HydrophobicContact CG1-CG1 3.68Å; I102-L111 HydrophobicContact CG2-CD1 3.65Å; I102-L111 HydrophobicContact CG2-CD2 3.95Å; I102-L111 HydrophobicContact CG2-CG 3.7Å; I102-V112 CarbonylContact C-O 3.57Å; I102-V112 WeakPolarHBondContact CA-O 3.22Å
103	F	97.6	Very high	94.7	Very high	29 Å²	29	29.3 Å²	29.3	13%	0.127	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	133.2	170.8	-54.2	-85.6	0	0	0	109.8	Q101 L111 V112 I114 G146 L148 L155	Q101-F103 HydrophobicContact CB-CE2 4.34Å; Q101-F103 HydrophobicContact CG-CE1 4.3Å; Q101-F103 HydrophobicContact CG-CE2 3.84Å; Q101-F103 HydrophobicContact CG-CZ 3.65Å; F103-L111 CarbonylContact O-C 3.59Å; F103-L111 WeakPolarHBondContact O-CA 3.3Å; F103-V112 HydrophobicContact CB-CB 4.42Å; F103-V112 HydrophobicContact CD2-CG1 4.49Å; F103-V112 PolarHBondContact N-O 2.95Å; F103-V112 PolarHBondContact O-N 2.82Å; F103-I114 HydrophobicContact CE2-CD1 3.81Å; F103-G146 VanDerWaalsContact CZ-O 3.3Å; F103-G146 WeakPolarHBondContact CZ-O 3.42Å; F103-L148 HydrophobicContact CB-CB 4.18Å; F103-L148 HydrophobicContact CB-CD2 3.76Å; F103-L148 HydrophobicContact CD1-CB 3.97Å; F103-L148 HydrophobicContact CG-CB 3.99Å; F103-L148 HydrophobicContact CG-CD2 4.37Å; F103-L155 HydrophobicContact CD2-CD1 4.35Å; F103-L155 HydrophobicContact CE2-CD1 4.3Å
104	F	97.1	Very high	95	Very high	14 Å²	14	29.3 Å²	29.3	6%	0.061	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	138.1	164.1	-73.7	-81.2	0	0	0	109.8	A62 D64 I69 A71 I81 V106 L111 I125	A62-F104 HydrophobicContact CB-CD2 4.04Å; A62-F104 HydrophobicContact CB-CE2 4.05Å; D64-F104 HydrophobicContact CB-CB 4.03Å; D64-F104 HydrophobicContact CB-CD1 4.21Å; D64-F104 HydrophobicContact CB-CD2 3.94Å; D64-F104 HydrophobicContact CB-CE2 4.42Å; D64-F104 HydrophobicContact CB-CG 3.81Å; I69-F104 HydrophobicContact CD1-CD1 4.23Å; I69-F104 HydrophobicContact CD1-CE1 3.51Å; I69-F104 HydrophobicContact CD1-CZ 3.93Å; I69-F104 HydrophobicContact CG1-CE1 3.93Å; I69-F104 HydrophobicContact CG1-CZ 3.87Å; A71-F104 HydrophobicContact CB-CE2 3.73Å; A71-F104 HydrophobicContact CB-CZ 3.52Å; I81-F104 HydrophobicContact CG2-CZ 4.5Å; F104-V106 VanDerWaalsContact C-N 3.27Å; F104-V106 PolarHBondContact O-N 3.02Å; F104-V106 VanDerWaalsContact O-N 3.09Å; F104-L111 HydrophobicContact CD1-CB 4.39Å; F104-L111 HydrophobicContact CD1-CD1 4.1Å; F104-L111 HydrophobicContact CE1-CD1 3.68Å; F104-L111 HydrophobicContact CZ-CD1 3.98Å; F104-I125 HydrophobicContact CD1-CD1 4.12Å; F104-I125 HydrophobicContact CE1-CD1 3.88Å
105	L	96	Very high	95.6	Very high	21 Å²	21	24.2 Å²	24.2	11%	0.11	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	93.2	154.6	-57.4	-174.2	0	0	0	106	N107 E108 G110 V112 L122 L148 V169	L105-N107 PolarHBondContact O-N 2.74Å; L105-N107 VanDerWaalsContact O-N 3.16Å; L105-E108 HydrophobicContact CB-CB 3.75Å; L105-E108 HydrophobicContact CB-CG 4.43Å; L105-E108 WeakPolarHBondContact O-CB 3.24Å; L105-E108 PolarHBondContact O-N 3.08Å; L105-G110 PolarHBondContact N-O 3.38Å; L105-V112 HydrophobicContact CD2-CG2 4.49Å; L105-L122 HydrophobicContact CD1-CD1 4.02Å; L105-L148 HydrophobicContact CD2-CD2 3.52Å; L105-L148 HydrophobicContact CD2-CG 4.49Å; L105-V169 HydrophobicContact CD1-CG1 3.81Å; L105-V169 HydrophobicContact CD2-CG1 3.82Å; L105-V169 HydrophobicContact CG-CG1 4.49Å
106	V	94.7	Very high	96	Very high	19 Å²	19	23.2 Å²	23.2	12%	0.115	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	-50.8	119.7	-167.3	178.1	0	0	0	0	110.8	P65 V66 F104 E108 V150 P387 M1212	P65-V106 HydrophobicContact CG-CG1 4.31Å; V66-V106 HydrophobicContact CB-CG1 4.38Å; V66-V106 HydrophobicContact CG2-CG1 3.76Å; F104-V106 VanDerWaalsContact C-N 3.27Å; F104-V106 PolarHBondContact O-N 3.02Å; F104-V106 VanDerWaalsContact O-N 3.09Å; V106-E108 PolarHBondContact O-N 2.98Å; V106-E108 VanDerWaalsContact O-N 3.1Å; V106-V150 HydrophobicContact CB-CG1 4.37Å; V106-V150 HydrophobicContact CG2-CG2 4.12Å; V106-P387 HydrophobicContact CG1-CB 4.01Å; V106-M1212 HydrophobicContact CG1-CE 4.14Å; V106-M1212 HydrophobicContact CG1-SD 4.33Å
107	N	94.3	Very high	96.2	Very high	22 Å²	22	22.6 Å²	22.6	12%	0.118	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	59	13.8	-178.3	-159.1	34.2	0	0	0	115.7	D64 V66 Q67 L105 F1207 S1210 M1212	D64-N107 PolarHBondContact OD2-N 3.26Å; V66-N107 HydrophobicContact CB-CB 3.93Å; V66-N107 HydrophobicContact CG1-CB 3.82Å; V66-N107 HydrophobicContact CG2-CB 4.33Å; Q67-N107 PolarHBondContact NE2-OD1 2.76Å; L105-N107 PolarHBondContact O-N 2.74Å; L105-N107 VanDerWaalsContact O-N 3.16Å; N107-F1207 WeakPolarHBondContact O-CZ 3.12Å; N107-S1210 PolarHBondContact ND2-O 3.35Å; N107-M1212 HydrophobicContact CB-SD 3.89Å; N107-M1212 PolarHBondContact ND2-N 2.94Å
108	E	94	Very high	96.3	Very high	94 Å²	94	22.2 Å²	22.2	44%	0.439	13%	0.127	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106.2	-1.6	179.5	-65.2	179.8	-169.7	0	0	112.9	L105 V106 G110 R126	L105-E108 HydrophobicContact CB-CB 3.75Å; L105-E108 HydrophobicContact CB-CG 4.43Å; L105-E108 WeakPolarHBondContact O-CB 3.24Å; L105-E108 PolarHBondContact O-N 3.08Å; V106-E108 PolarHBondContact O-N 2.98Å; V106-E108 VanDerWaalsContact O-N 3.1Å; E108-G110 PolarHBondContact O-N 2.83Å; E108-R126 PolarHBondContact O-NE 3.47Å; E108-R126 PolarHBondContact O-NH2 3Å
109	G	92.8	Very high	96.2	Very high	2 Å²	2	21.2 Å²	21.2	2%	0.021	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	64.4	24.8	177.9	0	0	0	0	0	113.3	N124 I125 F1207	G109-N124 PolarHBondContact O-OD1 2.86Å; G109-I125 VanDerWaalsContact C-CG1 3.41Å; G109-I125 WeakPolarHBondContact O-CG1 3.45Å; G109-I125 PolarHBondContact O-N 3.41Å; G109-F1207 VanDerWaalsContact CA-CD2 3.44Å; G109-F1207 VanDerWaalsContact CA-CE2 3.42Å
110	G	94.7	Very high	96.1	Very high	7 Å²	7	21.2 Å²	21.2	7%	0.072	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	154.1	168.7	0	0	0	0	0	111.4	L105 E108 W123	L105-G110 PolarHBondContact N-O 3.38Å; E108-G110 PolarHBondContact O-N 2.83Å; G110-W123 CarbonylContact C-O 3.6Å; G110-W123 WeakPolarHBondContact CA-O 3.33Å
111	L	96.1	Very high	96.1	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	133.5	176.7	175.1	152.6	0	0	0	108.9	A71 I79 I81 I102 F103 F104 W123 I125	A71-L111 HydrophobicContact CB-CD1 3.88Å; I79-L111 HydrophobicContact CD1-CD2 4.09Å; I81-L111 HydrophobicContact CD1-CD1 4.2Å; I102-L111 HydrophobicContact CG2-CD1 3.65Å; I102-L111 HydrophobicContact CG2-CD2 3.95Å; I102-L111 HydrophobicContact CG2-CG 3.7Å; F103-L111 CarbonylContact O-C 3.59Å; F103-L111 WeakPolarHBondContact O-CA 3.3Å; F104-L111 HydrophobicContact CD1-CB 4.39Å; F104-L111 HydrophobicContact CD1-CD1 4.1Å; F104-L111 HydrophobicContact CE1-CD1 3.68Å; F104-L111 HydrophobicContact CZ-CD1 3.98Å; L111-W123 HydrophobicContact CB-CB 4.22Å; L111-W123 HydrophobicContact CD2-CB 4.3Å; L111-W123 HydrophobicContact CD2-CG 4.07Å; L111-W123 PolarHBondContact N-O 3.42Å; L111-W123 WeakPolarHBondContact O-CB 3.46Å; L111-W123 PolarHBondContact O-N 2.8Å; L111-I125 HydrophobicContact CB-CG2 4.32Å
112	V	97.4	Very high	96	Very high	0 Å²	0	16 Å²	16	0%	0	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	134.8	174	176.9	0	0	0	0	108.8	I102 F103 L105 H121 L122 L148 L155	I102-V112 CarbonylContact C-O 3.57Å; I102-V112 WeakPolarHBondContact CA-O 3.22Å; F103-V112 HydrophobicContact CB-CB 4.42Å; F103-V112 HydrophobicContact CD2-CG1 4.49Å; F103-V112 PolarHBondContact N-O 2.95Å; F103-V112 PolarHBondContact O-N 2.82Å; L105-V112 HydrophobicContact CD2-CG2 4.49Å; V112-H121 VanDerWaalsContact CA-O 3.28Å; V112-H121 WeakPolarHBondContact CA-O 3.18Å; V112-L122 HydrophobicContact CG2-CD1 3.88Å; V112-L148 HydrophobicContact CG2-CD2 4.33Å; V112-L155 HydrophobicContact CG1-CD2 3.82Å
113	S	97.6	Very high	95.9	Very high	0 Å²	0	16.2 Å²	16.2	0%	0	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	136	176.1	55.6	0	0	0	0	110.3	H93 Q101 A120 H121 W123	H93-S113 PolarHBondContact CE1-OG 2.92Å; Q101-S113 WeakPolarHBondContact O-CA 3.39Å; S113-A120 CarbonylContact O-C 3.48Å; S113-A120 WeakPolarHBondContact O-CA 3.37Å; S113-H121 PolarHBondContact N-O 3.2Å; S113-H121 PolarHBondContact O-N 3.44Å; S113-W123 PolarHBondContact OG-NE1 2.83Å
114	I	97.4	Very high	95.7	Very high	2 Å²	2	16.6 Å²	16.6	1%	0.01	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	128.1	175.4	-59.1	171.8	0	0	0	107.9	L100 Q101 F103 L143 L157	L100-I114 HydrophobicContact CB-CG2 4.45Å; L100-I114 WeakPolarHBondContact CB-O 3.5Å; L100-I114 HydrophobicContact CD1-CG2 4.41Å; L100-I114 PolarHBondContact N-O 2.75Å; Q101-I114 HydrophobicContact CB-CD1 4.39Å; Q101-I114 PolarHBondContact N-O 2.87Å; Q101-I114 PolarHBondContact O-N 3.46Å; F103-I114 HydrophobicContact CE2-CD1 3.81Å; I114-L143 HydrophobicContact CG2-CB 3.94Å; I114-L143 HydrophobicContact CG2-CD1 3.85Å; I114-L157 HydrophobicContact CD1-CD2 3.36Å; I114-L157 HydrophobicContact CG1-CD2 4.11Å
115	C	97	Very high	95.5	Very high	0 Å²	0	16 Å²	16	0%	0	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	159	-174.8	-62.9	0	0	0	0	112.4	H93 A98 D117 D118 V119	H93-C115 PolarHBondContact CE1-SG 3.38Å; H93-C115 PolarHBondContact NE2-SG 3.46Å; A98-C115 CarbonylContact O-C 3.58Å; A98-C115 VanDerWaalsContact O-CA 3.3Å; A98-C115 WeakPolarHBondContact O-CA 3.38Å; C115-D117 WeakPolarHBondContact CB-OD1 3.23Å; C115-D117 PolarHBondContact O-N 2.79Å; C115-D118 PolarHBondContact O-N 3.07Å; C115-D118 VanDerWaalsContact O-N 3.12Å; C115-V119 WeakPolarHBondContact CB-O 3.25Å; C115-V119 PolarHBondContact N-O 3.03Å
116	G	95.6	Very high	95.3	Very high	38 Å²	38	21.6 Å²	21.6	39%	0.392	11%	0.113	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-3.1	-179.1	0	0	0	0	0	115.1	A98 D118	A98-G116 PolarHBondContact O-N 3.41Å; G116-D118 VanDerWaalsContact C-N 3.29Å
117	D	95.5	Very high	94.8	Very high	41 Å²	41	25.1 Å²	25.1	22%	0.219	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.2	15.7	168.1	62.7	-13.2	0	0	0	112.2	S95 S97 C115 V119	S95-D117 WeakPolarHBondContact CB-OD2 3.47Å; S95-D117 PolarHBondContact OG-OD2 3.39Å; S97-D117 PolarHBondContact OG-N 3.17Å; C115-D117 WeakPolarHBondContact CB-OD1 3.23Å; C115-D117 PolarHBondContact O-N 2.79Å; D117-V119 PolarHBondContact O-N 2.67Å; D117-V119 PolarHBondContact OD1-N 2.86Å
118	D	96.4	Very high	94	Very high	19 Å²	19	27.9 Å²	27.9	10%	0.102	14%	0.139	C	C	.	.	S	Bend	trans	62.7	27.7	179.1	-52.2	-55.5	0	0	0	114	C115 G116 F138 H142 L143	C115-D118 PolarHBondContact O-N 3.07Å; C115-D118 VanDerWaalsContact O-N 3.12Å; G116-D118 VanDerWaalsContact C-N 3.29Å; D118-F138 HydrophobicContact CB-CB 4.12Å; D118-F138 PolarHBondContact O-N 2.84Å; D118-H142 WeakPolarHBondContact OD1-CA 3.06Å; D118-H142 IonicContact OD1-CG 3.77Å; D118-H142 IonicContact OD1-ND1 3.47Å; D118-H142 IonicContact OD2-CE1 4Å; D118-H142 PolarHBondContact OD2-CE1 3.1Å; D118-H142 IonicContact OD2-CG 3.39Å; D118-H142 IonicContact OD2-ND1 3.49Å; D118-H142 PolarHBondContact OD2-ND1 3.26Å; D118-L143 HydrophobicContact CB-CG 4.37Å; D118-L143 PolarHBondContact OD1-N 3.01Å
119	V	95.9	Very high	93.5	Very high	2 Å²	2	27.5 Å²	27.5	1%	0.012	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	129	174.2	-171.1	0	0	0	0	110.2	C115 D117 H121 L136 Q137 L1255	C115-V119 WeakPolarHBondContact CB-O 3.25Å; C115-V119 PolarHBondContact N-O 3.03Å; D117-V119 PolarHBondContact O-N 2.67Å; D117-V119 PolarHBondContact OD1-N 2.86Å; V119-H121 VanDerWaalsContact CG1-CE1 3.44Å; V119-H121 WeakPolarHBondContact CG1-CE1 3.36Å; V119-H121 WeakPolarHBondContact CG1-NE2 3.05Å; V119-L136 WeakPolarHBondContact CA-O 3.41Å; V119-Q137 HydrophobicContact CG2-CB 3.96Å; V119-Q137 HydrophobicContact CG2-CG 3.9Å; V119-L1255 HydrophobicContact CG1-CD1 4.14Å; V119-L1255 HydrophobicContact CG2-CD1 4.24Å
120	A	96.1	Very high	93.4	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	134.9	162.5	0	0	0	0	0	108.9	S113 S135 L136 F172	S113-A120 CarbonylContact O-C 3.48Å; S113-A120 WeakPolarHBondContact O-CA 3.37Å; A120-S135 CarbonylContact O-C 3.54Å; A120-S135 WeakPolarHBondContact O-CA 3.4Å; A120-L136 PolarHBondContact N-O 3.39Å; A120-L136 PolarHBondContact O-N 2.87Å; A120-F172 HydrophobicContact CB-CE1 4.36Å; A120-F172 HydrophobicContact CB-CZ 3.97Å; A120-F172 VanDerWaalsContact O-CE1 3.24Å; A120-F172 WeakPolarHBondContact O-CE1 3.29Å
121	H	95.5	Very high	93.2	Very high	5 Å²	5	31.5 Å²	31.5	2%	0.023	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	139.2	175	-60.7	-86.9	0	0	0	110.8	H93 V112 S113 V119 H134 S135	H93-H121 AromaticContact CE1-CD2 3.33Å; H93-H121 PolarHBondContact CE1-CD2 3.46Å; H93-H121 AromaticContact CE1-CG 3.89Å; H93-H121 AromaticContact ND1-CD2 3.08Å; H93-H121 PolarHBondContact ND1-CD2 3.03Å; H93-H121 AromaticContact ND1-CG 3.76Å; H93-H121 AromaticContact ND1-NE2 3.31Å; H93-H121 PolarHBondContact ND1-NE2 3.5Å; V112-H121 VanDerWaalsContact CA-O 3.28Å; V112-H121 WeakPolarHBondContact CA-O 3.18Å; S113-H121 PolarHBondContact N-O 3.2Å; S113-H121 PolarHBondContact O-N 3.44Å; V119-H121 VanDerWaalsContact CG1-CE1 3.44Å; V119-H121 WeakPolarHBondContact CG1-CE1 3.36Å; V119-H121 WeakPolarHBondContact CG1-NE2 3.05Å; H121-H134 WeakPolarHBondContact CA-O 3.4Å; H121-S135 PolarHBondContact CE1-OG 2.8Å; H121-S135 WeakPolarHBondContact ND1-CB 3.13Å; H121-S135 PolarHBondContact ND1-OG 3.05Å
122	L	96.2	Very high	93	Very high	16 Å²	16	33.3 Å²	33.3	8%	0.084	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	125.5	167.1	176.8	64	0	0	0	109.1	L105 V112 I132 V133 H134 F172	L105-L122 HydrophobicContact CD1-CD1 4.02Å; V112-L122 HydrophobicContact CG2-CD1 3.88Å; L122-I132 CarbonylContact O-C 3.48Å; L122-V133 HydrophobicContact CD2-CB 4.21Å; L122-V133 HydrophobicContact CD2-CG1 4.35Å; L122-V133 HydrophobicContact CG-CB 4.18Å; L122-V133 PolarHBondContact O-N 3.37Å; L122-H134 HydrophobicContact CB-CB 4.42Å; L122-H134 PolarHBondContact N-O 2.88Å; L122-H134 PolarHBondContact O-N 2.91Å; L122-F172 HydrophobicContact CB-CD2 3.85Å; L122-F172 HydrophobicContact CB-CE2 3.61Å; L122-F172 HydrophobicContact CB-CG 4.44Å; L122-F172 HydrophobicContact CB-CZ 3.97Å; L122-F172 HydrophobicContact CD2-CD2 4.24Å
123	W	95.5	Very high	92.8	Very high	9 Å²	9	35.5 Å²	35.5	3%	0.034	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	143.2	179.9	-60.2	85.8	0	0	0	110.7	I91 H93 G110 L111 S113 E131 I132	I91-W123 HydrophobicContact CB-CH2 4.15Å; I91-W123 HydrophobicContact CB-CZ3 3.95Å; I91-W123 HydrophobicContact CD1-CD2 3.76Å; I91-W123 HydrophobicContact CD1-CE3 3.65Å; I91-W123 HydrophobicContact CD1-CG 4.33Å; I91-W123 HydrophobicContact CD1-CH2 4.13Å; I91-W123 HydrophobicContact CD1-CZ2 4.24Å; I91-W123 HydrophobicContact CD1-CZ3 3.84Å; I91-W123 HydrophobicContact CG1-CH2 4.31Å; I91-W123 HydrophobicContact CG1-CZ3 4.27Å; I91-W123 HydrophobicContact CG2-CZ3 4.4Å; H93-W123 AromaticContact CE1-CE2 3.84Å; H93-W123 AromaticContact CE1-CZ2 3.47Å; H93-W123 VanDerWaalsContact CE1-CZ2 3.47Å; H93-W123 WeakPolarHBondContact CE1-CZ2 3.19Å; H93-W123 AromaticContact CE1-NE1 3.61Å; H93-W123 AromaticContact ND1-CZ2 3.63Å; G110-W123 CarbonylContact C-O 3.6Å; G110-W123 WeakPolarHBondContact CA-O 3.33Å; L111-W123 HydrophobicContact CB-CB 4.22Å; L111-W123 HydrophobicContact CD2-CB 4.3Å; L111-W123 HydrophobicContact CD2-CG 4.07Å; L111-W123 PolarHBondContact N-O 3.42Å; L111-W123 WeakPolarHBondContact O-CB 3.46Å; L111-W123 PolarHBondContact O-N 2.8Å; S113-W123 PolarHBondContact OG-NE1 2.83Å; W123-E131 CarbonylContact C-O 3.58Å; W123-E131 VanDerWaalsContact CA-O 3.25Å; W123-E131 WeakPolarHBondContact CA-O 3.07Å; W123-I132 HydrophobicContact CD2-CG1 3.81Å; W123-I132 HydrophobicContact CE3-CB 4.45Å; W123-I132 HydrophobicContact CE3-CG1 3.5Å; W123-I132 HydrophobicContact CH2-CD1 3.55Å; W123-I132 HydrophobicContact CH2-CG1 3.36Å; W123-I132 HydrophobicContact CZ2-CD1 3.78Å; W123-I132 HydrophobicContact CZ2-CG1 3.66Å; W123-I132 HydrophobicContact CZ3-CD1 3.99Å; W123-I132 HydrophobicContact CZ3-CG1 3.28Å
124	N	94.3	Very high	92.6	Very high	37 Å²	37	38.2 Å²	38.2	20%	0.198	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	118.6	166.6	179	-0.3	0	0	0	108.5	G109 R126 Q127 P130 E131 V133	G109-N124 PolarHBondContact O-OD1 2.86Å; N124-R126 WeakPolarHBondContact OD1-CB 3.42Å; N124-R126 PolarHBondContact OD1-N 3.35Å; N124-Q127 PolarHBondContact ND2-NE2 2.78Å; N124-P130 WeakPolarHBondContact O-CA 3.39Å; N124-P130 WeakPolarHBondContact O-CB 3.37Å; N124-E131 HydrophobicContact CB-CG 4.22Å; N124-E131 PolarHBondContact N-O 2.79Å; N124-E131 PolarHBondContact O-N 3.37Å; N124-E131 VanDerWaalsContact O-N 3.08Å; N124-V133 HydrophobicContact CB-CG2 3.64Å
125	I	93.3	Very high	92.5	Very high	3 Å²	3	38.5 Å²	38.5	2%	0.015	20%	0.196	C	C	.	.			trans	-109.1	6.6	-179.4	62.3	162.7	0	0	0	112.6	I69 I81 F104 G109 L111 Q127 P130	I69-I125 HydrophobicContact CD1-CD1 3.9Å; I81-I125 HydrophobicContact CD1-CG2 3.92Å; F104-I125 HydrophobicContact CD1-CD1 4.12Å; F104-I125 HydrophobicContact CE1-CD1 3.88Å; G109-I125 VanDerWaalsContact C-CG1 3.41Å; G109-I125 WeakPolarHBondContact O-CG1 3.45Å; G109-I125 PolarHBondContact O-N 3.41Å; L111-I125 HydrophobicContact CB-CG2 4.32Å; I125-Q127 VanDerWaalsContact C-N 3.27Å; I125-Q127 PolarHBondContact O-N 3.48Å; I125-P130 HydrophobicContact CB-CB 4.43Å; I125-P130 HydrophobicContact CG2-CB 3.85Å; I125-P130 HydrophobicContact CG2-CG 4.2Å
126	R	91	Very high	92.4	Very high	138 Å²	138	38.7 Å²	38.7	52%	0.521	20%	0.197	S	C	.	.	S	Bend	trans	-70.2	-26.8	176.5	-63.6	-176.5	177.8	-103.4	7.1	112.8	E108 N124 F1207	E108-R126 PolarHBondContact O-NE 3.47Å; E108-R126 PolarHBondContact O-NH2 3Å; N124-R126 WeakPolarHBondContact OD1-CB 3.42Å; N124-R126 PolarHBondContact OD1-N 3.35Å; R126-F1207 HydrophobicContact CB-CD1 4.44Å; R126-F1207 HydrophobicContact CG-CD1 3.95Å; R126-F1207 HydrophobicContact CG-CE1 4.23Å; R126-F1207 HydrophobicContact CG-CG 4.3Å; R126-F1207 VanDerWaalsContact NH1-CE1 3.26Å
127	Q	83.7	Confident	92.4	Very high	93 Å²	93	39.7 Å²	39.7	44%	0.435	19%	0.191	S	C	.	.	S	Bend	trans	-88.1	152.2	179	-57.5	178.4	42.6	0	0	109.5	N124 I125 N129 E131	N124-Q127 PolarHBondContact ND2-NE2 2.78Å; I125-Q127 VanDerWaalsContact C-N 3.27Å; I125-Q127 PolarHBondContact O-N 3.48Å; Q127-N129 CarbonylContact O-C 3.59Å; Q127-N129 PolarHBondContact O-N 2.74Å; Q127-N129 VanDerWaalsContact O-N 3.14Å; Q127-E131 PolarHBondContact NE2-OE1 2.99Å
128	K	79	Confident	92.4	Very high	79 Å²	79	38.2 Å²	38.2	34%	0.343	18%	0.183	S	C	.	.	S	Bend	trans	-52.3	-37.2	177.4	-71.5	-169.4	170.3	-168.8	0	113.5	R1200	K128-R1200 WeakPolarHBondContact CD-O 3.34Å; K128-R1200 PolarHBondContact NZ-O 2.98Å
129	N	82.1	Confident	92.1	Very high	87 Å²	87	43 Å²	43	47%	0.465	20%	0.203	S	C	.	.	S	Bend	trans	-104.1	111.8	170.4	-70.4	-32.6	0	0	0	108.6	Q127 Q1203	Q127-N129 CarbonylContact O-C 3.59Å; Q127-N129 PolarHBondContact O-N 2.74Å; Q127-N129 VanDerWaalsContact O-N 3.14Å; N129-Q1203 PolarHBondContact OD1-OE1 3.07Å
130	P	90.6	Very high	91.8	Very high	21 Å²	21	50.5 Å²	50.5	14%	0.136	23%	0.231	C	C	.	.			trans	-64.6	145.9	174.9	-16.5	27.7	0	0	0	111.5	I91 N124 I125	I91-P130 HydrophobicContact CG2-CB 3.86Å; I91-P130 HydrophobicContact CG2-CG 3.85Å; N124-P130 WeakPolarHBondContact O-CA 3.39Å; N124-P130 WeakPolarHBondContact O-CB 3.37Å; I125-P130 HydrophobicContact CB-CB 4.43Å; I125-P130 HydrophobicContact CG2-CB 3.85Å; I125-P130 HydrophobicContact CG2-CG 4.2Å
131	E	91	Very high	91.6	Very high	72 Å²	72	52.4 Å²	52.4	34%	0.336	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	150.8	-177.2	67.4	179.8	170.2	0	0	112.2	W123 N124 Q127 V133	W123-E131 CarbonylContact C-O 3.58Å; W123-E131 VanDerWaalsContact CA-O 3.25Å; W123-E131 WeakPolarHBondContact CA-O 3.07Å; N124-E131 HydrophobicContact CB-CG 4.22Å; N124-E131 PolarHBondContact N-O 2.79Å; N124-E131 PolarHBondContact O-N 3.37Å; N124-E131 VanDerWaalsContact O-N 3.08Å; Q127-E131 PolarHBondContact NE2-OE1 2.99Å; E131-V133 PolarHBondContact O-N 2.49Å
132	I	92.9	Very high	91.7	Very high	37 Å²	37	57.4 Å²	57.4	19%	0.19	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	118.8	172.4	-59.7	177.7	0	0	0	108.5	P94 L122 W123 H134 S135	P94-I132 HydrophobicContact CG-CD1 3.81Å; L122-I132 CarbonylContact O-C 3.48Å; W123-I132 HydrophobicContact CD2-CG1 3.81Å; W123-I132 HydrophobicContact CE3-CB 4.45Å; W123-I132 HydrophobicContact CE3-CG1 3.5Å; W123-I132 HydrophobicContact CH2-CD1 3.55Å; W123-I132 HydrophobicContact CH2-CG1 3.36Å; W123-I132 HydrophobicContact CZ2-CD1 3.78Å; W123-I132 HydrophobicContact CZ2-CG1 3.66Å; W123-I132 HydrophobicContact CZ3-CD1 3.99Å; W123-I132 HydrophobicContact CZ3-CG1 3.28Å; I132-H134 WeakPolarHBondContact CG2-O 3.35Å; I132-S135 VanDerWaalsContact CG2-OG 3.3Å; I132-S135 WeakPolarHBondContact CG2-OG 3.4Å
133	V	93.1	Very high	91.7	Very high	46 Å²	46	57 Å²	57	28%	0.279	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	-48.5	173.5	-173.6	0	0	0	0	110	L122 N124 E131 N1257	L122-V133 HydrophobicContact CD2-CB 4.21Å; L122-V133 HydrophobicContact CD2-CG1 4.35Å; L122-V133 HydrophobicContact CG-CB 4.18Å; L122-V133 PolarHBondContact O-N 3.37Å; N124-V133 HydrophobicContact CB-CG2 3.64Å; E131-V133 PolarHBondContact O-N 2.49Å; V133-N1257 PolarHBondContact O-ND2 3.36Å; V133-N1257 PolarHBondContact O-OD1 3.1Å
134	H	93.5	Very high	91.8	Very high	57 Å²	57	58.8 Å²	58.8	26%	0.264	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	152.7	-178.8	-67.8	-55.3	0	0	0	111.9	H121 L122 I132 F172 L1254	H121-H134 WeakPolarHBondContact CA-O 3.4Å; L122-H134 HydrophobicContact CB-CB 4.42Å; L122-H134 PolarHBondContact N-O 2.88Å; L122-H134 PolarHBondContact O-N 2.91Å; I132-H134 WeakPolarHBondContact CG2-O 3.35Å; H134-F172 HydrophobicContact CB-CB 3.55Å; H134-F172 HydrophobicContact CB-CD1 3.35Å; H134-F172 HydrophobicContact CB-CD2 4.44Å; H134-F172 HydrophobicContact CB-CE1 4.11Å; H134-F172 HydrophobicContact CB-CG 3.53Å; H134-L1254 HydrophobicContact CB-CD1 4.39Å
135	S	95	Very high	92	Very high	9 Å²	9	57.4 Å²	57.4	6%	0.063	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	125.2	175.9	-55.9	0	0	0	0	109.4	A120 H121 I132 L1254 L1255	A120-S135 CarbonylContact O-C 3.54Å; A120-S135 WeakPolarHBondContact O-CA 3.4Å; H121-S135 PolarHBondContact CE1-OG 2.8Å; H121-S135 WeakPolarHBondContact ND1-CB 3.13Å; H121-S135 PolarHBondContact ND1-OG 3.05Å; I132-S135 VanDerWaalsContact CG2-OG 3.3Å; I132-S135 WeakPolarHBondContact CG2-OG 3.4Å; S135-L1254 WeakPolarHBondContact O-CD1 3.49Å; S135-L1255 PolarHBondContact O-N 3.02Å
136	L	94.9	Very high	92.2	Very high	4 Å²	4	57.5 Å²	57.5	2%	0.021	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	112.7	-175.7	-176.4	71.6	0	0	0	109.2	V119 A120 F138 I167 F172 L1254	V119-L136 WeakPolarHBondContact CA-O 3.41Å; A120-L136 PolarHBondContact N-O 3.39Å; A120-L136 PolarHBondContact O-N 2.87Å; L136-F138 HydrophobicContact CD2-CE2 4.17Å; L136-F138 HydrophobicContact CG-CE2 4.46Å; L136-I167 HydrophobicContact CD2-CD1 3.63Å; L136-I167 HydrophobicContact CD2-CG1 3.79Å; L136-I167 HydrophobicContact CD2-CG2 4.09Å; L136-F172 HydrophobicContact CB-CD1 3.73Å; L136-F172 HydrophobicContact CB-CE1 3.6Å; L136-L1254 HydrophobicContact CD1-CD1 4.5Å
137	Q	95	Very high	92.4	Very high	58 Å²	58	52.7 Å²	52.7	27%	0.271	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	131.3	-179.3	-175	175.5	36.5	0	0	111.3	V119 T1252 T1253 L1255	V119-Q137 HydrophobicContact CG2-CB 3.96Å; V119-Q137 HydrophobicContact CG2-CG 3.9Å; Q137-T1252 CarbonylContact O-C 3.54Å; Q137-T1252 WeakPolarHBondContact O-CA 3.27Å; Q137-T1253 PolarHBondContact N-O 3.34Å; Q137-T1253 PolarHBondContact O-N 3.19Å; Q137-L1255 HydrophobicContact CB-CD1 4.25Å; Q137-L1255 HydrophobicContact CB-CD2 4.15Å; Q137-L1255 HydrophobicContact CB-CG 4.15Å
138	F	94.8	Very high	93	Very high	10 Å²	10	49.4 Å²	49.4	4%	0.044	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	134	168	-75.2	-109.2	0	0	0	109.8	D118 L136 L143 L157 N165 I167 T1252	D118-F138 HydrophobicContact CB-CB 4.12Å; D118-F138 PolarHBondContact O-N 2.84Å; L136-F138 HydrophobicContact CD2-CE2 4.17Å; L136-F138 HydrophobicContact CG-CE2 4.46Å; F138-L143 HydrophobicContact CB-CD2 4.46Å; F138-L143 HydrophobicContact CB-CG 4.49Å; F138-L143 HydrophobicContact CD1-CD2 4.01Å; F138-L143 HydrophobicContact CD2-CD1 3.89Å; F138-L143 HydrophobicContact CD2-CD2 3.88Å; F138-L143 HydrophobicContact CD2-CG 4.19Å; F138-L143 HydrophobicContact CE1-CD2 4.22Å; F138-L143 HydrophobicContact CE2-CD1 4.31Å; F138-L143 HydrophobicContact CE2-CD2 4.1Å; F138-L143 HydrophobicContact CG-CD1 4.46Å; F138-L143 HydrophobicContact CG-CD2 3.85Å; F138-L143 HydrophobicContact CG-CG 4.28Å; F138-L143 HydrophobicContact CZ-CD2 4.28Å; F138-L157 HydrophobicContact CE2-CD1 3.67Å; F138-L157 HydrophobicContact CZ-CD1 3.79Å; F138-N165 HydrophobicContact CE1-CB 4.03Å; F138-N165 HydrophobicContact CZ-CB 4.34Å; F138-I167 HydrophobicContact CE2-CD1 3.92Å; F138-I167 HydrophobicContact CZ-CD1 3.96Å; F138-I167 HydrophobicContact CZ-CG1 4.43Å; F138-T1252 HydrophobicContact CD1-CG2 3.6Å; F138-T1252 HydrophobicContact CD2-CG2 3.93Å; F138-T1252 HydrophobicContact CE1-CG2 3.57Å; F138-T1252 HydrophobicContact CE2-CG2 3.9Å; F138-T1252 HydrophobicContact CG-CG2 3.77Å; F138-T1252 HydrophobicContact CZ-CG2 3.72Å
139	K	90.9	Very high	93.7	Very high	121 Å²	121	46.4 Å²	46.4	53%	0.526	23%	0.225	S	C	.	.	S	Bend	trans	-111.5	-16.2	-173.1	-73.4	-176.5	169.3	170.5	0	114.9	A1251 T1253	K139-A1251 PolarHBondContact N-O 3.41Å; K139-T1253 WeakPolarHBondContact CE-OG1 3.34Å; K139-T1253 PolarHBondContact NZ-OG1 3.4Å
140	R	88.7	Confident	94.1	Very high	159 Å²	159	45 Å²	45	60%	0.6	22%	0.219	S	C	*	.	S	Bend	trans	-116.8	-20.5	-171	-65	-173.6	-175.8	174.6	4.3	114	P1249	R140-P1249 PolarHBondContact NH2-O 2.94Å
141	E	93.3	Very high	94	Very high	39 Å²	39	46.9 Å²	46.9	18%	0.182	24%	0.243	C	C	.	.	S	Bend	trans	-138.5	145.9	-175	-57.9	-172.8	175.6	0	0	108.4	T159 K161 N163	E141-T159 HydrophobicContact CB-CG2 3.93Å; E141-T159 VanDerWaalsContact OE2-CB 3.29Å; E141-T159 WeakPolarHBondContact OE2-CB 3.46Å; E141-T159 WeakPolarHBondContact OE2-CG2 3.34Å; E141-T159 PolarHBondContact OE2-OG1 2.8Å; E141-K161 HydrophobicContact CG-CB 4.46Å; E141-K161 HydrophobicContact CG-CG 4Å; E141-N163 PolarHBondContact OE1-ND2 3.04Å
142	H	96.8	Very high	94	Very high	110 Å²	110	44.2 Å²	44.2	51%	0.509	23%	0.232	S	C	.	.			trans	-89.6	134.3	177.6	-64.4	-65.9	0	0	0	110.4	D118 T159 D160	D118-H142 WeakPolarHBondContact OD1-CA 3.06Å; D118-H142 IonicContact OD1-CG 3.77Å; D118-H142 IonicContact OD1-ND1 3.47Å; D118-H142 IonicContact OD2-CE1 4Å; D118-H142 PolarHBondContact OD2-CE1 3.1Å; D118-H142 IonicContact OD2-CG 3.39Å; D118-H142 IonicContact OD2-ND1 3.49Å; D118-H142 PolarHBondContact OD2-ND1 3.26Å; H142-T159 CarbonylContact O-C 3.55Å; H142-T159 WeakPolarHBondContact O-CA 3.39Å; H142-T159 VanDerWaalsContact O-CB 3.31Å; H142-T159 WeakPolarHBondContact O-CB 3.16Å; H142-D160 HydrophobicContact CB-CB 4.06Å; H142-D160 IonicContact CD2-OD2 3.09Å; H142-D160 PolarHBondContact N-OD1 3.26Å; H142-D160 PolarHBondContact O-N 2.71Å
143	L	97.4	Very high	94	Very high	7 Å²	7	44 Å²	44	4%	0.037	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	131.6	179.2	-61.9	-178.9	0	0	0	110.2	I114 D118 F138 L157 T159	I114-L143 HydrophobicContact CG2-CB 3.94Å; I114-L143 HydrophobicContact CG2-CD1 3.85Å; D118-L143 HydrophobicContact CB-CG 4.37Å; D118-L143 PolarHBondContact OD1-N 3.01Å; F138-L143 HydrophobicContact CB-CD2 4.46Å; F138-L143 HydrophobicContact CB-CG 4.49Å; F138-L143 HydrophobicContact CD1-CD2 4.01Å; F138-L143 HydrophobicContact CD2-CD1 3.89Å; F138-L143 HydrophobicContact CD2-CD2 3.88Å; F138-L143 HydrophobicContact CD2-CG 4.19Å; F138-L143 HydrophobicContact CE1-CD2 4.22Å; F138-L143 HydrophobicContact CE2-CD1 4.31Å; F138-L143 HydrophobicContact CE2-CD2 4.1Å; F138-L143 HydrophobicContact CG-CD1 4.46Å; F138-L143 HydrophobicContact CG-CD2 3.85Å; F138-L143 HydrophobicContact CG-CG 4.28Å; F138-L143 HydrophobicContact CZ-CD2 4.28Å; L143-L157 HydrophobicContact CD1-CD1 4.02Å; L143-L157 HydrophobicContact CD2-CB 4.15Å; L143-L157 HydrophobicContact CD2-CD1 3.81Å; L143-T159 HydrophobicContact CD2-CG2 4.25Å
144	T	97.3	Very high	94.1	Very high	48 Å²	48	42 Å²	42	29%	0.294	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	-31.8	-177	56.5	0	0	0	0	114	G158 T159 D160 K195 V196	T144-G158 PolarHBondContact N-O 2.77Å; T144-G158 PolarHBondContact OG1-O 2.94Å; T144-T159 PolarHBondContact OG1-N 3.45Å; T144-D160 HydrophobicContact CG2-CB 4.12Å; T144-K195 HydrophobicContact CG2-CB 4.27Å; T144-K195 HydrophobicContact CG2-CD 4.21Å; T144-V196 WeakPolarHBondContact CB-O 3.32Å; T144-V196 PolarHBondContact OG1-O 3.38Å
145	C	97.1	Very high	94.2	Very high	8 Å²	8	39.3 Å²	39.3	5%	0.054	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.8	158.1	176.3	62.2	0	0	0	0	110.7	L157 G158 I197	C145-L157 WeakPolarHBondContact O-CA 3.46Å; C145-G158 PolarHBondContact O-N 2.74Å; C145-I197 WeakPolarHBondContact CB-O 3.41Å
146	G	97.2	Very high	94.3	Very high	5 Å²	5	38.9 Å²	38.9	5%	0.052	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	162.7	168.5	0	0	0	0	0	112.6	Q101 F103 Y156	Q101-G146 PolarHBondContact NE2-O 3.19Å; F103-G146 VanDerWaalsContact CZ-O 3.3Å; F103-G146 WeakPolarHBondContact CZ-O 3.42Å; G146-Y156 CarbonylContact C-O 3.55Å; G146-Y156 WeakPolarHBondContact CA-O 3.37Å
147	H	97.2	Very high	94.5	Very high	37 Å²	37	38.7 Å²	38.7	17%	0.171	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	128.1	165.6	-176.6	68.6	0	0	0	109.8	Y156 I199 E201	H147-Y156 HydrophobicContact CB-CD2 4.43Å; H147-Y156 AromaticContact CD2-CD2 3.87Å; H147-Y156 PolarHBondContact N-O 3.42Å; H147-Y156 PolarHBondContact O-N 3.47Å; H147-I199 HydrophobicContact CB-CB 3.9Å; H147-I199 HydrophobicContact CB-CG2 4.08Å; H147-I199 WeakPolarHBondContact CB-O 3.28Å; H147-I199 PolarHBondContact ND1-O 3.14Å; H147-E201 WeakPolarHBondContact NE2-CB 3.12Å; H147-E201 PolarHBondContact NE2-N 3.09Å
148	L	96	Very high	94.6	Very high	23 Å²	23	36 Å²	36	12%	0.12	19%	0.192	C	C	.	.			trans	-128.7	100.3	179.1	-176.7	55.7	0	0	0	109.5	F103 L105 V112 W154 L155 V169	F103-L148 HydrophobicContact CB-CB 4.18Å; F103-L148 HydrophobicContact CB-CD2 3.76Å; F103-L148 HydrophobicContact CD1-CB 3.97Å; F103-L148 HydrophobicContact CG-CB 3.99Å; F103-L148 HydrophobicContact CG-CD2 4.37Å; L105-L148 HydrophobicContact CD2-CD2 3.52Å; L105-L148 HydrophobicContact CD2-CG 4.49Å; V112-L148 HydrophobicContact CG2-CD2 4.33Å; L148-W154 WeakPolarHBondContact CD1-O 3.47Å; L148-L155 HydrophobicContact CB-CD1 3.94Å; L148-L155 HydrophobicContact CD1-CB 4.26Å; L148-V169 HydrophobicContact CD1-CG2 3.88Å
149	P	92.9	Very high	94.8	Very high	17 Å²	17	35.5 Å²	35.5	11%	0.11	19%	0.19	C	C	.	.			trans	-65.6	146.2	176.8	-14.4	25.9	0	0	0	111.3	G151 S152 Y156 E201	P149-G151 PolarHBondContact O-N 2.87Å; P149-S152 WeakPolarHBondContact O-CB 3.42Å; P149-S152 PolarHBondContact O-N 3.04Å; P149-Y156 HydrophobicContact CG-CE2 4.15Å; P149-E201 VanDerWaalsContact CB-OE2 3.26Å; P149-E201 WeakPolarHBondContact CB-OE2 3.4Å; P149-E201 WeakPolarHBondContact CG-OE2 3.08Å
150	V	91.4	Very high	95.1	Very high	57 Å²	57	31.6 Å²	31.6	35%	0.345	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.3	127	179.6	177.7	0	0	0	0	110.5	V106 S152 P387 Y388 M1212	V106-V150 HydrophobicContact CB-CG1 4.37Å; V106-V150 HydrophobicContact CG2-CG2 4.12Å; V150-S152 PolarHBondContact O-N 2.92Å; V150-P387 HydrophobicContact CG1-CB 4.24Å; V150-P387 HydrophobicContact CG2-CB 4.27Å; V150-Y388 HydrophobicContact CG1-CD1 4.5Å; V150-Y388 HydrophobicContact CG1-CE1 4.06Å; V150-M1212 HydrophobicContact CG1-CE 3.72Å
151	G	88.3	Confident	95.4	Very high	61 Å²	61	28.8 Å²	28.8	63%	0.629	17%	0.167	S	C	*	.	T	Hydrogen-bonded Turn	trans	71.6	8.4	-177.5	0	0	0	0	0	114.9	P149	P149-G151 PolarHBondContact O-N 2.87Å
152	S	90.9	Very high	95.6	Very high	15 Å²	15	26.9 Å²	26.9	11%	0.105	16%	0.158	C	C	.	.			trans	-78.6	132.4	176.1	-179.1	0	0	0	0	111.5	P149 V150 W154	P149-S152 WeakPolarHBondContact O-CB 3.42Å; P149-S152 PolarHBondContact O-N 3.04Å; V150-S152 PolarHBondContact O-N 2.92Å; S152-W154 PolarHBondContact O-N 2.73Å; S152-W154 PolarHBondContact OG-N 3.1Å; S152-W154 PolarHBondContact OG-O 3.32Å
153	S	91.5	Very high	95.6	Very high	32 Å²	32	22.1 Å²	22.1	22%	0.224	14%	0.136	C	C	.	.	S	Bend	trans	-73	3.9	167.1	-59.8	0	0	0	0	113.6	S168 V169 Q170	S153-S168 CarbonylContact O-C 3.49Å; S153-S168 WeakPolarHBondContact O-CA 3.46Å; S153-V169 PolarHBondContact O-N 3.34Å; S153-Q170 PolarHBondContact OG-NE2 2.87Å
154	W	95	Very high	95.6	Very high	5 Å²	5	21.8 Å²	21.8	2%	0.019	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	129.5	-172.5	-64.4	92.2	0	0	0	112.4	L148 S152 Y156 F166 I167 D1236 F1239	L148-W154 WeakPolarHBondContact CD1-O 3.47Å; S152-W154 PolarHBondContact O-N 2.73Å; S152-W154 PolarHBondContact OG-N 3.1Å; S152-W154 PolarHBondContact OG-O 3.32Å; W154-Y156 HydrophobicContact CB-CD1 4.44Å; W154-Y156 HydrophobicContact CB-CE1 3.76Å; W154-F166 HydrophobicContact CE3-CB 4.25Å; W154-I167 WeakPolarHBondContact CA-O 3.26Å; W154-I167 VanDerWaalsContact CE3-C 3.46Å; W154-D1236 PolarHBondContact NE1-OD1 2.63Å; W154-F1239 HydrophobicContact CB-CD2 4.36Å; W154-F1239 AromaticContact CD1-CD2 3.96Å; W154-F1239 HydrophobicContact CD2-CB 3.79Å; W154-F1239 AromaticContact CD2-CD2 3.69Å; W154-F1239 HydrophobicContact CD2-CD2 3.69Å; W154-F1239 HydrophobicContact CD2-CG 4.16Å; W154-F1239 AromaticContact CE2-CD2 3.94Å; W154-F1239 HydrophobicContact CE3-CB 3.73Å; W154-F1239 HydrophobicContact CE3-CD2 4.19Å; W154-F1239 HydrophobicContact CE3-CG 4.27Å; W154-F1239 AromaticContact CG-CD2 3.74Å; W154-F1239 HydrophobicContact CG-CD2 3.74Å; W154-F1239 HydrophobicContact CG-CE2 4.37Å; W154-F1239 VanDerWaalsContact CH2-C 3.44Å; W154-F1239 HydrophobicContact CH2-CB 3.44Å; W154-F1239 VanDerWaalsContact CH2-CB 3.44Å; W154-F1239 WeakPolarHBondContact CH2-O 2.96Å; W154-F1239 HydrophobicContact CZ2-CB 3.5Å; W154-F1239 HydrophobicContact CZ3-CB 3.57Å
155	L	96.5	Very high	95.6	Very high	1 Å²	1	20.3 Å²	20.3	1%	0.005	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	132.2	171.8	171.4	70.2	0	0	0	109.5	F103 V112 L148 L157 F166 I167 V169	F103-L155 HydrophobicContact CD2-CD1 4.35Å; F103-L155 HydrophobicContact CE2-CD1 4.3Å; V112-L155 HydrophobicContact CG1-CD2 3.82Å; L148-L155 HydrophobicContact CB-CD1 3.94Å; L148-L155 HydrophobicContact CD1-CB 4.26Å; L155-L157 HydrophobicContact CD1-CD2 4.26Å; L155-L157 HydrophobicContact CD2-CD2 3.98Å; L155-L157 HydrophobicContact CD2-CG 4.24Å; L155-L157 HydrophobicContact CG-CD2 3.98Å; L155-L157 HydrophobicContact CG-CG 4.22Å; L155-F166 CarbonylContact O-C 3.56Å; L155-F166 WeakPolarHBondContact O-CA 3.46Å; L155-I167 HydrophobicContact CB-CB 4.34Å; L155-I167 HydrophobicContact CD2-CD1 4.16Å; L155-I167 PolarHBondContact N-O 2.95Å; L155-I167 PolarHBondContact O-N 2.9Å; L155-V169 HydrophobicContact CB-CG2 4.17Å
156	Y	97.6	Very high	95.5	Very high	0 Å²	0	20 Å²	20	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	131.8	179	-46.8	-18.8	0	0	0	108.7	G146 H147 P149 W154 N165 F166 I199 I209 F1239	G146-Y156 CarbonylContact C-O 3.55Å; G146-Y156 WeakPolarHBondContact CA-O 3.37Å; H147-Y156 HydrophobicContact CB-CD2 4.43Å; H147-Y156 AromaticContact CD2-CD2 3.87Å; H147-Y156 PolarHBondContact N-O 3.42Å; H147-Y156 PolarHBondContact O-N 3.47Å; P149-Y156 HydrophobicContact CG-CE2 4.15Å; W154-Y156 HydrophobicContact CB-CD1 4.44Å; W154-Y156 HydrophobicContact CB-CE1 3.76Å; Y156-N165 CarbonylContact C-O 3.55Å; Y156-N165 WeakPolarHBondContact CA-O 3.45Å; Y156-F166 AromaticContact CD1-CD1 3.2Å; Y156-F166 HydrophobicContact CD1-CD1 3.2Å; Y156-F166 AromaticContact CD1-CE1 3.39Å; Y156-F166 HydrophobicContact CD1-CE1 3.39Å; Y156-F166 HydrophobicContact CD1-CG 4.31Å; Y156-F166 HydrophobicContact CD2-CE1 4.22Å; Y156-F166 AromaticContact CE1-CD1 3.5Å; Y156-F166 HydrophobicContact CE1-CD1 3.5Å; Y156-F166 VanDerWaalsContact CE1-CD1 3.5Å; Y156-F166 AromaticContact CE1-CE1 3.62Å; Y156-F166 HydrophobicContact CE1-CE1 3.62Å; Y156-F166 HydrophobicContact CE2-CE1 4.39Å; Y156-F166 AromaticContact CG-CD1 3.97Å; Y156-F166 HydrophobicContact CG-CD1 3.97Å; Y156-F166 AromaticContact CG-CE1 3.75Å; Y156-F166 HydrophobicContact CG-CE1 3.75Å; Y156-I199 HydrophobicContact CD2-CG2 4.04Å; Y156-I209 HydrophobicContact CE2-CG2 4.14Å; Y156-F1239 HydrophobicContact CE1-CE2 4.31Å
157	L	98	Very high	95.4	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	121.4	-177.9	-67	-171.4	0	0	0	111	I114 F138 L143 C145 L155 V164 N165 I167	I114-L157 HydrophobicContact CD1-CD2 3.36Å; I114-L157 HydrophobicContact CG1-CD2 4.11Å; F138-L157 HydrophobicContact CE2-CD1 3.67Å; F138-L157 HydrophobicContact CZ-CD1 3.79Å; L143-L157 HydrophobicContact CD1-CD1 4.02Å; L143-L157 HydrophobicContact CD2-CB 4.15Å; L143-L157 HydrophobicContact CD2-CD1 3.81Å; C145-L157 WeakPolarHBondContact O-CA 3.46Å; L155-L157 HydrophobicContact CD1-CD2 4.26Å; L155-L157 HydrophobicContact CD2-CD2 3.98Å; L155-L157 HydrophobicContact CD2-CG 4.24Å; L155-L157 HydrophobicContact CG-CD2 3.98Å; L155-L157 HydrophobicContact CG-CG 4.22Å; L157-V164 CarbonylContact O-C 3.58Å; L157-V164 WeakPolarHBondContact O-CA 3.49Å; L157-N165 PolarHBondContact N-O 3Å; L157-N165 PolarHBondContact O-N 3.5Å; L157-I167 HydrophobicContact CD1-CD1 3.24Å; L157-I167 HydrophobicContact CD1-CG1 4.44Å; L157-I167 HydrophobicContact CG-CD1 3.93Å
158	G	98.1	Very high	95.3	Very high	0 Å²	0	18 Å²	18	0%	0	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89	151	172	0	0	0	0	0	111.9	T144 C145 N163	T144-G158 PolarHBondContact N-O 2.77Å; T144-G158 PolarHBondContact OG1-O 2.94Å; C145-G158 PolarHBondContact O-N 2.74Å; G158-N163 WeakPolarHBondContact CA-O 3.03Å
159	T	97.8	Very high	95.1	Very high	0 Å²	0	17.4 Å²	17.4	0%	0	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	167.2	-176.6	70.9	0	0	0	0	114.6	E141 H142 L143 T144 K161 G162 N163 V196	E141-T159 HydrophobicContact CB-CG2 3.93Å; E141-T159 VanDerWaalsContact OE2-CB 3.29Å; E141-T159 WeakPolarHBondContact OE2-CB 3.46Å; E141-T159 WeakPolarHBondContact OE2-CG2 3.34Å; E141-T159 PolarHBondContact OE2-OG1 2.8Å; H142-T159 CarbonylContact O-C 3.55Å; H142-T159 WeakPolarHBondContact O-CA 3.39Å; H142-T159 VanDerWaalsContact O-CB 3.31Å; H142-T159 WeakPolarHBondContact O-CB 3.16Å; L143-T159 HydrophobicContact CD2-CG2 4.25Å; T144-T159 PolarHBondContact OG1-N 3.45Å; T159-K161 PolarHBondContact O-N 3.41Å; T159-G162 PolarHBondContact O-N 2.85Å; T159-N163 PolarHBondContact N-O 3.02Å; T159-N163 PolarHBondContact OG1-N 3.34Å; T159-N163 PolarHBondContact OG1-O 2.92Å; T159-V196 PolarHBondContact O-N 3.25Å
160	D	97.3	Very high	94.9	Very high	40 Å²	40	22.9 Å²	22.9	21%	0.214	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-28.4	175.2	76.2	-52.8	0	0	0	112.8	H142 T144 G162 K195	H142-D160 HydrophobicContact CB-CB 4.06Å; H142-D160 IonicContact CD2-OD2 3.09Å; H142-D160 PolarHBondContact N-OD1 3.26Å; H142-D160 PolarHBondContact O-N 2.71Å; T144-D160 HydrophobicContact CG2-CB 4.12Å; D160-G162 VanDerWaalsContact C-N 3.27Å; D160-G162 PolarHBondContact O-N 3.19Å; D160-K195 WeakPolarHBondContact O-CA 3.17Å
161	K	96.1	Very high	94.7	Very high	99 Å²	99	25.7 Å²	25.7	43%	0.43	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.9	1.1	174.8	-57.2	-51.9	-179.8	-153.9	0	114.1	E141 T159 N163 H192	E141-K161 HydrophobicContact CG-CB 4.46Å; E141-K161 HydrophobicContact CG-CG 4Å; T159-K161 PolarHBondContact O-N 3.41Å; K161-N163 VanDerWaalsContact C-N 3.33Å; K161-H192 PolarHBondContact O-NE2 2.82Å
162	G	96.7	Very high	94.9	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	11%	0.108	C	C	.	.	S	Bend	trans	81.9	7.7	179.1	0	0	0	0	0	114.6	T159 D160 W181 G194 V196 Y213	T159-G162 PolarHBondContact O-N 2.85Å; D160-G162 VanDerWaalsContact C-N 3.27Å; D160-G162 PolarHBondContact O-N 3.19Å; G162-W181 WeakPolarHBondContact O-CB 3.41Å; G162-G194 WeakPolarHBondContact CA-O 3.48Å; G162-V196 VanDerWaalsContact C-CG2 3.43Å; G162-Y213 VanDerWaalsContact O-CE1 3.31Å; G162-Y213 WeakPolarHBondContact O-CE1 3.43Å; G162-Y213 PolarHBondContact O-OH 2.84Å
163	N	97.2	Very high	95	Very high	10 Å²	10	24.2 Å²	24.2	5%	0.053	12%	0.116	C	C	.	.			trans	-89.1	153.1	179.6	-64.2	-33.9	0	0	0	111.1	E141 G158 T159 K161 V178 I179 N180 W181	E141-N163 PolarHBondContact OE1-ND2 3.04Å; G158-N163 WeakPolarHBondContact CA-O 3.03Å; T159-N163 PolarHBondContact N-O 3.02Å; T159-N163 PolarHBondContact OG1-N 3.34Å; T159-N163 PolarHBondContact OG1-O 2.92Å; K161-N163 VanDerWaalsContact C-N 3.33Å; N163-V178 HydrophobicContact CB-CG1 4.29Å; N163-I179 WeakPolarHBondContact CA-O 3.33Å; N163-N180 VanDerWaalsContact OD1-CA 3.29Å; N163-N180 WeakPolarHBondContact OD1-CA 3.12Å; N163-W181 VanDerWaalsContact OD1-CD1 3.3Å; N163-W181 PolarHBondContact OD1-N 3.3Å
164	V	97.8	Very high	95.1	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	118.7	172	-178.3	0	0	0	0	109.9	L157 F166 V178 I179 V196 I199 I211	L157-V164 CarbonylContact O-C 3.58Å; L157-V164 WeakPolarHBondContact O-CA 3.49Å; V164-F166 HydrophobicContact CG1-CE2 4.06Å; V164-F166 HydrophobicContact CG1-CZ 4.06Å; V164-V178 WeakPolarHBondContact O-CG1 3.49Å; V164-I179 HydrophobicContact CB-CB 4.2Å; V164-I179 PolarHBondContact N-O 2.92Å; V164-I179 PolarHBondContact O-N 3.21Å; V164-V196 HydrophobicContact CG2-CG1 4.49Å; V164-V196 HydrophobicContact CG2-CG2 4.25Å; V164-I199 HydrophobicContact CB-CD1 4.39Å; V164-I199 HydrophobicContact CG1-CD1 3.61Å; V164-I199 HydrophobicContact CG1-CG1 4.47Å; V164-I199 HydrophobicContact CG2-CD1 3.93Å; V164-I199 HydrophobicContact CG2-CG1 4.2Å; V164-I211 HydrophobicContact CG2-CD1 3.83Å; V164-I211 HydrophobicContact CG2-CG1 4.19Å; V164-I211 HydrophobicContact CG2-CG2 3.98Å
165	N	96.5	Very high	95	Very high	17 Å²	17	23.3 Å²	23.3	9%	0.091	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	152.3	178.6	-64.4	-86.5	0	0	0	110.2	F138 Y156 L157	F138-N165 HydrophobicContact CE1-CB 4.03Å; F138-N165 HydrophobicContact CZ-CB 4.34Å; Y156-N165 CarbonylContact C-O 3.55Å; Y156-N165 WeakPolarHBondContact CA-O 3.45Å; L157-N165 PolarHBondContact N-O 3Å; L157-N165 PolarHBondContact O-N 3.5Å
166	F	96	Very high	94.8	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	133.3	-179.1	-63	-99.4	0	0	0	109.7	W154 L155 Y156 V164 S175 Y177 I179 I209 L223 F1239	W154-F166 HydrophobicContact CE3-CB 4.25Å; L155-F166 CarbonylContact O-C 3.56Å; L155-F166 WeakPolarHBondContact O-CA 3.46Å; Y156-F166 AromaticContact CD1-CD1 3.2Å; Y156-F166 HydrophobicContact CD1-CD1 3.2Å; Y156-F166 AromaticContact CD1-CE1 3.39Å; Y156-F166 HydrophobicContact CD1-CE1 3.39Å; Y156-F166 HydrophobicContact CD1-CG 4.31Å; Y156-F166 HydrophobicContact CD2-CE1 4.22Å; Y156-F166 AromaticContact CE1-CD1 3.5Å; Y156-F166 HydrophobicContact CE1-CD1 3.5Å; Y156-F166 VanDerWaalsContact CE1-CD1 3.5Å; Y156-F166 AromaticContact CE1-CE1 3.62Å; Y156-F166 HydrophobicContact CE1-CE1 3.62Å; Y156-F166 HydrophobicContact CE2-CE1 4.39Å; Y156-F166 AromaticContact CG-CD1 3.97Å; Y156-F166 HydrophobicContact CG-CD1 3.97Å; Y156-F166 AromaticContact CG-CE1 3.75Å; Y156-F166 HydrophobicContact CG-CE1 3.75Å; V164-F166 HydrophobicContact CG1-CE2 4.06Å; V164-F166 HydrophobicContact CG1-CZ 4.06Å; F166-S175 WeakPolarHBondContact O-CB 3.5Å; F166-S175 PolarHBondContact O-N 3.34Å; F166-Y177 AromaticContact CD2-CD1 3.8Å; F166-Y177 HydrophobicContact CD2-CD1 3.8Å; F166-Y177 HydrophobicContact CD2-CE1 4.44Å; F166-Y177 WeakPolarHBondContact CD2-O 3.38Å; F166-Y177 AromaticContact CE2-CD1 3.65Å; F166-Y177 HydrophobicContact CE2-CD1 3.65Å; F166-Y177 AromaticContact CE2-CE1 3.84Å; F166-Y177 HydrophobicContact CE2-CE1 3.84Å; F166-Y177 HydrophobicContact CZ-CD1 4.33Å; F166-Y177 HydrophobicContact CZ-CE1 4.23Å; F166-I179 HydrophobicContact CE2-CD1 3.93Å; F166-I179 HydrophobicContact CE2-CG1 4Å; F166-I179 HydrophobicContact CZ-CD1 3.72Å; F166-I179 HydrophobicContact CZ-CG1 4.29Å; F166-I209 HydrophobicContact CZ-CD1 4.23Å; F166-L223 HydrophobicContact CZ-CD2 4.3Å; F166-F1239 HydrophobicContact CB-CD1 4.38Å; F166-F1239 HydrophobicContact CB-CG 4.48Å; F166-F1239 HydrophobicContact CD1-CD1 4.03Å; F166-F1239 HydrophobicContact CD1-CD2 4.29Å; F166-F1239 AromaticContact CD1-CE1 3.58Å; F166-F1239 HydrophobicContact CD1-CE1 3.58Å; F166-F1239 AromaticContact CD1-CE2 3.88Å; F166-F1239 HydrophobicContact CD1-CE2 3.88Å; F166-F1239 HydrophobicContact CD1-CG 4.36Å; F166-F1239 AromaticContact CD1-CZ 3.49Å; F166-F1239 HydrophobicContact CD1-CZ 3.49Å; F166-F1239 VanDerWaalsContact CD1-CZ 3.49Å; F166-F1239 HydrophobicContact CD2-CD1 4.41Å; F166-F1239 HydrophobicContact CD2-CE1 4.2Å; F166-F1239 HydrophobicContact CE1-CD1 4.48Å; F166-F1239 AromaticContact CE1-CE1 3.61Å; F166-F1239 HydrophobicContact CE1-CE1 3.61Å; F166-F1239 HydrophobicContact CE1-CE2 4.13Å; F166-F1239 AromaticContact CE1-CZ 3.39Å; F166-F1239 HydrophobicContact CE1-CZ 3.39Å; F166-F1239 HydrophobicContact CE2-CE1 4.21Å; F166-F1239 HydrophobicContact CG-CD1 4.02Å; F166-F1239 AromaticContact CG-CE1 3.92Å; F166-F1239 HydrophobicContact CG-CE1 3.92Å; F166-F1239 HydrophobicContact CG-CG 4.47Å; F166-F1239 HydrophobicContact CG-CZ 4.28Å; F166-F1239 AromaticContact CZ-CE1 3.94Å; F166-F1239 HydrophobicContact CZ-CE1 3.94Å; F166-F1239 HydrophobicContact CZ-CZ 4.09Å
167	I	95.4	Very high	94.7	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	130.5	179	-63.9	162.2	0	0	0	108.8	L136 F138 W154 L155 L157 V169 F172 T173	L136-I167 HydrophobicContact CD2-CD1 3.63Å; L136-I167 HydrophobicContact CD2-CG1 3.79Å; L136-I167 HydrophobicContact CD2-CG2 4.09Å; F138-I167 HydrophobicContact CE2-CD1 3.92Å; F138-I167 HydrophobicContact CZ-CD1 3.96Å; F138-I167 HydrophobicContact CZ-CG1 4.43Å; W154-I167 WeakPolarHBondContact CA-O 3.26Å; W154-I167 VanDerWaalsContact CE3-C 3.46Å; L155-I167 HydrophobicContact CB-CB 4.34Å; L155-I167 HydrophobicContact CD2-CD1 4.16Å; L155-I167 PolarHBondContact N-O 2.95Å; L155-I167 PolarHBondContact O-N 2.9Å; L157-I167 HydrophobicContact CD1-CD1 3.24Å; L157-I167 HydrophobicContact CD1-CG1 4.44Å; L157-I167 HydrophobicContact CG-CD1 3.93Å; I167-V169 PolarHBondContact O-N 3.37Å; I167-F172 HydrophobicContact CG2-CD2 4.29Å; I167-T173 WeakPolarHBondContact CA-O 3.29Å
168	S	93.6	Very high	94.5	Very high	1 Å²	1	27.2 Å²	27.2	1%	0.007	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	120	170.2	175.6	0	0	0	0	108.7	S153 Q170 R171 F172 T173	S153-S168 CarbonylContact O-C 3.49Å; S153-S168 WeakPolarHBondContact O-CA 3.46Å; S168-Q170 VanDerWaalsContact C-N 3.29Å; S168-Q170 PolarHBondContact O-N 2.99Å; S168-R171 PolarHBondContact OG-N 2.78Å; S168-F172 WeakPolarHBondContact O-CA 3.35Å; S168-F172 PolarHBondContact O-N 3.33Å; S168-T173 PolarHBondContact N-O 3.44Å
169	V	92.6	Very high	94.4	Very high	10 Å²	10	27.3 Å²	27.3	6%	0.061	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-37.5	178.5	177.2	0	0	0	0	110.9	L105 L148 S153 L155 I167	L105-V169 HydrophobicContact CD1-CG1 3.81Å; L105-V169 HydrophobicContact CD2-CG1 3.82Å; L105-V169 HydrophobicContact CG-CG1 4.49Å; L148-V169 HydrophobicContact CD1-CG2 3.88Å; S153-V169 PolarHBondContact O-N 3.34Å; L155-V169 HydrophobicContact CB-CG2 4.17Å; I167-V169 PolarHBondContact O-N 3.37Å
170	Q	88.9	Confident	94.3	Very high	132 Å²	132	30 Å²	30	62%	0.617	15%	0.151	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.4	-44.1	-179.5	-65.9	178.6	-1.9	0	0	113.2	S153 S168	S153-Q170 PolarHBondContact OG-NE2 2.87Å; S168-Q170 VanDerWaalsContact C-N 3.29Å; S168-Q170 PolarHBondContact O-N 2.99Å
171	R	88	Confident	94.1	Very high	116 Å²	116	31.8 Å²	31.8	44%	0.438	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.4	-17.4	-178.7	-69	-174.3	-76.7	-90.6	-1.5	113.5	S168 T173	S168-R171 PolarHBondContact OG-N 2.78Å; R171-T173 HydrophobicContact CB-CG2 4.33Å; R171-T173 PolarHBondContact O-N 2.71Å
172	F	92.6	Very high	93.9	Very high	1 Å²	1	31 Å²	31	0%	0.004	16%	0.156	C	C	.	.			trans	52.5	39	-173	-140.4	-108.4	0	0	0	114.2	A120 L122 H134 L136 I167 S168 L1254	A120-F172 HydrophobicContact CB-CE1 4.36Å; A120-F172 HydrophobicContact CB-CZ 3.97Å; A120-F172 VanDerWaalsContact O-CE1 3.24Å; A120-F172 WeakPolarHBondContact O-CE1 3.29Å; L122-F172 HydrophobicContact CB-CD2 3.85Å; L122-F172 HydrophobicContact CB-CE2 3.61Å; L122-F172 HydrophobicContact CB-CG 4.44Å; L122-F172 HydrophobicContact CB-CZ 3.97Å; L122-F172 HydrophobicContact CD2-CD2 4.24Å; H134-F172 HydrophobicContact CB-CB 3.55Å; H134-F172 HydrophobicContact CB-CD1 3.35Å; H134-F172 HydrophobicContact CB-CD2 4.44Å; H134-F172 HydrophobicContact CB-CE1 4.11Å; H134-F172 HydrophobicContact CB-CG 3.53Å; L136-F172 HydrophobicContact CB-CD1 3.73Å; L136-F172 HydrophobicContact CB-CE1 3.6Å; I167-F172 HydrophobicContact CG2-CD2 4.29Å; S168-F172 WeakPolarHBondContact O-CA 3.35Å; S168-F172 PolarHBondContact O-N 3.33Å; F172-L1254 HydrophobicContact CD1-CD1 4.46Å
173	T	91.8	Very high	93.6	Very high	45 Å²	45	37.8 Å²	37.8	28%	0.276	19%	0.185	S	C	.	.			trans	-118.1	143.6	180	54.5	0	0	0	0	111.5	I167 S168 R171	I167-T173 WeakPolarHBondContact CA-O 3.29Å; S168-T173 PolarHBondContact N-O 3.44Å; R171-T173 HydrophobicContact CB-CG2 4.33Å; R171-T173 PolarHBondContact O-N 2.71Å
174	T	93.3	Very high	93.3	Very high	13 Å²	13	37.3 Å²	37.3	8%	0.08	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	128.5	175.8	-41.2	0	0	0	0	111.4	G1247 T1252	T174-G1247 PolarHBondContact O-N 2.9Å; T174-G1247 VanDerWaalsContact O-N 3.11Å; T174-T1252 HydrophobicContact CG2-CG2 4.35Å; T174-T1252 WeakPolarHBondContact OG1-CB 3.14Å; T174-T1252 VanDerWaalsContact OG1-CG2 3.31Å; T174-T1252 WeakPolarHBondContact OG1-CG2 3.03Å; T174-T1252 PolarHBondContact OG1-OG1 3.33Å
175	S	93.6	Very high	92.9	Very high	4 Å²	4	37.9 Å²	37.9	3%	0.028	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.8	150.9	170.2	-176.7	0	0	0	0	111.2	F166 Y177 F1239 S1244 G1247	F166-S175 WeakPolarHBondContact O-CB 3.5Å; F166-S175 PolarHBondContact O-N 3.34Å; S175-Y177 WeakPolarHBondContact OG-CB 3.46Å; S175-Y177 PolarHBondContact OG-N 3.05Å; S175-F1239 WeakPolarHBondContact CB-O 3.48Å; S175-F1239 WeakPolarHBondContact OG-CA 3.28Å; S175-F1239 PolarHBondContact OG-O 2.93Å; S175-S1244 PolarHBondContact OG-OG 2.73Å; S175-G1247 WeakPolarHBondContact O-CA 3.19Å
176	G	92.6	Very high	92.1	Very high	27 Å²	27	40.8 Å²	40.8	28%	0.278	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	-16.2	165.6	0	0	0	0	0	113.2	S1244 G1245	G176-S1244 WeakPolarHBondContact CA-O 3.43Å; G176-G1245 WeakPolarHBondContact CA-O 3.49Å; G176-G1245 PolarHBondContact N-O 2.74Å
177	Y	94.3	Very high	91.2	Very high	25 Å²	25	48.9 Å²	48.9	10%	0.098	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	122.1	174.3	-172.3	-98.9	0	0	0	110.8	F166 S175 I179 W221 L223 K226 L1238 F1239	F166-Y177 AromaticContact CD2-CD1 3.8Å; F166-Y177 HydrophobicContact CD2-CD1 3.8Å; F166-Y177 HydrophobicContact CD2-CE1 4.44Å; F166-Y177 WeakPolarHBondContact CD2-O 3.38Å; F166-Y177 AromaticContact CE2-CD1 3.65Å; F166-Y177 HydrophobicContact CE2-CD1 3.65Å; F166-Y177 AromaticContact CE2-CE1 3.84Å; F166-Y177 HydrophobicContact CE2-CE1 3.84Å; F166-Y177 HydrophobicContact CZ-CD1 4.33Å; F166-Y177 HydrophobicContact CZ-CE1 4.23Å; S175-Y177 WeakPolarHBondContact OG-CB 3.46Å; S175-Y177 PolarHBondContact OG-N 3.05Å; Y177-I179 HydrophobicContact CE1-CD1 4.3Å; Y177-I179 HydrophobicContact CE1-CG1 3.78Å; Y177-W221 PolarHBondContact OH-NE1 3.17Å; Y177-L223 HydrophobicContact CE1-CD2 4.37Å; Y177-K226 HydrophobicContact CE2-CB 4.48Å; Y177-K226 HydrophobicContact CE2-CD 3.9Å; Y177-K226 HydrophobicContact CE2-CG 3.9Å; Y177-L1238 HydrophobicContact CE2-CD1 4.4Å; Y177-F1239 AromaticContact CD1-CD1 3.59Å; Y177-F1239 HydrophobicContact CD1-CD1 3.59Å; Y177-F1239 AromaticContact CD1-CE1 3.46Å; Y177-F1239 HydrophobicContact CD1-CE1 3.46Å; Y177-F1239 VanDerWaalsContact CD1-CE1 3.46Å; Y177-F1239 HydrophobicContact CE1-CD1 4.32Å; Y177-F1239 AromaticContact CE1-CE1 3.75Å; Y177-F1239 HydrophobicContact CE1-CE1 3.75Å; Y177-F1239 HydrophobicContact CG-CD1 4.01Å; Y177-F1239 HydrophobicContact CG-CE1 4.28Å
178	V	94.9	Very high	90.3	Very high	32 Å²	32	52.8 Å²	52.8	19%	0.194	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	129.3	177.4	-179.9	0	0	0	0	108.8	N163 V164 N180	N163-V178 HydrophobicContact CB-CG1 4.29Å; V164-V178 WeakPolarHBondContact O-CG1 3.49Å; V178-N180 PolarHBondContact O-N 3.01Å; V178-N180 PolarHBondContact O-ND2 2.79Å
179	I	95.9	Very high	89.5	Confident	2 Å²	2	55.7 Å²	55.7	1%	0.01	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	105.1	169.8	-58.9	167.1	0	0	0	106.6	N163 V164 F166 Y177 A184 I209 I211 W221 L223	N163-I179 WeakPolarHBondContact CA-O 3.33Å; V164-I179 HydrophobicContact CB-CB 4.2Å; V164-I179 PolarHBondContact N-O 2.92Å; V164-I179 PolarHBondContact O-N 3.21Å; F166-I179 HydrophobicContact CE2-CD1 3.93Å; F166-I179 HydrophobicContact CE2-CG1 4Å; F166-I179 HydrophobicContact CZ-CD1 3.72Å; F166-I179 HydrophobicContact CZ-CG1 4.29Å; Y177-I179 HydrophobicContact CE1-CD1 4.3Å; Y177-I179 HydrophobicContact CE1-CG1 3.78Å; I179-A184 HydrophobicContact CG2-CB 4.24Å; I179-I209 HydrophobicContact CD1-CD1 3.7Å; I179-I211 HydrophobicContact CD1-CD1 4.02Å; I179-I211 HydrophobicContact CG2-CD1 3.93Å; I179-W221 VanDerWaalsContact CD1-CD1 3.44Å; I179-W221 HydrophobicContact CD1-CD2 4.1Å; I179-W221 HydrophobicContact CD1-CG 3.79Å; I179-W221 HydrophobicContact CG1-CD2 4.31Å; I179-W221 HydrophobicContact CG1-CG 4.5Å; I179-W221 HydrophobicContact CG1-CZ2 4.15Å; I179-W221 HydrophobicContact CG2-CD2 3.96Å; I179-W221 HydrophobicContact CG2-CE3 3.98Å; I179-W221 HydrophobicContact CG2-CH2 4.24Å; I179-W221 HydrophobicContact CG2-CZ2 4.21Å; I179-W221 HydrophobicContact CG2-CZ3 4.14Å; I179-L223 HydrophobicContact CD1-CD2 4.48Å
180	N	94.8	Very high	88.6	Confident	56 Å²	56	61.6 Å²	61.6	30%	0.299	33%	0.326	S	S	.	.			trans	-82.2	137.1	178.8	-67.4	-93.2	0	0	0	109.5	N163 V178 N182 K183 A184	N163-N180 VanDerWaalsContact OD1-CA 3.29Å; N163-N180 WeakPolarHBondContact OD1-CA 3.12Å; V178-N180 PolarHBondContact O-N 3.01Å; V178-N180 PolarHBondContact O-ND2 2.79Å; N180-N182 WeakPolarHBondContact CB-OD1 3.17Å; N180-N182 PolarHBondContact O-N 2.66Å; N180-N182 VanDerWaalsContact O-N 3.13Å; N180-K183 PolarHBondContact O-N 3.33Å; N180-A184 PolarHBondContact O-N 2.91Å; N180-A184 VanDerWaalsContact O-N 3.09Å
181	W	94	Very high	88.5	Confident	78 Å²	78	58.5 Å²	58.5	30%	0.295	32%	0.319	S	S	.	.	H	α-helix	trans	-53.5	-37.9	-177.8	67.8	-94.7	0	0	0	112.6	G162 N163 K183 A184 I185 H192 P193	G162-W181 WeakPolarHBondContact O-CB 3.41Å; N163-W181 VanDerWaalsContact OD1-CD1 3.3Å; N163-W181 PolarHBondContact OD1-N 3.3Å; W181-K183 VanDerWaalsContact C-N 3.3Å; W181-K183 PolarHBondContact O-N 3.11Å; W181-A184 WeakPolarHBondContact O-CB 3.42Å; W181-A184 PolarHBondContact O-N 2.71Å; W181-I185 HydrophobicContact CE3-CD1 3.7Å; W181-I185 HydrophobicContact CE3-CG1 4.26Å; W181-I185 HydrophobicContact CZ3-CD1 3.51Å; W181-I185 HydrophobicContact CZ3-CG1 4.42Å; W181-I185 WeakPolarHBondContact O-CG1 3.41Å; W181-I185 PolarHBondContact O-N 2.92Å; W181-H192 AromaticContact CD1-NE2 3.9Å; W181-H192 AromaticContact CD2-CD2 3.67Å; W181-H192 AromaticContact CD2-NE2 3.82Å; W181-H192 AromaticContact CE2-CD2 3.53Å; W181-H192 AromaticContact CE2-NE2 3.77Å; W181-H192 AromaticContact CE3-CD2 3.9Å; W181-H192 AromaticContact CG-NE2 3.94Å; W181-H192 AromaticContact CH2-CD2 3.9Å; W181-H192 AromaticContact CZ2-CD2 3.67Å; W181-H192 AromaticContact CZ3-CD2 4Å; W181-H192 AromaticContact NE1-NE2 3.8Å; W181-P193 HydrophobicContact CB-CG 4.13Å; W181-P193 VanDerWaalsContact CE3-CD 3.47Å; W181-P193 HydrophobicContact CE3-CG 4.19Å
182	N	91.4	Very high	88.8	Confident	83 Å²	83	56.9 Å²	56.9	44%	0.444	32%	0.316	S	S	.	.	H	α-helix	trans	-71.8	-20	-178.3	66.3	-21.7	0	0	0	113.9	N180	N180-N182 WeakPolarHBondContact CB-OD1 3.17Å; N180-N182 PolarHBondContact O-N 2.66Å; N180-N182 VanDerWaalsContact O-N 3.13Å
183	K	91.3	Very high	88.9	Confident	141 Å²	141	57 Å²	57	61%	0.613	32%	0.317	S	S	*	.	H	α-helix	trans	-88.4	-28.6	170	-67.4	-173.6	179.3	-179.1	0	111.9	N180 W181 W221	N180-K183 PolarHBondContact O-N 3.33Å; W181-K183 VanDerWaalsContact C-N 3.3Å; W181-K183 PolarHBondContact O-N 3.11Å; K183-W221 HydrophobicContact CB-CH2 4.35Å
184	A	90.5	Very high	89.1	Confident	0 Å²	0	55.6 Å²	55.6	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-70.6	-45.9	177.4	0	0	0	0	0	111.8	I179 N180 W181 V219 W221 R231	I179-A184 HydrophobicContact CG2-CB 4.24Å; N180-A184 PolarHBondContact O-N 2.91Å; N180-A184 VanDerWaalsContact O-N 3.09Å; W181-A184 WeakPolarHBondContact O-CB 3.42Å; W181-A184 PolarHBondContact O-N 2.71Å; A184-V219 HydrophobicContact CB-CG1 4.03Å; A184-W221 HydrophobicContact CB-CE3 4.46Å; A184-W221 HydrophobicContact CB-CZ3 4.39Å; A184-R231 PolarHBondContact O-NE 3.41Å; A184-R231 PolarHBondContact O-NH2 3.41Å
185	I	88.3	Confident	89.3	Confident	13 Å²	13	59.8 Å²	59.8	7%	0.067	33%	0.328	C	S	.	.	S	Bend	trans	-75.3	158	174.5	72.4	172.5	0	0	0	111.2	W181 Q189 P193 F217	W181-I185 HydrophobicContact CE3-CD1 3.7Å; W181-I185 HydrophobicContact CE3-CG1 4.26Å; W181-I185 HydrophobicContact CZ3-CD1 3.51Å; W181-I185 HydrophobicContact CZ3-CG1 4.42Å; W181-I185 WeakPolarHBondContact O-CG1 3.41Å; W181-I185 PolarHBondContact O-N 2.92Å; I185-Q189 HydrophobicContact CD1-CB 4.23Å; I185-P193 HydrophobicContact CG2-CB 3.96Å; I185-P193 HydrophobicContact CG2-CG 3.76Å; I185-F217 HydrophobicContact CB-CE1 4.29Å; I185-F217 HydrophobicContact CB-CZ 4.41Å; I185-F217 HydrophobicContact CG2-CD1 4.06Å; I185-F217 HydrophobicContact CG2-CE1 3.67Å; I185-F217 HydrophobicContact CG2-CZ 4.22Å
186	D	81.3	Confident	89.5	Confident	77 Å²	77	59.6 Å²	59.6	41%	0.412	33%	0.327	S	S	.	.			trans	-75.6	145.9	171.8	-173.4	14.6	0	0	0	110.1	S188 Q189	D186-S188 PolarHBondContact O-N 2.99Å; D186-S188 VanDerWaalsContact O-N 3.08Å; D186-S188 PolarHBondContact OD2-OG 3.22Å; D186-Q189 PolarHBondContact O-N 3.41Å
187	L	76.3	Confident	89.7	Confident	170 Å²	170	60.1 Å²	60.1	89%	0.89	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-20.8	177.8	-74.3	165.5	0	0	0	112.2	Q189	L187-Q189 PolarHBondContact O-N 3.45Å
188	S	76.3	Confident	89.9	Confident	83 Å²	83	61.7 Å²	61.7	58%	0.58	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.7	-19	174.1	66.4	0	0	0	0	113.9	D186	D186-S188 PolarHBondContact O-N 2.99Å; D186-S188 VanDerWaalsContact O-N 3.08Å; D186-S188 PolarHBondContact OD2-OG 3.22Å
189	Q	76.4	Confident	90.1	Very high	62 Å²	62	60.3 Å²	60.3	29%	0.29	32%	0.323	S	S	.	.			trans	-87.6	115.8	177.9	-64.8	-65.3	-65.6	0	0	110.7	I185 D186 L187	I185-Q189 HydrophobicContact CD1-CB 4.23Å; D186-Q189 PolarHBondContact O-N 3.41Å; L187-Q189 PolarHBondContact O-N 3.45Å
190	S	74.4	Confident	90.1	Very high	133 Å²	133	60.7 Å²	60.7	93%	0.93	33%	0.326	S	S	*	.			trans	-81.8	-12.8	178.6	58.6	0	0	0	0	114.6
191	S	87.1	Confident	90.1	Very high	68 Å²	68	59.2 Å²	59.2	48%	0.476	32%	0.317	S	S	.	.	S	Bend	trans	-107	140.9	-174.1	61.6	0	0	0	0	112.3
192	H	93.3	Very high	90.2	Very high	82 Å²	82	55.8 Å²	55.8	38%	0.38	31%	0.305	S	S	.	.			trans	-63.3	133.9	175.7	-174	-87	0	0	0	110.4	K161 W181 G194	K161-H192 PolarHBondContact O-NE2 2.82Å; W181-H192 AromaticContact CD1-NE2 3.9Å; W181-H192 AromaticContact CD2-CD2 3.67Å; W181-H192 AromaticContact CD2-NE2 3.82Å; W181-H192 AromaticContact CE2-CD2 3.53Å; W181-H192 AromaticContact CE2-NE2 3.77Å; W181-H192 AromaticContact CE3-CD2 3.9Å; W181-H192 AromaticContact CG-NE2 3.94Å; W181-H192 AromaticContact CH2-CD2 3.9Å; W181-H192 AromaticContact CZ2-CD2 3.67Å; W181-H192 AromaticContact CZ3-CD2 4Å; W181-H192 AromaticContact NE1-NE2 3.8Å; H192-G194 PolarHBondContact CE1-O 3.14Å; H192-G194 WeakPolarHBondContact ND1-CA 3.35Å; H192-G194 PolarHBondContact ND1-N 3.42Å; H192-G194 PolarHBondContact O-N 2.79Å
193	P	94.7	Very high	90.2	Very high	4 Å²	4	52.8 Å²	52.8	3%	0.026	29%	0.29	C	S	.	.			trans	-71.8	-14.9	-175.1	30.7	-37.1	0	0	0	113.3	W181 I185 Y213 S215 F217	W181-P193 HydrophobicContact CB-CG 4.13Å; W181-P193 VanDerWaalsContact CE3-CD 3.47Å; W181-P193 HydrophobicContact CE3-CG 4.19Å; I185-P193 HydrophobicContact CG2-CB 3.96Å; I185-P193 HydrophobicContact CG2-CG 3.76Å; P193-Y213 HydrophobicContact CB-CD1 3.91Å; P193-Y213 HydrophobicContact CB-CD2 4.01Å; P193-Y213 HydrophobicContact CB-CE1 4.36Å; P193-Y213 HydrophobicContact CB-CE2 4.45Å; P193-Y213 HydrophobicContact CB-CG 3.72Å; P193-Y213 HydrophobicContact CG-CD1 3.89Å; P193-Y213 HydrophobicContact CG-CE1 3.94Å; P193-Y213 HydrophobicContact CG-CG 4.2Å; P193-Y213 VanDerWaalsContact O-CB 3.27Å; P193-Y213 WeakPolarHBondContact O-CB 3.47Å; P193-S215 WeakPolarHBondContact O-CB 3.48Å; P193-S215 PolarHBondContact O-N 3.01Å; P193-S215 PolarHBondContact O-OG 3.49Å; P193-F217 HydrophobicContact CB-CB 4.33Å; P193-F217 HydrophobicContact CB-CD1 4.34Å
194	G	95.8	Very high	90.2	Very high	14 Å²	14	50.3 Å²	50.3	14%	0.144	28%	0.281	C	S	.	.			trans	99.5	-168.9	-179.6	0	0	0	0	0	112.4	G162 H192	G162-G194 WeakPolarHBondContact CA-O 3.48Å; H192-G194 PolarHBondContact CE1-O 3.14Å; H192-G194 WeakPolarHBondContact ND1-CA 3.35Å; H192-G194 PolarHBondContact ND1-N 3.42Å; H192-G194 PolarHBondContact O-N 2.79Å
195	K	97.4	Very high	90.3	Very high	101 Å²	101	51.9 Å²	51.9	44%	0.439	29%	0.289	S	S	.	.	S	Bend	trans	-70.5	151.5	178.4	61.5	178.1	-179.9	178.3	0	111.2	T144 D160 I197 Y213 S214	T144-K195 HydrophobicContact CG2-CB 4.27Å; T144-K195 HydrophobicContact CG2-CD 4.21Å; D160-K195 WeakPolarHBondContact O-CA 3.17Å; K195-I197 HydrophobicContact CD-CD1 4.33Å; K195-I197 HydrophobicContact CG-CD1 4.03Å; K195-I197 PolarHBondContact O-N 3.45Å; K195-Y213 WeakPolarHBondContact O-CA 3.34Å; K195-S214 PolarHBondContact N-OG 2.88Å; K195-S214 PolarHBondContact O-N 3.09Å
196	V	98.4	Very high	90.3	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	124.2	171.2	-169.8	0	0	0	0	108.5	T144 T159 G162 V164 I199 I211 Y213	T144-V196 WeakPolarHBondContact CB-O 3.32Å; T144-V196 PolarHBondContact OG1-O 3.38Å; T159-V196 PolarHBondContact O-N 3.25Å; G162-V196 VanDerWaalsContact C-CG2 3.43Å; V164-V196 HydrophobicContact CG2-CG1 4.49Å; V164-V196 HydrophobicContact CG2-CG2 4.25Å; V196-I199 HydrophobicContact CG1-CD1 4.36Å; V196-I199 HydrophobicContact CG1-CG1 3.89Å; V196-I211 HydrophobicContact CG1-CG2 3.87Å; V196-I211 HydrophobicContact CG2-CG2 4.49Å; V196-Y213 HydrophobicContact CG2-CD1 4.4Å; V196-Y213 HydrophobicContact CG2-CE1 4.08Å
197	I	97.7	Very high	90.8	Very high	39 Å²	39	49.2 Å²	49.2	20%	0.2	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	-44.6	178.8	-66.4	-62.9	0	0	0	110.7	C145 K195 G212 Y239	C145-I197 WeakPolarHBondContact CB-O 3.41Å; K195-I197 HydrophobicContact CD-CD1 4.33Å; K195-I197 HydrophobicContact CG-CD1 4.03Å; K195-I197 PolarHBondContact O-N 3.45Å; I197-G212 PolarHBondContact N-O 2.94Å; I197-Y239 WeakPolarHBondContact CG2-O 3.29Å
198	Q	97.9	Very high	91.7	Very high	58 Å²	58	42.3 Å²	42.3	27%	0.271	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.4	144.8	-178.4	-165.6	170.1	-4.5	0	0	110.8	G212 S240 V241	Q198-G212 PolarHBondContact N-O 2.83Å; Q198-G212 PolarHBondContact O-N 2.95Å; Q198-S240 PolarHBondContact OE1-OG 2.97Å; Q198-V241 VanDerWaalsContact CD-O 3.28Å; Q198-V241 PolarHBondContact NE2-O 3.05Å; Q198-V241 PolarHBondContact OE1-O 3.26Å
199	I	98.1	Very high	92.7	Very high	2 Å²	2	38.4 Å²	38.4	1%	0.01	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	133.1	170.5	-58.5	158	0	0	0	106.7	H147 Y156 V164 V196 L210	H147-I199 HydrophobicContact CB-CB 3.9Å; H147-I199 HydrophobicContact CB-CG2 4.08Å; H147-I199 WeakPolarHBondContact CB-O 3.28Å; H147-I199 PolarHBondContact ND1-O 3.14Å; Y156-I199 HydrophobicContact CD2-CG2 4.04Å; V164-I199 HydrophobicContact CB-CD1 4.39Å; V164-I199 HydrophobicContact CG1-CD1 3.61Å; V164-I199 HydrophobicContact CG1-CG1 4.47Å; V164-I199 HydrophobicContact CG2-CD1 3.93Å; V164-I199 HydrophobicContact CG2-CG1 4.2Å; V196-I199 HydrophobicContact CG1-CD1 4.36Å; V196-I199 HydrophobicContact CG1-CG1 3.89Å; I199-L210 WeakPolarHBondContact CA-O 3.19Å
200	A	96.6	Very high	93.7	Very high	10 Å²	10	35.5 Å²	35.5	8%	0.083	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	119.1	-178.9	0	0	0	0	0	111.4	L210 W243	A200-L210 PolarHBondContact N-O 3.44Å; A200-L210 PolarHBondContact O-N 2.81Å; A200-W243 PolarHBondContact O-NE1 3.44Å; A200-W243 VanDerWaalsContact O-NE1 3.13Å
201	E	95.2	Very high	94.9	Very high	25 Å²	25	29.1 Å²	29.1	12%	0.117	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	139.1	172.9	-175.7	173.7	157.2	0	0	111.4	H147 P149 S206 I209 W243 R1235	H147-E201 WeakPolarHBondContact NE2-CB 3.12Å; H147-E201 PolarHBondContact NE2-N 3.09Å; P149-E201 VanDerWaalsContact CB-OE2 3.26Å; P149-E201 WeakPolarHBondContact CB-OE2 3.4Å; P149-E201 WeakPolarHBondContact CG-OE2 3.08Å; E201-S206 WeakPolarHBondContact OE1-CA 3.49Å; E201-S206 WeakPolarHBondContact OE1-CB 3.42Å; E201-I209 HydrophobicContact CB-CG2 4.5Å; E201-W243 PolarHBondContact O-NE1 2.91Å; E201-R1235 IonicContact OE1-CZ 3.06Å; E201-R1235 IonicContact OE1-NH1 3.4Å; E201-R1235 IonicContact OE1-NH2 3.13Å; E201-R1235 PolarHBondContact OE1-NH2 3.37Å; E201-R1235 IonicContact OE2-CZ 3.64Å; E201-R1235 IonicContact OE2-NH1 2.75Å; E201-R1235 PolarHBondContact OE2-NH1 2.97Å; E201-R1235 IonicContact OE2-NH2 3.73Å; E201-R1235 PolarHBondContact OE2-NH2 3.32Å
202	N	95.7	Very high	95.4	Very high	7 Å²	7	25.9 Å²	25.9	4%	0.037	13%	0.132	C	C	.	.			trans	-67.4	125	173.9	-177.6	-54.1	0	0	0	109.7	Q204 D205 K208 W243 G247	N202-Q204 PolarHBondContact O-N 2.88Å; N202-Q204 VanDerWaalsContact O-N 3.14Å; N202-Q204 PolarHBondContact OD1-N 3.32Å; N202-D205 WeakPolarHBondContact CB-O 3.38Å; N202-D205 CarbonylContact O-C 3.57Å; N202-D205 PolarHBondContact O-N 3.13Å; N202-D205 PolarHBondContact OD1-N 3.35Å; N202-D205 VanDerWaalsContact OD1-N 3.09Å; N202-K208 HydrophobicContact CB-CB 4.02Å; N202-K208 WeakPolarHBondContact CB-O 3.42Å; N202-K208 PolarHBondContact N-O 3.34Å; N202-W243 HydrophobicContact CB-CH2 4.4Å; N202-W243 HydrophobicContact CB-CZ2 3.98Å; N202-W243 WeakPolarHBondContact ND2-CH2 3.4Å; N202-G247 PolarHBondContact ND2-O 2.69Å; N202-G247 WeakPolarHBondContact OD1-CA 3.29Å
203	P	92.4	Very high	95.6	Very high	20 Å²	20	22 Å²	22	13%	0.13	11%	0.114	C	C	.	.	S	Bend	trans	-64.9	-21.9	-173.1	23.9	-33.7	0	0	0	114	W243 H244 W245 I389 S390	P203-W243 HydrophobicContact CG-CB 4Å; P203-W243 HydrophobicContact CG-CG 4.45Å; P203-H244 WeakPolarHBondContact CG-O 3.22Å; P203-W245 WeakPolarHBondContact CG-O 3.38Å; P203-I389 HydrophobicContact CB-CD1 4.04Å; P203-I389 HydrophobicContact CB-CG1 4.06Å; P203-S390 WeakPolarHBondContact O-CB 3.3Å
204	Q	90.9	Very high	95.7	Very high	89 Å²	89	23.4 Å²	23.4	42%	0.416	12%	0.124	S	C	.	.	S	Bend	trans	-106.7	-17.7	-179.9	-61.4	-60.4	-41.6	0	0	113.6	N202 W245 D246 S390	N202-Q204 PolarHBondContact O-N 2.88Å; N202-Q204 VanDerWaalsContact O-N 3.14Å; N202-Q204 PolarHBondContact OD1-N 3.32Å; Q204-W245 WeakPolarHBondContact CG-O 3.2Å; Q204-W245 PolarHBondContact NE2-O 2.73Å; Q204-D246 VanDerWaalsContact CG-O 3.27Å; Q204-D246 WeakPolarHBondContact CG-O 3.42Å; Q204-S390 PolarHBondContact NE2-O 2.97Å
205	D	91	Very high	95.7	Very high	33 Å²	33	25 Å²	25	18%	0.176	13%	0.132	C	C	.	.			trans	-133.5	95.5	178.7	-172.1	-3.9	0	0	0	111.4	N202 N207 K208	N202-D205 WeakPolarHBondContact CB-O 3.38Å; N202-D205 CarbonylContact O-C 3.57Å; N202-D205 PolarHBondContact O-N 3.13Å; N202-D205 PolarHBondContact OD1-N 3.35Å; N202-D205 VanDerWaalsContact OD1-N 3.09Å; D205-N207 PolarHBondContact O-N 2.76Å; D205-N207 VanDerWaalsContact OD1-CB 3.27Å; D205-N207 WeakPolarHBondContact OD1-CB 3.46Å; D205-N207 PolarHBondContact OD1-N 2.92Å; D205-N207 PolarHBondContact OD1-ND2 3.16Å; D205-K208 HydrophobicContact CB-CB 4.48Å; D205-K208 HydrophobicContact CB-CG 4.15Å; D205-K208 PolarHBondContact O-N 2.91Å; D205-K208 VanDerWaalsContact OD2-CG 3.28Å; D205-K208 WeakPolarHBondContact OD2-CG 3.48Å
206	S	88.9	Confident	95.5	Very high	25 Å²	25	20.2 Å²	20.2	18%	0.175	11%	0.112	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-10	179.7	59.8	0	0	0	0	114.4	E201 K208 R1235	E201-S206 WeakPolarHBondContact OE1-CA 3.49Å; E201-S206 WeakPolarHBondContact OE1-CB 3.42Å; S206-K208 VanDerWaalsContact C-N 3.34Å; S206-R1235 PolarHBondContact O-NH2 3.24Å
207	N	92.5	Very high	95.4	Very high	8 Å²	8	20.8 Å²	20.8	4%	0.043	11%	0.114	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85	-11.7	175.3	-54.9	-35.9	0	0	0	112.2	D205 L223 S1231 L1233	D205-N207 PolarHBondContact O-N 2.76Å; D205-N207 VanDerWaalsContact OD1-CB 3.27Å; D205-N207 WeakPolarHBondContact OD1-CB 3.46Å; D205-N207 PolarHBondContact OD1-N 2.92Å; D205-N207 PolarHBondContact OD1-ND2 3.16Å; N207-L223 WeakPolarHBondContact O-CB 3.38Å; N207-L223 WeakPolarHBondContact O-CG 3.21Å; N207-L223 PolarHBondContact O-N 2.93Å; N207-S1231 PolarHBondContact ND2-O 3.32Å; N207-L1233 WeakPolarHBondContact OD1-CB 3.18Å; N207-L1233 PolarHBondContact OD1-N 3.3Å
208	K	95.2	Very high	95.4	Very high	26 Å²	26	18.9 Å²	18.9	11%	0.113	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	128.3	-175.9	-57.7	-73.3	-177.1	168.9	0	109.9	N202 D205 S206 L220 W221 D222 D229	N202-K208 HydrophobicContact CB-CB 4.02Å; N202-K208 WeakPolarHBondContact CB-O 3.42Å; N202-K208 PolarHBondContact N-O 3.34Å; D205-K208 HydrophobicContact CB-CB 4.48Å; D205-K208 HydrophobicContact CB-CG 4.15Å; D205-K208 PolarHBondContact O-N 2.91Å; D205-K208 VanDerWaalsContact OD2-CG 3.28Å; D205-K208 WeakPolarHBondContact OD2-CG 3.48Å; S206-K208 VanDerWaalsContact C-N 3.34Å; K208-L220 HydrophobicContact CB-CD1 4.03Å; K208-W221 WeakPolarHBondContact CA-O 3.45Å; K208-D222 HydrophobicContact CD-CB 3.82Å; K208-D222 WeakPolarHBondContact CE-OD2 3.3Å; K208-D222 VanDerWaalsContact NZ-CG 3.31Å; K208-D222 IonicContact NZ-OD2 2.54Å; K208-D222 PolarHBondContact NZ-OD2 3.09Å; K208-D229 IonicContact NZ-OD1 2.74Å; K208-D229 IonicContact NZ-OD2 2.87Å; K208-D229 PolarHBondContact NZ-OD2 2.84Å
209	I	96.7	Very high	95.3	Very high	0 Å²	0	16.1 Å²	16.1	0%	0	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	141.7	173.9	65.8	173.6	0	0	0	109.7	Y156 F166 I179 E201 I211 L220 W221 L223	Y156-I209 HydrophobicContact CE2-CG2 4.14Å; F166-I209 HydrophobicContact CZ-CD1 4.23Å; I179-I209 HydrophobicContact CD1-CD1 3.7Å; E201-I209 HydrophobicContact CB-CG2 4.5Å; I209-I211 HydrophobicContact CD1-CD1 4.41Å; I209-I211 HydrophobicContact CD1-CG1 4.44Å; I209-L220 CarbonylContact O-C 3.55Å; I209-W221 HydrophobicContact CG1-CB 3.92Å; I209-W221 PolarHBondContact N-O 3.35Å; I209-W221 PolarHBondContact O-N 2.91Å; I209-L223 HydrophobicContact CD1-CD2 4.11Å; I209-L223 HydrophobicContact CG2-CD1 4.04Å; I209-L223 HydrophobicContact CG2-CG 4.49Å
210	L	98.1	Very high	95.3	Very high	1 Å²	1	16.1 Å²	16.1	1%	0.005	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	127	174.5	-171	58.8	0	0	0	108.8	I199 A200 L218 V219 L220 F232 V241 W243 F250	I199-L210 WeakPolarHBondContact CA-O 3.19Å; A200-L210 PolarHBondContact N-O 3.44Å; A200-L210 PolarHBondContact O-N 2.81Å; L210-L218 HydrophobicContact CD1-CB 4.07Å; L210-L218 HydrophobicContact CD1-CD2 4.44Å; L210-L218 HydrophobicContact CD2-CD2 4.33Å; L210-L218 HydrophobicContact CG-CD2 4.35Å; L210-V219 WeakPolarHBondContact CA-O 3.47Å; L210-V219 WeakPolarHBondContact CD1-O 3.25Å; L210-L220 HydrophobicContact CD1-CB 4.46Å; L210-F232 HydrophobicContact CD1-CD2 4.39Å; L210-F232 HydrophobicContact CD1-CE2 4.3Å; L210-V241 HydrophobicContact CD2-CG1 3.47Å; L210-V241 VanDerWaalsContact CD2-CG1 3.47Å; L210-V241 HydrophobicContact CG-CG1 4.29Å; L210-W243 HydrophobicContact CB-CZ2 3.77Å; L210-W243 HydrophobicContact CD2-CZ2 3.96Å; L210-W243 HydrophobicContact CG-CZ2 4.42Å; L210-F250 HydrophobicContact CD1-CZ 4.4Å; L210-F250 HydrophobicContact CD2-CB 4.26Å; L210-F250 HydrophobicContact CD2-CD1 3.87Å; L210-F250 HydrophobicContact CD2-CD2 3.68Å; L210-F250 HydrophobicContact CD2-CE1 4.08Å; L210-F250 HydrophobicContact CD2-CE2 3.9Å; L210-F250 HydrophobicContact CD2-CG 3.66Å; L210-F250 HydrophobicContact CD2-CZ 4.09Å
211	I	98.3	Very high	95.3	Very high	0 Å²	0	16 Å²	16	0%	0	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	117.9	176.6	-53.7	167.3	0	0	0	107.2	V164 I179 V196 I209 Y213 L218 V219 W221	V164-I211 HydrophobicContact CG2-CD1 3.83Å; V164-I211 HydrophobicContact CG2-CG1 4.19Å; V164-I211 HydrophobicContact CG2-CG2 3.98Å; I179-I211 HydrophobicContact CD1-CD1 4.02Å; I179-I211 HydrophobicContact CG2-CD1 3.93Å; V196-I211 HydrophobicContact CG1-CG2 3.87Å; V196-I211 HydrophobicContact CG2-CG2 4.49Å; I209-I211 HydrophobicContact CD1-CD1 4.41Å; I209-I211 HydrophobicContact CD1-CG1 4.44Å; I211-Y213 HydrophobicContact CB-CE2 4.4Å; I211-Y213 HydrophobicContact CG2-CE1 4.19Å; I211-Y213 HydrophobicContact CG2-CE2 3.87Å; I211-L218 CarbonylContact O-C 3.54Å; I211-L218 VanDerWaalsContact O-CA 3.23Å; I211-L218 WeakPolarHBondContact O-CA 3.48Å; I211-V219 HydrophobicContact CB-CG1 3.76Å; I211-V219 HydrophobicContact CD1-CG1 4.11Å; I211-V219 HydrophobicContact CG1-CG1 4.29Å; I211-V219 PolarHBondContact N-O 2.83Å; I211-V219 PolarHBondContact O-N 2.84Å; I211-W221 HydrophobicContact CD1-CB 4.3Å
212	G	97.9	Very high	95.3	Very high	0 Å²	0	15.6 Å²	15.6	0%	0	9%	0.087	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	134.5	177.5	0	0	0	0	0	112	I197 Q198 L238	I197-G212 PolarHBondContact N-O 2.94Å; Q198-G212 PolarHBondContact N-O 2.83Å; Q198-G212 PolarHBondContact O-N 2.95Å; G212-L238 VanDerWaalsContact CA-CD2 3.49Å
213	Y	98	Very high	95.2	Very high	0 Å²	0	15.2 Å²	15.2	0%	0	9%	0.086	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	154.8	-178.4	-59.7	-88.3	0	0	0	112.6	G162 P193 K195 V196 I211 S215 G216 F217 V219 L238	G162-Y213 VanDerWaalsContact O-CE1 3.31Å; G162-Y213 WeakPolarHBondContact O-CE1 3.43Å; G162-Y213 PolarHBondContact O-OH 2.84Å; P193-Y213 HydrophobicContact CB-CD1 3.91Å; P193-Y213 HydrophobicContact CB-CD2 4.01Å; P193-Y213 HydrophobicContact CB-CE1 4.36Å; P193-Y213 HydrophobicContact CB-CE2 4.45Å; P193-Y213 HydrophobicContact CB-CG 3.72Å; P193-Y213 HydrophobicContact CG-CD1 3.89Å; P193-Y213 HydrophobicContact CG-CE1 3.94Å; P193-Y213 HydrophobicContact CG-CG 4.2Å; P193-Y213 VanDerWaalsContact O-CB 3.27Å; P193-Y213 WeakPolarHBondContact O-CB 3.47Å; K195-Y213 WeakPolarHBondContact O-CA 3.34Å; V196-Y213 HydrophobicContact CG2-CD1 4.4Å; V196-Y213 HydrophobicContact CG2-CE1 4.08Å; I211-Y213 HydrophobicContact CB-CE2 4.4Å; I211-Y213 HydrophobicContact CG2-CE1 4.19Å; I211-Y213 HydrophobicContact CG2-CE2 3.87Å; Y213-S215 PolarHBondContact O-N 2.66Å; Y213-G216 PolarHBondContact O-N 2.98Å; Y213-F217 WeakPolarHBondContact CB-O 3.13Å; Y213-F217 HydrophobicContact CD2-CB 4.39Å; Y213-F217 AromaticContact CD2-CD1 3.89Å; Y213-F217 HydrophobicContact CD2-CD1 3.89Å; Y213-F217 WeakPolarHBondContact CD2-O 3.29Å; Y213-F217 HydrophobicContact CE2-CD1 4.14Å; Y213-F217 PolarHBondContact N-O 2.95Å; Y213-V219 HydrophobicContact CE2-CG1 4.02Å; Y213-L238 VanDerWaalsContact O-CB 3.31Å; Y213-L238 WeakPolarHBondContact O-CB 3.45Å
214	S	97	Very high	95.2	Very high	34 Å²	34	19.8 Å²	19.8	24%	0.238	10%	0.103	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-21.7	-175.7	63.3	0	0	0	0	115	K195 G216 S237 L238	K195-S214 PolarHBondContact N-OG 2.88Å; K195-S214 PolarHBondContact O-N 3.09Å; S214-G216 PolarHBondContact O-N 3.49Å; S214-S237 VanDerWaalsContact O-CA 3.32Å; S214-S237 WeakPolarHBondContact O-CA 3.37Å; S214-S237 WeakPolarHBondContact O-CB 3.26Å; S214-L238 PolarHBondContact O-N 3.4Å
215	S	95.2	Very high	95.3	Very high	47 Å²	47	19.3 Å²	19.3	33%	0.329	11%	0.107	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-5.5	176.5	61.7	0	0	0	0	114.9	P193 Y213 F217	P193-S215 WeakPolarHBondContact O-CB 3.48Å; P193-S215 PolarHBondContact O-N 3.01Å; P193-S215 PolarHBondContact O-OG 3.49Å; Y213-S215 PolarHBondContact O-N 2.66Å; S215-F217 VanDerWaalsContact C-N 3.35Å; S215-F217 WeakPolarHBondContact OG-CB 3.49Å; S215-F217 PolarHBondContact OG-N 2.85Å
216	G	94.7	Very high	95.4	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	12%	0.12	C	C	.	.	S	Bend	trans	89.4	0.8	-168.9	0	0	0	0	0	113.7	Y213 S214 L218 H234 D236	Y213-G216 PolarHBondContact O-N 2.98Å; S214-G216 PolarHBondContact O-N 3.49Å; G216-L218 WeakPolarHBondContact O-CD1 3.31Å; G216-H234 PolarHBondContact O-N 2.77Å; G216-D236 WeakPolarHBondContact CA-O 3.24Å
217	F	95.7	Very high	95.6	Very high	12 Å²	12	27.9 Å²	27.9	5%	0.053	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	139.8	173.2	-164.7	-97	0	0	0	111.2	I185 P193 Y213 S215 V219 R231 F232 K233	I185-F217 HydrophobicContact CB-CE1 4.29Å; I185-F217 HydrophobicContact CB-CZ 4.41Å; I185-F217 HydrophobicContact CG2-CD1 4.06Å; I185-F217 HydrophobicContact CG2-CE1 3.67Å; I185-F217 HydrophobicContact CG2-CZ 4.22Å; P193-F217 HydrophobicContact CB-CB 4.33Å; P193-F217 HydrophobicContact CB-CD1 4.34Å; Y213-F217 WeakPolarHBondContact CB-O 3.13Å; Y213-F217 HydrophobicContact CD2-CB 4.39Å; Y213-F217 AromaticContact CD2-CD1 3.89Å; Y213-F217 HydrophobicContact CD2-CD1 3.89Å; Y213-F217 WeakPolarHBondContact CD2-O 3.29Å; Y213-F217 HydrophobicContact CE2-CD1 4.14Å; Y213-F217 PolarHBondContact N-O 2.95Å; S215-F217 VanDerWaalsContact C-N 3.35Å; S215-F217 WeakPolarHBondContact OG-CB 3.49Å; S215-F217 PolarHBondContact OG-N 2.85Å; F217-V219 HydrophobicContact CE1-CB 4.48Å; F217-R231 HydrophobicContact CE1-CG 4.44Å; F217-R231 HydrophobicContact CE2-CB 4.42Å; F217-R231 HydrophobicContact CZ-CB 3.88Å; F217-R231 HydrophobicContact CZ-CG 3.94Å; F217-F232 CarbonylContact C-O 3.55Å; F217-F232 WeakPolarHBondContact CA-O 3.12Å; F217-K233 HydrophobicContact CD2-CB 4.09Å; F217-K233 HydrophobicContact CD2-CD 4.2Å; F217-K233 HydrophobicContact CD2-CG 4.13Å
218	L	97	Very high	95.6	Very high	0 Å²	0	28 Å²	28	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	148	173	-51.7	91.7	0	0	0	110.7	L210 I211 G216 R231 F232 L238 V241 F250 T252	L210-L218 HydrophobicContact CD1-CB 4.07Å; L210-L218 HydrophobicContact CD1-CD2 4.44Å; L210-L218 HydrophobicContact CD2-CD2 4.33Å; L210-L218 HydrophobicContact CG-CD2 4.35Å; I211-L218 CarbonylContact O-C 3.54Å; I211-L218 VanDerWaalsContact O-CA 3.23Å; I211-L218 WeakPolarHBondContact O-CA 3.48Å; G216-L218 WeakPolarHBondContact O-CD1 3.31Å; L218-R231 CarbonylContact O-C 3.54Å; L218-R231 WeakPolarHBondContact O-CA 3.25Å; L218-F232 HydrophobicContact CB-CB 4.21Å; L218-F232 HydrophobicContact CB-CD2 4.24Å; L218-F232 HydrophobicContact CD1-CB 4.23Å; L218-F232 PolarHBondContact N-O 3.22Å; L218-F232 PolarHBondContact O-N 2.98Å; L218-L238 HydrophobicContact CD2-CD2 4.05Å; L218-L238 HydrophobicContact CG-CD2 4.08Å; L218-V241 HydrophobicContact CD2-CG1 4.22Å; L218-V241 HydrophobicContact CD2-CG2 3.71Å; L218-F250 HydrophobicContact CD2-CE2 4.06Å; L218-T252 HydrophobicContact CD1-CG2 4.38Å; L218-T252 HydrophobicContact CD2-CG2 3.74Å
219	V	96.7	Very high	95.5	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	129.3	174.2	62.4	0	0	0	0	110.3	A184 L210 I211 Y213 F217 W221 A230 R231	A184-V219 HydrophobicContact CB-CG1 4.03Å; L210-V219 WeakPolarHBondContact CA-O 3.47Å; L210-V219 WeakPolarHBondContact CD1-O 3.25Å; I211-V219 HydrophobicContact CB-CG1 3.76Å; I211-V219 HydrophobicContact CD1-CG1 4.11Å; I211-V219 HydrophobicContact CG1-CG1 4.29Å; I211-V219 PolarHBondContact N-O 2.83Å; I211-V219 PolarHBondContact O-N 2.84Å; Y213-V219 HydrophobicContact CE2-CG1 4.02Å; F217-V219 HydrophobicContact CE1-CB 4.48Å; V219-W221 PolarHBondContact O-N 2.94Å; V219-A230 WeakPolarHBondContact CA-O 3.45Å; V219-R231 HydrophobicContact CG2-CG 4.14Å
220	L	97.6	Very high	95.5	Very high	2 Å²	2	31.7 Å²	31.7	1%	0.01	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	104	164.2	-173.8	68.1	0	0	0	107.3	K208 I209 L210 G228 D229 A230 F232 W243 I264	K208-L220 HydrophobicContact CB-CD1 4.03Å; I209-L220 CarbonylContact O-C 3.55Å; L210-L220 HydrophobicContact CD1-CB 4.46Å; L220-G228 CarbonylContact O-C 3.6Å; L220-D229 HydrophobicContact CD2-CB 4.48Å; L220-D229 WeakPolarHBondContact O-CB 3.45Å; L220-D229 PolarHBondContact O-N 2.95Å; L220-A230 HydrophobicContact CB-CB 4.08Å; L220-A230 HydrophobicContact CD2-CB 4.42Å; L220-A230 PolarHBondContact N-O 2.81Å; L220-A230 PolarHBondContact O-N 3.01Å; L220-F232 HydrophobicContact CB-CE2 4.06Å; L220-W243 HydrophobicContact CD1-CH2 3.91Å; L220-W243 HydrophobicContact CD1-CZ2 3.81Å; L220-I264 HydrophobicContact CD2-CD1 4.16Å; L220-I264 HydrophobicContact CD2-CG1 4.3Å; L220-I264 HydrophobicContact CD2-CG2 3.72Å
221	W	97.3	Very high	95.3	Very high	8 Å²	8	35.4 Å²	35.4	3%	0.03	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	133.6	-179.7	-174.1	-90.5	0	0	0	110.7	Y177 I179 K183 A184 K208 I209 I211 V219 K226	Y177-W221 PolarHBondContact OH-NE1 3.17Å; I179-W221 VanDerWaalsContact CD1-CD1 3.44Å; I179-W221 HydrophobicContact CD1-CD2 4.1Å; I179-W221 HydrophobicContact CD1-CG 3.79Å; I179-W221 HydrophobicContact CG1-CD2 4.31Å; I179-W221 HydrophobicContact CG1-CG 4.5Å; I179-W221 HydrophobicContact CG1-CZ2 4.15Å; I179-W221 HydrophobicContact CG2-CD2 3.96Å; I179-W221 HydrophobicContact CG2-CE3 3.98Å; I179-W221 HydrophobicContact CG2-CH2 4.24Å; I179-W221 HydrophobicContact CG2-CZ2 4.21Å; I179-W221 HydrophobicContact CG2-CZ3 4.14Å; K183-W221 HydrophobicContact CB-CH2 4.35Å; A184-W221 HydrophobicContact CB-CE3 4.46Å; A184-W221 HydrophobicContact CB-CZ3 4.39Å; K208-W221 WeakPolarHBondContact CA-O 3.45Å; I209-W221 HydrophobicContact CG1-CB 3.92Å; I209-W221 PolarHBondContact N-O 3.35Å; I209-W221 PolarHBondContact O-N 2.91Å; I211-W221 HydrophobicContact CD1-CB 4.3Å; V219-W221 PolarHBondContact O-N 2.94Å; W221-K226 VanDerWaalsContact CH2-O 3.24Å; W221-K226 WeakPolarHBondContact CH2-O 3.44Å; W221-K226 HydrophobicContact CZ2-CB 4.43Å; W221-K226 WeakPolarHBondContact CZ2-O 3.31Å
222	D	95.3	Very high	95.2	Very high	15 Å²	15	35.4 Å²	35.4	8%	0.08	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	114.6	174.1	-177.1	-16.7	0	0	0	110.1	K208 K224 T225 K226 Q227 D229	K208-D222 HydrophobicContact CD-CB 3.82Å; K208-D222 WeakPolarHBondContact CE-OD2 3.3Å; K208-D222 VanDerWaalsContact NZ-CG 3.31Å; K208-D222 IonicContact NZ-OD2 2.54Å; K208-D222 PolarHBondContact NZ-OD2 3.09Å; D222-K224 VanDerWaalsContact C-N 3.3Å; D222-K224 PolarHBondContact O-N 2.98Å; D222-K224 WeakPolarHBondContact OD1-CA 3.26Å; D222-K224 VanDerWaalsContact OD1-CB 3.32Å; D222-K224 WeakPolarHBondContact OD1-CB 3.27Å; D222-K224 PolarHBondContact OD1-N 3.13Å; D222-T225 VanDerWaalsContact CB-OG1 3.22Å; D222-T225 WeakPolarHBondContact CB-OG1 3.44Å; D222-T225 PolarHBondContact OD1-N 3.08Å; D222-T225 PolarHBondContact OD2-OG1 3.39Å; D222-T225 VanDerWaalsContact OD2-OG1 3.08Å; D222-K226 VanDerWaalsContact O-CA 3.22Å; D222-K226 WeakPolarHBondContact O-CA 3.41Å; D222-K226 PolarHBondContact O-N 2.83Å; D222-Q227 PolarHBondContact N-O 2.99Å; D222-Q227 PolarHBondContact O-N 3.33Å; D222-D229 HydrophobicContact CB-CB 4.42Å
223	L	93.7	Very high	95	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-31.5	179.7	-66.9	175	0	0	0	112.3	F166 Y177 I179 N207 I209 L1233 L1238 F1239	F166-L223 HydrophobicContact CZ-CD2 4.3Å; Y177-L223 HydrophobicContact CE1-CD2 4.37Å; I179-L223 HydrophobicContact CD1-CD2 4.48Å; N207-L223 WeakPolarHBondContact O-CB 3.38Å; N207-L223 WeakPolarHBondContact O-CG 3.21Å; N207-L223 PolarHBondContact O-N 2.93Å; I209-L223 HydrophobicContact CD1-CD2 4.11Å; I209-L223 HydrophobicContact CG2-CD1 4.04Å; I209-L223 HydrophobicContact CG2-CG 4.49Å; L223-L1233 HydrophobicContact CB-CD2 3.64Å; L223-L1238 HydrophobicContact CB-CD2 3.77Å; L223-L1238 HydrophobicContact CD2-CD2 4.16Å; L223-L1238 HydrophobicContact CG-CD2 4.47Å; L223-L1238 WeakPolarHBondContact O-CD2 3.48Å; L223-F1239 HydrophobicContact CD1-CZ 4.06Å; L223-F1239 HydrophobicContact CD2-CE1 4.08Å; L223-F1239 HydrophobicContact CD2-CZ 3.82Å
224	K	90.9	Very high	94.8	Very high	115 Å²	115	41.6 Å²	41.6	50%	0.5	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-45.2	-179.3	-174.9	175.1	179.8	176.6	0	110.9	D222 S1231 L1233	D222-K224 VanDerWaalsContact C-N 3.3Å; D222-K224 PolarHBondContact O-N 2.98Å; D222-K224 WeakPolarHBondContact OD1-CA 3.26Å; D222-K224 VanDerWaalsContact OD1-CB 3.32Å; D222-K224 WeakPolarHBondContact OD1-CB 3.27Å; D222-K224 PolarHBondContact OD1-N 3.13Å; K224-S1231 PolarHBondContact NZ-OG 3.29Å; K224-L1233 HydrophobicContact CB-CD1 4.36Å; K224-L1233 HydrophobicContact CB-CD2 4.39Å; K224-L1233 HydrophobicContact CG-CD1 4.33Å
225	T	93.4	Very high	94.5	Very high	80 Å²	80	46 Å²	46	49%	0.491	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.3	-10.9	179.4	61.3	0	0	0	0	113.6	D222 Q227	D222-T225 VanDerWaalsContact CB-OG1 3.22Å; D222-T225 WeakPolarHBondContact CB-OG1 3.44Å; D222-T225 PolarHBondContact OD1-N 3.08Å; D222-T225 PolarHBondContact OD2-OG1 3.39Å; D222-T225 VanDerWaalsContact OD2-OG1 3.08Å; T225-Q227 VanDerWaalsContact C-N 3.26Å; T225-Q227 PolarHBondContact O-N 2.84Å
226	K	93.4	Very high	94.5	Very high	103 Å²	103	44.6 Å²	44.6	45%	0.448	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.5	37.1	-178.1	-56.9	174.1	171.5	174.1	0	112.6	Y177 W221 D222 L1238	Y177-K226 HydrophobicContact CE2-CB 4.48Å; Y177-K226 HydrophobicContact CE2-CD 3.9Å; Y177-K226 HydrophobicContact CE2-CG 3.9Å; W221-K226 VanDerWaalsContact CH2-O 3.24Å; W221-K226 WeakPolarHBondContact CH2-O 3.44Å; W221-K226 HydrophobicContact CZ2-CB 4.43Å; W221-K226 WeakPolarHBondContact CZ2-O 3.31Å; D222-K226 VanDerWaalsContact O-CA 3.22Å; D222-K226 WeakPolarHBondContact O-CA 3.41Å; D222-K226 PolarHBondContact O-N 2.83Å; K226-L1238 HydrophobicContact CD-CD1 4.39Å; K226-L1238 HydrophobicContact CG-CD1 4.42Å
227	Q	93	Very high	94.5	Very high	135 Å²	135	47 Å²	47	63%	0.631	24%	0.239	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-140.1	160.1	-180	-66.5	-172.2	7.6	0	0	111.9	D222 T225 D229	D222-Q227 PolarHBondContact N-O 2.99Å; D222-Q227 PolarHBondContact O-N 3.33Å; T225-Q227 VanDerWaalsContact C-N 3.26Å; T225-Q227 PolarHBondContact O-N 2.84Å; Q227-D229 PolarHBondContact O-N 3.47Å
228	G	93.2	Very high	94.6	Very high	11 Å²	11	46.6 Å²	46.6	11%	0.113	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	109.2	171.6	0	0	0	0	0	111.3	L220 R231	L220-G228 CarbonylContact O-C 3.6Å; G228-R231 PolarHBondContact O-NH1 2.77Å
229	D	93.4	Very high	94.6	Very high	92 Å²	92	49.8 Å²	49.8	49%	0.492	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	-42.1	179.8	-172.1	33.5	0	0	0	112	K208 L220 D222 Q227	K208-D229 IonicContact NZ-OD1 2.74Å; K208-D229 IonicContact NZ-OD2 2.87Å; K208-D229 PolarHBondContact NZ-OD2 2.84Å; L220-D229 HydrophobicContact CD2-CB 4.48Å; L220-D229 WeakPolarHBondContact O-CB 3.45Å; L220-D229 PolarHBondContact O-N 2.95Å; D222-D229 HydrophobicContact CB-CB 4.42Å; Q227-D229 PolarHBondContact O-N 3.47Å
230	A	94.9	Very high	94.6	Very high	10 Å²	10	50 Å²	50	8%	0.083	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	151.9	175.3	0	0	0	0	0	110.9	V219 L220 F232 P267	V219-A230 WeakPolarHBondContact CA-O 3.45Å; L220-A230 HydrophobicContact CB-CB 4.08Å; L220-A230 HydrophobicContact CD2-CB 4.42Å; L220-A230 PolarHBondContact N-O 2.81Å; L220-A230 PolarHBondContact O-N 3.01Å; A230-F232 HydrophobicContact CB-CE2 3.83Å; A230-F232 HydrophobicContact CB-CZ 3.71Å; A230-P267 HydrophobicContact CB-CB 4.32Å
231	R	94.6	Very high	94.6	Very high	80 Å²	80	50 Å²	50	30%	0.302	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	130.9	179.5	-69.1	167.4	-176.2	82.9	-2.7	109	A184 F217 L218 V219 G228 P267	A184-R231 PolarHBondContact O-NE 3.41Å; A184-R231 PolarHBondContact O-NH2 3.41Å; F217-R231 HydrophobicContact CE1-CG 4.44Å; F217-R231 HydrophobicContact CE2-CB 4.42Å; F217-R231 HydrophobicContact CZ-CB 3.88Å; F217-R231 HydrophobicContact CZ-CG 3.94Å; L218-R231 CarbonylContact O-C 3.54Å; L218-R231 WeakPolarHBondContact O-CA 3.25Å; V219-R231 HydrophobicContact CG2-CG 4.14Å; G228-R231 PolarHBondContact O-NH1 2.77Å; R231-P267 WeakPolarHBondContact O-CB 3.42Å
232	F	95.9	Very high	94.6	Very high	0 Å²	0	51 Å²	51	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	143.9	-176.8	-46.7	-96.1	0	0	0	108.3	L210 F217 L218 L220 A230 F250 W262 P267	L210-F232 HydrophobicContact CD1-CD2 4.39Å; L210-F232 HydrophobicContact CD1-CE2 4.3Å; F217-F232 CarbonylContact C-O 3.55Å; F217-F232 WeakPolarHBondContact CA-O 3.12Å; L218-F232 HydrophobicContact CB-CB 4.21Å; L218-F232 HydrophobicContact CB-CD2 4.24Å; L218-F232 HydrophobicContact CD1-CB 4.23Å; L218-F232 PolarHBondContact N-O 3.22Å; L218-F232 PolarHBondContact O-N 2.98Å; L220-F232 HydrophobicContact CB-CE2 4.06Å; A230-F232 HydrophobicContact CB-CE2 3.83Å; A230-F232 HydrophobicContact CB-CZ 3.71Å; F232-F250 HydrophobicContact CD1-CE1 4.32Å; F232-F250 AromaticContact CD1-CZ 3.8Å; F232-F250 HydrophobicContact CD1-CZ 3.8Å; F232-F250 HydrophobicContact CD2-CE1 4.35Å; F232-F250 AromaticContact CD2-CZ 3.8Å; F232-F250 HydrophobicContact CD2-CZ 3.8Å; F232-F250 AromaticContact CE1-CE1 3.91Å; F232-F250 HydrophobicContact CE1-CE1 3.91Å; F232-F250 AromaticContact CE1-CZ 3.87Å; F232-F250 HydrophobicContact CE1-CZ 3.87Å; F232-F250 AromaticContact CE2-CE1 3.97Å; F232-F250 HydrophobicContact CE2-CE1 3.97Å; F232-F250 AromaticContact CE2-CZ 3.89Å; F232-F250 HydrophobicContact CE2-CZ 3.89Å; F232-F250 AromaticContact CG-CZ 3.77Å; F232-F250 HydrophobicContact CG-CZ 3.77Å; F232-F250 AromaticContact CZ-CE1 3.74Å; F232-F250 HydrophobicContact CZ-CE1 3.74Å; F232-F250 AromaticContact CZ-CZ 3.93Å; F232-F250 HydrophobicContact CZ-CZ 3.93Å; F232-W262 HydrophobicContact CB-CD2 4.44Å; F232-W262 HydrophobicContact CB-CE3 4.08Å; F232-W262 HydrophobicContact CB-CH2 4.37Å; F232-W262 HydrophobicContact CB-CZ3 4.02Å; F232-W262 HydrophobicContact CD1-CB 4.5Å; F232-W262 HydrophobicContact CD1-CD2 4.24Å; F232-W262 AromaticContact CD1-CE3 3.64Å; F232-W262 HydrophobicContact CD1-CE3 3.64Å; F232-W262 HydrophobicContact CD1-CZ3 4.19Å; F232-W262 HydrophobicContact CG-CE3 4.3Å; F232-P267 HydrophobicContact CD1-CB 3.82Å; F232-P267 HydrophobicContact CE1-CB 3.65Å; F232-P267 HydrophobicContact CZ-CB 4.24Å
233	K	93.7	Very high	94.6	Very high	113 Å²	113	51 Å²	51	49%	0.491	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	115.1	179.4	-170.3	174.7	-174	174.5	0	110.1	F217	F217-K233 HydrophobicContact CD2-CB 4.09Å; F217-K233 HydrophobicContact CD2-CD 4.2Å; F217-K233 HydrophobicContact CD2-CG 4.13Å
234	H	94.7	Very high	94.6	Very high	17 Å²	17	52.6 Å²	52.6	8%	0.079	27%	0.265	C	S	.	.			trans	-92.4	157	165.7	-160.3	-97.7	0	0	0	110	G216 D236 H254 W262	G216-H234 PolarHBondContact O-N 2.77Å; H234-D236 IonicContact CE1-OD2 2.62Å; H234-D236 PolarHBondContact CE1-OD2 2.78Å; H234-D236 PolarHBondContact ND1-N 3.43Å; H234-D236 VanDerWaalsContact ND1-N 3.12Å; H234-D236 IonicContact ND1-OD2 2.64Å; H234-H254 WeakPolarHBondContact CB-CE1 3.44Å; H234-H254 AromaticContact CD2-NE2 3.96Å; H234-H254 AromaticContact CG-CE1 3.49Å; H234-H254 VanDerWaalsContact CG-CE1 3.49Å; H234-H254 AromaticContact CG-ND1 3.83Å; H234-H254 AromaticContact CG-NE2 3.62Å; H234-H254 AromaticContact ND1-CD2 3.88Å; H234-H254 AromaticContact ND1-CE1 3.68Å; H234-H254 AromaticContact ND1-CG 3.67Å; H234-H254 AromaticContact ND1-ND1 3.52Å; H234-H254 AromaticContact ND1-NE2 3.89Å; H234-W262 HydrophobicContact CB-CZ2 4.06Å
235	T	91.3	Very high	94.5	Very high	126 Å²	126	51.6 Å²	51.6	77%	0.773	26%	0.258	S	S	*	.	S	Bend	trans	-73.5	-38	177.4	42.6	0	0	0	0	112.5
236	D	93.5	Very high	94.4	Very high	18 Å²	18	49.8 Å²	49.8	10%	0.096	25%	0.245	C	C	.	.	S	Bend	trans	-91.7	151	-176.5	-60.5	-86.5	0	0	0	113.5	G216 H234 H254 N255 H256	G216-D236 WeakPolarHBondContact CA-O 3.24Å; H234-D236 IonicContact CE1-OD2 2.62Å; H234-D236 PolarHBondContact CE1-OD2 2.78Å; H234-D236 PolarHBondContact ND1-N 3.43Å; H234-D236 VanDerWaalsContact ND1-N 3.12Å; H234-D236 IonicContact ND1-OD2 2.64Å; D236-H254 HydrophobicContact CB-CB 3.93Å; D236-H254 PolarHBondContact O-ND1 3.41Å; D236-H254 VanDerWaalsContact O-ND1 3.08Å; D236-N255 HydrophobicContact CB-CB 4.27Å; D236-H256 IonicContact OD1-CE1 3.76Å; D236-H256 PolarHBondContact OD1-CE1 3.23Å; D236-H256 IonicContact OD1-ND1 3.72Å; D236-H256 PolarHBondContact OD1-ND1 3.5Å
237	S	95.6	Very high	94.4	Very high	50 Å²	50	45.2 Å²	45.2	35%	0.35	23%	0.227	S	C	.	.	P	Polyproline II helix	trans	-54.2	137.6	177.4	-60.6	0	0	0	0	112.7	S214 H254 N255	S214-S237 VanDerWaalsContact O-CA 3.32Å; S214-S237 WeakPolarHBondContact O-CA 3.37Å; S214-S237 WeakPolarHBondContact O-CB 3.26Å; S237-H254 WeakPolarHBondContact O-CA 3.39Å; S237-H254 WeakPolarHBondContact O-CB 3.3Å; S237-H254 PolarHBondContact O-ND1 2.93Å; S237-N255 PolarHBondContact O-N 2.82Å
238	L	97.8	Very high	94.5	Very high	3 Å²	3	44.3 Å²	44.3	2%	0.016	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	137.9	179.9	-175.6	69.3	0	0	0	111.3	G212 Y213 S214 L218 V241 T252	G212-L238 VanDerWaalsContact CA-CD2 3.49Å; Y213-L238 VanDerWaalsContact O-CB 3.31Å; Y213-L238 WeakPolarHBondContact O-CB 3.45Å; S214-L238 PolarHBondContact O-N 3.4Å; L218-L238 HydrophobicContact CD2-CD2 4.05Å; L218-L238 HydrophobicContact CG-CD2 4.08Å; L238-V241 HydrophobicContact CD1-CG2 3.94Å; L238-V241 HydrophobicContact CD2-CG2 3.72Å; L238-V241 HydrophobicContact CG-CG2 4.18Å; L238-T252 HydrophobicContact CD1-CG2 3.98Å
239	Y	96.8	Very high	94.6	Very high	67 Å²	67	44.5 Å²	44.5	26%	0.263	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	-37.7	173.6	-71.5	-86.4	0	0	0	113.7	I197 S253 N255 P292 I293 R294	I197-Y239 WeakPolarHBondContact CG2-O 3.29Å; Y239-S253 PolarHBondContact N-O 2.81Å; Y239-N255 HydrophobicContact CE2-CB 4.39Å; Y239-N255 WeakPolarHBondContact CE2-OD1 3.47Å; Y239-N255 PolarHBondContact OH-OD1 3.4Å; Y239-P292 HydrophobicContact CD2-CB 4.24Å; Y239-P292 HydrophobicContact CE2-CB 3.66Å; Y239-P292 HydrophobicContact CE2-CG 4.35Å; Y239-I293 WeakPolarHBondContact CB-O 3.39Å; Y239-R294 WeakPolarHBondContact CB-O 3.28Å; Y239-R294 VanDerWaalsContact CE1-CD 3.46Å
240	S	97.6	Very high	94.8	Very high	5 Å²	5	40.1 Å²	40.1	4%	0.035	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	154	-179.2	-175.4	0	0	0	0	112	Q198 T252 S253 V296	Q198-S240 PolarHBondContact OE1-OG 2.97Å; S240-T252 WeakPolarHBondContact O-CA 3.49Å; S240-S253 WeakPolarHBondContact CB-OG 3.46Å; S240-S253 PolarHBondContact N-OG 2.86Å; S240-S253 PolarHBondContact O-N 2.57Å; S240-V296 PolarHBondContact OG-N 2.85Å
241	V	97.6	Very high	95	Very high	3 Å²	3	39.8 Å²	39.8	2%	0.018	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	129.3	-177.9	-175.2	0	0	0	0	108.5	Q198 L210 L218 L238 F250 L251 T252	Q198-V241 VanDerWaalsContact CD-O 3.28Å; Q198-V241 PolarHBondContact NE2-O 3.05Å; Q198-V241 PolarHBondContact OE1-O 3.26Å; L210-V241 HydrophobicContact CD2-CG1 3.47Å; L210-V241 VanDerWaalsContact CD2-CG1 3.47Å; L210-V241 HydrophobicContact CG-CG1 4.29Å; L218-V241 HydrophobicContact CD2-CG1 4.22Å; L218-V241 HydrophobicContact CD2-CG2 3.71Å; L238-V241 HydrophobicContact CD1-CG2 3.94Å; L238-V241 HydrophobicContact CD2-CG2 3.72Å; L238-V241 HydrophobicContact CG-CG2 4.18Å; V241-F250 HydrophobicContact CG1-CD2 4.25Å; V241-L251 WeakPolarHBondContact CA-O 3.4Å; V241-T252 HydrophobicContact CG1-CG2 4.39Å; V241-T252 HydrophobicContact CG2-CG2 4.23Å
242	V	96.7	Very high	95.1	Very high	27 Å²	27	36 Å²	36	16%	0.164	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	131.2	175.4	63.7	0	0	0	0	111.3	F250 L251 V296 W298	V242-F250 CarbonylContact O-C 3.6Å; V242-F250 VanDerWaalsContact O-CA 3.29Å; V242-F250 WeakPolarHBondContact O-CA 3.39Å; V242-F250 WeakPolarHBondContact O-CB 3.23Å; V242-L251 HydrophobicContact CG1-CB 3.82Å; V242-L251 HydrophobicContact CG1-CD2 4.29Å; V242-L251 HydrophobicContact CG1-CG 4.48Å; V242-L251 PolarHBondContact N-O 3.5Å; V242-L251 PolarHBondContact O-N 2.81Å; V242-V296 HydrophobicContact CG1-CG1 4.02Å; V242-V296 HydrophobicContact CG1-CG2 4.34Å; V242-W298 HydrophobicContact CG1-CB 3.64Å; V242-W298 HydrophobicContact CG2-CB 4.1Å
243	W	96.1	Very high	95.2	Very high	17 Å²	17	36 Å²	36	6%	0.064	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	143	175.6	-79.8	107.5	0	0	0	111	A200 E201 N202 P203 L210 L220 S249 F250 I264	A200-W243 PolarHBondContact O-NE1 3.44Å; A200-W243 VanDerWaalsContact O-NE1 3.13Å; E201-W243 PolarHBondContact O-NE1 2.91Å; N202-W243 HydrophobicContact CB-CH2 4.4Å; N202-W243 HydrophobicContact CB-CZ2 3.98Å; N202-W243 WeakPolarHBondContact ND2-CH2 3.4Å; P203-W243 HydrophobicContact CG-CB 4Å; P203-W243 HydrophobicContact CG-CG 4.45Å; L210-W243 HydrophobicContact CB-CZ2 3.77Å; L210-W243 HydrophobicContact CD2-CZ2 3.96Å; L210-W243 HydrophobicContact CG-CZ2 4.42Å; L220-W243 HydrophobicContact CD1-CH2 3.91Å; L220-W243 HydrophobicContact CD1-CZ2 3.81Å; W243-S249 VanDerWaalsContact CE3-O 3.32Å; W243-F250 HydrophobicContact CD2-CB 4.12Å; W243-F250 HydrophobicContact CE3-CB 3.86Å; W243-F250 HydrophobicContact CE3-CD1 4.31Å; W243-F250 AromaticContact CH2-CD1 3.98Å; W243-F250 HydrophobicContact CH2-CD1 3.98Å; W243-F250 HydrophobicContact CZ3-CB 4.22Å; W243-F250 AromaticContact CZ3-CD1 3.8Å; W243-F250 HydrophobicContact CZ3-CD1 3.8Å; W243-F250 HydrophobicContact CZ3-CG 4.46Å; W243-I264 HydrophobicContact CH2-CD1 3.66Å; W243-I264 HydrophobicContact CH2-CG1 4.01Å; W243-I264 HydrophobicContact CZ3-CD1 3.7Å; W243-I264 HydrophobicContact CZ3-CG1 4.04Å
244	H	93.4	Very high	95.4	Very high	32 Å²	32	30.6 Å²	30.6	15%	0.148	16%	0.156	C	C	.	.			trans	-72.1	142	154.5	-173.6	-110.4	0	0	0	108.9	P203 D246 G247 S249 W298	P203-H244 WeakPolarHBondContact CG-O 3.22Å; H244-D246 IonicContact CE1-OD1 3.62Å; H244-D246 IonicContact CG-OD1 2.69Å; H244-D246 IonicContact ND1-OD1 3.44Å; H244-D246 PolarHBondContact ND1-OD1 2.65Å; H244-D246 IonicContact ND1-OD2 2.74Å; H244-D246 PolarHBondContact O-N 2.91Å; H244-G247 PolarHBondContact O-N 3.36Å; H244-S249 VanDerWaalsContact CB-O 3.28Å; H244-S249 WeakPolarHBondContact CB-O 3.29Å; H244-S249 WeakPolarHBondContact CB-OG 3.43Å; H244-S249 PolarHBondContact N-O 2.88Å; H244-W298 HydrophobicContact CB-CD2 4.32Å; H244-W298 HydrophobicContact CB-CE3 3.87Å; H244-W298 HydrophobicContact CB-CH2 3.81Å; H244-W298 HydrophobicContact CB-CZ2 4.23Å; H244-W298 HydrophobicContact CB-CZ3 3.62Å; H244-W298 AromaticContact CD2-CE2 3.55Å; H244-W298 AromaticContact CD2-CH2 3.88Å; H244-W298 AromaticContact CD2-CZ2 3.42Å; H244-W298 VanDerWaalsContact CD2-CZ2 3.42Å; H244-W298 WeakPolarHBondContact CD2-CZ2 3.25Å; H244-W298 AromaticContact CD2-NE1 3.98Å; H244-W298 AromaticContact CG-CH2 4Å
245	W	88.7	Confident	95.3	Very high	95 Å²	95	31.6 Å²	31.6	36%	0.36	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-25.5	-174.7	70.8	-78	0	0	0	114.8	P203 Q204 G247 P300	P203-W245 WeakPolarHBondContact CG-O 3.38Å; Q204-W245 WeakPolarHBondContact CG-O 3.2Å; Q204-W245 PolarHBondContact NE2-O 2.73Å; W245-G247 PolarHBondContact O-N 3.48Å; W245-P300 HydrophobicContact CB-CG 3.75Å; W245-P300 VanDerWaalsContact CD1-CG 3.44Å; W245-P300 HydrophobicContact CG-CB 3.95Å; W245-P300 HydrophobicContact CG-CG 3.62Å
246	D	90.9	Very high	95.3	Very high	42 Å²	42	28.1 Å²	28.1	23%	0.225	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-4.9	178.1	87.8	-26.5	0	0	0	113.8	Q204 H244 K248	Q204-D246 VanDerWaalsContact CG-O 3.27Å; Q204-D246 WeakPolarHBondContact CG-O 3.42Å; H244-D246 IonicContact CE1-OD1 3.62Å; H244-D246 IonicContact CG-OD1 2.69Å; H244-D246 IonicContact ND1-OD1 3.44Å; H244-D246 PolarHBondContact ND1-OD1 2.65Å; H244-D246 IonicContact ND1-OD2 2.74Å; H244-D246 PolarHBondContact O-N 2.91Å; D246-K248 PolarHBondContact O-N 3.32Å; D246-K248 PolarHBondContact OD1-N 3.23Å; D246-K248 WeakPolarHBondContact OD2-CD 3.05Å; D246-K248 IonicContact OD2-NZ 3.82Å
247	G	92.7	Very high	95.3	Very high	6 Å²	6	27.3 Å²	27.3	6%	0.062	13%	0.132	C	C	.	.	S	Bend	trans	66.5	13.4	176	0	0	0	0	0	114.8	N202 H244 W245 I264	N202-G247 PolarHBondContact ND2-O 2.69Å; N202-G247 WeakPolarHBondContact OD1-CA 3.29Å; H244-G247 PolarHBondContact O-N 3.36Å; W245-G247 PolarHBondContact O-N 3.48Å; G247-I264 WeakPolarHBondContact O-CD1 3.43Å
248	K	95.2	Very high	95.3	Very high	117 Å²	117	25.1 Å²	25.1	51%	0.509	12%	0.117	S	C	.	.	S	Bend	trans	-101.7	-22.9	179.4	-61.9	-178.8	-164.4	154	0	113.5	D246 I264	D246-K248 PolarHBondContact O-N 3.32Å; D246-K248 PolarHBondContact OD1-N 3.23Å; D246-K248 WeakPolarHBondContact OD2-CD 3.05Å; D246-K248 IonicContact OD2-NZ 3.82Å; K248-I264 WeakPolarHBondContact O-CG1 3.12Å; K248-I264 PolarHBondContact O-N 3.03Å
249	S	96	Very high	95.2	Very high	14 Å²	14	25 Å²	25	10%	0.098	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	157.6	179	52.6	0	0	0	0	111.7	W243 H244 W262	W243-S249 VanDerWaalsContact CE3-O 3.32Å; H244-S249 VanDerWaalsContact CB-O 3.28Å; H244-S249 WeakPolarHBondContact CB-O 3.29Å; H244-S249 WeakPolarHBondContact CB-OG 3.43Å; H244-S249 PolarHBondContact N-O 2.88Å; S249-W262 CarbonylContact C-O 3.55Å; S249-W262 WeakPolarHBondContact CA-O 3.19Å; S249-W262 WeakPolarHBondContact CB-O 3.01Å
250	F	97.7	Very high	95.2	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	159.5	172.9	59.1	-89.5	0	0	0	109.8	L210 L218 F232 V241 V242 W243 T252 W262	L210-F250 HydrophobicContact CD1-CZ 4.4Å; L210-F250 HydrophobicContact CD2-CB 4.26Å; L210-F250 HydrophobicContact CD2-CD1 3.87Å; L210-F250 HydrophobicContact CD2-CD2 3.68Å; L210-F250 HydrophobicContact CD2-CE1 4.08Å; L210-F250 HydrophobicContact CD2-CE2 3.9Å; L210-F250 HydrophobicContact CD2-CG 3.66Å; L210-F250 HydrophobicContact CD2-CZ 4.09Å; L218-F250 HydrophobicContact CD2-CE2 4.06Å; F232-F250 HydrophobicContact CD1-CE1 4.32Å; F232-F250 AromaticContact CD1-CZ 3.8Å; F232-F250 HydrophobicContact CD1-CZ 3.8Å; F232-F250 HydrophobicContact CD2-CE1 4.35Å; F232-F250 AromaticContact CD2-CZ 3.8Å; F232-F250 HydrophobicContact CD2-CZ 3.8Å; F232-F250 AromaticContact CE1-CE1 3.91Å; F232-F250 HydrophobicContact CE1-CE1 3.91Å; F232-F250 AromaticContact CE1-CZ 3.87Å; F232-F250 HydrophobicContact CE1-CZ 3.87Å; F232-F250 AromaticContact CE2-CE1 3.97Å; F232-F250 HydrophobicContact CE2-CE1 3.97Å; F232-F250 AromaticContact CE2-CZ 3.89Å; F232-F250 HydrophobicContact CE2-CZ 3.89Å; F232-F250 AromaticContact CG-CZ 3.77Å; F232-F250 HydrophobicContact CG-CZ 3.77Å; F232-F250 AromaticContact CZ-CE1 3.74Å; F232-F250 HydrophobicContact CZ-CE1 3.74Å; F232-F250 AromaticContact CZ-CZ 3.93Å; F232-F250 HydrophobicContact CZ-CZ 3.93Å; V241-F250 HydrophobicContact CG1-CD2 4.25Å; V242-F250 CarbonylContact O-C 3.6Å; V242-F250 VanDerWaalsContact O-CA 3.29Å; V242-F250 WeakPolarHBondContact O-CA 3.39Å; V242-F250 WeakPolarHBondContact O-CB 3.23Å; W243-F250 HydrophobicContact CD2-CB 4.12Å; W243-F250 HydrophobicContact CE3-CB 3.86Å; W243-F250 HydrophobicContact CE3-CD1 4.31Å; W243-F250 AromaticContact CH2-CD1 3.98Å; W243-F250 HydrophobicContact CH2-CD1 3.98Å; W243-F250 HydrophobicContact CZ3-CB 4.22Å; W243-F250 AromaticContact CZ3-CD1 3.8Å; W243-F250 HydrophobicContact CZ3-CD1 3.8Å; W243-F250 HydrophobicContact CZ3-CG 4.46Å; F250-T252 HydrophobicContact CD2-CG2 3.79Å; F250-T252 HydrophobicContact CE2-CG2 3.78Å; F250-W262 HydrophobicContact CD1-CB 4.14Å; F250-W262 HydrophobicContact CD2-CB 3.96Å; F250-W262 AromaticContact CD2-CD1 3.93Å; F250-W262 HydrophobicContact CD2-CG 4.19Å; F250-W262 HydrophobicContact CE1-CB 3.68Å; F250-W262 HydrophobicContact CE1-CG 4.5Å; F250-W262 HydrophobicContact CE2-CB 3.48Å; F250-W262 VanDerWaalsContact CE2-CB 3.48Å; F250-W262 AromaticContact CE2-CD1 3.45Å; F250-W262 VanDerWaalsContact CE2-CD1 3.45Å; F250-W262 HydrophobicContact CE2-CD2 4.4Å; F250-W262 AromaticContact CE2-CG 3.5Å; F250-W262 HydrophobicContact CE2-CG 3.5Å; F250-W262 VanDerWaalsContact CE2-CG 3.5Å; F250-W262 HydrophobicContact CG-CB 4.27Å; F250-W262 HydrophobicContact CZ-CB 3.32Å; F250-W262 HydrophobicContact CZ-CD2 4.42Å; F250-W262 AromaticContact CZ-CG 3.68Å; F250-W262 HydrophobicContact CZ-CG 3.68Å; F250-W262 PolarHBondContact N-O 3.28Å; F250-W262 VanDerWaalsContact N-O 3.09Å; F250-W262 PolarHBondContact O-N 2.76Å
251	L	97.9	Very high	95.2	Very high	4 Å²	4	23.1 Å²	23.1	2%	0.021	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	137.5	179.5	-176.4	68.1	0	0	0	108.7	V241 V242 L259 A260 T261 V296 W298 I308	V241-L251 WeakPolarHBondContact CA-O 3.4Å; V242-L251 HydrophobicContact CG1-CB 3.82Å; V242-L251 HydrophobicContact CG1-CD2 4.29Å; V242-L251 HydrophobicContact CG1-CG 4.48Å; V242-L251 PolarHBondContact N-O 3.5Å; V242-L251 PolarHBondContact O-N 2.81Å; L251-L259 HydrophobicContact CD1-CB 4.09Å; L251-A260 WeakPolarHBondContact CA-O 3.48Å; L251-T261 WeakPolarHBondContact CD1-OG1 3.31Å; L251-V296 HydrophobicContact CD2-CG2 3.62Å; L251-V296 HydrophobicContact CG-CG2 4.47Å; L251-W298 HydrophobicContact CB-CE3 3.7Å; L251-W298 HydrophobicContact CB-CZ3 4.12Å; L251-W298 HydrophobicContact CD2-CB 4.47Å; L251-I308 HydrophobicContact CD2-CG2 3.91Å
252	T	98.4	Very high	95.3	Very high	0 Å²	0	23 Å²	23	0%	0	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	139.9	176.8	56.1	0	0	0	0	110.5	L218 L238 S240 V241 F250 H254 L259 A260 W262	L218-T252 HydrophobicContact CD1-CG2 4.38Å; L218-T252 HydrophobicContact CD2-CG2 3.74Å; L238-T252 HydrophobicContact CD1-CG2 3.98Å; S240-T252 WeakPolarHBondContact O-CA 3.49Å; V241-T252 HydrophobicContact CG1-CG2 4.39Å; V241-T252 HydrophobicContact CG2-CG2 4.23Å; F250-T252 HydrophobicContact CD2-CG2 3.79Å; F250-T252 HydrophobicContact CE2-CG2 3.78Å; T252-H254 VanDerWaalsContact CB-NE2 3.32Å; T252-H254 WeakPolarHBondContact CB-NE2 3.48Å; T252-H254 PolarHBondContact OG1-NE2 3.41Å; T252-L259 WeakPolarHBondContact O-CA 3.38Å; T252-A260 PolarHBondContact N-O 2.94Å; T252-A260 PolarHBondContact O-N 3.44Å; T252-A260 PolarHBondContact OG1-O 2.86Å; T252-W262 PolarHBondContact OG1-NE1 2.8Å
253	S	97.6	Very high	95.3	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	139.5	173.7	78	0	0	0	0	111.3	Y239 S240 I293	Y239-S253 PolarHBondContact N-O 2.81Å; S240-S253 WeakPolarHBondContact CB-OG 3.46Å; S240-S253 PolarHBondContact N-OG 2.86Å; S240-S253 PolarHBondContact O-N 2.57Å; S253-I293 VanDerWaalsContact CB-O 3.28Å; S253-I293 WeakPolarHBondContact CB-O 3.25Å; S253-I293 PolarHBondContact OG-O 2.89Å
254	H	97	Very high	95.3	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	179.7	-171.2	-60.8	-83.7	0	0	0	113.1	H234 D236 S237 T252 L258 I293	H234-H254 WeakPolarHBondContact CB-CE1 3.44Å; H234-H254 AromaticContact CD2-NE2 3.96Å; H234-H254 AromaticContact CG-CE1 3.49Å; H234-H254 VanDerWaalsContact CG-CE1 3.49Å; H234-H254 AromaticContact CG-ND1 3.83Å; H234-H254 AromaticContact CG-NE2 3.62Å; H234-H254 AromaticContact ND1-CD2 3.88Å; H234-H254 AromaticContact ND1-CE1 3.68Å; H234-H254 AromaticContact ND1-CG 3.67Å; H234-H254 AromaticContact ND1-ND1 3.52Å; H234-H254 AromaticContact ND1-NE2 3.89Å; D236-H254 HydrophobicContact CB-CB 3.93Å; D236-H254 PolarHBondContact O-ND1 3.41Å; D236-H254 VanDerWaalsContact O-ND1 3.08Å; S237-H254 WeakPolarHBondContact O-CA 3.39Å; S237-H254 WeakPolarHBondContact O-CB 3.3Å; S237-H254 PolarHBondContact O-ND1 2.93Å; T252-H254 VanDerWaalsContact CB-NE2 3.32Å; T252-H254 WeakPolarHBondContact CB-NE2 3.48Å; T252-H254 PolarHBondContact OG1-NE2 3.41Å; H254-L258 HydrophobicContact CB-CB 4.29Å; H254-L258 PolarHBondContact N-O 2.86Å; H254-I293 PolarHBondContact O-N 3.39Å; H254-I293 VanDerWaalsContact O-N 3.16Å
255	N	92.8	Very high	95.3	Very high	37 Å²	37	35.8 Å²	35.8	20%	0.198	16%	0.162	C	C	.	.	S	Bend	trans	-56.1	165.3	162.1	-96	-14.2	0	0	0	111.3	D236 S237 Y239 G257 L258 P292	D236-N255 HydrophobicContact CB-CB 4.27Å; S237-N255 PolarHBondContact O-N 2.82Å; Y239-N255 HydrophobicContact CE2-CB 4.39Å; Y239-N255 WeakPolarHBondContact CE2-OD1 3.47Å; Y239-N255 PolarHBondContact OH-OD1 3.4Å; N255-G257 VanDerWaalsContact C-N 3.31Å; N255-G257 PolarHBondContact O-N 2.96Å; N255-L258 PolarHBondContact O-N 2.96Å; N255-P292 WeakPolarHBondContact OD1-CG 3.39Å
256	H	92.1	Very high	95.6	Very high	54 Å²	54	34.5 Å²	34.5	25%	0.25	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	62	32.6	171.5	-48	133.3	0	0	0	114.8	D236 L258 Y287 Y290	D236-H256 IonicContact OD1-CE1 3.76Å; D236-H256 PolarHBondContact OD1-CE1 3.23Å; D236-H256 IonicContact OD1-ND1 3.72Å; D236-H256 PolarHBondContact OD1-ND1 3.5Å; H256-L258 HydrophobicContact CB-CG 4.42Å; H256-L258 WeakPolarHBondContact O-CG 3.45Å; H256-L258 PolarHBondContact O-N 2.74Å; H256-Y287 HydrophobicContact CB-CD2 3.47Å; H256-Y287 VanDerWaalsContact CB-CD2 3.47Å; H256-Y287 HydrophobicContact CB-CE2 3.86Å; H256-Y287 WeakPolarHBondContact CB-O 3.47Å; H256-Y287 AromaticContact ND1-CE2 3.81Å; H256-Y290 VanDerWaalsContact CA-O 3.28Å; H256-Y290 WeakPolarHBondContact CA-O 3.46Å
257	G	92.2	Very high	95.7	Very high	0 Å²	0	34 Å²	34	0%	0	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	67.7	14.3	177.1	0	0	0	0	0	115.7	N255 P276 E291 I293	N255-G257 VanDerWaalsContact C-N 3.31Å; N255-G257 PolarHBondContact O-N 2.96Å; G257-P276 VanDerWaalsContact O-CD 3.27Å; G257-P276 WeakPolarHBondContact O-CD 3.4Å; G257-E291 VanDerWaalsContact CA-O 3.29Å; G257-E291 WeakPolarHBondContact CA-O 3.14Å; G257-E291 PolarHBondContact N-O 2.9Å; G257-I293 VanDerWaalsContact O-CD1 3.27Å; G257-I293 WeakPolarHBondContact O-CD1 3.06Å
258	L	95.9	Very high	95.6	Very high	5 Å²	5	41.9 Å²	41.9	3%	0.026	19%	0.194	C	C	.	.			trans	-89.9	137.2	-170.7	-59.3	179.7	0	0	0	113.5	H254 N255 H256 V273 C275 V283 Y287	H254-L258 HydrophobicContact CB-CB 4.29Å; H254-L258 PolarHBondContact N-O 2.86Å; N255-L258 PolarHBondContact O-N 2.96Å; H256-L258 HydrophobicContact CB-CG 4.42Å; H256-L258 WeakPolarHBondContact O-CG 3.45Å; H256-L258 PolarHBondContact O-N 2.74Å; L258-V273 HydrophobicContact CB-CG1 4.44Å; L258-V273 HydrophobicContact CD1-CG1 4.43Å; L258-V273 HydrophobicContact CD2-CG1 4.27Å; L258-C275 HydrophobicContact CD2-CB 4.09Å; L258-V283 HydrophobicContact CD2-CG1 3.85Å; L258-V283 HydrophobicContact CD2-CG2 4.33Å; L258-Y287 HydrophobicContact CD1-CD2 3.88Å; L258-Y287 HydrophobicContact CD1-CE2 3.85Å; L258-Y287 HydrophobicContact CD2-CD2 4.14Å; L258-Y287 HydrophobicContact CG-CD2 4.17Å
259	L	96.5	Very high	95.5	Very high	1 Å²	1	44.7 Å²	44.7	1%	0.005	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	127.7	164.3	-67	-179.7	0	0	0	109.7	L251 T252 V273 I274 P276 I293 V296 I308 F310	L251-L259 HydrophobicContact CD1-CB 4.09Å; T252-L259 WeakPolarHBondContact O-CA 3.38Å; L259-V273 WeakPolarHBondContact O-CA 3.25Å; L259-I274 HydrophobicContact CB-CD1 4.48Å; L259-I274 HydrophobicContact CB-CG1 3.9Å; L259-I274 PolarHBondContact N-O 3.08Å; L259-I274 PolarHBondContact O-N 3.14Å; L259-P276 HydrophobicContact CD1-CG 3.66Å; L259-P276 HydrophobicContact CG-CG 4.09Å; L259-I293 HydrophobicContact CD1-CD1 4.34Å; L259-I293 HydrophobicContact CD2-CD1 3.85Å; L259-I293 HydrophobicContact CD2-CG2 4.07Å; L259-I293 HydrophobicContact CG-CD1 3.68Å; L259-V296 HydrophobicContact CD2-CB 4.45Å; L259-V296 HydrophobicContact CD2-CG2 4.27Å; L259-I308 HydrophobicContact CD1-CG2 4.43Å; L259-F310 HydrophobicContact CD1-CD1 4.28Å; L259-F310 HydrophobicContact CD1-CE1 4.34Å
260	A	97	Very high	95.5	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	127	178.5	0	0	0	0	0	111.2	L251 T252 P270 S272 V273	L251-A260 WeakPolarHBondContact CA-O 3.48Å; T252-A260 PolarHBondContact N-O 2.94Å; T252-A260 PolarHBondContact O-N 3.44Å; T252-A260 PolarHBondContact OG1-O 2.86Å; A260-P270 HydrophobicContact CB-CB 4.12Å; A260-S272 CarbonylContact C-O 3.57Å; A260-S272 WeakPolarHBondContact CA-O 3.42Å; A260-V273 HydrophobicContact CB-CG2 4.09Å
261	T	97.4	Very high	95.5	Very high	32 Å²	32	49.1 Å²	49.1	20%	0.196	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	130.3	176.1	-54.8	0	0	0	0	110	L251 P270 V271 S272 W298	L251-T261 WeakPolarHBondContact CD1-OG1 3.31Å; T261-P270 CarbonylContact O-C 3.6Å; T261-P270 WeakPolarHBondContact O-CA 3.48Å; T261-P270 WeakPolarHBondContact O-CB 3.43Å; T261-V271 PolarHBondContact O-N 2.96Å; T261-S272 VanDerWaalsContact CB-OG 3.31Å; T261-S272 WeakPolarHBondContact CB-OG 3.28Å; T261-S272 PolarHBondContact N-O 2.72Å; T261-S272 PolarHBondContact OG1-OG 2.8Å; T261-W298 HydrophobicContact CG2-CH2 4.29Å; T261-W298 HydrophobicContact CG2-CZ3 4.4Å
262	W	98.1	Very high	95.3	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	143.5	-176.2	-61.7	87	0	0	0	111	F232 H234 S249 F250 T252 R269 P270	F232-W262 HydrophobicContact CB-CD2 4.44Å; F232-W262 HydrophobicContact CB-CE3 4.08Å; F232-W262 HydrophobicContact CB-CH2 4.37Å; F232-W262 HydrophobicContact CB-CZ3 4.02Å; F232-W262 HydrophobicContact CD1-CB 4.5Å; F232-W262 HydrophobicContact CD1-CD2 4.24Å; F232-W262 AromaticContact CD1-CE3 3.64Å; F232-W262 HydrophobicContact CD1-CE3 3.64Å; F232-W262 HydrophobicContact CD1-CZ3 4.19Å; F232-W262 HydrophobicContact CG-CE3 4.3Å; H234-W262 HydrophobicContact CB-CZ2 4.06Å; S249-W262 CarbonylContact C-O 3.55Å; S249-W262 WeakPolarHBondContact CA-O 3.19Å; S249-W262 WeakPolarHBondContact CB-O 3.01Å; F250-W262 HydrophobicContact CD1-CB 4.14Å; F250-W262 HydrophobicContact CD2-CB 3.96Å; F250-W262 AromaticContact CD2-CD1 3.93Å; F250-W262 HydrophobicContact CD2-CG 4.19Å; F250-W262 HydrophobicContact CE1-CB 3.68Å; F250-W262 HydrophobicContact CE1-CG 4.5Å; F250-W262 HydrophobicContact CE2-CB 3.48Å; F250-W262 VanDerWaalsContact CE2-CB 3.48Å; F250-W262 AromaticContact CE2-CD1 3.45Å; F250-W262 VanDerWaalsContact CE2-CD1 3.45Å; F250-W262 HydrophobicContact CE2-CD2 4.4Å; F250-W262 AromaticContact CE2-CG 3.5Å; F250-W262 HydrophobicContact CE2-CG 3.5Å; F250-W262 VanDerWaalsContact CE2-CG 3.5Å; F250-W262 HydrophobicContact CG-CB 4.27Å; F250-W262 HydrophobicContact CZ-CB 3.32Å; F250-W262 HydrophobicContact CZ-CD2 4.42Å; F250-W262 AromaticContact CZ-CG 3.68Å; F250-W262 HydrophobicContact CZ-CG 3.68Å; F250-W262 PolarHBondContact N-O 3.28Å; F250-W262 VanDerWaalsContact N-O 3.09Å; F250-W262 PolarHBondContact O-N 2.76Å; T252-W262 PolarHBondContact OG1-NE1 2.8Å; W262-R269 VanDerWaalsContact CZ3-C 3.49Å; W262-P270 HydrophobicContact CD2-CB 3.97Å; W262-P270 HydrophobicContact CE3-CB 4.13Å; W262-P270 HydrophobicContact CH2-CB 4.22Å; W262-P270 VanDerWaalsContact CH2-CD 3.48Å; W262-P270 HydrophobicContact CH2-CG 4.16Å; W262-P270 HydrophobicContact CZ2-CB 4Å; W262-P270 HydrophobicContact CZ2-CG 4.16Å; W262-P270 HydrophobicContact CZ3-CB 4.28Å; W262-P270 HydrophobicContact CZ3-CG 4.5Å; W262-P270 VanDerWaalsContact CZ3-N 3.33Å
263	L	97.3	Very high	95.2	Very high	66 Å²	66	53.4 Å²	53.4	35%	0.346	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	136.4	166.8	-76.1	171	0	0	0	109	R265 Q266 V271	L263-R265 PolarHBondContact O-N 2.82Å; L263-Q266 HydrophobicContact CB-CB 4.23Å; L263-Q266 CarbonylContact O-C 3.53Å; L263-Q266 PolarHBondContact O-N 3.5Å; L263-V271 HydrophobicContact CB-CG2 4.03Å; L263-V271 HydrophobicContact CD1-CG2 3.48Å; L263-V271 VanDerWaalsContact CD1-CG2 3.48Å; L263-V271 HydrophobicContact CG-CG2 3.57Å
264	I	95.6	Very high	95	Very high	38 Å²	38	55.7 Å²	55.7	20%	0.195	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-38.6	176.6	-65.4	175.6	0	0	0	111.3	L220 W243 G247 K248 Q266	L220-I264 HydrophobicContact CD2-CD1 4.16Å; L220-I264 HydrophobicContact CD2-CG1 4.3Å; L220-I264 HydrophobicContact CD2-CG2 3.72Å; W243-I264 HydrophobicContact CH2-CD1 3.66Å; W243-I264 HydrophobicContact CH2-CG1 4.01Å; W243-I264 HydrophobicContact CZ3-CD1 3.7Å; W243-I264 HydrophobicContact CZ3-CG1 4.04Å; G247-I264 WeakPolarHBondContact O-CD1 3.43Å; K248-I264 WeakPolarHBondContact O-CG1 3.12Å; K248-I264 PolarHBondContact O-N 3.03Å; I264-Q266 PolarHBondContact O-N 3.5Å
265	R	94.5	Very high	94.9	Very high	241 Å²	241	56 Å²	56	91%	0.909	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.1	-11.4	-179.3	-64.8	-175.5	178.4	-175.1	-2.4	113.9	L263 P267	L263-R265 PolarHBondContact O-N 2.82Å; R265-P267 VanDerWaalsContact C-CD 3.47Å
266	Q	94	Very high	94.9	Very high	67 Å²	67	55.3 Å²	55.3	31%	0.313	27%	0.268	S	S	.	.			trans	-128.7	69	-178.9	-168.7	-173.7	-38.9	0	0	110.6	L263 I264 Q268 R269	L263-Q266 HydrophobicContact CB-CB 4.23Å; L263-Q266 CarbonylContact O-C 3.53Å; L263-Q266 PolarHBondContact O-N 3.5Å; I264-Q266 PolarHBondContact O-N 3.5Å; Q266-Q268 VanDerWaalsContact C-N 3.3Å; Q266-Q268 PolarHBondContact O-N 2.84Å; Q266-R269 VanDerWaalsContact NE2-CG 3.32Å; Q266-R269 PolarHBondContact NE2-O 2.94Å
267	P	92.8	Very high	94.9	Very high	32 Å²	32	54.5 Å²	54.5	21%	0.208	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-18.8	-174.3	28.8	-35.2	0	0	0	114.5	A230 R231 F232 R265 R269	A230-P267 HydrophobicContact CB-CB 4.32Å; R231-P267 WeakPolarHBondContact O-CB 3.42Å; F232-P267 HydrophobicContact CD1-CB 3.82Å; F232-P267 HydrophobicContact CE1-CB 3.65Å; F232-P267 HydrophobicContact CZ-CB 4.24Å; R265-P267 VanDerWaalsContact C-CD 3.47Å; P267-R269 VanDerWaalsContact C-N 3.33Å; P267-R269 PolarHBondContact O-N 3.41Å
268	Q	91.7	Very high	94.8	Very high	172 Å²	172	55.1 Å²	55.1	80%	0.804	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.1	-26.3	-172.8	-60.3	-57.7	-33	0	0	114	Q266	Q266-Q268 VanDerWaalsContact C-N 3.3Å; Q266-Q268 PolarHBondContact O-N 2.84Å
269	R	93.9	Very high	94.1	Very high	176 Å²	176	60 Å²	60	66%	0.664	30%	0.301	S	S	*	.	S	Bend	trans	-158.9	149.3	179.1	68.6	-178.5	-178.1	177.9	1.1	110.8	W262 Q266 P267	W262-R269 VanDerWaalsContact CZ3-C 3.49Å; Q266-R269 VanDerWaalsContact NE2-CG 3.32Å; Q266-R269 PolarHBondContact NE2-O 2.94Å; P267-R269 VanDerWaalsContact C-N 3.33Å; P267-R269 PolarHBondContact O-N 3.41Å
270	P	96	Very high	93.4	Very high	30 Å²	30	62.8 Å²	62.8	20%	0.195	32%	0.321	C	S	.	.			trans	-62.6	152.4	173.6	27.7	-32.6	0	0	0	110.6	A260 T261 W262 V273	A260-P270 HydrophobicContact CB-CB 4.12Å; T261-P270 CarbonylContact O-C 3.6Å; T261-P270 WeakPolarHBondContact O-CA 3.48Å; T261-P270 WeakPolarHBondContact O-CB 3.43Å; W262-P270 HydrophobicContact CD2-CB 3.97Å; W262-P270 HydrophobicContact CE3-CB 4.13Å; W262-P270 HydrophobicContact CH2-CB 4.22Å; W262-P270 VanDerWaalsContact CH2-CD 3.48Å; W262-P270 HydrophobicContact CH2-CG 4.16Å; W262-P270 HydrophobicContact CZ2-CB 4Å; W262-P270 HydrophobicContact CZ2-CG 4.16Å; W262-P270 HydrophobicContact CZ3-CB 4.28Å; W262-P270 HydrophobicContact CZ3-CG 4.5Å; W262-P270 VanDerWaalsContact CZ3-N 3.33Å; P270-V273 HydrophobicContact CB-CG2 3.92Å; P270-V273 HydrophobicContact CG-CG2 3.39Å
271	V	95.8	Very high	92.3	Very high	76 Å²	76	71.2 Å²	71.2	46%	0.461	36%	0.36	S	S	.	.	S	Bend	trans	-77.2	-37.8	176.9	179.7	0	0	0	0	110.9	T261 L263	T261-V271 PolarHBondContact O-N 2.96Å; L263-V271 HydrophobicContact CB-CG2 4.03Å; L263-V271 HydrophobicContact CD1-CG2 3.48Å; L263-V271 VanDerWaalsContact CD1-CG2 3.48Å; L263-V271 HydrophobicContact CG-CG2 3.57Å
272	S	94.9	Very high	91.6	Very high	47 Å²	47	74.3 Å²	74.3	33%	0.329	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	137.8	175.5	59.9	0	0	0	0	109.6	A260 T261	A260-S272 CarbonylContact C-O 3.57Å; A260-S272 WeakPolarHBondContact CA-O 3.42Å; T261-S272 VanDerWaalsContact CB-OG 3.31Å; T261-S272 WeakPolarHBondContact CB-OG 3.28Å; T261-S272 PolarHBondContact N-O 2.72Å; T261-S272 PolarHBondContact OG1-OG 2.8Å
273	V	95.5	Very high	91.1	Very high	47 Å²	47	76.6 Å²	76.6	29%	0.285	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	125.3	167.9	-175.1	0	0	0	0	106.1	L258 L259 A260 P270 V283	L258-V273 HydrophobicContact CB-CG1 4.44Å; L258-V273 HydrophobicContact CD1-CG1 4.43Å; L258-V273 HydrophobicContact CD2-CG1 4.27Å; L259-V273 WeakPolarHBondContact O-CA 3.25Å; A260-V273 HydrophobicContact CB-CG2 4.09Å; P270-V273 HydrophobicContact CB-CG2 3.92Å; P270-V273 HydrophobicContact CG-CG2 3.39Å; V273-V283 HydrophobicContact CB-CG2 4.41Å; V273-V283 HydrophobicContact CG1-CG2 4.12Å; V273-V283 WeakPolarHBondContact O-CG2 3.42Å
274	I	94.5	Very high	90.5	Very high	49 Å²	49	74.6 Å²	74.6	25%	0.251	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	148.9	-178.9	63.7	172.9	0	0	0	109.8	L259 P276	L259-I274 HydrophobicContact CB-CD1 4.48Å; L259-I274 HydrophobicContact CB-CG1 3.9Å; L259-I274 PolarHBondContact N-O 3.08Å; L259-I274 PolarHBondContact O-N 3.14Å; I274-P276 HydrophobicContact CD1-CG 4.09Å; I274-P276 HydrophobicContact CG1-CG 4.16Å
275	C	94.2	Very high	90	Very high	6 Å²	6	80.8 Å²	80.8	4%	0.041	42%	0.417	C	S	.	.			trans	-109.6	94.1	164.7	-174.7	0	0	0	0	106.9	L258 H277 A278	L258-C275 HydrophobicContact CD2-CB 4.09Å; C275-H277 PolarHBondContact O-N 2.75Å; C275-A278 HydrophobicContact CB-CB 3.84Å; C275-A278 VanDerWaalsContact O-CB 3.28Å; C275-A278 WeakPolarHBondContact O-CB 3.3Å; C275-A278 PolarHBondContact O-N 2.94Å
276	P	92.8	Very high	89.5	Confident	23 Å²	23	71.8 Å²	71.8	15%	0.149	39%	0.387	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-23.8	-166.2	-25.9	34.8	0	0	0	115.4	G257 L259 I274 I293 F310 L368	G257-P276 VanDerWaalsContact O-CD 3.27Å; G257-P276 WeakPolarHBondContact O-CD 3.4Å; L259-P276 HydrophobicContact CD1-CG 3.66Å; L259-P276 HydrophobicContact CG-CG 4.09Å; I274-P276 HydrophobicContact CD1-CG 4.09Å; I274-P276 HydrophobicContact CG1-CG 4.16Å; P276-I293 HydrophobicContact CG-CD1 4.4Å; P276-F310 HydrophobicContact CB-CE1 4.31Å; P276-F310 HydrophobicContact CB-CE2 4.46Å; P276-F310 HydrophobicContact CB-CZ 3.65Å; P276-F310 HydrophobicContact CG-CE1 4.35Å; P276-F310 HydrophobicContact CG-CE2 4.45Å; P276-F310 HydrophobicContact CG-CZ 3.87Å; P276-L368 HydrophobicContact CB-CD1 4.28Å
277	H	91.8	Very high	89.1	Confident	36 Å²	36	72.2 Å²	72.2	17%	0.167	39%	0.387	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.9	0.3	178.7	-66.8	-72.1	0	0	0	113.3	C275 Y290 F310 G313 M359 T361	C275-H277 PolarHBondContact O-N 2.75Å; H277-Y290 HydrophobicContact CB-CD1 4.31Å; H277-Y290 HydrophobicContact CB-CE1 4.14Å; H277-F310 AromaticContact CD2-CE2 3.96Å; H277-F310 AromaticContact NE2-CE2 3.38Å; H277-F310 WeakPolarHBondContact NE2-CE2 3.16Å; H277-F310 AromaticContact NE2-CZ 3.7Å; H277-G313 WeakPolarHBondContact CB-O 3.39Å; H277-G313 PolarHBondContact CD2-O 2.97Å; H277-M359 WeakPolarHBondContact CE1-CE 3.38Å; H277-M359 WeakPolarHBondContact NE2-CE 3.29Å; H277-T361 PolarHBondContact CE1-OG1 2.78Å; H277-T361 PolarHBondContact NE2-OG1 2.86Å; H277-T361 VanDerWaalsContact NE2-OG1 3.07Å
278	A	90.3	Very high	88.8	Confident	13 Å²	13	73.6 Å²	73.6	11%	0.107	40%	0.401	C	S	.	.	S	Bend	trans	-72.4	147	172.8	0	0	0	0	0	110.6	C275 S280 P284 Y290	C275-A278 HydrophobicContact CB-CB 3.84Å; C275-A278 VanDerWaalsContact O-CB 3.28Å; C275-A278 WeakPolarHBondContact O-CB 3.3Å; C275-A278 PolarHBondContact O-N 2.94Å; A278-S280 PolarHBondContact O-N 3.17Å; A278-P284 HydrophobicContact CB-CG 3.85Å; A278-Y290 WeakPolarHBondContact CA-OH 3.31Å
279	P	82.4	Confident	88.6	Confident	108 Å²	108	69.8 Å²	69.8	70%	0.701	38%	0.382	S	S	*	.	S	Bend	trans	-68	-19	179.6	26.1	-33.7	0	0	0	113.4
280	S	80.7	Confident	88.5	Confident	59 Å²	59	61.9 Å²	61.9	41%	0.413	35%	0.352	S	S	.	.	S	Bend	trans	-112	152.2	177.2	-177.4	0	0	0	0	110.8	A278 T282	A278-S280 PolarHBondContact O-N 3.17Å; S280-T282 PolarHBondContact O-N 2.87Å; S280-T282 PolarHBondContact OG-N 2.83Å; S280-T282 PolarHBondContact OG-OG1 3.03Å
281	E	74.2	Confident	88.2	Confident	177 Å²	177	62 Å²	62	83%	0.827	35%	0.35	S	S	*	.	S	Bend	trans	-65.2	-24	170.4	-67.6	-170.1	166.3	0	0	112.3
282	T	82.7	Confident	88.1	Confident	98 Å²	98	59.5 Å²	59.5	60%	0.601	34%	0.335	S	S	*	.	S	Bend	trans	-79.2	135.3	173.2	57	0	0	0	0	110.4	S280 P284	S280-T282 PolarHBondContact O-N 2.87Å; S280-T282 PolarHBondContact OG-N 2.83Å; S280-T282 PolarHBondContact OG-OG1 3.03Å; T282-P284 WeakPolarHBondContact O-CD 3.49Å; T282-P284 VanDerWaalsContact O-N 3.14Å
283	V	87.1	Confident	88.1	Confident	48 Å²	48	57.2 Å²	57.2	29%	0.291	32%	0.32	S	S	.	.	P	Polyproline II helix	trans	-55.4	120.9	172.4	-179.1	0	0	0	0	108.5	L258 V273 Y287	L258-V283 HydrophobicContact CD2-CG1 3.85Å; L258-V283 HydrophobicContact CD2-CG2 4.33Å; V273-V283 HydrophobicContact CB-CG2 4.41Å; V273-V283 HydrophobicContact CG1-CG2 4.12Å; V273-V283 WeakPolarHBondContact O-CG2 3.42Å; V283-Y287 HydrophobicContact CG1-CD1 4.17Å; V283-Y287 HydrophobicContact CG1-CG 3.99Å
284	P	86	Confident	88.1	Confident	24 Å²	24	60.4 Å²	60.4	16%	0.156	33%	0.326	C	S	.	.	P	Polyproline II helix	trans	-74.3	151	-176.1	31.9	-36.1	0	0	0	110.4	A278 T282 D286 Y287 Y290	A278-P284 HydrophobicContact CB-CG 3.85Å; T282-P284 WeakPolarHBondContact O-CD 3.49Å; T282-P284 VanDerWaalsContact O-N 3.14Å; P284-D286 WeakPolarHBondContact CB-OD1 3.32Å; P284-D286 PolarHBondContact O-N 3.39Å; P284-D286 VanDerWaalsContact O-N 3.15Å; P284-Y287 WeakPolarHBondContact O-CB 3.17Å; P284-Y287 VanDerWaalsContact O-CD1 3.23Å; P284-Y287 WeakPolarHBondContact O-CD1 3.44Å; P284-Y287 PolarHBondContact O-N 3.49Å; P284-Y287 VanDerWaalsContact O-N 3.09Å; P284-Y290 HydrophobicContact CG-CE2 3.97Å
285	D	83.6	Confident	88.2	Confident	167 Å²	167	60.5 Å²	60.5	89%	0.893	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-26	179.4	-67	-33.5	0	0	0	112.4	Y287	D285-Y287 VanDerWaalsContact C-N 3.34Å
286	D	83.8	Confident	88.3	Confident	52 Å²	52	60.5 Å²	60.5	28%	0.278	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.5	21.2	179.2	80.9	-37.7	0	0	0	113.3	P284 A288 F289 R315	P284-D286 WeakPolarHBondContact CB-OD1 3.32Å; P284-D286 PolarHBondContact O-N 3.39Å; P284-D286 VanDerWaalsContact O-N 3.15Å; D286-A288 PolarHBondContact O-N 3.46Å; D286-F289 HydrophobicContact CB-CD2 3.8Å; D286-F289 HydrophobicContact CB-CE2 4.07Å; D286-F289 VanDerWaalsContact O-CD2 3.3Å; D286-F289 WeakPolarHBondContact O-CD2 3.19Å; D286-F289 PolarHBondContact O-N 3.02Å; D286-R315 IonicContact OD2-CZ 2.9Å; D286-R315 IonicContact OD2-NH2 3.5Å; D286-R315 PolarHBondContact OD2-NH2 3.13Å
287	Y	87.1	Confident	88.5	Confident	76 Å²	76	61.3 Å²	61.3	30%	0.298	33%	0.329	S	S	.	.	G	3₁₀ helix	trans	-56.4	-20.8	-179.3	72.7	-78.9	0	0	0	114.1	H256 L258 V283 P284 D285 F289 Y290	H256-Y287 HydrophobicContact CB-CD2 3.47Å; H256-Y287 VanDerWaalsContact CB-CD2 3.47Å; H256-Y287 HydrophobicContact CB-CE2 3.86Å; H256-Y287 WeakPolarHBondContact CB-O 3.47Å; H256-Y287 AromaticContact ND1-CE2 3.81Å; L258-Y287 HydrophobicContact CD1-CD2 3.88Å; L258-Y287 HydrophobicContact CD1-CE2 3.85Å; L258-Y287 HydrophobicContact CD2-CD2 4.14Å; L258-Y287 HydrophobicContact CG-CD2 4.17Å; V283-Y287 HydrophobicContact CG1-CD1 4.17Å; V283-Y287 HydrophobicContact CG1-CG 3.99Å; P284-Y287 WeakPolarHBondContact O-CB 3.17Å; P284-Y287 VanDerWaalsContact O-CD1 3.23Å; P284-Y287 WeakPolarHBondContact O-CD1 3.44Å; P284-Y287 PolarHBondContact O-N 3.49Å; P284-Y287 VanDerWaalsContact O-N 3.09Å; D285-Y287 VanDerWaalsContact C-N 3.34Å; Y287-F289 PolarHBondContact O-N 3.5Å; Y287-F289 VanDerWaalsContact O-N 3.08Å; Y287-Y290 WeakPolarHBondContact O-CB 3.49Å; Y287-Y290 WeakPolarHBondContact O-CD2 3.34Å; Y287-Y290 PolarHBondContact O-N 3.38Å
288	A	86.3	Confident	88.6	Confident	62 Å²	62	61.2 Å²	61.2	51%	0.512	33%	0.327	S	S	.	.	G	3₁₀ helix	trans	-57	-21.4	174.2	0	0	0	0	0	113.9	D286 Y290	D286-A288 PolarHBondContact O-N 3.46Å; A288-Y290 VanDerWaalsContact C-N 3.3Å; A288-Y290 PolarHBondContact O-N 2.75Å
289	F	87	Confident	88.8	Confident	92 Å²	92	61.5 Å²	61.5	40%	0.404	33%	0.327	S	S	.	.	G	3₁₀ helix	trans	-81.2	-3.1	175.9	-66.1	-64.9	0	0	0	114.5	D286 Y287 S316 A319	D286-F289 HydrophobicContact CB-CD2 3.8Å; D286-F289 HydrophobicContact CB-CE2 4.07Å; D286-F289 VanDerWaalsContact O-CD2 3.3Å; D286-F289 WeakPolarHBondContact O-CD2 3.19Å; D286-F289 PolarHBondContact O-N 3.02Å; Y287-F289 PolarHBondContact O-N 3.5Å; Y287-F289 VanDerWaalsContact O-N 3.08Å; F289-S316 VanDerWaalsContact O-CB 3.26Å; F289-S316 WeakPolarHBondContact O-CB 3.2Å; F289-S316 PolarHBondContact O-N 3.4Å; F289-A319 HydrophobicContact CB-CB 3.95Å; F289-A319 HydrophobicContact CD1-CB 3.54Å; F289-A319 HydrophobicContact CD2-CB 4.28Å; F289-A319 HydrophobicContact CE1-CB 4.07Å; F289-A319 HydrophobicContact CG-CB 3.67Å
290	Y	90.9	Very high	89.3	Confident	9 Å²	9	56.8 Å²	56.8	4%	0.035	30%	0.296	C	S	.	.	B	Isolated β-bridge	trans	-88.8	143.4	176.8	-66.4	-104.1	0	0	0	110.2	H256 H277 A278 P284 Y287 A288 R315	H256-Y290 VanDerWaalsContact CA-O 3.28Å; H256-Y290 WeakPolarHBondContact CA-O 3.46Å; H277-Y290 HydrophobicContact CB-CD1 4.31Å; H277-Y290 HydrophobicContact CB-CE1 4.14Å; A278-Y290 WeakPolarHBondContact CA-OH 3.31Å; P284-Y290 HydrophobicContact CG-CE2 3.97Å; Y287-Y290 WeakPolarHBondContact O-CB 3.49Å; Y287-Y290 WeakPolarHBondContact O-CD2 3.34Å; Y287-Y290 PolarHBondContact O-N 3.38Å; A288-Y290 VanDerWaalsContact C-N 3.3Å; A288-Y290 PolarHBondContact O-N 2.75Å; Y290-R315 HydrophobicContact CD1-CB 4.16Å; Y290-R315 HydrophobicContact CE1-CB 4.04Å; Y290-R315 HydrophobicContact CE1-CG 4.29Å; Y290-R315 HydrophobicContact CE2-CG 4.46Å
291	E	90.7	Very high	89.7	Confident	34 Å²	34	54.6 Å²	54.6	16%	0.159	28%	0.28	C	S	.	.	P	Polyproline II helix	trans	-81.7	157.2	179.7	-60.1	-170	178	0	0	110.4	G257 G313 G314 S316 S356	G257-E291 VanDerWaalsContact CA-O 3.29Å; G257-E291 WeakPolarHBondContact CA-O 3.14Å; G257-E291 PolarHBondContact N-O 2.9Å; E291-G313 VanDerWaalsContact O-CA 3.3Å; E291-G313 WeakPolarHBondContact O-CA 3.31Å; E291-G314 PolarHBondContact N-O 2.82Å; E291-S316 PolarHBondContact OE1-OG 3.13Å; E291-S356 VanDerWaalsContact CB-CB 3.42Å; E291-S356 WeakPolarHBondContact CB-OG 3.38Å; E291-S356 WeakPolarHBondContact OE2-CA 3.44Å; E291-S356 WeakPolarHBondContact OE2-CB 3.15Å; E291-S356 PolarHBondContact OE2-N 3.48Å; E291-S356 PolarHBondContact OE2-OG 3.24Å
292	P	93.4	Very high	90.3	Very high	22 Å²	22	55.8 Å²	55.8	14%	0.143	28%	0.277	C	S	.	.	P	Polyproline II helix	trans	-65.6	147.9	-173.1	-21.9	34.5	0	0	0	113.5	Y239 N255 G313	Y239-P292 HydrophobicContact CD2-CB 4.24Å; Y239-P292 HydrophobicContact CE2-CB 3.66Å; Y239-P292 HydrophobicContact CE2-CG 4.35Å; N255-P292 WeakPolarHBondContact OD1-CG 3.39Å; P292-G313 PolarHBondContact O-N 3.21Å
293	I	95.6	Very high	90.4	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	109.5	167.4	-64.6	170.7	0	0	0	108.5	Y239 S253 H254 G257 L259 P276 F310 S311	Y239-I293 WeakPolarHBondContact CB-O 3.39Å; S253-I293 VanDerWaalsContact CB-O 3.28Å; S253-I293 WeakPolarHBondContact CB-O 3.25Å; S253-I293 PolarHBondContact OG-O 2.89Å; H254-I293 PolarHBondContact O-N 3.39Å; H254-I293 VanDerWaalsContact O-N 3.16Å; G257-I293 VanDerWaalsContact O-CD1 3.27Å; G257-I293 WeakPolarHBondContact O-CD1 3.06Å; L259-I293 HydrophobicContact CD1-CD1 4.34Å; L259-I293 HydrophobicContact CD2-CD1 3.85Å; L259-I293 HydrophobicContact CD2-CG2 4.07Å; L259-I293 HydrophobicContact CG-CD1 3.68Å; P276-I293 HydrophobicContact CG-CD1 4.4Å; I293-F310 HydrophobicContact CD1-CD2 3.84Å; I293-F310 HydrophobicContact CD1-CE2 3.87Å; I293-F310 HydrophobicContact CG1-CD2 3.98Å; I293-F310 HydrophobicContact CG1-CE2 4.28Å; I293-F310 HydrophobicContact CG2-CB 3.75Å; I293-F310 HydrophobicContact CG2-CD2 3.81Å; I293-F310 HydrophobicContact CG2-CG 4.12Å; I293-S311 WeakPolarHBondContact CA-O 3.26Å
294	R	94.8	Very high	90.4	Very high	113 Å²	113	56.1 Å²	56.1	43%	0.426	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	-36.6	-168.8	-63.7	-65.8	-178.3	89.7	0.4	114.4	Y239 S311	Y239-R294 WeakPolarHBondContact CB-O 3.28Å; Y239-R294 VanDerWaalsContact CE1-CD 3.46Å; R294-S311 PolarHBondContact N-O 2.87Å; R294-S311 VanDerWaalsContact N-O 3.11Å
295	L	95.9	Very high	90.5	Very high	52 Å²	52	59.3 Å²	59.3	27%	0.272	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	141	-177.9	-68	169.9	0	0	0	108.5	F310 S311 Q379 F380	L295-F310 WeakPolarHBondContact O-CA 3.38Å; L295-F310 VanDerWaalsContact O-CB 3.25Å; L295-F310 WeakPolarHBondContact O-CB 3.46Å; L295-S311 PolarHBondContact N-OG 2.99Å; L295-S311 PolarHBondContact O-N 2.86Å; L295-Q379 HydrophobicContact CD1-CB 4.23Å; L295-Q379 HydrophobicContact CD1-CG 3.83Å; L295-F380 HydrophobicContact CB-CD1 4.39Å; L295-F380 HydrophobicContact CB-CE1 3.67Å; L295-F380 HydrophobicContact CB-CZ 4.26Å; L295-F380 HydrophobicContact CD1-CD1 4.43Å; L295-F380 HydrophobicContact CD1-CE1 4.5Å
296	V	97.2	Very high	91	Very high	5 Å²	5	53.2 Å²	53.2	3%	0.03	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	137.2	175.3	61.6	0	0	0	0	110.9	S240 V242 L251 L259 I308 I309 F310	S240-V296 PolarHBondContact OG-N 2.85Å; V242-V296 HydrophobicContact CG1-CG1 4.02Å; V242-V296 HydrophobicContact CG1-CG2 4.34Å; L251-V296 HydrophobicContact CD2-CG2 3.62Å; L251-V296 HydrophobicContact CG-CG2 4.47Å; L259-V296 HydrophobicContact CD2-CB 4.45Å; L259-V296 HydrophobicContact CD2-CG2 4.27Å; V296-I308 HydrophobicContact CG2-CG2 4.01Å; V296-I309 CarbonylContact C-O 3.38Å; V296-I309 WeakPolarHBondContact CA-O 3.36Å; V296-F310 HydrophobicContact CB-CB 4.05Å; V296-F310 HydrophobicContact CG2-CB 4.06Å
297	E	96.3	Very high	91.5	Very high	41 Å²	41	51 Å²	51	19%	0.192	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	139.5	169.3	-68.8	-172.4	-179.6	0	0	109.8	L299 I308 I309 F380 T382	E297-L299 HydrophobicContact CB-CD1 4.31Å; E297-L299 HydrophobicContact CB-CG 4.29Å; E297-I308 WeakPolarHBondContact O-CA 3.38Å; E297-I309 PolarHBondContact N-O 3.34Å; E297-I309 PolarHBondContact O-N 2.8Å; E297-F380 HydrophobicContact CB-CE2 4.15Å; E297-F380 HydrophobicContact CG-CE2 3.73Å; E297-F380 HydrophobicContact CG-CZ 4.23Å; E297-T382 VanDerWaalsContact OE2-CB 3.28Å; E297-T382 WeakPolarHBondContact OE2-CB 3.45Å; E297-T382 WeakPolarHBondContact OE2-CG2 3.39Å; E297-T382 PolarHBondContact OE2-OG1 3.41Å
298	W	95.6	Very high	91.9	Very high	34 Å²	34	48.2 Å²	48.2	13%	0.129	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	103.3	178.5	-174.7	10.4	0	0	0	109.2	V242 H244 L251 T261 F307 I308	V242-W298 HydrophobicContact CG1-CB 3.64Å; V242-W298 HydrophobicContact CG2-CB 4.1Å; H244-W298 HydrophobicContact CB-CD2 4.32Å; H244-W298 HydrophobicContact CB-CE3 3.87Å; H244-W298 HydrophobicContact CB-CH2 3.81Å; H244-W298 HydrophobicContact CB-CZ2 4.23Å; H244-W298 HydrophobicContact CB-CZ3 3.62Å; H244-W298 AromaticContact CD2-CE2 3.55Å; H244-W298 AromaticContact CD2-CH2 3.88Å; H244-W298 AromaticContact CD2-CZ2 3.42Å; H244-W298 VanDerWaalsContact CD2-CZ2 3.42Å; H244-W298 WeakPolarHBondContact CD2-CZ2 3.25Å; H244-W298 AromaticContact CD2-NE1 3.98Å; H244-W298 AromaticContact CG-CH2 4Å; L251-W298 HydrophobicContact CB-CE3 3.7Å; L251-W298 HydrophobicContact CB-CZ3 4.12Å; L251-W298 HydrophobicContact CD2-CB 4.47Å; T261-W298 HydrophobicContact CG2-CH2 4.29Å; T261-W298 HydrophobicContact CG2-CZ3 4.4Å; W298-F307 WeakPolarHBondContact CA-O 3.48Å; W298-I308 HydrophobicContact CG-CG1 4.2Å
299	L	94.5	Very high	92.5	Very high	19 Å²	19	45.3 Å²	45.3	10%	0.099	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	111.7	-164.7	-59.6	165.4	0	0	0	110.4	E297 P306 F307 T382 M393 P395	E297-L299 HydrophobicContact CB-CD1 4.31Å; E297-L299 HydrophobicContact CB-CG 4.29Å; L299-P306 CarbonylContact O-C 3.6Å; L299-P306 VanDerWaalsContact O-CA 3.26Å; L299-P306 WeakPolarHBondContact O-CA 3.38Å; L299-P306 WeakPolarHBondContact O-CB 3.37Å; L299-F307 HydrophobicContact CB-CB 4.29Å; L299-F307 PolarHBondContact N-O 2.8Å; L299-F307 PolarHBondContact O-N 2.89Å; L299-T382 HydrophobicContact CD1-CG2 3.48Å; L299-T382 VanDerWaalsContact CD1-CG2 3.48Å; L299-T382 VanDerWaalsContact CD1-OG1 3.26Å; L299-T382 WeakPolarHBondContact CD1-OG1 3.47Å; L299-M393 HydrophobicContact CD2-CB 4.46Å; L299-M393 HydrophobicContact CD2-CG 4.26Å; L299-P395 HydrophobicContact CB-CG 4.14Å; L299-P395 HydrophobicContact CD1-CB 4.06Å; L299-P395 HydrophobicContact CD1-CG 3.92Å
300	P	91.5	Very high	92.9	Very high	9 Å²	9	40.9 Å²	40.9	6%	0.058	21%	0.205	C	C	.	.			trans	-70.6	150.2	175.7	33.5	-40.7	0	0	0	112	W245 M393 D394	W245-P300 HydrophobicContact CB-CG 3.75Å; W245-P300 VanDerWaalsContact CD1-CG 3.44Å; W245-P300 HydrophobicContact CG-CB 3.95Å; W245-P300 HydrophobicContact CG-CG 3.62Å; P300-M393 HydrophobicContact CG-CG 4.39Å; P300-M393 PolarHBondContact O-N 3.05Å; P300-D394 PolarHBondContact O-N 3.01Å
301	T	90.4	Very high	93.2	Very high	12 Å²	12	40.8 Å²	40.8	7%	0.074	21%	0.205	C	C	.	.			trans	-125.9	154.2	-179.1	52.2	0	0	0	0	109.3	N303 G304 E305 F307 D394	T301-N303 VanDerWaalsContact CB-OD1 3.27Å; T301-N303 WeakPolarHBondContact CB-OD1 3.22Å; T301-N303 PolarHBondContact O-N 2.69Å; T301-N303 PolarHBondContact OG1-OD1 3.17Å; T301-G304 PolarHBondContact O-N 3.36Å; T301-G304 VanDerWaalsContact O-N 3.14Å; T301-E305 PolarHBondContact OG1-N 2.84Å; T301-E305 PolarHBondContact OG1-O 2.86Å; T301-F307 HydrophobicContact CG2-CD2 3.51Å; T301-F307 HydrophobicContact CG2-CE2 3.75Å; T301-D394 WeakPolarHBondContact CA-OD1 3.44Å
302	R	86.5	Confident	93.2	Very high	202 Å²	202	39.2 Å²	39.2	76%	0.762	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-25.3	176.1	-73.7	171.9	-163.5	-144	-2	113.6	G304 T392 D394	R302-G304 PolarHBondContact O-N 2.78Å; R302-T392 HydrophobicContact CG-CG2 4.36Å; R302-D394 WeakPolarHBondContact CD-OD2 3.39Å; R302-D394 WeakPolarHBondContact CG-OD2 3.41Å; R302-D394 IonicContact CZ-OD2 3.52Å; R302-D394 PolarHBondContact N-OD1 2.59Å; R302-D394 IonicContact NE-OD2 3.97Å; R302-D394 PolarHBondContact NE-OD2 2.92Å
303	N	85.1	Confident	93.1	Very high	92 Å²	92	38.2 Å²	38.2	49%	0.492	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-1.9	178.9	81.6	-28.2	0	0	0	113.3	T301 E305 R364	T301-N303 VanDerWaalsContact CB-OD1 3.27Å; T301-N303 WeakPolarHBondContact CB-OD1 3.22Å; T301-N303 PolarHBondContact O-N 2.69Å; T301-N303 PolarHBondContact OG1-OD1 3.17Å; N303-E305 VanDerWaalsContact C-N 3.33Å; N303-E305 PolarHBondContact O-N 3.3Å; N303-E305 PolarHBondContact OD1-N 2.86Å; N303-R364 PolarHBondContact ND2-NH2 2.75Å
304	G	85.6	Confident	92.7	Very high	62 Å²	62	38.4 Å²	38.4	64%	0.639	19%	0.194	S	C	*	.	S	Bend	trans	85.5	-7.2	176.3	0	0	0	0	0	115.4	T301 R302 P306	T301-G304 PolarHBondContact O-N 3.36Å; T301-G304 VanDerWaalsContact O-N 3.14Å; R302-G304 PolarHBondContact O-N 2.78Å; G304-P306 WeakPolarHBondContact O-CD 3.3Å
305	E	89.8	Confident	92.2	Very high	90 Å²	90	36.9 Å²	36.9	42%	0.421	19%	0.188	S	C	.	.			trans	-101.9	102.9	175.7	-70.4	-166.8	138.6	0	0	110.8	T301 N303 R364	T301-E305 PolarHBondContact OG1-N 2.84Å; T301-E305 PolarHBondContact OG1-O 2.86Å; N303-E305 VanDerWaalsContact C-N 3.33Å; N303-E305 PolarHBondContact O-N 3.3Å; N303-E305 PolarHBondContact OD1-N 2.86Å; E305-R364 HydrophobicContact CB-CG 4.25Å; E305-R364 IonicContact OE2-NE 3.86Å
306	P	92.9	Very high	91.1	Very high	39 Å²	39	36 Å²	36	25%	0.253	19%	0.186	S	C	.	.			trans	-69.4	149.7	-176.4	30	-35.4	0	0	0	111.5	L299 G304	L299-P306 CarbonylContact O-C 3.6Å; L299-P306 VanDerWaalsContact O-CA 3.26Å; L299-P306 WeakPolarHBondContact O-CA 3.38Å; L299-P306 WeakPolarHBondContact O-CB 3.37Å; G304-P306 WeakPolarHBondContact O-CD 3.3Å
307	F	94.8	Very high	89.4	Confident	5 Å²	5	38.4 Å²	38.4	2%	0.022	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	130.8	162.8	-74.9	-87.4	0	0	0	109.1	W298 L299 T301 I309 I362 P395 L411 F416	W298-F307 WeakPolarHBondContact CA-O 3.48Å; L299-F307 HydrophobicContact CB-CB 4.29Å; L299-F307 PolarHBondContact N-O 2.8Å; L299-F307 PolarHBondContact O-N 2.89Å; T301-F307 HydrophobicContact CG2-CD2 3.51Å; T301-F307 HydrophobicContact CG2-CE2 3.75Å; F307-I309 HydrophobicContact CB-CD1 4.48Å; F307-I309 HydrophobicContact CB-CG1 4.27Å; F307-I362 HydrophobicContact CD1-CG2 3.77Å; F307-I362 HydrophobicContact CE1-CG2 4.08Å; F307-P395 HydrophobicContact CB-CG 4.47Å; F307-P395 HydrophobicContact CD2-CG 3.63Å; F307-P395 HydrophobicContact CE2-CG 4.11Å; F307-P395 HydrophobicContact CG-CG 4.21Å; F307-L411 HydrophobicContact CE1-CD2 4.4Å; F307-L411 HydrophobicContact CZ-CB 4.48Å; F307-F416 HydrophobicContact CE1-CE1 4.08Å; F307-F416 HydrophobicContact CE1-CZ 4.18Å
308	I	96.1	Very high	87.6	Confident	19 Å²	19	39.6 Å²	39.6	10%	0.097	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	109.5	163.8	-58.5	171.4	0	0	0	106.2	L251 L259 V296 E297 W298 F310 K363	L251-I308 HydrophobicContact CD2-CG2 3.91Å; L259-I308 HydrophobicContact CD1-CG2 4.43Å; V296-I308 HydrophobicContact CG2-CG2 4.01Å; E297-I308 WeakPolarHBondContact O-CA 3.38Å; W298-I308 HydrophobicContact CG-CG1 4.2Å; I308-F310 HydrophobicContact CG2-CD1 4.21Å; I308-K363 HydrophobicContact CB-CB 4.19Å; I308-K363 PolarHBondContact N-O 2.91Å; I308-K363 PolarHBondContact O-N 3.23Å
309	I	97.2	Very high	85.5	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	130.1	-177.2	-56.1	-176.4	0	0	0	107.9	V296 E297 F307 L360 T361 I362 F380 T382 L411	V296-I309 CarbonylContact C-O 3.38Å; V296-I309 WeakPolarHBondContact CA-O 3.36Å; E297-I309 PolarHBondContact N-O 3.34Å; E297-I309 PolarHBondContact O-N 2.8Å; F307-I309 HydrophobicContact CB-CD1 4.48Å; F307-I309 HydrophobicContact CB-CG1 4.27Å; I309-L360 HydrophobicContact CG2-CD1 3.82Å; I309-L360 HydrophobicContact CG2-CD2 4Å; I309-L360 HydrophobicContact CG2-CG 3.99Å; I309-T361 CarbonylContact C-O 3.52Å; I309-T361 WeakPolarHBondContact CA-O 3.33Å; I309-I362 HydrophobicContact CD1-CG1 4.46Å; I309-I362 HydrophobicContact CG1-CG1 4.28Å; I309-I362 HydrophobicContact CG1-CG2 4.32Å; I309-I362 HydrophobicContact CG2-CG1 4.37Å; I309-F380 HydrophobicContact CB-CE2 4.13Å; I309-F380 HydrophobicContact CB-CZ 4.43Å; I309-F380 HydrophobicContact CG2-CD2 4.17Å; I309-F380 HydrophobicContact CG2-CE2 3.7Å; I309-F380 HydrophobicContact CG2-CZ 3.99Å; I309-F380 WeakPolarHBondContact O-CZ 3.32Å; I309-T382 HydrophobicContact CD1-CG2 3.78Å; I309-L411 HydrophobicContact CD1-CD1 4.01Å; I309-L411 HydrophobicContact CD1-CD2 4.3Å
310	F	97.2	Very high	83.2	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	155.3	-177.4	62.6	-88.2	0	0	0	113.1	L259 P276 H277 I293 L295 V296 I308 T361 L368	L259-F310 HydrophobicContact CD1-CD1 4.28Å; L259-F310 HydrophobicContact CD1-CE1 4.34Å; P276-F310 HydrophobicContact CB-CE1 4.31Å; P276-F310 HydrophobicContact CB-CE2 4.46Å; P276-F310 HydrophobicContact CB-CZ 3.65Å; P276-F310 HydrophobicContact CG-CE1 4.35Å; P276-F310 HydrophobicContact CG-CE2 4.45Å; P276-F310 HydrophobicContact CG-CZ 3.87Å; H277-F310 AromaticContact CD2-CE2 3.96Å; H277-F310 AromaticContact NE2-CE2 3.38Å; H277-F310 WeakPolarHBondContact NE2-CE2 3.16Å; H277-F310 AromaticContact NE2-CZ 3.7Å; I293-F310 HydrophobicContact CD1-CD2 3.84Å; I293-F310 HydrophobicContact CD1-CE2 3.87Å; I293-F310 HydrophobicContact CG1-CD2 3.98Å; I293-F310 HydrophobicContact CG1-CE2 4.28Å; I293-F310 HydrophobicContact CG2-CB 3.75Å; I293-F310 HydrophobicContact CG2-CD2 3.81Å; I293-F310 HydrophobicContact CG2-CG 4.12Å; L295-F310 WeakPolarHBondContact O-CA 3.38Å; L295-F310 VanDerWaalsContact O-CB 3.25Å; L295-F310 WeakPolarHBondContact O-CB 3.46Å; V296-F310 HydrophobicContact CB-CB 4.05Å; V296-F310 HydrophobicContact CG2-CB 4.06Å; I308-F310 HydrophobicContact CG2-CD1 4.21Å; F310-T361 HydrophobicContact CD1-CG2 4.46Å; F310-T361 HydrophobicContact CE1-CG2 3.6Å; F310-T361 HydrophobicContact CE2-CG2 3.99Å; F310-T361 VanDerWaalsContact CZ-CB 3.42Å; F310-T361 HydrophobicContact CZ-CG2 3.32Å; F310-T361 PolarHBondContact N-O 3.49Å; F310-T361 PolarHBondContact O-N 3.3Å; F310-L368 HydrophobicContact CZ-CD1 4.43Å
311	S	95.5	Very high	80.9	Confident	6 Å²	6	47.4 Å²	47.4	4%	0.042	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	137.1	179.3	64.8	0	0	0	0	111.8	I293 R294 L295	I293-S311 WeakPolarHBondContact CA-O 3.26Å; R294-S311 PolarHBondContact N-O 2.87Å; R294-S311 VanDerWaalsContact N-O 3.11Å; L295-S311 PolarHBondContact N-OG 2.99Å; L295-S311 PolarHBondContact O-N 2.86Å
312	G	92.4	Very high	78.3	Confident	2 Å²	2	51.5 Å²	51.5	2%	0.021	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	81.2	-155.5	-179.2	0	0	0	0	0	113.5	S356 M359	G312-S356 WeakPolarHBondContact CA-O 3.28Å; G312-M359 PolarHBondContact N-O 3.24Å; G312-M359 WeakPolarHBondContact O-CE 3.17Å
313	G	90.8	Very high	75.8	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	28%	0.282	C	S	.	.			trans	86.7	-1.2	-176.1	0	0	0	0	0	115.5	H277 E291 P292	H277-G313 WeakPolarHBondContact CB-O 3.39Å; H277-G313 PolarHBondContact CD2-O 2.97Å; E291-G313 VanDerWaalsContact O-CA 3.3Å; E291-G313 WeakPolarHBondContact O-CA 3.31Å; P292-G313 PolarHBondContact O-N 3.21Å
314	G	87.3	Confident	73.2	Confident	4 Å²	4	51.8 Å²	51.8	4%	0.041	30%	0.298	C	S	.	.	P	Polyproline II helix	trans	-63.1	161.3	174.6	0	0	0	0	0	113.1	E291 M359	E291-G314 PolarHBondContact N-O 2.82Å; G314-M359 PolarHBondContact N-SD 2.86Å; G314-M359 VanDerWaalsContact N-SD 3.41Å
315	R	82.8	Confident	70.5	Confident	82 Å²	82	53.1 Å²	53.1	31%	0.309	30%	0.298	S	S	.	.	B	Isolated β-bridge	trans	-83	129.4	176.9	-164.4	177.8	-172.8	-170.9	4.8	109.8	D286 Y290	D286-R315 IonicContact OD2-CZ 2.9Å; D286-R315 IonicContact OD2-NH2 3.5Å; D286-R315 PolarHBondContact OD2-NH2 3.13Å; Y290-R315 HydrophobicContact CD1-CB 4.16Å; Y290-R315 HydrophobicContact CE1-CB 4.04Å; Y290-R315 HydrophobicContact CE1-CG 4.29Å; Y290-R315 HydrophobicContact CE2-CG 4.46Å
316	S	73.3	Confident	67.4	Low	32 Å²	32	53.3 Å²	53.3	22%	0.224	31%	0.31	C	S	.	.	P	Polyproline II helix	trans	-65.7	134.2	-178.4	-167.1	0	0	0	0	111.3	F289 E291 A318 A319	F289-S316 VanDerWaalsContact O-CB 3.26Å; F289-S316 WeakPolarHBondContact O-CB 3.2Å; F289-S316 PolarHBondContact O-N 3.4Å; E291-S316 PolarHBondContact OE1-OG 3.13Å; S316-A318 PolarHBondContact O-N 3.41Å; S316-A319 PolarHBondContact O-N 3.17Å
317	P	62.7	Low	64.4	Low	56 Å²	56	58.5 Å²	58.5	36%	0.364	34%	0.34	S	S	.	.	G	3₁₀ helix	trans	-63.3	-22.4	178.3	20.6	-29.1	0	0	0	113.2	A319 Q320 M353	P317-A319 PolarHBondContact O-N 3.18Å; P317-A319 VanDerWaalsContact O-N 3.07Å; P317-Q320 PolarHBondContact O-N 3.35Å; P317-M353 HydrophobicContact CB-CE 4.17Å
318	A	57.3	Low	61.1	Low	67 Å²	67	62.3 Å²	62.3	55%	0.554	37%	0.372	S	S	*	.	G	3₁₀ helix	trans	-60.6	-19.3	179.5	0	0	0	0	0	114	S316	S316-A318 PolarHBondContact O-N 3.41Å
319	A	50.9	Low	57.8	Low	5 Å²	5	67.3 Å²	67.3	4%	0.041	40%	0.404	C	S	.	.	G	3₁₀ helix	trans	-72.4	-27.3	-179.4	0	0	0	0	0	113.6	F289 S316 P317	F289-A319 HydrophobicContact CB-CB 3.95Å; F289-A319 HydrophobicContact CD1-CB 3.54Å; F289-A319 HydrophobicContact CD2-CB 4.28Å; F289-A319 HydrophobicContact CE1-CB 4.07Å; F289-A319 HydrophobicContact CG-CB 3.67Å; S316-A319 PolarHBondContact O-N 3.17Å; P317-A319 PolarHBondContact O-N 3.18Å; P317-A319 VanDerWaalsContact O-N 3.07Å
320	Q	46.3	Very low	54.4	Low	105 Å²	105	73.3 Å²	73.3	49%	0.491	44%	0.441	S	S	.	.	H	α-helix	trans	-83.5	-26	-172.3	-139.3	164.2	16.2	0	0	113.1	P317 V322	P317-Q320 PolarHBondContact O-N 3.35Å; Q320-V322 PolarHBondContact O-N 3.43Å
321	T	43.1	Very low	50.9	Low	115 Å²	115	80.8 Å²	80.8	71%	0.706	48%	0.481	S	S	*	.	H	α-helix	trans	-68.1	-24.2	178	-36.9	0	0	0	0	112.6
322	V	37.5	Very low	47.7	Very low	98 Å²	98	87.6 Å²	87.6	59%	0.594	52%	0.522	S	S	*	.	H	α-helix	trans	-86.8	-23.9	-176.3	-174.6	0	0	0	0	112.6	Q320 H324 S325	Q320-V322 PolarHBondContact O-N 3.43Å; V322-H324 PolarHBondContact O-N 3.4Å; V322-S325 PolarHBondContact O-N 3.01Å
323	I	33.8	Very low	44.5	Very low	118 Å²	118	92.5 Å²	92.5	61%	0.605	56%	0.556	S	S	*	*	H	α-helix	trans	-82.1	-10.5	-172.1	-59.8	176.6	0	0	0	113.4
324	H	29.9	Very low	41.3	Very low	182 Å²	182	97.4 Å²	97.4	84%	0.843	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100	10	171.5	-79.6	-68.1	0	0	0	115.2	V322	V322-H324 PolarHBondContact O-N 3.4Å
325	S	29.1	Very low	38.1	Very low	90 Å²	90	103.7 Å²	103.7	63%	0.629	63%	0.628	S	S	*	*	S	Bend	trans	-126.7	51.4	-179.2	54.4	0	0	0	0	113.9	V322	V322-S325 PolarHBondContact O-N 3.01Å
326	S	24.9	Very low	35.3	Very low	95 Å²	95	105.6 Å²	105.6	66%	0.664	65%	0.653	S	S	*	*	S	Bend	trans	-158.1	121.8	158	60.9	0	0	0	0	112.6
327	V	28.5	Very low	33	Very low	148 Å²	148	111.3 Å²	111.3	90%	0.897	68%	0.681	S	S	*	*	S	Bend	trans	79.3	114.5	169.3	-163.9	0	0	0	0	113.5
328	A	27	Very low	31	Very low	84 Å²	84	115.6 Å²	115.6	69%	0.694	70%	0.7	S	S	*	*			cis	-150.5	158.5	22.6	0	0	0	0	0	112.9
329	T	25.5	Very low	29.4	Very low	124 Å²	124	119.3 Å²	119.3	76%	0.761	71%	0.71	S	S	*	*			trans	-34.2	154.4	161.1	42.1	0	0	0	0	118.2
330	T	27.5	Very low	28.1	Very low	127 Å²	127	123.7 Å²	123.7	78%	0.779	74%	0.741	S	S	*	*			trans	80.7	99.4	157.5	54.4	0	0	0	0	120.3
331	N	23.4	Very low	26.9	Very low	156 Å²	156	125.1 Å²	125.1	83%	0.834	75%	0.752	S	S	*	*			trans	24.5	107.6	130.8	-60.9	-5.7	0	0	0	118.6
332	V	26.9	Very low	26	Very low	150 Å²	150	127.7 Å²	127.7	91%	0.909	76%	0.756	S	S	*	*				-154.4	135.3	122.7	-171.1	0	0	0	0	108.8
333	S	25.5	Very low	25.5	Very low	104 Å²	104	128.2 Å²	128.2	73%	0.727	76%	0.764	S	S	*	*			trans	-67.3	149.4	178.7	-45	0	0	0	0	114.7
334	S	23.2	Very low	25.1	Very low	103 Å²	103	132.6 Å²	132.6	72%	0.72	78%	0.782	S	S	*	*			trans	72.8	114.2	142.6	-53.5	0	0	0	0	121.2
335	T	21.7	Very low	25.1	Very low	137 Å²	137	128.6 Å²	128.6	84%	0.84	77%	0.774	S	S	*	*			trans	56.5	110.2	134.4	60.4	0	0	0	0	120.1
336	S	24.3	Very low	25	Very low	121 Å²	121	131.2 Å²	131.2	85%	0.846	78%	0.781	S	S	*	*			trans	-162.7	138.3	130.5	69.1	0	0	0	0	113.4
337	L	24.1	Very low	25.4	Very low	153 Å²	153	132 Å²	132	80%	0.801	78%	0.784	S	S	*	*			trans	-62	162.4	169.2	-68.3	152.8	0	0	0	113.6
338	L	21.2	Very low	25.6	Very low	145 Å²	145	132 Å²	132	76%	0.759	78%	0.779	S	S	*	*			trans	70.3	112.8	151.7	-64.7	146.8	0	0	0	118.3
339	N	22.9	Very low	26	Very low	145 Å²	145	134.6 Å²	134.6	78%	0.775	78%	0.78	S	S	*	*				170.9	138.3	105.2	-91.5	-26.3	0	0	0	114.4
340	S	23.4	Very low	26.6	Very low	98 Å²	98	133.6 Å²	133.6	69%	0.685	78%	0.778	S	S	*	*			trans	62.6	121.1	139.3	67.4	0	0	0	0	121.9
341	D	21.9	Very low	27.3	Very low	134 Å²	134	130.2 Å²	130.2	72%	0.717	76%	0.76	S	S	*	*				91.5	122.8	124.9	-85.5	14.3	0	0	0	121.7
342	Q	23.8	Very low	28.1	Very low	169 Å²	169	125.4 Å²	125.4	79%	0.79	74%	0.738	S	S	*	*			trans	80.4	88.1	144.4	-63.7	175.6	40.7	0	0	118.5
343	S	27.6	Very low	29	Very low	110 Å²	110	123.7 Å²	123.7	77%	0.769	72%	0.722	S	S	*	*				175.6	122.2	113	40.3	0	0	0	0	109.7	S345	S343-S345 PolarHBondContact O-N 2.91Å
344	E	25.3	Very low	30.2	Very low	210 Å²	210	119.6 Å²	119.6	98%	0.981	69%	0.692	S	S	*	*			trans	-68.1	89.2	174.9	-72.2	-178.8	145.9	0	0	110
345	S	28.8	Very low	32.1	Very low	97 Å²	97	117.1 Å²	117.1	68%	0.678	68%	0.675	S	S	*	*			trans	-102.4	116.5	156	59.6	0	0	0	0	107.8	S343	S343-S345 PolarHBondContact O-N 2.91Å
346	D	28	Very low	34.1	Very low	146 Å²	146	111 Å²	111	78%	0.781	64%	0.638	S	S	*	*			trans	-38.1	118.8	178.4	-95.8	-44.8	0	0	0	112.5	N348	D346-N348 PolarHBondContact O-N 2.8Å
347	P	32.8	Very low	36.6	Very low	111 Å²	111	107.9 Å²	107.9	72%	0.721	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.6	0.8	-179.3	-14.7	28.3	0	0	0	114.5	L349	P347-L349 VanDerWaalsContact C-N 3.34Å; P347-L349 PolarHBondContact O-N 3.12Å
348	N	33.5	Very low	39.7	Very low	147 Å²	147	103.2 Å²	103.2	79%	0.786	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.9	8	-168.6	-75.5	-19.9	0	0	0	115.3	D346	D346-N348 PolarHBondContact O-N 2.8Å
349	L	33.8	Very low	43.1	Very low	139 Å²	139	96.4 Å²	96.4	73%	0.728	55%	0.55	S	S	*	*			trans	-115.1	47	170.2	-156.2	70.9	0	0	0	111.5	P347 S351	P347-L349 VanDerWaalsContact C-N 3.34Å; P347-L349 PolarHBondContact O-N 3.12Å; L349-S351 PolarHBondContact O-N 2.8Å
350	S	38.8	Very low	46.5	Very low	103 Å²	103	89.5 Å²	89.5	72%	0.72	51%	0.513	S	S	*	.			trans	-58.4	108.5	159.3	61.4	0	0	0	0	107.8	C352	S350-C352 PolarHBondContact O-N 3.39Å; S350-C352 VanDerWaalsContact O-N 3.11Å
351	S	42.1	Very low	49.9	Very low	56 Å²	56	84.9 Å²	84.9	39%	0.392	48%	0.48	S	S	.	.			trans	-38.3	115.2	179.1	55	0	0	0	0	112	L349 M353	L349-S351 PolarHBondContact O-N 2.8Å; S351-M353 WeakPolarHBondContact O-CG 3.46Å; S351-M353 PolarHBondContact O-N 2.82Å
352	C	41.1	Very low	53.5	Low	56 Å²	56	78.5 Å²	78.5	38%	0.378	45%	0.447	S	S	.	.			trans	-58.7	97.7	179.8	-162.9	0	0	0	0	109.9	S350 V354	S350-C352 PolarHBondContact O-N 3.39Å; S350-C352 VanDerWaalsContact O-N 3.11Å; C352-V354 PolarHBondContact O-N 2.88Å; C352-V354 WeakPolarHBondContact SG-CG2 3.11Å
353	M	45.8	Very low	56.8	Low	114 Å²	114	73.3 Å²	73.3	56%	0.562	42%	0.421	S	S	*	.			trans	-75.9	37.5	-179.3	-62.4	-169.1	83.2	0	0	113	P317 S351	P317-M353 HydrophobicContact CB-CE 4.17Å; S351-M353 WeakPolarHBondContact O-CG 3.46Å; S351-M353 PolarHBondContact O-N 2.82Å
354	V	51.1	Low	59.8	Low	17 Å²	17	72 Å²	72	10%	0.103	40%	0.399	C	S	.	.			trans	-95.3	133.9	-174.5	-179.4	0	0	0	0	109.4	C352 S356 H358 Q372	C352-V354 PolarHBondContact O-N 2.88Å; C352-V354 WeakPolarHBondContact SG-CG2 3.11Å; V354-S356 PolarHBondContact O-N 2.82Å; V354-H358 HydrophobicContact CG1-CB 4.11Å; V354-Q372 HydrophobicContact CG1-CG 4.09Å; V354-Q372 HydrophobicContact CG2-CG 4.1Å
355	S	62.3	Low	62.7	Low	52 Å²	52	63.4 Å²	63.4	36%	0.364	37%	0.367	S	S	.	.			trans	-54.8	124.2	170.2	174.2	0	0	0	0	109.3	N357 H358	S355-N357 PolarHBondContact O-N 2.82Å; S355-H358 PolarHBondContact O-N 2.82Å
356	S	64.6	Low	65.4	Low	9 Å²	9	68.4 Å²	68.4	6%	0.063	38%	0.377	C	S	.	.	G	3₁₀ helix	trans	-60.5	-16.9	-170.8	67.7	0	0	0	0	115	E291 G312 V354 H358 M359	E291-S356 VanDerWaalsContact CB-CB 3.42Å; E291-S356 WeakPolarHBondContact CB-OG 3.38Å; E291-S356 WeakPolarHBondContact OE2-CA 3.44Å; E291-S356 WeakPolarHBondContact OE2-CB 3.15Å; E291-S356 PolarHBondContact OE2-N 3.48Å; E291-S356 PolarHBondContact OE2-OG 3.24Å; G312-S356 WeakPolarHBondContact CA-O 3.28Å; V354-S356 PolarHBondContact O-N 2.82Å; S356-H358 PolarHBondContact O-N 2.96Å; S356-M359 WeakPolarHBondContact O-CG 3.34Å
357	N	76.8	Confident	68.3	Low	54 Å²	54	67 Å²	67	29%	0.289	36%	0.364	S	S	.	.	G	3₁₀ helix	trans	-68.9	-10.6	174.4	-65.8	-50.5	0	0	0	112.3	S355 K376 L377	S355-N357 PolarHBondContact O-N 2.82Å; N357-K376 HydrophobicContact CB-CD 4.08Å; N357-K376 HydrophobicContact CB-CG 3.98Å; N357-K376 CarbonylContact O-C 3.47Å; N357-K376 VanDerWaalsContact O-CA 3.29Å; N357-K376 WeakPolarHBondContact O-CA 3.41Å; N357-L377 PolarHBondContact O-N 2.76Å
358	H	88	Confident	71.1	Confident	56 Å²	56	64.7 Å²	64.7	26%	0.259	35%	0.345	S	S	.	.	G	3₁₀ helix	trans	-118.9	34.5	-174.8	-58.9	85.3	0	0	0	112.1	V354 S355 S356 L373 K376	V354-H358 HydrophobicContact CG1-CB 4.11Å; S355-H358 PolarHBondContact O-N 2.82Å; S356-H358 PolarHBondContact O-N 2.96Å; H358-L373 PolarHBondContact O-N 3.31Å; H358-K376 PolarHBondContact CD2-N 2.84Å; H358-K376 PolarHBondContact NE2-N 2.88Å
359	M	91.9	Very high	74	Confident	2 Å²	2	59.3 Å²	59.3	1%	0.01	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	144.7	-179.4	68.3	-177	-68.5	0	0	113.9	H277 G312 G314 S356 T361 V370 L371	H277-M359 WeakPolarHBondContact CE1-CE 3.38Å; H277-M359 WeakPolarHBondContact NE2-CE 3.29Å; G312-M359 PolarHBondContact N-O 3.24Å; G312-M359 WeakPolarHBondContact O-CE 3.17Å; G314-M359 PolarHBondContact N-SD 2.86Å; G314-M359 VanDerWaalsContact N-SD 3.41Å; S356-M359 WeakPolarHBondContact O-CG 3.34Å; M359-T361 WeakPolarHBondContact CE-OG1 3.27Å; M359-V370 HydrophobicContact CE-CG1 3.69Å; M359-L371 VanDerWaalsContact CA-O 3.32Å; M359-L371 WeakPolarHBondContact CA-O 3.42Å
360	L	95.3	Very high	76.7	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	133.9	166.5	-173.1	79.2	0	0	0	108.9	I309 L371 L373 L377 F380 V398 I400	I309-L360 HydrophobicContact CG2-CD1 3.82Å; I309-L360 HydrophobicContact CG2-CD2 4Å; I309-L360 HydrophobicContact CG2-CG 3.99Å; L360-L371 HydrophobicContact CB-CB 4.47Å; L360-L371 HydrophobicContact CB-CD1 4.48Å; L360-L371 HydrophobicContact CD2-CD1 4.17Å; L360-L371 PolarHBondContact N-O 2.91Å; L360-L371 WeakPolarHBondContact O-CB 3.45Å; L360-L371 PolarHBondContact O-N 2.93Å; L360-L373 HydrophobicContact CB-CD1 4.25Å; L360-L377 HydrophobicContact CB-CD1 4.16Å; L360-L377 HydrophobicContact CD1-CD1 3.91Å; L360-F380 HydrophobicContact CD1-CB 4.37Å; L360-F380 HydrophobicContact CD1-CD1 3.4Å; L360-F380 VanDerWaalsContact CD1-CD1 3.4Å; L360-F380 HydrophobicContact CD1-CD2 4.4Å; L360-F380 HydrophobicContact CD1-CE1 3.68Å; L360-F380 HydrophobicContact CD1-CG 3.81Å; L360-F380 HydrophobicContact CD1-CZ 4.3Å; L360-V398 HydrophobicContact CD2-CG1 4.22Å; L360-V398 HydrophobicContact CD2-CG2 4.34Å; L360-I400 HydrophobicContact CD2-CD1 3.5Å; L360-I400 HydrophobicContact CD2-CG1 3.97Å
361	T	95.8	Very high	79.2	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	131.4	180	-57.2	0	0	0	0	110.3	H277 I309 F310 M359 L368 V369 V370	H277-T361 PolarHBondContact CE1-OG1 2.78Å; H277-T361 PolarHBondContact NE2-OG1 2.86Å; H277-T361 VanDerWaalsContact NE2-OG1 3.07Å; I309-T361 CarbonylContact C-O 3.52Å; I309-T361 WeakPolarHBondContact CA-O 3.33Å; F310-T361 HydrophobicContact CD1-CG2 4.46Å; F310-T361 HydrophobicContact CE1-CG2 3.6Å; F310-T361 HydrophobicContact CE2-CG2 3.99Å; F310-T361 VanDerWaalsContact CZ-CB 3.42Å; F310-T361 HydrophobicContact CZ-CG2 3.32Å; F310-T361 PolarHBondContact N-O 3.49Å; F310-T361 PolarHBondContact O-N 3.3Å; M359-T361 WeakPolarHBondContact CE-OG1 3.27Å; T361-L368 HydrophobicContact CG2-CD1 3.51Å; T361-L368 HydrophobicContact CG2-CD2 4.19Å; T361-L368 HydrophobicContact CG2-CG 3.66Å; T361-V369 CarbonylContact C-O 3.52Å; T361-V369 WeakPolarHBondContact CA-O 3.47Å; T361-V370 HydrophobicContact CG2-CG2 4.28Å
362	I	95.6	Very high	81.5	Confident	1 Å²	1	55.5 Å²	55.5	1%	0.005	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	112.5	176	-58	171.4	0	0	0	108.2	F307 I309 V369 L371 L411 F416	F307-I362 HydrophobicContact CD1-CG2 3.77Å; F307-I362 HydrophobicContact CE1-CG2 4.08Å; I309-I362 HydrophobicContact CD1-CG1 4.46Å; I309-I362 HydrophobicContact CG1-CG1 4.28Å; I309-I362 HydrophobicContact CG1-CG2 4.32Å; I309-I362 HydrophobicContact CG2-CG1 4.37Å; I362-V369 PolarHBondContact N-O 3.47Å; I362-V369 PolarHBondContact O-N 3.28Å; I362-L371 HydrophobicContact CD1-CD1 3.65Å; I362-L371 HydrophobicContact CG1-CD1 4.21Å; I362-L411 HydrophobicContact CD1-CD2 3.71Å; I362-F416 HydrophobicContact CB-CE2 4.24Å; I362-F416 HydrophobicContact CD1-CD1 4.35Å; I362-F416 HydrophobicContact CD1-CD2 4.07Å; I362-F416 HydrophobicContact CD1-CE2 4.3Å; I362-F416 HydrophobicContact CD1-CG 4.09Å; I362-F416 HydrophobicContact CG2-CE1 4.41Å; I362-F416 HydrophobicContact CG2-CE2 3.94Å; I362-F416 HydrophobicContact CG2-CZ 3.77Å
363	K	93.7	Very high	83.8	Confident	59 Å²	59	53.5 Å²	53.5	26%	0.257	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	126.2	173	-176.9	176.5	-179.9	-108	0	110.2	I308 K367 L368	I308-K363 HydrophobicContact CB-CB 4.19Å; I308-K363 PolarHBondContact N-O 2.91Å; I308-K363 PolarHBondContact O-N 3.23Å; K363-K367 WeakPolarHBondContact CA-O 3.07Å; K363-L368 HydrophobicContact CB-CD1 3.98Å; K363-L368 HydrophobicContact CD-CD1 4.41Å; K363-L368 HydrophobicContact CG-CD1 4.27Å
364	R	90.2	Very high	85.6	Confident	83 Å²	83	55.2 Å²	55.2	31%	0.313	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	116.4	172.7	-172.5	179.8	-177.3	174.5	4.2	109.5	N303 E305 K366 K367	N303-R364 PolarHBondContact ND2-NH2 2.75Å; E305-R364 HydrophobicContact CB-CG 4.25Å; E305-R364 IonicContact OE2-NE 3.86Å; R364-K366 PolarHBondContact O-N 3.41Å; R364-K367 PolarHBondContact N-O 2.71Å; R364-K367 WeakPolarHBondContact O-CB 3.38Å; R364-K367 PolarHBondContact O-N 3.08Å
365	G	86.7	Confident	87.3	Confident	30 Å²	30	56.9 Å²	56.9	31%	0.309	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.1	-120.3	-170.9	0	0	0	0	0	111
366	K	85.7	Confident	88.7	Confident	202 Å²	202	58.8 Å²	58.8	88%	0.878	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.3	-13	173.9	-62.7	-172.2	178.6	-171.6	0	113.9	R364	R364-K366 PolarHBondContact O-N 3.41Å
367	K	89.3	Confident	90.1	Very high	116 Å²	116	59.1 Å²	59.1	50%	0.504	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	125.2	-178.4	-170.1	-178.9	-178.5	-175.1	0	109.4	K363 R364 V369	K363-K367 WeakPolarHBondContact CA-O 3.07Å; R364-K367 PolarHBondContact N-O 2.71Å; R364-K367 WeakPolarHBondContact O-CB 3.38Å; R364-K367 PolarHBondContact O-N 3.08Å; K367-V369 HydrophobicContact CD-CG2 4.2Å; K367-V369 HydrophobicContact CG-CG2 4.12Å
368	L	91.7	Very high	91	Very high	63 Å²	63	58.3 Å²	58.3	33%	0.33	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	120.4	170.8	-166	88.5	0	0	0	107.7	P276 F310 T361 K363 V370	P276-L368 HydrophobicContact CB-CD1 4.28Å; F310-L368 HydrophobicContact CZ-CD1 4.43Å; T361-L368 HydrophobicContact CG2-CD1 3.51Å; T361-L368 HydrophobicContact CG2-CD2 4.19Å; T361-L368 HydrophobicContact CG2-CG 3.66Å; K363-L368 HydrophobicContact CB-CD1 3.98Å; K363-L368 HydrophobicContact CD-CD1 4.41Å; K363-L368 HydrophobicContact CG-CD1 4.27Å; L368-V370 HydrophobicContact CD2-CG2 4.08Å
369	V	92.9	Very high	91.4	Very high	33 Å²	33	57.9 Å²	57.9	20%	0.2	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	124	172.2	-178.2	0	0	0	0	108.8	T361 I362 K367 L371 F416	T361-V369 CarbonylContact C-O 3.52Å; T361-V369 WeakPolarHBondContact CA-O 3.47Å; I362-V369 PolarHBondContact N-O 3.47Å; I362-V369 PolarHBondContact O-N 3.28Å; K367-V369 HydrophobicContact CD-CG2 4.2Å; K367-V369 HydrophobicContact CG-CG2 4.12Å; V369-L371 HydrophobicContact CG1-CD2 4.22Å; V369-F416 HydrophobicContact CB-CD2 3.95Å; V369-F416 HydrophobicContact CB-CE2 3.89Å; V369-F416 HydrophobicContact CG1-CD2 3.93Å; V369-F416 HydrophobicContact CG1-CE2 4.39Å; V369-F416 HydrophobicContact CG2-CD2 3.94Å; V369-F416 HydrophobicContact CG2-CE2 3.61Å
370	V	92.3	Very high	91.7	Very high	51 Å²	51	58 Å²	58	31%	0.309	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	119.6	178.7	-172.5	0	0	0	0	108.5	M359 T361 L368	M359-V370 HydrophobicContact CE-CG1 3.69Å; T361-V370 HydrophobicContact CG2-CG2 4.28Å; L368-V370 HydrophobicContact CD2-CG2 4.08Å
371	L	91.3	Very high	91.7	Very high	29 Å²	29	59.1 Å²	59.1	15%	0.152	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	117.1	178.8	-58.3	164.2	0	0	0	108.1	M359 L360 I362 V369 I409	M359-L371 VanDerWaalsContact CA-O 3.32Å; M359-L371 WeakPolarHBondContact CA-O 3.42Å; L360-L371 HydrophobicContact CB-CB 4.47Å; L360-L371 HydrophobicContact CB-CD1 4.48Å; L360-L371 HydrophobicContact CD2-CD1 4.17Å; L360-L371 PolarHBondContact N-O 2.91Å; L360-L371 WeakPolarHBondContact O-CB 3.45Å; L360-L371 PolarHBondContact O-N 2.93Å; I362-L371 HydrophobicContact CD1-CD1 3.65Å; I362-L371 HydrophobicContact CG1-CD1 4.21Å; V369-L371 HydrophobicContact CG1-CD2 4.22Å; L371-I409 HydrophobicContact CD1-CD1 3.32Å; L371-I409 HydrophobicContact CD2-CD1 4.4Å; L371-I409 HydrophobicContact CG-CD1 4.35Å
372	Q	89.1	Confident	91.8	Very high	138 Å²	138	59.7 Å²	59.7	65%	0.645	30%	0.295	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.6	130.2	171.8	-179.5	171.2	-9.5	0	0	109.1	V354	V354-Q372 HydrophobicContact CG1-CG 4.09Å; V354-Q372 HydrophobicContact CG2-CG 4.1Å
373	L	89.9	Confident	91.8	Very high	15 Å²	15	59.7 Å²	59.7	8%	0.079	29%	0.294	C	S	.	.			trans	-109.4	142.4	-175.2	-57.6	164.6	0	0	0	109.5	H358 L360 H375 L377 I400 L402	H358-L373 PolarHBondContact O-N 3.31Å; L360-L373 HydrophobicContact CB-CD1 4.25Å; L373-H375 VanDerWaalsContact C-N 3.3Å; L373-H375 PolarHBondContact O-N 2.84Å; L373-L377 HydrophobicContact CD1-CB 3.95Å; L373-L377 HydrophobicContact CD1-CD1 3.71Å; L373-L377 HydrophobicContact CD1-CG 4.33Å; L373-I400 HydrophobicContact CD1-CG2 4.18Å; L373-I400 HydrophobicContact CD2-CD1 4.21Å; L373-L402 HydrophobicContact CB-CD1 4.37Å; L373-L402 HydrophobicContact CB-CD2 4.19Å; L373-L402 HydrophobicContact CD1-CD2 3.79Å; L373-L402 HydrophobicContact CD2-CD2 4.36Å; L373-L402 HydrophobicContact CG-CD2 4.33Å
374	D	83.7	Confident	91.8	Very high	149 Å²	149	57.2 Å²	57.2	80%	0.797	28%	0.284	S	S	*	.	S	Bend	trans	-69.3	-31.8	-177.9	-66.8	-30.9	0	0	0	112.5
375	H	87.4	Confident	91.7	Very high	52 Å²	52	57.7 Å²	57.7	24%	0.241	30%	0.296	C	S	.	.	S	Bend	trans	-122.5	160	179.7	-59.2	-81.6	0	0	0	111.3	L373 L377 L402 E404	L373-H375 VanDerWaalsContact C-N 3.3Å; L373-H375 PolarHBondContact O-N 2.84Å; H375-L377 PolarHBondContact O-N 2.84Å; H375-L402 HydrophobicContact CB-CB 3.9Å; H375-L402 HydrophobicContact CB-CD1 4.17Å; H375-E404 IonicContact CE1-OE2 3.74Å; H375-E404 PolarHBondContact CE1-OE2 3.23Å; H375-E404 IonicContact ND1-OE2 2.74Å; H375-E404 PolarHBondContact ND1-OE2 3.28Å
376	K	90.7	Very high	91.8	Very high	93 Å²	93	57 Å²	57	40%	0.404	29%	0.287	S	S	.	.			trans	-57.5	127.8	178.6	168.2	168.8	-178.2	-168.2	0	110.8	N357 H358 V378 L402 Q403	N357-K376 HydrophobicContact CB-CD 4.08Å; N357-K376 HydrophobicContact CB-CG 3.98Å; N357-K376 CarbonylContact O-C 3.47Å; N357-K376 VanDerWaalsContact O-CA 3.29Å; N357-K376 WeakPolarHBondContact O-CA 3.41Å; H358-K376 PolarHBondContact CD2-N 2.84Å; H358-K376 PolarHBondContact NE2-N 2.88Å; K376-V378 PolarHBondContact O-N 2.85Å; K376-L402 CarbonylContact O-C 3.56Å; K376-L402 VanDerWaalsContact O-CA 3.26Å; K376-L402 WeakPolarHBondContact O-CA 3.35Å; K376-Q403 HydrophobicContact CB-CB 4.25Å; K376-Q403 PolarHBondContact O-N 3.4Å
377	L	94.9	Very high	92	Very high	16 Å²	16	48 Å²	48	8%	0.084	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	125	170.6	-173.3	154.8	0	0	0	110	N357 L360 L373 H375 F380 I400 L402	N357-L377 PolarHBondContact O-N 2.76Å; L360-L377 HydrophobicContact CB-CD1 4.16Å; L360-L377 HydrophobicContact CD1-CD1 3.91Å; L373-L377 HydrophobicContact CD1-CB 3.95Å; L373-L377 HydrophobicContact CD1-CD1 3.71Å; L373-L377 HydrophobicContact CD1-CG 4.33Å; H375-L377 PolarHBondContact O-N 2.84Å; L377-F380 HydrophobicContact CD1-CD1 4.45Å; L377-I400 HydrophobicContact CD1-CG2 3.8Å; L377-I400 HydrophobicContact CG-CG2 4.09Å; L377-L402 HydrophobicContact CB-CD2 4.2Å
378	V	95.4	Very high	92	Very high	36 Å²	36	44.3 Å²	44.3	22%	0.218	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	-55.2	173.1	176.7	0	0	0	0	109.6	P58 K376 L401	P58-V378 HydrophobicContact CG-CG2 4.41Å; K376-V378 PolarHBondContact O-N 2.85Å; V378-L401 HydrophobicContact CB-CD2 4.18Å; V378-L401 HydrophobicContact CB-CG 4.19Å; V378-L401 WeakPolarHBondContact CB-O 3.46Å; V378-L401 HydrophobicContact CG1-CD2 3.96Å; V378-L401 PolarHBondContact N-O 3.35Å
379	Q	96.4	Very high	91.8	Very high	47 Å²	47	45.8 Å²	45.8	22%	0.22	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.8	160	179.3	-169.3	-179.6	-16.5	0	0	109.6	C60 I61 L295 L401	C60-Q379 VanDerWaalsContact CA-OE1 3.27Å; I61-Q379 HydrophobicContact CG2-CB 3.96Å; I61-Q379 HydrophobicContact CG2-CG 3.87Å; I61-Q379 VanDerWaalsContact N-OE1 3.1Å; I61-Q379 PolarHBondContact O-NE2 3.01Å; L295-Q379 HydrophobicContact CD1-CB 4.23Å; L295-Q379 HydrophobicContact CD1-CG 3.83Å; Q379-L401 PolarHBondContact N-O 3.41Å; Q379-L401 WeakPolarHBondContact O-CA 3.49Å; Q379-L401 WeakPolarHBondContact O-CB 3.34Å; Q379-L401 PolarHBondContact O-N 2.87Å
380	F	97.4	Very high	91.3	Very high	5 Å²	5	45.7 Å²	45.7	2%	0.022	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	160.1	165.5	68.1	-91.4	0	0	0	110.5	L295 E297 I309 L360 L377 V398 A399 I400	L295-F380 HydrophobicContact CB-CD1 4.39Å; L295-F380 HydrophobicContact CB-CE1 3.67Å; L295-F380 HydrophobicContact CB-CZ 4.26Å; L295-F380 HydrophobicContact CD1-CD1 4.43Å; L295-F380 HydrophobicContact CD1-CE1 4.5Å; E297-F380 HydrophobicContact CB-CE2 4.15Å; E297-F380 HydrophobicContact CG-CE2 3.73Å; E297-F380 HydrophobicContact CG-CZ 4.23Å; I309-F380 HydrophobicContact CB-CE2 4.13Å; I309-F380 HydrophobicContact CB-CZ 4.43Å; I309-F380 HydrophobicContact CG2-CD2 4.17Å; I309-F380 HydrophobicContact CG2-CE2 3.7Å; I309-F380 HydrophobicContact CG2-CZ 3.99Å; I309-F380 WeakPolarHBondContact O-CZ 3.32Å; L360-F380 HydrophobicContact CD1-CB 4.37Å; L360-F380 HydrophobicContact CD1-CD1 3.4Å; L360-F380 VanDerWaalsContact CD1-CD1 3.4Å; L360-F380 HydrophobicContact CD1-CD2 4.4Å; L360-F380 HydrophobicContact CD1-CE1 3.68Å; L360-F380 HydrophobicContact CD1-CG 3.81Å; L360-F380 HydrophobicContact CD1-CZ 4.3Å; L377-F380 HydrophobicContact CD1-CD1 4.45Å; F380-V398 HydrophobicContact CB-CG2 4.12Å; F380-V398 HydrophobicContact CD2-CG2 3.93Å; F380-V398 HydrophobicContact CG-CG2 4.39Å; F380-A399 CarbonylContact C-O 3.43Å; F380-A399 WeakPolarHBondContact CA-O 3.48Å; F380-A399 WeakPolarHBondContact CB-O 3.39Å; F380-I400 HydrophobicContact CB-CG1 4.4Å
381	T	96	Very high	91	Very high	23 Å²	23	46.1 Å²	46.1	14%	0.141	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	135.6	171.9	-171.9	0	0	0	0	109.4	I61 F63 L383 A399	I61-T381 HydrophobicContact CD1-CG2 4.2Å; I61-T381 HydrophobicContact CG1-CG2 4.28Å; I61-T381 HydrophobicContact CG2-CG2 4.19Å; F63-T381 HydrophobicContact CB-CG2 4.11Å; T381-L383 HydrophobicContact CG2-CD2 4.49Å; T381-A399 HydrophobicContact CG2-CB 4.11Å; T381-A399 PolarHBondContact N-O 3.29Å; T381-A399 PolarHBondContact O-N 3.16Å
382	T	96.9	Very high	90.6	Very high	13 Å²	13	46.8 Å²	46.8	8%	0.08	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	140.1	176.4	51.7	0	0	0	0	112.5	E297 L299 I309 V398	E297-T382 VanDerWaalsContact OE2-CB 3.28Å; E297-T382 WeakPolarHBondContact OE2-CB 3.45Å; E297-T382 WeakPolarHBondContact OE2-CG2 3.39Å; E297-T382 PolarHBondContact OE2-OG1 3.41Å; L299-T382 HydrophobicContact CD1-CG2 3.48Å; L299-T382 VanDerWaalsContact CD1-CG2 3.48Å; L299-T382 VanDerWaalsContact CD1-OG1 3.26Å; L299-T382 WeakPolarHBondContact CD1-OG1 3.47Å; I309-T382 HydrophobicContact CD1-CG2 3.78Å; T382-V398 HydrophobicContact CG2-CB 4.11Å; T382-V398 HydrophobicContact CG2-CG2 3.99Å
383	L	96.5	Very high	90.6	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	110.2	179	-49.6	-171.3	0	0	0	108.1	F63 T381 Y396 A397 A399 V408 P476	F63-L383 HydrophobicContact CB-CD2 4.4Å; F63-L383 HydrophobicContact CD1-CD2 3.65Å; F63-L383 HydrophobicContact CD2-CD2 3.88Å; F63-L383 HydrophobicContact CE1-CB 4.18Å; F63-L383 HydrophobicContact CE1-CD2 3.75Å; F63-L383 HydrophobicContact CE2-CD2 3.98Å; F63-L383 HydrophobicContact CG-CD2 3.72Å; F63-L383 HydrophobicContact CZ-CB 4.42Å; F63-L383 HydrophobicContact CZ-CD2 3.92Å; T381-L383 HydrophobicContact CG2-CD2 4.49Å; L383-Y396 HydrophobicContact CB-CD2 4.39Å; L383-Y396 HydrophobicContact CB-CE1 4.06Å; L383-Y396 HydrophobicContact CB-CE2 3.75Å; L383-Y396 HydrophobicContact CD1-CE2 4.34Å; L383-Y396 WeakPolarHBondContact O-CD1 3.47Å; L383-Y396 VanDerWaalsContact O-CE1 3.25Å; L383-Y396 WeakPolarHBondContact O-CE1 3.48Å; L383-Y396 PolarHBondContact O-N 3.08Å; L383-A397 HydrophobicContact CB-CB 4.14Å; L383-A397 HydrophobicContact CD1-CB 3.92Å; L383-A397 HydrophobicContact CG-CB 4.2Å; L383-A397 PolarHBondContact N-O 2.92Å; L383-A399 HydrophobicContact CD2-CB 4.17Å; L383-V408 HydrophobicContact CD1-CG1 4.17Å; L383-P476 HydrophobicContact CD1-CB 3.86Å; L383-P476 HydrophobicContact CD1-CG 3.72Å
384	C	93.5	Very high	90.6	Very high	7 Å²	7	42.9 Å²	42.9	5%	0.047	23%	0.227	C	C	.	.			trans	-119.5	156.5	177.3	-56.7	0	0	0	0	110	P65 M393	P65-C384 WeakPolarHBondContact CB-O 3Å; C384-M393 HydrophobicContact CB-CE 3.35Å
385	V	87.9	Confident	91.1	Very high	93 Å²	93	35.8 Å²	35.8	56%	0.564	19%	0.19	S	C	*	.	S	Bend	trans	-79.8	-41.7	178	179.7	0	0	0	0	111	Y396	V385-Y396 HydrophobicContact CG2-CD1 4.07Å; V385-Y396 HydrophobicContact CG2-CE1 3.99Å
386	S	89.2	Confident	91.5	Very high	15 Å²	15	34.5 Å²	34.5	11%	0.105	18%	0.183	C	C	.	.			trans	-85.1	138.7	178.8	-176.3	0	0	0	0	111.2	Y388 E391 M393	S386-Y388 VanDerWaalsContact C-N 3.29Å; S386-Y388 PolarHBondContact OG-N 3.39Å; S386-Y388 VanDerWaalsContact OG-N 3.1Å; S386-E391 WeakPolarHBondContact CB-OE1 3.15Å; S386-E391 PolarHBondContact OG-OE1 3.37Å; S386-M393 WeakPolarHBondContact O-CE 3.38Å
387	P	89.8	Confident	91.8	Very high	13 Å²	13	30.1 Å²	30.1	8%	0.084	16%	0.164	C	C	.	.			trans	-79.5	-9.3	168.4	32.4	-34.1	0	0	0	113.3	P65 V66 V106 V150 M1212	P65-P387 HydrophobicContact CG-CB 3.73Å; V66-P387 HydrophobicContact CG2-CG 4.38Å; V106-P387 HydrophobicContact CG1-CB 4.01Å; V150-P387 HydrophobicContact CG1-CB 4.24Å; V150-P387 HydrophobicContact CG2-CB 4.27Å; P387-M1212 HydrophobicContact CG-CE 3.88Å
388	Y	90.1	Very high	91.9	Very high	39 Å²	39	29.3 Å²	29.3	15%	0.153	16%	0.16	C	C	.	.			trans	-95.4	110.1	-169.3	-58.4	-68.7	0	0	0	112.5	V150 S386 S390 E391 M393 M1212 P1213 P1215	V150-Y388 HydrophobicContact CG1-CD1 4.5Å; V150-Y388 HydrophobicContact CG1-CE1 4.06Å; S386-Y388 VanDerWaalsContact C-N 3.29Å; S386-Y388 PolarHBondContact OG-N 3.39Å; S386-Y388 VanDerWaalsContact OG-N 3.1Å; Y388-S390 PolarHBondContact O-N 3.05Å; Y388-E391 WeakPolarHBondContact O-CG 3.15Å; Y388-M393 VanDerWaalsContact O-SD 3.38Å; Y388-M1212 WeakPolarHBondContact OH-CE 3.49Å; Y388-P1213 HydrophobicContact CE2-CB 4.44Å; Y388-P1213 WeakPolarHBondContact CE2-O 3.28Å; Y388-P1213 PolarHBondContact OH-O 2.82Å; Y388-P1215 HydrophobicContact CE1-CB 4.05Å; Y388-P1215 VanDerWaalsContact CE2-CA 3.49Å; Y388-P1215 HydrophobicContact CE2-CB 4.18Å
389	I	86.1	Confident	92	Very high	95 Å²	95	27.6 Å²	27.6	49%	0.487	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-1.2	178.7	61.8	164.9	0	0	0	115.4	P203	P203-I389 HydrophobicContact CB-CD1 4.04Å; P203-I389 HydrophobicContact CB-CG1 4.06Å
390	S	84.1	Confident	92	Very high	31 Å²	31	25.4 Å²	25.4	22%	0.217	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.5	3	-175.7	61.6	0	0	0	0	113.8	P203 Q204 Y388 P1216	P203-S390 WeakPolarHBondContact O-CB 3.3Å; Q204-S390 PolarHBondContact NE2-O 2.97Å; Y388-S390 PolarHBondContact O-N 3.05Å; S390-P1216 WeakPolarHBondContact OG-CG 3.36Å
391	E	84.2	Confident	91.9	Very high	59 Å²	59	25.1 Å²	25.1	28%	0.276	14%	0.138	S	C	.	.	S	Bend	trans	-129.4	179.7	177.5	59.1	178.2	-171.9	0	0	112	S386 Y388 M393 P1216	S386-E391 WeakPolarHBondContact CB-OE1 3.15Å; S386-E391 PolarHBondContact OG-OE1 3.37Å; Y388-E391 WeakPolarHBondContact O-CG 3.15Å; E391-M393 PolarHBondContact O-N 3.26Å; E391-P1216 HydrophobicContact CB-CB 4.47Å
392	T	84.6	Confident	91.8	Very high	43 Å²	43	24.1 Å²	24.1	26%	0.264	13%	0.132	S	C	.	.			trans	-64.6	129.6	171.6	51.9	0	0	0	0	109.9	R302	R302-T392 HydrophobicContact CG-CG2 4.36Å
393	M	87.3	Confident	91.5	Very high	20 Å²	20	26.6 Å²	26.6	10%	0.099	14%	0.142	C	C	.	.			trans	-90.6	-34.2	-172.1	-65.9	-58	-48.7	0	0	113.2	L299 P300 C384 S386 Y388 E391	L299-M393 HydrophobicContact CD2-CB 4.46Å; L299-M393 HydrophobicContact CD2-CG 4.26Å; P300-M393 HydrophobicContact CG-CG 4.39Å; P300-M393 PolarHBondContact O-N 3.05Å; C384-M393 HydrophobicContact CB-CE 3.35Å; S386-M393 WeakPolarHBondContact O-CE 3.38Å; Y388-M393 VanDerWaalsContact O-SD 3.38Å; E391-M393 PolarHBondContact O-N 3.26Å
394	D	90.1	Very high	91	Very high	51 Å²	51	30.5 Å²	30.5	27%	0.273	16%	0.16	S	C	.	.			trans	44.5	63.1	-175.6	-58.1	-54.4	0	0	0	112.7	P300 T301 R302 Y396	P300-D394 PolarHBondContact O-N 3.01Å; T301-D394 WeakPolarHBondContact CA-OD1 3.44Å; R302-D394 WeakPolarHBondContact CD-OD2 3.39Å; R302-D394 WeakPolarHBondContact CG-OD2 3.41Å; R302-D394 IonicContact CZ-OD2 3.52Å; R302-D394 PolarHBondContact N-OD1 2.59Å; R302-D394 IonicContact NE-OD2 3.97Å; R302-D394 PolarHBondContact NE-OD2 2.92Å; D394-Y396 PolarHBondContact O-N 3.31Å
395	P	95.1	Very high	90.7	Very high	1 Å²	1	31.8 Å²	31.8	1%	0.006	17%	0.167	C	C	.	.			trans	-61.2	130.1	-176.5	28.9	-36.6	0	0	0	110.3	L299 F307 L411	L299-P395 HydrophobicContact CB-CG 4.14Å; L299-P395 HydrophobicContact CD1-CB 4.06Å; L299-P395 HydrophobicContact CD1-CG 3.92Å; F307-P395 HydrophobicContact CB-CG 4.47Å; F307-P395 HydrophobicContact CD2-CG 3.63Å; F307-P395 HydrophobicContact CE2-CG 4.11Å; F307-P395 HydrophobicContact CG-CG 4.21Å; P395-L411 HydrophobicContact CB-CD1 3.84Å; P395-L411 HydrophobicContact CG-CD1 4.17Å
396	Y	95.2	Very high	90.9	Very high	25 Å²	25	27.4 Å²	27.4	10%	0.098	14%	0.14	C	C	.	.			trans	-101.4	-17.1	-176.8	62.4	-94.3	0	0	0	113.2	L383 V385 D394 L411 P476	L383-Y396 HydrophobicContact CB-CD2 4.39Å; L383-Y396 HydrophobicContact CB-CE1 4.06Å; L383-Y396 HydrophobicContact CB-CE2 3.75Å; L383-Y396 HydrophobicContact CD1-CE2 4.34Å; L383-Y396 WeakPolarHBondContact O-CD1 3.47Å; L383-Y396 VanDerWaalsContact O-CE1 3.25Å; L383-Y396 WeakPolarHBondContact O-CE1 3.48Å; L383-Y396 PolarHBondContact O-N 3.08Å; V385-Y396 HydrophobicContact CG2-CD1 4.07Å; V385-Y396 HydrophobicContact CG2-CE1 3.99Å; D394-Y396 PolarHBondContact O-N 3.31Å; Y396-L411 PolarHBondContact O-N 3.11Å; Y396-L411 VanDerWaalsContact O-N 3.12Å; Y396-P476 HydrophobicContact CD2-CB 4.46Å; Y396-P476 HydrophobicContact CE2-CB 3.68Å
397	A	97	Very high	91	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.1	166.4	175.6	0	0	0	0	0	111.1	L383 V408 I409 F419 P476	L383-A397 HydrophobicContact CB-CB 4.14Å; L383-A397 HydrophobicContact CD1-CB 3.92Å; L383-A397 HydrophobicContact CG-CB 4.2Å; L383-A397 PolarHBondContact N-O 2.92Å; A397-V408 HydrophobicContact CB-CG1 4.05Å; A397-I409 CarbonylContact C-O 3.52Å; A397-I409 WeakPolarHBondContact CA-O 3.27Å; A397-I409 VanDerWaalsContact CB-O 3.28Å; A397-I409 WeakPolarHBondContact CB-O 3.48Å; A397-F419 HydrophobicContact CB-CE2 3.92Å; A397-P476 HydrophobicContact CB-CG 4.34Å
398	V	97.1	Very high	91.3	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	126.6	169.3	58.8	0	0	0	0	109.6	L360 F380 T382 I400 V408 I409 L411	L360-V398 HydrophobicContact CD2-CG1 4.22Å; L360-V398 HydrophobicContact CD2-CG2 4.34Å; F380-V398 HydrophobicContact CB-CG2 4.12Å; F380-V398 HydrophobicContact CD2-CG2 3.93Å; F380-V398 HydrophobicContact CG-CG2 4.39Å; T382-V398 HydrophobicContact CG2-CB 4.11Å; T382-V398 HydrophobicContact CG2-CG2 3.99Å; V398-I400 HydrophobicContact CG1-CG1 4.46Å; V398-I400 HydrophobicContact CG2-CG1 4.27Å; V398-V408 CarbonylContact O-C 3.57Å; V398-V408 WeakPolarHBondContact O-CA 3.17Å; V398-I409 HydrophobicContact CG1-CB 3.78Å; V398-I409 HydrophobicContact CG1-CG2 4.4Å; V398-I409 PolarHBondContact N-O 3.23Å; V398-I409 PolarHBondContact O-N 2.97Å; V398-L411 HydrophobicContact CB-CD1 4.33Å; V398-L411 HydrophobicContact CG1-CD2 4.18Å; V398-L411 HydrophobicContact CG1-CG 4.41Å
399	A	97	Very high	91.5	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	126.8	173.3	0	0	0	0	0	109.5	I61 F380 T381 L383 V408	I61-A399 HydrophobicContact CD1-CB 4.41Å; F380-A399 CarbonylContact C-O 3.43Å; F380-A399 WeakPolarHBondContact CA-O 3.48Å; F380-A399 WeakPolarHBondContact CB-O 3.39Å; T381-A399 HydrophobicContact CG2-CB 4.11Å; T381-A399 PolarHBondContact N-O 3.29Å; T381-A399 PolarHBondContact O-N 3.16Å; L383-A399 HydrophobicContact CD2-CB 4.17Å; A399-V408 HydrophobicContact CB-CG2 4.03Å
400	I	96.1	Very high	91.9	Very high	0 Å²	0	21 Å²	21	0%	0	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	109.7	-172	-48	172.1	0	0	0	107.7	L360 L373 L377 F380 V398 L402 V407 I409	L360-I400 HydrophobicContact CD2-CD1 3.5Å; L360-I400 HydrophobicContact CD2-CG1 3.97Å; L373-I400 HydrophobicContact CD1-CG2 4.18Å; L373-I400 HydrophobicContact CD2-CD1 4.21Å; L377-I400 HydrophobicContact CD1-CG2 3.8Å; L377-I400 HydrophobicContact CG-CG2 4.09Å; F380-I400 HydrophobicContact CB-CG1 4.4Å; V398-I400 HydrophobicContact CG1-CG1 4.46Å; V398-I400 HydrophobicContact CG2-CG1 4.27Å; I400-L402 HydrophobicContact CG2-CD2 3.59Å; I400-L402 HydrophobicContact CG2-CG 4.44Å; I400-L402 PolarHBondContact O-N 3.22Å; I400-V407 HydrophobicContact CB-CB 4.41Å; I400-V407 PolarHBondContact N-O 3.41Å; I400-V407 PolarHBondContact O-N 3.29Å; I400-I409 HydrophobicContact CD1-CD1 3.52Å; I400-I409 HydrophobicContact CD1-CG1 4.04Å
401	L	96	Very high	92.4	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	112.8	174.1	-178	69.8	0	0	0	108.8	F54 P58 I61 V72 V378 Q379	F54-L401 HydrophobicContact CE2-CD1 3.92Å; F54-L401 HydrophobicContact CZ-CD1 3.64Å; P58-L401 HydrophobicContact CB-CD1 3.84Å; P58-L401 HydrophobicContact CB-CD2 3.95Å; P58-L401 HydrophobicContact CB-CG 4.11Å; P58-L401 HydrophobicContact CG-CD1 4.06Å; P58-L401 HydrophobicContact CG-CD2 4.48Å; P58-L401 HydrophobicContact CG-CG 4.22Å; I61-L401 HydrophobicContact CB-CB 4.2Å; I61-L401 HydrophobicContact CB-CD2 3.95Å; I61-L401 HydrophobicContact CD1-CB 4.22Å; I61-L401 HydrophobicContact CG2-CB 4.26Å; I61-L401 HydrophobicContact CG2-CD2 4.49Å; V72-L401 HydrophobicContact CG1-CD1 3.77Å; V72-L401 HydrophobicContact CG1-CD2 4.27Å; V72-L401 HydrophobicContact CG2-CD1 4.13Å; V378-L401 HydrophobicContact CB-CD2 4.18Å; V378-L401 HydrophobicContact CB-CG 4.19Å; V378-L401 WeakPolarHBondContact CB-O 3.46Å; V378-L401 HydrophobicContact CG1-CD2 3.96Å; V378-L401 PolarHBondContact N-O 3.35Å; Q379-L401 PolarHBondContact N-O 3.41Å; Q379-L401 WeakPolarHBondContact O-CA 3.49Å; Q379-L401 WeakPolarHBondContact O-CB 3.34Å; Q379-L401 PolarHBondContact O-N 2.87Å
402	L	93.8	Very high	92.9	Very high	2 Å²	2	22 Å²	22	1%	0.01	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	173.2	172.7	-48.2	-177.9	0	0	0	110.6	F54 P58 L373 H375 K376 L377 I400 E404 D405 V407	F54-L402 WeakPolarHBondContact CZ-O 3.43Å; P58-L402 VanDerWaalsContact CG-O 3.24Å; P58-L402 WeakPolarHBondContact CG-O 3.09Å; L373-L402 HydrophobicContact CB-CD1 4.37Å; L373-L402 HydrophobicContact CB-CD2 4.19Å; L373-L402 HydrophobicContact CD1-CD2 3.79Å; L373-L402 HydrophobicContact CD2-CD2 4.36Å; L373-L402 HydrophobicContact CG-CD2 4.33Å; H375-L402 HydrophobicContact CB-CB 3.9Å; H375-L402 HydrophobicContact CB-CD1 4.17Å; K376-L402 CarbonylContact O-C 3.56Å; K376-L402 VanDerWaalsContact O-CA 3.26Å; K376-L402 WeakPolarHBondContact O-CA 3.35Å; L377-L402 HydrophobicContact CB-CD2 4.2Å; I400-L402 HydrophobicContact CG2-CD2 3.59Å; I400-L402 HydrophobicContact CG2-CG 4.44Å; I400-L402 PolarHBondContact O-N 3.22Å; L402-E404 PolarHBondContact O-N 2.86Å; L402-D405 WeakPolarHBondContact CA-O 3.36Å; L402-D405 VanDerWaalsContact CB-O 3.28Å; L402-D405 WeakPolarHBondContact CB-O 3.28Å; L402-D405 HydrophobicContact CD1-CB 4.38Å; L402-D405 PolarHBondContact N-O 3.01Å; L402-V407 HydrophobicContact CD1-CG2 3.8Å; L402-V407 HydrophobicContact CG-CG2 4.48Å
403	Q	90.4	Very high	93.1	Very high	64 Å²	64	21 Å²	21	30%	0.299	11%	0.108	S	C	.	.	S	Bend	trans	-63.4	-30.1	179.3	-173.3	62.9	47.4	0	0	112.9	P58 K376	P58-Q403 VanDerWaalsContact CD-O 3.32Å; P58-Q403 WeakPolarHBondContact CD-O 3.35Å; K376-Q403 HydrophobicContact CB-CB 4.25Å; K376-Q403 PolarHBondContact O-N 3.4Å
404	E	85.8	Confident	92.9	Very high	83 Å²	83	25 Å²	25	39%	0.388	14%	0.135	S	C	.	.	S	Bend	trans	-132.3	-2.4	-173.8	-58.1	-177.4	-170.7	0	0	113.5	F54 H375 L402 H428	F54-E404 WeakPolarHBondContact CD1-O 3.33Å; H375-E404 IonicContact CE1-OE2 3.74Å; H375-E404 PolarHBondContact CE1-OE2 3.23Å; H375-E404 IonicContact ND1-OE2 2.74Å; H375-E404 PolarHBondContact ND1-OE2 3.28Å; L402-E404 PolarHBondContact O-N 2.86Å; E404-H428 PolarHBondContact O-CE1 2.73Å; E404-H428 PolarHBondContact O-NE2 2.65Å; E404-H428 IonicContact OE2-CD2 3.3Å; E404-H428 PolarHBondContact OE2-CD2 2.93Å; E404-H428 IonicContact OE2-NE2 3.83Å
405	D	87.8	Confident	92.7	Very high	34 Å²	34	27.4 Å²	27.4	18%	0.182	15%	0.148	C	C	.	.			trans	-149.6	164.6	-177.9	-167.7	20.4	0	0	0	112.9	F54 L402 M425	F54-D405 VanDerWaalsContact CE1-N 3.26Å; F54-D405 VanDerWaalsContact CZ-O 3.26Å; F54-D405 WeakPolarHBondContact CZ-O 3.27Å; L402-D405 WeakPolarHBondContact CA-O 3.36Å; L402-D405 VanDerWaalsContact CB-O 3.28Å; L402-D405 WeakPolarHBondContact CB-O 3.28Å; L402-D405 HydrophobicContact CD1-CB 4.38Å; L402-D405 PolarHBondContact N-O 3.01Å; D405-M425 WeakPolarHBondContact OD1-CB 3.32Å; D405-M425 WeakPolarHBondContact OD1-CG 3.25Å
406	L	92	Very high	92.5	Very high	1 Å²	1	28.2 Å²	28.2	1%	0.005	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	111.7	170.5	177.5	66.5	0	0	0	109.2	F54 I61 N421	F54-L406 HydrophobicContact CE2-CB 4.07Å; I61-L406 HydrophobicContact CD1-CD1 3.91Å; L406-N421 PolarHBondContact O-ND2 2.93Å
407	V	92.1	Very high	92.3	Very high	23 Å²	23	27.6 Å²	27.6	14%	0.139	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	135.4	-179.9	179.8	0	0	0	0	109.1	I400 L402 I409 T418	I400-V407 HydrophobicContact CB-CB 4.41Å; I400-V407 PolarHBondContact N-O 3.41Å; I400-V407 PolarHBondContact O-N 3.29Å; L402-V407 HydrophobicContact CD1-CG2 3.8Å; L402-V407 HydrophobicContact CG-CG2 4.48Å; V407-I409 HydrophobicContact CG1-CG1 4.12Å; V407-T418 HydrophobicContact CG1-CG2 3.68Å
408	V	95	Very high	92	Very high	1 Å²	1	29.6 Å²	29.6	1%	0.006	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	129.8	172.8	-173.5	0	0	0	0	109.2	L383 A397 V398 A399 T418 F419 W475 P476	L383-V408 HydrophobicContact CD1-CG1 4.17Å; A397-V408 HydrophobicContact CB-CG1 4.05Å; V398-V408 CarbonylContact O-C 3.57Å; V398-V408 WeakPolarHBondContact O-CA 3.17Å; A399-V408 HydrophobicContact CB-CG2 4.03Å; V408-T418 CarbonylContact O-C 3.54Å; V408-F419 HydrophobicContact CB-CB 4.42Å; V408-F419 HydrophobicContact CB-CD2 4.14Å; V408-F419 HydrophobicContact CG1-CD2 3.75Å; V408-F419 HydrophobicContact CG1-CE2 4.2Å; V408-F419 PolarHBondContact O-N 3.31Å; V408-W475 HydrophobicContact CB-CH2 3.94Å; V408-W475 HydrophobicContact CB-CZ3 3.74Å; V408-W475 HydrophobicContact CG2-CH2 3.24Å; V408-W475 HydrophobicContact CG2-CZ2 3.95Å; V408-W475 HydrophobicContact CG2-CZ3 3.61Å; V408-P476 HydrophobicContact CG1-CG 3.61Å
409	I	95.1	Very high	91.7	Very high	4 Å²	4	29.8 Å²	29.8	2%	0.021	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	135.1	-176.3	-64.1	-178.8	0	0	0	110	L371 A397 V398 I400 V407 L411 F416	L371-I409 HydrophobicContact CD1-CD1 3.32Å; L371-I409 HydrophobicContact CD2-CD1 4.4Å; L371-I409 HydrophobicContact CG-CD1 4.35Å; A397-I409 CarbonylContact C-O 3.52Å; A397-I409 WeakPolarHBondContact CA-O 3.27Å; A397-I409 VanDerWaalsContact CB-O 3.28Å; A397-I409 WeakPolarHBondContact CB-O 3.48Å; V398-I409 HydrophobicContact CG1-CB 3.78Å; V398-I409 HydrophobicContact CG1-CG2 4.4Å; V398-I409 PolarHBondContact N-O 3.23Å; V398-I409 PolarHBondContact O-N 2.97Å; I400-I409 HydrophobicContact CD1-CD1 3.52Å; I400-I409 HydrophobicContact CD1-CG1 4.04Å; V407-I409 HydrophobicContact CG1-CG1 4.12Å; I409-L411 PolarHBondContact O-N 3.45Å; I409-F416 HydrophobicContact CG2-CB 3.79Å; I409-F416 WeakPolarHBondContact CG2-O 3.38Å
410	D	95.1	Very high	91.1	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	106.1	178.1	-174	4.6	0	0	0	111.4	L412 S413 F416 A417 F419 S471 R473	D410-L412 PolarHBondContact O-N 3.38Å; D410-L412 WeakPolarHBondContact OD1-CB 3.21Å; D410-L412 PolarHBondContact OD1-N 2.97Å; D410-S413 PolarHBondContact O-N 2.99Å; D410-S413 PolarHBondContact OD1-N 3.47Å; D410-S413 WeakPolarHBondContact OD2-CB 3.46Å; D410-S413 PolarHBondContact OD2-OG 3.14Å; D410-F416 WeakPolarHBondContact O-CA 3.46Å; D410-A417 WeakPolarHBondContact CB-O 3.37Å; D410-A417 PolarHBondContact N-O 3.06Å; D410-F419 VanDerWaalsContact CA-CE2 3.45Å; D410-F419 HydrophobicContact CB-CD2 4.12Å; D410-F419 HydrophobicContact CB-CE2 3.44Å; D410-F419 VanDerWaalsContact CB-CE2 3.44Å; D410-F419 HydrophobicContact CB-CZ 3.69Å; D410-S471 PolarHBondContact OD2-OG 3.36Å; D410-R473 IonicContact OD1-CZ 3.89Å; D410-R473 IonicContact OD1-NH1 2.78Å; D410-R473 PolarHBondContact OD1-NH1 3.4Å; D410-R473 WeakPolarHBondContact OD2-CD 3.13Å; D410-R473 IonicContact OD2-NH1 3.84Å
411	L	94.5	Very high	90.4	Very high	3 Å²	3	38.2 Å²	38.2	2%	0.016	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-12.6	179.3	-65	176.7	0	0	0	113.1	F307 I309 I362 P395 Y396 V398 I409 F416	F307-L411 HydrophobicContact CE1-CD2 4.4Å; F307-L411 HydrophobicContact CZ-CB 4.48Å; I309-L411 HydrophobicContact CD1-CD1 4.01Å; I309-L411 HydrophobicContact CD1-CD2 4.3Å; I362-L411 HydrophobicContact CD1-CD2 3.71Å; P395-L411 HydrophobicContact CB-CD1 3.84Å; P395-L411 HydrophobicContact CG-CD1 4.17Å; Y396-L411 PolarHBondContact O-N 3.11Å; Y396-L411 VanDerWaalsContact O-N 3.12Å; V398-L411 HydrophobicContact CB-CD1 4.33Å; V398-L411 HydrophobicContact CG1-CD2 4.18Å; V398-L411 HydrophobicContact CG1-CG 4.41Å; I409-L411 PolarHBondContact O-N 3.45Å; L411-F416 HydrophobicContact CD2-CD1 4.02Å; L411-F416 HydrophobicContact CD2-CE1 4.07Å
412	L	93	Very high	89.4	Confident	107 Å²	107	40.6 Å²	40.6	56%	0.56	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.6	-18.6	174.4	-52.6	-168.7	0	0	0	112.1	D410	D410-L412 PolarHBondContact O-N 3.38Å; D410-L412 WeakPolarHBondContact OD1-CB 3.21Å; D410-L412 PolarHBondContact OD1-N 2.97Å
413	S	90	Very high	88.4	Confident	23 Å²	23	41.4 Å²	41.4	16%	0.161	22%	0.223	C	C	.	.	S	Bend	trans	-73.9	132.9	173.1	-80	0	0	0	0	110.7	D410 N415 F416	D410-S413 PolarHBondContact O-N 2.99Å; D410-S413 PolarHBondContact OD1-N 3.47Å; D410-S413 WeakPolarHBondContact OD2-CB 3.46Å; D410-S413 PolarHBondContact OD2-OG 3.14Å; S413-N415 PolarHBondContact O-N 3.44Å; S413-N415 VanDerWaalsContact O-N 3.16Å; S413-F416 PolarHBondContact O-N 3.33Å
414	P	83.9	Confident	87.1	Confident	103 Å²	103	39.2 Å²	39.2	67%	0.669	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-27.3	-175.2	24.2	-33.9	0	0	0	113.8
415	N	85.1	Confident	86	Confident	102 Å²	102	35.5 Å²	35.5	55%	0.545	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.9	2.7	178.7	-64.4	-13.7	0	0	0	113.3	S413 D468	S413-N415 PolarHBondContact O-N 3.44Å; S413-N415 VanDerWaalsContact O-N 3.16Å; N415-D468 PolarHBondContact ND2-OD2 3.3Å
416	F	90.3	Very high	84.7	Confident	17 Å²	17	38.2 Å²	38.2	8%	0.075	21%	0.212	C	C	.	.			trans	52.5	51.6	-171.2	-56.2	-50.3	0	0	0	112.4	F307 I362 V369 I409 D410 L411 S413	F307-F416 HydrophobicContact CE1-CE1 4.08Å; F307-F416 HydrophobicContact CE1-CZ 4.18Å; I362-F416 HydrophobicContact CB-CE2 4.24Å; I362-F416 HydrophobicContact CD1-CD1 4.35Å; I362-F416 HydrophobicContact CD1-CD2 4.07Å; I362-F416 HydrophobicContact CD1-CE2 4.3Å; I362-F416 HydrophobicContact CD1-CG 4.09Å; I362-F416 HydrophobicContact CG2-CE1 4.41Å; I362-F416 HydrophobicContact CG2-CE2 3.94Å; I362-F416 HydrophobicContact CG2-CZ 3.77Å; V369-F416 HydrophobicContact CB-CD2 3.95Å; V369-F416 HydrophobicContact CB-CE2 3.89Å; V369-F416 HydrophobicContact CG1-CD2 3.93Å; V369-F416 HydrophobicContact CG1-CE2 4.39Å; V369-F416 HydrophobicContact CG2-CD2 3.94Å; V369-F416 HydrophobicContact CG2-CE2 3.61Å; I409-F416 HydrophobicContact CG2-CB 3.79Å; I409-F416 WeakPolarHBondContact CG2-O 3.38Å; D410-F416 WeakPolarHBondContact O-CA 3.46Å; L411-F416 HydrophobicContact CD2-CD1 4.02Å; L411-F416 HydrophobicContact CD2-CE1 4.07Å; S413-F416 PolarHBondContact O-N 3.33Å
417	A	90.4	Very high	83.4	Confident	12 Å²	12	38.2 Å²	38.2	10%	0.099	21%	0.212	C	C	.	.	P	Polyproline II helix	trans	-63.9	148	179	0	0	0	0	0	111.6	D410	D410-A417 WeakPolarHBondContact CB-O 3.37Å; D410-A417 PolarHBondContact N-O 3.06Å
418	T	90.8	Very high	82.1	Confident	42 Å²	42	38.5 Å²	38.5	26%	0.258	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	143.1	-179.9	-62.7	0	0	0	0	110.4	V407 V408 V469 F470 S471	V407-T418 HydrophobicContact CG1-CG2 3.68Å; V408-T418 CarbonylContact O-C 3.54Å; T418-V469 PolarHBondContact N-O 2.89Å; T418-F470 HydrophobicContact CG2-CD1 4.44Å; T418-F470 HydrophobicContact CG2-CE1 4.36Å; T418-F470 CarbonylContact O-C 3.41Å; T418-F470 WeakPolarHBondContact O-CA 3.42Å; T418-F470 WeakPolarHBondContact O-CD1 3.46Å; T418-S471 PolarHBondContact O-N 2.84Å
419	F	91	Very high	80.9	Confident	5 Å²	5	41.7 Å²	41.7	2%	0.022	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	139.4	167.2	-68.8	-90.9	0	0	0	109.9	A397 V408 D410 N421 R473 E474 W475 P476	A397-F419 HydrophobicContact CB-CE2 3.92Å; V408-F419 HydrophobicContact CB-CB 4.42Å; V408-F419 HydrophobicContact CB-CD2 4.14Å; V408-F419 HydrophobicContact CG1-CD2 3.75Å; V408-F419 HydrophobicContact CG1-CE2 4.2Å; V408-F419 PolarHBondContact O-N 3.31Å; D410-F419 VanDerWaalsContact CA-CE2 3.45Å; D410-F419 HydrophobicContact CB-CD2 4.12Å; D410-F419 HydrophobicContact CB-CE2 3.44Å; D410-F419 VanDerWaalsContact CB-CE2 3.44Å; D410-F419 HydrophobicContact CB-CZ 3.69Å; F419-N421 PolarHBondContact O-N 3.08Å; F419-R473 WeakPolarHBondContact CD1-O 3.4Å; F419-R473 HydrophobicContact CE1-CB 3.71Å; F419-R473 HydrophobicContact CZ-CB 4.34Å; F419-E474 WeakPolarHBondContact CE1-O 3.35Å; F419-W475 HydrophobicContact CB-CE3 3.72Å; F419-W475 HydrophobicContact CB-CZ3 3.93Å; F419-P476 HydrophobicContact CD2-CG 4.27Å; F419-P476 HydrophobicContact CE2-CG 4.11Å; F419-P476 HydrophobicContact CZ-CG 4.32Å
420	E	84.6	Confident	80.2	Confident	141 Å²	141	42 Å²	42	66%	0.659	24%	0.237	S	C	*	.	P	Polyproline II helix	trans	-63.4	121.5	170.7	-172.2	173.6	-168.1	0	0	109.3	P422 F470	E420-P422 WeakPolarHBondContact O-CD 3.28Å; E420-F470 HydrophobicContact CB-CD1 4.23Å
421	N	81.3	Confident	79.8	Confident	36 Å²	36	46.2 Å²	46.2	19%	0.193	26%	0.264	C	S	.	.	P	Polyproline II helix	trans	-73.8	117.8	179.1	-174.6	-17.5	0	0	0	109.1	L406 F419 Y423 M425 W475	L406-N421 PolarHBondContact O-ND2 2.93Å; F419-N421 PolarHBondContact O-N 3.08Å; N421-Y423 PolarHBondContact O-N 3.27Å; N421-Y423 WeakPolarHBondContact OD1-CB 3.44Å; N421-Y423 WeakPolarHBondContact OD1-CD2 3.33Å; N421-Y423 PolarHBondContact OD1-N 3.12Å; N421-M425 WeakPolarHBondContact ND2-CG 3.41Å; N421-W475 HydrophobicContact CB-CH2 4.34Å; N421-W475 HydrophobicContact CB-CZ3 4.32Å
422	P	76.4	Confident	79.6	Confident	49 Å²	49	46.9 Å²	46.9	32%	0.318	27%	0.268	S	S	.	.	S	Bend	trans	-74.9	-12.1	-176.8	31.3	-36.2	0	0	0	113.2	P85 E420 W475	P85-P422 HydrophobicContact CB-CB 4.24Å; P85-P422 HydrophobicContact CG-CB 3.66Å; P85-P422 HydrophobicContact CG-CG 3.69Å; E420-P422 WeakPolarHBondContact O-CD 3.28Å; P422-W475 VanDerWaalsContact CD-CD2 3.48Å; P422-W475 HydrophobicContact CG-CD2 3.97Å; P422-W475 HydrophobicContact CG-CG 3.92Å
423	Y	72.4	Confident	79.6	Confident	19 Å²	19	42.3 Å²	42.3	8%	0.075	25%	0.245	C	C	.	.	S	Bend	trans	-90.7	130	177.2	-57.8	-78.5	0	0	0	109.1	F82 G83 K84 N421 M425	F82-Y423 HydrophobicContact CB-CE2 4.42Å; F82-Y423 HydrophobicContact CD1-CD1 4.39Å; F82-Y423 AromaticContact CD1-CE1 3.96Å; F82-Y423 HydrophobicContact CD1-CE1 3.96Å; F82-Y423 HydrophobicContact CD1-CE2 4.1Å; F82-Y423 AromaticContact CD1-CZ 3.81Å; G83-Y423 PolarHBondContact O-OH 3.45Å; K84-Y423 PolarHBondContact O-OH 3.29Å; N421-Y423 PolarHBondContact O-N 3.27Å; N421-Y423 WeakPolarHBondContact OD1-CB 3.44Å; N421-Y423 WeakPolarHBondContact OD1-CD2 3.33Å; N421-Y423 PolarHBondContact OD1-N 3.12Å; Y423-M425 VanDerWaalsContact C-N 3.31Å; Y423-M425 WeakPolarHBondContact CB-SD 3.17Å; Y423-M425 HydrophobicContact CG-SD 4.47Å; Y423-M425 WeakPolarHBondContact O-CG 3.42Å; Y423-M425 PolarHBondContact O-N 2.88Å
424	P	62.9	Low	79.7	Confident	18 Å²	18	41.7 Å²	41.7	12%	0.117	24%	0.24	C	C	.	.			trans	-73.1	85.1	177.5	33.1	-40.1	0	0	0	110.5	D426 L427 W505 L512	P424-D426 VanDerWaalsContact C-N 3.26Å; P424-D426 PolarHBondContact O-N 2.87Å; P424-L427 WeakPolarHBondContact O-CD1 3.49Å; P424-W505 HydrophobicContact CB-CE3 4.5Å; P424-W505 HydrophobicContact CB-CZ3 3.94Å; P424-L512 VanDerWaalsContact CD-O 3.23Å; P424-L512 WeakPolarHBondContact CD-O 3.38Å; P424-L512 HydrophobicContact CG-CB 3.9Å; P424-L512 HydrophobicContact CG-CD2 4.28Å; P424-L512 HydrophobicContact CG-CG 4.35Å; P424-L512 WeakPolarHBondContact CG-O 3.42Å
425	M	62.5	Low	80.2	Confident	5 Å²	5	37.1 Å²	37.1	3%	0.025	21%	0.211	C	C	.	.	G	3₁₀ helix	trans	-71.2	-29.7	-178.7	-48.3	-43.9	-92.9	0	0	110.9	F54 D405 N421 Y423 L427 H428	F54-M425 HydrophobicContact CB-CB 4.32Å; F54-M425 HydrophobicContact CB-CE 3.54Å; F54-M425 HydrophobicContact CB-SD 4.46Å; F54-M425 HydrophobicContact CD2-CE 3.05Å; F54-M425 HydrophobicContact CE2-CE 4Å; F54-M425 HydrophobicContact CG-CE 3.65Å; D405-M425 WeakPolarHBondContact OD1-CB 3.32Å; D405-M425 WeakPolarHBondContact OD1-CG 3.25Å; N421-M425 WeakPolarHBondContact ND2-CG 3.41Å; Y423-M425 VanDerWaalsContact C-N 3.31Å; Y423-M425 WeakPolarHBondContact CB-SD 3.17Å; Y423-M425 HydrophobicContact CG-SD 4.47Å; Y423-M425 WeakPolarHBondContact O-CG 3.42Å; Y423-M425 PolarHBondContact O-N 2.88Å; M425-L427 PolarHBondContact O-N 2.91Å; M425-H428 PolarHBondContact O-CE1 3.41Å; M425-H428 PolarHBondContact O-ND1 3.33Å
426	D	60.5	Low	80.8	Confident	91 Å²	91	34.2 Å²	34.2	49%	0.487	20%	0.195	S	C	.	.	G	3₁₀ helix	trans	-67.7	9.6	-169.3	-68.6	-10.7	0	0	0	117.7	P424 H428 S429 R503	P424-D426 VanDerWaalsContact C-N 3.26Å; P424-D426 PolarHBondContact O-N 2.87Å; D426-H428 PolarHBondContact O-N 3.16Å; D426-S429 PolarHBondContact O-N 3.48Å; D426-S429 PolarHBondContact O-OG 2.71Å; D426-R503 PolarHBondContact O-NH1 3.48Å
427	L	64.6	Low	81.1	Confident	1 Å²	1	34 Å²	34	1%	0.005	19%	0.194	C	C	.	.	G	3₁₀ helix	trans	-50.5	-30.1	170.3	-81.3	130.8	0	0	0	111.6	P424 M425 W505 L512 L1186	P424-L427 WeakPolarHBondContact O-CD1 3.49Å; M425-L427 PolarHBondContact O-N 2.91Å; L427-W505 HydrophobicContact CD2-CZ2 4.39Å; L427-W505 HydrophobicContact CG-CH2 4.17Å; L427-W505 HydrophobicContact CG-CZ2 4.28Å; L427-L512 HydrophobicContact CD1-CD2 4Å; L427-L512 HydrophobicContact CD2-CD2 4.21Å; L427-L512 HydrophobicContact CG-CD2 4.45Å; L427-L1186 HydrophobicContact CD2-CB 4.21Å; L427-L1186 HydrophobicContact CD2-CD1 4.39Å
428	H	65.1	Low	81.3	Confident	29 Å²	29	35 Å²	35	13%	0.134	20%	0.197	C	C	.	.	G	3₁₀ helix	trans	-91.6	-14.1	-170.8	66.3	-86.8	0	0	0	116.2	E404 M425 D426 S430	E404-H428 PolarHBondContact O-CE1 2.73Å; E404-H428 PolarHBondContact O-NE2 2.65Å; E404-H428 IonicContact OE2-CD2 3.3Å; E404-H428 PolarHBondContact OE2-CD2 2.93Å; E404-H428 IonicContact OE2-NE2 3.83Å; M425-H428 PolarHBondContact O-CE1 3.41Å; M425-H428 PolarHBondContact O-ND1 3.33Å; D426-H428 PolarHBondContact O-N 3.16Å; H428-S430 PolarHBondContact O-N 3.21Å
429	S	69	Low	81.4	Confident	68 Å²	68	33.5 Å²	33.5	48%	0.476	19%	0.188	S	C	.	.	S	Bend	trans	-55.6	-17.8	-175	47.7	0	0	0	0	114.8	D426 R503	D426-S429 PolarHBondContact O-N 3.48Å; D426-S429 PolarHBondContact O-OG 2.71Å; S429-R503 VanDerWaalsContact OG-CZ 3.23Å; S429-R503 PolarHBondContact OG-NH1 2.77Å; S429-R503 PolarHBondContact OG-NH2 3.4Å
430	S	81.9	Confident	81.3	Confident	11 Å²	11	37.2 Å²	37.2	8%	0.077	21%	0.208	C	C	.	.	S	Bend	trans	-148	141.2	161.1	177.3	0	0	0	0	108.6	H428 V432 H497 A498 D499	H428-S430 PolarHBondContact O-N 3.21Å; S430-V432 PolarHBondContact O-N 2.86Å; S430-H497 PolarHBondContact O-ND1 3.08Å; S430-A498 PolarHBondContact OG-N 2.72Å; S430-D499 WeakPolarHBondContact OG-CB 3.4Å; S430-D499 PolarHBondContact OG-N 2.61Å
431	P	85.5	Confident	81.5	Confident	89 Å²	89	30.9 Å²	30.9	58%	0.578	18%	0.179	S	C	*	.			trans	-53.2	131.8	179.8	-26.5	33.4	0	0	0	112.4	T433 H497 A498	P431-T433 PolarHBondContact O-N 2.63Å; P431-H497 CarbonylContact O-C 3.57Å; P431-H497 VanDerWaalsContact O-CA 3.24Å; P431-H497 WeakPolarHBondContact O-CA 3.32Å; P431-A498 HydrophobicContact CB-CB 4.3Å; P431-A498 HydrophobicContact CG-CB 4.38Å; P431-A498 PolarHBondContact O-N 3.01Å
432	V	90.7	Very high	82	Confident	16 Å²	16	31.2 Å²	31.2	10%	0.097	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	122.2	172.3	178.9	0	0	0	0	108.7	S430 S434 T495 G496 L1180	S430-V432 PolarHBondContact O-N 2.86Å; V432-S434 WeakPolarHBondContact CG1-O 3.35Å; V432-T495 HydrophobicContact CG1-CG2 4.2Å; V432-T495 HydrophobicContact CG2-CG2 4.38Å; V432-G496 CarbonylContact C-O 3.57Å; V432-G496 WeakPolarHBondContact CA-O 3.45Å; V432-L1180 HydrophobicContact CB-CD1 3.63Å; V432-L1180 HydrophobicContact CG1-CD1 4.21Å; V432-L1180 HydrophobicContact CG2-CD1 3.99Å
433	T	92.3	Very high	82.5	Confident	12 Å²	12	31.8 Å²	31.8	7%	0.074	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	-17.9	-178	47.3	0	0	0	0	112.7	P431 G496 A498 A565 I566	P431-T433 PolarHBondContact O-N 2.63Å; T433-G496 PolarHBondContact N-O 3.49Å; T433-G496 PolarHBondContact OG1-O 3.48Å; T433-A498 HydrophobicContact CG2-CB 4.07Å; T433-A565 HydrophobicContact CG2-CB 4.46Å; T433-I566 VanDerWaalsContact CB-O 3.28Å; T433-I566 WeakPolarHBondContact CB-O 3.45Å; T433-I566 PolarHBondContact OG1-O 3.21Å
434	S	93.1	Very high	83.3	Confident	9 Å²	9	34.4 Å²	34.4	6%	0.063	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.3	149.2	179	-164	0	0	0	0	110.7	V432 G496 I566 H567	V432-S434 WeakPolarHBondContact CG1-O 3.35Å; S434-G496 PolarHBondContact N-O 3.46Å; S434-G496 PolarHBondContact O-N 3Å; S434-I566 WeakPolarHBondContact CB-O 3.44Å; S434-H567 WeakPolarHBondContact CB-O 3.45Å; S434-H567 PolarHBondContact OG-O 2.84Å
435	C	95	Very high	84.7	Confident	8 Å²	8	33.5 Å²	33.5	5%	0.054	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	141.1	179.2	-164.2	0	0	0	0	111	I494 S1168 A1170	C435-I494 CarbonylContact C-O 3.51Å; C435-I494 WeakPolarHBondContact CA-O 3.29Å; C435-S1168 WeakPolarHBondContact CB-O 3.47Å; C435-A1170 HydrophobicContact CB-CB 4.24Å; C435-A1170 WeakPolarHBondContact O-CB 3.24Å
436	L	96.5	Very high	86.2	Confident	41 Å²	41	33.9 Å²	33.9	22%	0.215	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	145.1	165.7	-62.9	175.3	0	0	0	109.1	L438 I493 I494 M569 F571	L436-L438 HydrophobicContact CB-CD1 4.32Å; L436-I493 WeakPolarHBondContact O-CA 3.3Å; L436-I494 HydrophobicContact CB-CB 4.23Å; L436-I494 PolarHBondContact N-O 3.08Å; L436-I494 PolarHBondContact O-N 3.3Å; L436-M569 HydrophobicContact CD1-CB 3.65Å; L436-M569 HydrophobicContact CG-CB 4.1Å; L436-M569 HydrophobicContact CG-CE 4.21Å; L436-F571 HydrophobicContact CD1-CB 3.65Å
437	Y	96.6	Very high	87.7	Confident	12 Å²	12	32.8 Å²	32.8	5%	0.047	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	118.6	179.5	179.7	-142	0	0	0	110	V439 E491 I493 G1172 Q1176 V1178 K1188	Y437-V439 HydrophobicContact CD1-CG2 4.16Å; Y437-V439 HydrophobicContact CD2-CG2 4.36Å; Y437-V439 HydrophobicContact CE1-CG2 3.51Å; Y437-V439 HydrophobicContact CE2-CG2 3.78Å; Y437-V439 WeakPolarHBondContact OH-CG2 3.28Å; Y437-E491 HydrophobicContact CE2-CB 4.43Å; Y437-E491 PolarHBondContact OH-OE2 3.5Å; Y437-I493 HydrophobicContact CD2-CD1 4.36Å; Y437-I493 HydrophobicContact CD2-CG1 3.58Å; Y437-I493 HydrophobicContact CE2-CD1 4.48Å; Y437-I493 HydrophobicContact CE2-CG1 4.04Å; Y437-I493 HydrophobicContact CG-CG1 4.49Å; Y437-G1172 VanDerWaalsContact CD1-CA 3.45Å; Y437-Q1176 HydrophobicContact CE1-CB 3.75Å; Y437-Q1176 PolarHBondContact OH-OE1 2.83Å; Y437-V1178 HydrophobicContact CD1-CB 4.39Å; Y437-V1178 HydrophobicContact CD1-CG1 3.73Å; Y437-V1178 HydrophobicContact CD1-CG2 4.06Å; Y437-V1178 HydrophobicContact CD2-CG1 4.04Å; Y437-V1178 HydrophobicContact CE1-CG1 3.81Å; Y437-V1178 HydrophobicContact CE2-CG1 4.09Å; Y437-V1178 HydrophobicContact CG-CB 4.46Å; Y437-V1178 HydrophobicContact CG-CG1 3.85Å; Y437-V1178 HydrophobicContact CG-CG2 3.82Å; Y437-K1188 WeakPolarHBondContact OH-CE 3.14Å
438	L	94.8	Very high	89	Confident	32 Å²	32	32.7 Å²	32.7	17%	0.168	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	120.2	-179.2	-67.2	89.9	0	0	0	108.4	L436 C441 E491 L492 I494 F571	L436-L438 HydrophobicContact CB-CD1 4.32Å; L438-C441 HydrophobicContact CB-CB 4.32Å; L438-E491 WeakPolarHBondContact O-CA 3.34Å; L438-L492 HydrophobicContact CB-CB 4.33Å; L438-L492 PolarHBondContact N-O 3.26Å; L438-L492 PolarHBondContact O-N 3.3Å; L438-I494 HydrophobicContact CD1-CD1 4.16Å; L438-F571 HydrophobicContact CD1-CD1 3.84Å; L438-F571 HydrophobicContact CD1-CE1 4.39Å; L438-F571 HydrophobicContact CD2-CD1 3.61Å; L438-F571 HydrophobicContact CD2-CE1 3.73Å; L438-F571 HydrophobicContact CG-CD1 4.4Å
439	V	92.2	Very high	90.3	Very high	11 Å²	11	31.4 Å²	31.4	7%	0.067	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	134.3	173.4	-177.3	0	0	0	0	107.4	Y437 V489 E491 Q1173 Y1174 Q1176	Y437-V439 HydrophobicContact CD1-CG2 4.16Å; Y437-V439 HydrophobicContact CD2-CG2 4.36Å; Y437-V439 HydrophobicContact CE1-CG2 3.51Å; Y437-V439 HydrophobicContact CE2-CG2 3.78Å; Y437-V439 WeakPolarHBondContact OH-CG2 3.28Å; V439-V489 HydrophobicContact CG1-CG1 4.18Å; V439-E491 HydrophobicContact CG1-CG 4.24Å; V439-E491 HydrophobicContact CG2-CG 4.47Å; V439-Q1173 HydrophobicContact CB-CB 4.39Å; V439-Y1174 HydrophobicContact CG1-CD2 3.91Å; V439-Q1176 HydrophobicContact CG2-CB 4.26Å
440	D	89.4	Confident	91.2	Very high	83 Å²	83	32.9 Å²	32.9	44%	0.444	20%	0.197	S	C	.	.	S	Bend	trans	65.3	45.4	-177	-156.9	24.1	0	0	0	112.7	V489 P490 Y1174	D440-V489 HydrophobicContact CB-CG1 3.47Å; D440-V489 VanDerWaalsContact CB-CG1 3.47Å; D440-V489 VanDerWaalsContact N-CG1 3.32Å; D440-P490 PolarHBondContact N-O 3.36Å; D440-Y1174 HydrophobicContact CB-CE2 3.76Å; D440-Y1174 PolarHBondContact OD2-OH 3.22Å
441	C	90.1	Very high	91.4	Very high	8 Å²	8	35 Å²	35	5%	0.054	21%	0.212	C	C	.	.			trans	-71.4	160.4	175.4	66.6	0	0	0	0	111.7	L438 G443 L445 P490	L438-C441 HydrophobicContact CB-CB 4.32Å; C441-G443 PolarHBondContact O-N 2.95Å; C441-L445 HydrophobicContact CB-CD2 3.98Å; C441-P490 PolarHBondContact N-O 3.32Å; C441-P490 WeakPolarHBondContact O-CG 3.32Å; C441-P490 PolarHBondContact SG-O 2.85Å
442	P	90	Very high	91.5	Very high	43 Å²	43	31.5 Å²	31.5	28%	0.279	19%	0.189	S	C	.	.			trans	-52	131.1	178.8	-27.1	34.8	0	0	0	112	D444 L445	P442-D444 PolarHBondContact O-N 2.83Å; P442-L445 WeakPolarHBondContact O-CB 3.5Å; P442-L445 PolarHBondContact O-N 2.91Å
443	G	86.9	Confident	90.7	Very high	61 Å²	61	31.6 Å²	31.6	63%	0.629	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-13.7	-169.4	0	0	0	0	0	115.7	C441 P447	C441-G443 PolarHBondContact O-N 2.95Å; G443-P447 WeakPolarHBondContact O-CD 3.41Å; G443-P447 WeakPolarHBondContact O-CG 3.3Å
444	D	90.5	Very high	88.9	Confident	74 Å²	74	35.1 Å²	35.1	40%	0.396	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.7	-6.3	176.3	73.2	-28.6	0	0	0	113.8	P442 A448 R576	P442-D444 PolarHBondContact O-N 2.83Å; D444-A448 VanDerWaalsContact O-CB 3.3Å; D444-A448 WeakPolarHBondContact O-CB 3.34Å; D444-A448 PolarHBondContact O-N 2.86Å; D444-R576 IonicContact OD1-NH2 3.65Å; D444-R576 PolarHBondContact OD1-NH2 2.95Å; D444-R576 IonicContact OD2-CZ 3.72Å; D444-R576 IonicContact OD2-NH2 2.74Å; D444-R576 PolarHBondContact OD2-NH2 2.93Å
445	L	92.4	Very high	86.7	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-68.1	-52.7	-177.1	-176.7	63.9	0	0	0	112.4	C441 P442 A448 F449 L492 F571 R576	C441-L445 HydrophobicContact CB-CD2 3.98Å; P442-L445 WeakPolarHBondContact O-CB 3.5Å; P442-L445 PolarHBondContact O-N 2.91Å; L445-A448 WeakPolarHBondContact O-CB 3.47Å; L445-A448 PolarHBondContact O-N 3.07Å; L445-F449 HydrophobicContact CD1-CE2 3.84Å; L445-F449 HydrophobicContact CD1-CZ 4.28Å; L445-F449 HydrophobicContact CG-CE2 3.93Å; L445-F449 VanDerWaalsContact O-CD2 3.3Å; L445-F449 WeakPolarHBondContact O-CD2 3.4Å; L445-F449 PolarHBondContact O-N 2.98Å; L445-L492 HydrophobicContact CD2-CD2 3.89Å; L445-F571 HydrophobicContact CD1-CZ 4.17Å; L445-F571 HydrophobicContact CD2-CE1 3.95Å; L445-F571 HydrophobicContact CD2-CZ 4Å; L445-R576 HydrophobicContact CD1-CG 3.85Å
446	I	93.1	Very high	84.3	Confident	12 Å²	12	46.5 Å²	46.5	6%	0.062	26%	0.256	C	S	.	.	H	α-helix	trans	-61.9	-49.1	177.1	-68.7	172.8	0	0	0	110.9	A448 F449 Y450 P490 E491 D506 S508 L515	I446-A448 PolarHBondContact O-N 2.79Å; I446-F449 PolarHBondContact O-N 3.19Å; I446-Y450 HydrophobicContact CG2-CD2 3.87Å; I446-Y450 HydrophobicContact CG2-CE2 3.55Å; I446-Y450 WeakPolarHBondContact O-CD2 3.47Å; I446-Y450 PolarHBondContact O-N 2.73Å; I446-P490 HydrophobicContact CD1-CB 3.94Å; I446-E491 WeakPolarHBondContact CD1-O 3.45Å; I446-D506 WeakPolarHBondContact CG2-OD2 3.37Å; I446-S508 WeakPolarHBondContact CD1-OG 3.26Å; I446-L515 HydrophobicContact CG1-CD1 4.33Å; I446-L515 HydrophobicContact CG2-CD1 4.08Å; I446-L515 HydrophobicContact CG2-CD2 4.33Å
447	P	92	Very high	81.7	Confident	68 Å²	68	51.2 Å²	51.2	44%	0.442	28%	0.281	S	S	.	.	H	α-helix	trans	-54.8	-34.6	172.3	-29	35.6	0	0	0	114.3	G443 F449 Y450 S451	G443-P447 WeakPolarHBondContact O-CD 3.41Å; G443-P447 WeakPolarHBondContact O-CG 3.3Å; P447-F449 PolarHBondContact O-N 2.88Å; P447-Y450 PolarHBondContact O-N 2.8Å; P447-S451 PolarHBondContact O-N 2.78Å
448	A	91	Very high	78.9	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-63.4	-39.9	175.9	0	0	0	0	0	112.1	D444 L445 I446 S451 F591	D444-A448 VanDerWaalsContact O-CB 3.3Å; D444-A448 WeakPolarHBondContact O-CB 3.34Å; D444-A448 PolarHBondContact O-N 2.86Å; L445-A448 WeakPolarHBondContact O-CB 3.47Å; L445-A448 PolarHBondContact O-N 3.07Å; I446-A448 PolarHBondContact O-N 2.79Å; A448-S451 PolarHBondContact O-N 3.18Å; A448-S451 PolarHBondContact O-OG 3.2Å; A448-F591 HydrophobicContact CB-CE1 3.98Å; A448-F591 HydrophobicContact CB-CZ 4.14Å
449	F	92.5	Very high	76.1	Confident	1 Å²	1	64.2 Å²	64.2	0%	0.004	34%	0.338	C	S	.	.	H	α-helix	trans	-65.9	-43.1	175.1	-69.8	-58.8	0	0	0	112.5	L445 I446 P447 S451 V452 S453 L492 F504 L515 Y516 F591 Y687	L445-F449 HydrophobicContact CD1-CE2 3.84Å; L445-F449 HydrophobicContact CD1-CZ 4.28Å; L445-F449 HydrophobicContact CG-CE2 3.93Å; L445-F449 VanDerWaalsContact O-CD2 3.3Å; L445-F449 WeakPolarHBondContact O-CD2 3.4Å; L445-F449 PolarHBondContact O-N 2.98Å; I446-F449 PolarHBondContact O-N 3.19Å; P447-F449 PolarHBondContact O-N 2.88Å; F449-S451 PolarHBondContact O-N 2.92Å; F449-V452 VanDerWaalsContact O-CG2 3.25Å; F449-V452 WeakPolarHBondContact O-CG2 3.44Å; F449-V452 PolarHBondContact O-N 3.4Å; F449-S453 WeakPolarHBondContact O-CB 3.41Å; F449-S453 PolarHBondContact O-N 2.99Å; F449-S453 PolarHBondContact O-OG 3.22Å; F449-L492 HydrophobicContact CE2-CD2 4.11Å; F449-F504 HydrophobicContact CE1-CD1 4.09Å; F449-F504 HydrophobicContact CE1-CE1 4.12Å; F449-F504 AromaticContact CE2-CD1 3.87Å; F449-F504 HydrophobicContact CE2-CD1 3.87Å; F449-F504 HydrophobicContact CE2-CE1 4.23Å; F449-F504 AromaticContact CZ-CD1 3.64Å; F449-F504 HydrophobicContact CZ-CD1 3.64Å; F449-F504 AromaticContact CZ-CE1 3.62Å; F449-F504 HydrophobicContact CZ-CE1 3.62Å; F449-F504 HydrophobicContact CZ-CG 4.46Å; F449-F504 HydrophobicContact CZ-CZ 4.43Å; F449-L515 HydrophobicContact CB-CB 4.13Å; F449-Y516 HydrophobicContact CD1-CD1 4.48Å; F449-Y516 HydrophobicContact CD1-CG 4.17Å; F449-F591 HydrophobicContact CD1-CD2 4.21Å; F449-F591 AromaticContact CD1-CE2 3.58Å; F449-F591 HydrophobicContact CD1-CE2 3.58Å; F449-F591 HydrophobicContact CD1-CZ 4.33Å; F449-F591 AromaticContact CE1-CD2 3.65Å; F449-F591 HydrophobicContact CE1-CD2 3.65Å; F449-F591 AromaticContact CE1-CE2 3.51Å; F449-F591 HydrophobicContact CE1-CE2 3.51Å; F449-F591 HydrophobicContact CE1-CZ 4.48Å; F449-F591 HydrophobicContact CZ-CD2 4.46Å; F449-Y687 HydrophobicContact CE1-CD2 4.21Å; F449-Y687 AromaticContact CE1-CE2 3.5Å; F449-Y687 HydrophobicContact CE1-CE2 3.5Å; F449-Y687 VanDerWaalsContact CE1-CE2 3.5Å; F449-Y687 AromaticContact CZ-CE2 3.8Å; F449-Y687 HydrophobicContact CZ-CE2 3.8Å
450	Y	89.1	Confident	73.3	Confident	99 Å²	99	70.1 Å²	70.1	39%	0.388	37%	0.365	S	S	.	.	H	α-helix	trans	-56.7	-38.7	173.4	-78.7	-67.1	0	0	0	112.5	I446 P447 V452 S453 S454 D506 L515	I446-Y450 HydrophobicContact CG2-CD2 3.87Å; I446-Y450 HydrophobicContact CG2-CE2 3.55Å; I446-Y450 WeakPolarHBondContact O-CD2 3.47Å; I446-Y450 PolarHBondContact O-N 2.73Å; P447-Y450 PolarHBondContact O-N 2.8Å; Y450-V452 PolarHBondContact O-N 3.3Å; Y450-S453 PolarHBondContact O-N 3.11Å; Y450-S454 PolarHBondContact O-N 3.12Å; Y450-D506 PolarHBondContact OH-OD2 3.06Å; Y450-D506 VanDerWaalsContact OH-OD2 3.12Å; Y450-L515 HydrophobicContact CD1-CD2 4.01Å; Y450-L515 HydrophobicContact CD2-CD2 3.81Å; Y450-L515 HydrophobicContact CE1-CD2 3.54Å; Y450-L515 HydrophobicContact CE2-CD2 3.32Å; Y450-L515 HydrophobicContact CG-CD2 4.13Å; Y450-L515 WeakPolarHBondContact OH-CD2 3.48Å
451	S	86.4	Confident	70.6	Confident	57 Å²	57	69.1 Å²	69.1	40%	0.399	36%	0.364	S	S	.	.	H	α-helix	trans	-63.6	-26.5	-179	77.2	0	0	0	0	114.1	P447 A448 F449	P447-S451 PolarHBondContact O-N 2.78Å; A448-S451 PolarHBondContact O-N 3.18Å; A448-S451 PolarHBondContact O-OG 3.2Å; F449-S451 PolarHBondContact O-N 2.92Å
452	V	87.3	Confident	67.6	Low	15 Å²	15	71.6 Å²	71.6	9%	0.091	39%	0.391	C	S	.	.	H	α-helix	trans	-100.8	-25.1	179.8	-61.6	0	0	0	0	113.2	F449 Y450 Y516 F591 R593 P685	F449-V452 VanDerWaalsContact O-CG2 3.25Å; F449-V452 WeakPolarHBondContact O-CG2 3.44Å; F449-V452 PolarHBondContact O-N 3.4Å; Y450-V452 PolarHBondContact O-N 3.3Å; V452-Y516 HydrophobicContact CG2-CD2 3.92Å; V452-Y516 HydrophobicContact CG2-CE2 4.11Å; V452-F591 HydrophobicContact CG1-CE2 4.45Å; V452-F591 HydrophobicContact CG1-CZ 3.83Å; V452-F591 HydrophobicContact CG2-CE2 3.83Å; V452-F591 HydrophobicContact CG2-CZ 3.83Å; V452-R593 HydrophobicContact CG1-CG 4.47Å; V452-P685 HydrophobicContact CB-CB 4.16Å; V452-P685 HydrophobicContact CG1-CB 3.75Å
453	S	74.2	Confident	64.6	Low	17 Å²	17	75.9 Å²	75.9	12%	0.119	42%	0.416	C	S	.	.	H	α-helix	trans	-85.2	-28.6	-176.4	-65.7	0	0	0	0	114.9	F449 Y450 R455 R456 L515 Y516	F449-S453 WeakPolarHBondContact O-CB 3.41Å; F449-S453 PolarHBondContact O-N 2.99Å; F449-S453 PolarHBondContact O-OG 3.22Å; Y450-S453 PolarHBondContact O-N 3.11Å; S453-R455 PolarHBondContact O-N 3.46Å; S453-R456 PolarHBondContact O-N 3.16Å; S453-L515 WeakPolarHBondContact CB-O 2.95Å; S453-L515 PolarHBondContact OG-O 3.12Å; S453-Y516 WeakPolarHBondContact OG-CD2 3.26Å
454	S	53.1	Low	61.8	Low	86 Å²	86	78.9 Å²	78.9	60%	0.601	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	-22.2	-177.8	62.8	0	0	0	0	114	Y450	Y450-S454 PolarHBondContact O-N 3.12Å
455	R	48.9	Very low	59	Low	188 Å²	188	77.2 Å²	77.2	71%	0.709	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.3	-12.8	177.4	-71.2	-174.2	176	-172.6	-1	114.5	S453 T459	S453-R455 PolarHBondContact O-N 3.46Å; R455-T459 PolarHBondContact O-OG1 2.84Å
456	R	43.9	Very low	56.3	Low	69 Å²	69	83.5 Å²	83.5	26%	0.26	45%	0.452	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.3	-34.6	-168.1	-157.1	170	174.8	179.4	-6.2	114.2	S453 R458 Q460	S453-R456 PolarHBondContact O-N 3.16Å; R456-R458 VanDerWaalsContact C-N 3.33Å; R456-R458 PolarHBondContact O-N 2.78Å; R456-Q460 HydrophobicContact CG-CG 3.95Å; R456-Q460 VanDerWaalsContact NE-NE2 3.17Å; R456-Q460 VanDerWaalsContact NH2-OE1 3.12Å; R456-Q460 PolarHBondContact O-N 2.8Å
457	N	42.1	Very low	53.8	Low	139 Å²	139	88.7 Å²	88.7	74%	0.743	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.2	-20.5	-179.6	-76.1	6.2	0	0	0	113.4
458	R	37.5	Very low	52	Low	228 Å²	228	89.9 Å²	89.9	86%	0.86	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.5	-15.2	177	-158.4	171	177.1	-178.5	-0.3	114.4	R456	R456-R458 VanDerWaalsContact C-N 3.33Å; R456-R458 PolarHBondContact O-N 2.78Å
459	T	34.9	Very low	51	Low	90 Å²	90	93.6 Å²	93.6	55%	0.552	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	-136.8	6.9	-168.7	56.5	0	0	0	0	116	R455 S461 G462	R455-T459 PolarHBondContact O-OG1 2.84Å; T459-S461 VanDerWaalsContact C-N 3.35Å; T459-S461 PolarHBondContact O-N 2.96Å; T459-G462 WeakPolarHBondContact O-CA 3.37Å; T459-G462 PolarHBondContact O-N 3.21Å
460	Q	33.9	Very low	50.6	Low	135 Å²	135	99.1 Å²	99.1	63%	0.631	54%	0.536	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.2	39.5	169.1	-76.5	-163	-6	0	0	114.8	R456	R456-Q460 HydrophobicContact CG-CG 3.95Å; R456-Q460 VanDerWaalsContact NE-NE2 3.17Å; R456-Q460 VanDerWaalsContact NH2-OE1 3.12Å; R456-Q460 PolarHBondContact O-N 2.8Å
461	S	33.4	Very low	50.6	Low	62 Å²	62	95.1 Å²	95.1	43%	0.434	52%	0.523	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.1	11.7	136.4	44.5	0	0	0	0	111.8	T459 T463 C464 A465	T459-S461 VanDerWaalsContact C-N 3.35Å; T459-S461 PolarHBondContact O-N 2.96Å; S461-T463 CarbonylContact O-C 3.53Å; S461-T463 PolarHBondContact O-N 2.83Å; S461-C464 CarbonylContact O-C 3.37Å; S461-A465 VanDerWaalsContact C-CB 3.43Å; S461-A465 VanDerWaalsContact CB-CB 3.48Å; S461-A465 VanDerWaalsContact O-CA 3.29Å; S461-A465 WeakPolarHBondContact O-CA 3.49Å; S461-A465 WeakPolarHBondContact O-CB 3.41Å; S461-A465 PolarHBondContact O-N 2.82Å; S461-A465 WeakPolarHBondContact OG-CB 3.07Å
462	G	26.9	Very low	50.6	Low	59 Å²	59	98.4 Å²	98.4	61%	0.608	55%	0.546	S	S	*	.			trans	-63.2	31.8	-169.6	0	0	0	0	0	119.8	T459	T459-G462 WeakPolarHBondContact O-CA 3.37Å; T459-G462 PolarHBondContact O-N 3.21Å
463	T	27.7	Very low	50.7	Low	133 Å²	133	102.7 Å²	102.7	82%	0.816	56%	0.56	S	S	*	*	S	Bend	trans	-132.6	94.9	150.1	53.8	0	0	0	0	105.6	S461	S461-T463 CarbonylContact O-C 3.53Å; S461-T463 PolarHBondContact O-N 2.83Å
464	C	26.3	Very low	51.3	Low	124 Å²	124	110.3 Å²	110.3	84%	0.838	59%	0.594	S	S	*	*	S	Bend	trans	73.4	38.4	-170.1	-50.6	0	0	0	0	116.4	S461 E466	S461-C464 CarbonylContact O-C 3.37Å; C464-E466 VanDerWaalsContact C-N 3.32Å; C464-E466 PolarHBondContact O-N 3.18Å
465	A	33	Very low	53.2	Low	40 Å²	40	107.5 Å²	107.5	33%	0.331	57%	0.57	S	S	.	*			trans	-69.3	85.9	163.5	0	0	0	0	0	110	S461 P467	S461-A465 VanDerWaalsContact C-CB 3.43Å; S461-A465 VanDerWaalsContact CB-CB 3.48Å; S461-A465 VanDerWaalsContact O-CA 3.29Å; S461-A465 WeakPolarHBondContact O-CA 3.49Å; S461-A465 WeakPolarHBondContact O-CB 3.41Å; S461-A465 PolarHBondContact O-N 2.82Å; S461-A465 WeakPolarHBondContact OG-CB 3.07Å; A465-P467 WeakPolarHBondContact O-CD 3.14Å
466	E	34.6	Very low	55.3	Low	131 Å²	131	99 Å²	99	61%	0.612	54%	0.54	S	S	*	.			trans	-56.3	128.5	163.1	-68.4	-61.2	137.1	0	0	108.4	C464 D468	C464-E466 VanDerWaalsContact C-N 3.32Å; C464-E466 PolarHBondContact O-N 3.18Å; E466-D468 PolarHBondContact O-N 3.37Å
467	P	41.6	Very low	57.7	Low	122 Å²	122	95.8 Å²	95.8	79%	0.792	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	12.4	179.3	20.8	-29.2	0	0	0	115.5	A465	A465-P467 WeakPolarHBondContact O-CD 3.14Å
468	D	54.2	Low	60.2	Low	93 Å²	93	92 Å²	92	50%	0.497	51%	0.509	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.4	12.3	-172.7	-78.7	-9.1	0	0	0	114.4	N415 E466 F470	N415-D468 PolarHBondContact ND2-OD2 3.3Å; E466-D468 PolarHBondContact O-N 3.37Å; D468-F470 PolarHBondContact O-N 2.8Å
469	V	70.7	Confident	62.8	Low	77 Å²	77	81.3 Å²	81.3	47%	0.467	47%	0.47	S	S	.	.	S	Bend	trans	-64.8	-40.3	-175.8	-179.9	0	0	0	0	112.8	T418	T418-V469 PolarHBondContact N-O 2.89Å
470	F	84.1	Confident	65.5	Low	117 Å²	117	77.2 Å²	77.2	51%	0.513	45%	0.446	S	S	.	.	B	Isolated β-bridge	trans	-113.5	144.7	-178.1	-65.1	-70.1	0	0	0	112.8	T418 E420 D468	T418-F470 HydrophobicContact CG2-CD1 4.44Å; T418-F470 HydrophobicContact CG2-CE1 4.36Å; T418-F470 CarbonylContact O-C 3.41Å; T418-F470 WeakPolarHBondContact O-CA 3.42Å; T418-F470 WeakPolarHBondContact O-CD1 3.46Å; E420-F470 HydrophobicContact CB-CD1 4.23Å; D468-F470 PolarHBondContact O-N 2.8Å
471	S	88.5	Confident	68.1	Low	16 Å²	16	76.2 Å²	76.2	11%	0.112	44%	0.441	C	S	.	.			trans	-64.5	140.3	171.8	-178.3	0	0	0	0	110.3	D410 T418 R473	D410-S471 PolarHBondContact OD2-OG 3.36Å; T418-S471 PolarHBondContact O-N 2.84Å; S471-R473 PolarHBondContact O-N 2.57Å; S471-R473 PolarHBondContact OG-N 2.97Å
472	S	85.5	Confident	70.2	Confident	125 Å²	125	76.2 Å²	76.2	87%	0.874	43%	0.432	S	S	*	.	S	Bend	trans	-79.3	-5.5	173.3	55.6	0	0	0	0	113.4
473	R	89.9	Confident	72.3	Confident	105 Å²	105	83.2 Å²	83.2	40%	0.396	44%	0.44	S	S	.	.	S	Bend	trans	-83.6	155.4	179.8	-65.1	175.2	68.6	-152.1	0.8	110.8	D410 F419 S471	D410-R473 IonicContact OD1-CZ 3.89Å; D410-R473 IonicContact OD1-NH1 2.78Å; D410-R473 PolarHBondContact OD1-NH1 3.4Å; D410-R473 WeakPolarHBondContact OD2-CD 3.13Å; D410-R473 IonicContact OD2-NH1 3.84Å; F419-R473 WeakPolarHBondContact CD1-O 3.4Å; F419-R473 HydrophobicContact CE1-CB 3.71Å; F419-R473 HydrophobicContact CZ-CB 4.34Å; S471-R473 PolarHBondContact O-N 2.57Å; S471-R473 PolarHBondContact OG-N 2.97Å
474	E	87.7	Confident	73.8	Confident	178 Å²	178	82.9 Å²	82.9	83%	0.832	43%	0.433	S	S	*	.	P	Polyproline II helix	trans	-66.7	149.4	177.9	-64.5	-178.4	172.4	0	0	112.3	F419	F419-E474 WeakPolarHBondContact CE1-O 3.35Å
475	W	91.5	Very high	75.4	Confident	27 Å²	27	79.7 Å²	79.7	10%	0.102	41%	0.412	C	S	.	.	P	Polyproline II helix	trans	-50.8	126.5	175.2	178.6	-107.8	0	0	0	111.5	V408 F419 N421 P422 I477 T478	V408-W475 HydrophobicContact CB-CH2 3.94Å; V408-W475 HydrophobicContact CB-CZ3 3.74Å; V408-W475 HydrophobicContact CG2-CH2 3.24Å; V408-W475 HydrophobicContact CG2-CZ2 3.95Å; V408-W475 HydrophobicContact CG2-CZ3 3.61Å; F419-W475 HydrophobicContact CB-CE3 3.72Å; F419-W475 HydrophobicContact CB-CZ3 3.93Å; N421-W475 HydrophobicContact CB-CH2 4.34Å; N421-W475 HydrophobicContact CB-CZ3 4.32Å; P422-W475 VanDerWaalsContact CD-CD2 3.48Å; P422-W475 HydrophobicContact CG-CD2 3.97Å; P422-W475 HydrophobicContact CG-CG 3.92Å; W475-I477 VanDerWaalsContact CD1-O 3.27Å; W475-I477 HydrophobicContact CZ2-CD1 3.73Å; W475-I477 HydrophobicContact CZ2-CG1 4.35Å; W475-I477 PolarHBondContact O-N 3.41Å; W475-T478 VanDerWaalsContact O-CG2 3.25Å; W475-T478 WeakPolarHBondContact O-CG2 3.35Å
476	P	94.3	Very high	76.3	Confident	10 Å²	10	84 Å²	84	7%	0.065	44%	0.439	C	S	.	.	S	Bend	trans	-79.9	-17.5	-166.9	26.2	-33.5	0	0	0	115.8	L383 Y396 A397 V408 F419 T478	L383-P476 HydrophobicContact CD1-CB 3.86Å; L383-P476 HydrophobicContact CD1-CG 3.72Å; Y396-P476 HydrophobicContact CD2-CB 4.46Å; Y396-P476 HydrophobicContact CE2-CB 3.68Å; A397-P476 HydrophobicContact CB-CG 4.34Å; V408-P476 HydrophobicContact CG1-CG 3.61Å; F419-P476 HydrophobicContact CD2-CG 4.27Å; F419-P476 HydrophobicContact CE2-CG 4.11Å; F419-P476 HydrophobicContact CZ-CG 4.32Å; P476-T478 PolarHBondContact O-N 3.09Å
477	I	94.5	Very high	77.2	Confident	1 Å²	1	85.8 Å²	85.8	1%	0.005	45%	0.448	C	S	.	.			trans	-87.5	93.9	178.4	-52	169.1	0	0	0	107.2	R68 V70 G83 K84 W475	R68-I477 VanDerWaalsContact O-CG2 3.25Å; R68-I477 WeakPolarHBondContact O-CG2 3.26Å; V70-I477 HydrophobicContact CB-CD1 4.12Å; V70-I477 HydrophobicContact CB-CG2 4.48Å; V70-I477 HydrophobicContact CG2-CD1 3.51Å; V70-I477 HydrophobicContact CG2-CG1 3.96Å; V70-I477 HydrophobicContact CG2-CG2 4.18Å; G83-I477 CarbonylContact C-O 3.45Å; G83-I477 WeakPolarHBondContact O-CG2 3.48Å; K84-I477 WeakPolarHBondContact CA-O 3.38Å; K84-I477 PolarHBondContact N-O 3.45Å; W475-I477 VanDerWaalsContact CD1-O 3.27Å; W475-I477 HydrophobicContact CZ2-CD1 3.73Å; W475-I477 HydrophobicContact CZ2-CG1 4.35Å; W475-I477 PolarHBondContact O-N 3.41Å
478	T	93.6	Very high	78.4	Confident	58 Å²	58	83.7 Å²	83.7	36%	0.356	43%	0.427	S	S	.	.			trans	-113.2	14	-169.7	66.2	0	0	0	0	113.8	R68 W475 P476	R68-T478 WeakPolarHBondContact CD-OG1 3.38Å; R68-T478 PolarHBondContact NH1-OG1 3.26Å; R68-T478 PolarHBondContact O-N 2.84Å; W475-T478 VanDerWaalsContact O-CG2 3.25Å; W475-T478 WeakPolarHBondContact O-CG2 3.35Å; P476-T478 PolarHBondContact O-N 3.09Å
479	G	93	Very high	79.8	Confident	4 Å²	4	81.8 Å²	81.8	4%	0.041	42%	0.419	C	S	.	.			trans	-68.9	152.7	-173.3	0	0	0	0	0	114.8	Q67 R68 G83 K84	Q67-G479 WeakPolarHBondContact O-CA 3.38Å; R68-G479 WeakPolarHBondContact O-CA 2.96Å; R68-G479 PolarHBondContact O-N 3.41Å; G83-G479 CarbonylContact C-O 3.59Å; G83-G479 WeakPolarHBondContact CA-O 3.45Å; K84-G479 PolarHBondContact N-O 3.4Å
480	G	91.6	Very high	80.8	Confident	4 Å²	4	79.7 Å²	79.7	4%	0.041	41%	0.407	C	S	.	.	S	Bend	trans	74.3	172.9	174.3	0	0	0	0	0	116.2	K84 E1205	K84-G480 VanDerWaalsContact CD-O 3.3Å; K84-G480 WeakPolarHBondContact CD-O 3.48Å; K84-G480 VanDerWaalsContact CE-O 3.22Å; K84-G480 WeakPolarHBondContact CE-O 3.47Å; K84-G480 PolarHBondContact NZ-O 2.92Å; G480-E1205 CarbonylContact C-O 3.49Å; G480-E1205 WeakPolarHBondContact CA-O 3.28Å
481	E	87.8	Confident	81.3	Confident	114 Å²	114	74.8 Å²	74.8	53%	0.533	39%	0.385	S	S	.	.	B	Isolated β-bridge	trans	-132.8	140.2	179.9	-85.7	177.1	-166.3	0	0	112	G1204 E1205 L1208	E481-G1204 CarbonylContact O-C 3.37Å; E481-G1204 WeakPolarHBondContact O-CA 3.23Å; E481-E1205 PolarHBondContact N-O 3.2Å; E481-E1205 PolarHBondContact O-N 2.88Å; E481-L1208 HydrophobicContact CB-CD1 4.2Å; E481-L1208 HydrophobicContact CB-CD2 4.19Å; E481-L1208 HydrophobicContact CG-CD1 3.78Å; E481-L1208 HydrophobicContact CG-CD2 4.46Å
482	W	77.2	Confident	81.6	Confident	63 Å²	63	74 Å²	74	24%	0.239	38%	0.38	C	S	.	.			trans	-125.4	150.3	169.3	71.3	-89.9	0	0	0	108.6	K84 P85 V87 L484 V510	K84-W482 VanDerWaalsContact CE-CD1 3.47Å; P85-W482 PolarHBondContact O-NE1 3.37Å; V87-W482 HydrophobicContact CG2-CB 4.05Å; V87-W482 HydrophobicContact CG2-CG 4.38Å; W482-L484 HydrophobicContact CH2-CD2 3.52Å; W482-L484 HydrophobicContact CH2-CG 3.9Å; W482-L484 HydrophobicContact CZ3-CB 4.47Å; W482-L484 HydrophobicContact CZ3-CD2 3.78Å; W482-L484 HydrophobicContact CZ3-CG 3.91Å; W482-V510 HydrophobicContact CE3-CG2 4.44Å
483	R	70.6	Confident	82	Confident	205 Å²	205	68 Å²	68	77%	0.774	34%	0.338	S	S	*	.			trans	-105.4	137.1	178.7	-67	-176	-179.4	173.6	1.7	109.8	S485	R483-S485 PolarHBondContact O-N 3.45Å
484	L	60	Low	82.3	Confident	127 Å²	127	63 Å²	63	67%	0.665	32%	0.319	S	S	*	.			trans	-63.5	120.7	169.7	-75	151.1	0	0	0	109.3	W482	W482-L484 HydrophobicContact CH2-CD2 3.52Å; W482-L484 HydrophobicContact CH2-CG 3.9Å; W482-L484 HydrophobicContact CZ3-CB 4.47Å; W482-L484 HydrophobicContact CZ3-CD2 3.78Å; W482-L484 HydrophobicContact CZ3-CG 3.91Å
485	S	59.3	Low	82.7	Confident	57 Å²	57	54.6 Å²	54.6	40%	0.399	28%	0.28	S	S	.	.			trans	-73	131.6	169.3	54.1	0	0	0	0	109.2	R483 Q487	R483-S485 PolarHBondContact O-N 3.45Å; S485-Q487 PolarHBondContact O-N 2.99Å; S485-Q487 VanDerWaalsContact O-N 3.12Å
486	S	53	Low	82.9	Confident	129 Å²	129	53.3 Å²	53.3	90%	0.902	28%	0.275	S	S	*	.	S	Bend	trans	-68.9	-5.6	-173.8	59.3	0	0	0	0	115.8
487	Q	52.2	Low	82.9	Confident	170 Å²	170	52.8 Å²	52.8	79%	0.794	27%	0.272	S	S	*	.			trans	-132.7	92.5	176.7	-72.4	-171.4	-21.4	0	0	109.7	S485	S485-Q487 PolarHBondContact O-N 2.99Å; S485-Q487 VanDerWaalsContact O-N 3.12Å
488	Q	68.1	Low	82.7	Confident	77 Å²	77	53.1 Å²	53.1	36%	0.36	28%	0.275	S	S	.	.			trans	-98.3	113.2	170.9	-72.9	178	-18.3	0	0	108.7
489	V	83.8	Confident	82.6	Confident	54 Å²	54	53.2 Å²	53.2	33%	0.327	27%	0.273	S	S	.	.			trans	-78.4	134.5	169.2	175.3	0	0	0	0	106.8	V439 D440 E491	V439-V489 HydrophobicContact CG1-CG1 4.18Å; D440-V489 HydrophobicContact CB-CG1 3.47Å; D440-V489 VanDerWaalsContact CB-CG1 3.47Å; D440-V489 VanDerWaalsContact N-CG1 3.32Å; V489-E491 PolarHBondContact O-N 3.42Å
490	P	91.5	Very high	82.6	Confident	33 Å²	33	53 Å²	53	21%	0.214	27%	0.271	C	S	.	.			trans	-67.6	126.2	178.8	28.3	-35.7	0	0	0	110.5	D440 C441 I446	D440-P490 PolarHBondContact N-O 3.36Å; C441-P490 PolarHBondContact N-O 3.32Å; C441-P490 WeakPolarHBondContact O-CG 3.32Å; C441-P490 PolarHBondContact SG-O 2.85Å; I446-P490 HydrophobicContact CD1-CB 3.94Å
491	E	93	Very high	82.7	Confident	13 Å²	13	52.8 Å²	52.8	6%	0.061	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	134.9	-176.7	-63.3	-179.6	-155.8	0	0	111.9	Y437 L438 V439 I446 V489 A507 S508 K1188	Y437-E491 HydrophobicContact CE2-CB 4.43Å; Y437-E491 PolarHBondContact OH-OE2 3.5Å; L438-E491 WeakPolarHBondContact O-CA 3.34Å; V439-E491 HydrophobicContact CG1-CG 4.24Å; V439-E491 HydrophobicContact CG2-CG 4.47Å; I446-E491 WeakPolarHBondContact CD1-O 3.45Å; V489-E491 PolarHBondContact O-N 3.42Å; E491-A507 HydrophobicContact CB-CB 4.06Å; E491-A507 PolarHBondContact O-N 3.12Å; E491-S508 PolarHBondContact N-OG 3.15Å; E491-S508 PolarHBondContact O-OG 3.09Å; E491-K1188 IonicContact OE1-NZ 2.68Å; E491-K1188 PolarHBondContact OE1-NZ 2.82Å; E491-K1188 WeakPolarHBondContact OE2-CE 3.4Å; E491-K1188 IonicContact OE2-NZ 2.91Å; E491-K1188 PolarHBondContact OE2-NZ 2.79Å
492	L	95.2	Very high	83.1	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	125.7	-176.7	-177.8	72.2	0	0	0	109.8	L438 L445 F449 I494 F504 L515 F571	L438-L492 HydrophobicContact CB-CB 4.33Å; L438-L492 PolarHBondContact N-O 3.26Å; L438-L492 PolarHBondContact O-N 3.3Å; L445-L492 HydrophobicContact CD2-CD2 3.89Å; F449-L492 HydrophobicContact CE2-CD2 4.11Å; L492-I494 HydrophobicContact CD2-CD1 4.08Å; L492-I494 HydrophobicContact CD2-CG1 4.13Å; L492-I494 HydrophobicContact CG-CG1 4.12Å; L492-F504 HydrophobicContact CD1-CB 4.37Å; L492-F504 HydrophobicContact CD1-CD1 4.34Å; L492-F504 HydrophobicContact CD2-CD1 4.31Å; L492-L515 HydrophobicContact CD1-CD1 3.72Å; L492-F571 HydrophobicContact CD2-CE1 4.02Å
493	I	95.3	Very high	83.9	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	136	168	-64.6	172	0	0	0	108.1	L436 Y437 T495 W505 A507 L512 V1178 L1186	L436-I493 WeakPolarHBondContact O-CA 3.3Å; Y437-I493 HydrophobicContact CD2-CD1 4.36Å; Y437-I493 HydrophobicContact CD2-CG1 3.58Å; Y437-I493 HydrophobicContact CE2-CD1 4.48Å; Y437-I493 HydrophobicContact CE2-CG1 4.04Å; Y437-I493 HydrophobicContact CG-CG1 4.49Å; I493-T495 HydrophobicContact CG2-CG2 4.07Å; I493-W505 HydrophobicContact CB-CB 4.23Å; I493-W505 PolarHBondContact N-O 2.8Å; I493-W505 PolarHBondContact O-N 2.77Å; I493-A507 HydrophobicContact CD1-CB 3.7Å; I493-A507 HydrophobicContact CG1-CB 3.89Å; I493-L512 HydrophobicContact CD1-CD1 4.01Å; I493-V1178 HydrophobicContact CD1-CG1 3.96Å; I493-L1186 HydrophobicContact CD1-CD1 4.35Å; I493-L1186 HydrophobicContact CD1-CD2 3.77Å; I493-L1186 HydrophobicContact CG2-CD1 4.15Å
494	I	96.1	Very high	85	Confident	0 Å²	0	35.6 Å²	35.6	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	122.1	174.1	-50.6	174.1	0	0	0	108.1	C435 L436 L438 L492 V502 R503 F504 M569 F571	C435-I494 CarbonylContact C-O 3.51Å; C435-I494 WeakPolarHBondContact CA-O 3.29Å; L436-I494 HydrophobicContact CB-CB 4.23Å; L436-I494 PolarHBondContact N-O 3.08Å; L436-I494 PolarHBondContact O-N 3.3Å; L438-I494 HydrophobicContact CD1-CD1 4.16Å; L492-I494 HydrophobicContact CD2-CD1 4.08Å; L492-I494 HydrophobicContact CD2-CG1 4.13Å; L492-I494 HydrophobicContact CG-CG1 4.12Å; I494-V502 HydrophobicContact CG2-CG1 3.43Å; I494-V502 VanDerWaalsContact CG2-CG1 3.43Å; I494-R503 CarbonylContact C-O 3.57Å; I494-R503 VanDerWaalsContact CA-O 3.29Å; I494-R503 WeakPolarHBondContact CA-O 3.31Å; I494-F504 HydrophobicContact CD1-CD1 3.97Å; I494-F504 HydrophobicContact CD1-CE1 3.57Å; I494-F504 HydrophobicContact CD1-CZ 4.39Å; I494-F504 HydrophobicContact CG1-CD1 3.77Å; I494-F504 HydrophobicContact CG1-CE1 3.86Å; I494-F504 HydrophobicContact CG2-CD1 4.42Å; I494-F504 HydrophobicContact CG2-CE1 4.19Å; I494-F504 HydrophobicContact CG2-CE2 4.47Å; I494-F504 HydrophobicContact CG2-CZ 4.2Å; I494-M569 HydrophobicContact CG2-CE 4.26Å; I494-M569 HydrophobicContact CG2-SD 4.08Å; I494-M569 WeakPolarHBondContact O-CE 3.35Å; I494-F571 HydrophobicContact CD1-CB 3.98Å; I494-F571 HydrophobicContact CD1-CD1 3.5Å; I494-F571 HydrophobicContact CD1-CD2 4.27Å; I494-F571 HydrophobicContact CD1-CE1 4.05Å; I494-F571 HydrophobicContact CD1-CG 3.63Å
495	T	95.4	Very high	86.6	Confident	0 Å²	0	29.8 Å²	29.8	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	129.5	178.3	58.5	0	0	0	0	110.7	V432 I493 H497 V502 R503 W505	V432-T495 HydrophobicContact CG1-CG2 4.2Å; V432-T495 HydrophobicContact CG2-CG2 4.38Å; I493-T495 HydrophobicContact CG2-CG2 4.07Å; T495-H497 PolarHBondContact O-CD2 3.06Å; T495-H497 PolarHBondContact OG1-NE2 3.4Å; T495-V502 CarbonylContact O-C 3.56Å; T495-V502 WeakPolarHBondContact O-CA 3.45Å; T495-R503 PolarHBondContact N-O 2.84Å; T495-R503 PolarHBondContact O-N 3.28Å; T495-W505 PolarHBondContact OG1-NE1 3.07Å
496	G	95.1	Very high	88.1	Confident	0 Å²	0	27.9 Å²	27.9	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	141.3	168.6	0	0	0	0	0	109.4	V432 T433 S434 M569	V432-G496 CarbonylContact C-O 3.57Å; V432-G496 WeakPolarHBondContact CA-O 3.45Å; T433-G496 PolarHBondContact N-O 3.49Å; T433-G496 PolarHBondContact OG1-O 3.48Å; S434-G496 PolarHBondContact N-O 3.46Å; S434-G496 PolarHBondContact O-N 3Å; G496-M569 VanDerWaalsContact N-CE 3.3Å
497	H	94.2	Very high	89.9	Confident	0 Å²	0	21.8 Å²	21.8	0%	0	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	161.8	-171.2	-64.8	-98.5	0	0	0	112.7	S430 P431 T495 D499 G500 S501 R503 I566	S430-H497 PolarHBondContact O-ND1 3.08Å; P431-H497 CarbonylContact O-C 3.57Å; P431-H497 VanDerWaalsContact O-CA 3.24Å; P431-H497 WeakPolarHBondContact O-CA 3.32Å; T495-H497 PolarHBondContact O-CD2 3.06Å; T495-H497 PolarHBondContact OG1-NE2 3.4Å; H497-D499 VanDerWaalsContact C-N 3.26Å; H497-D499 WeakPolarHBondContact CB-OD1 3.18Å; H497-D499 PolarHBondContact O-N 3.43Å; H497-G500 PolarHBondContact O-N 3.32Å; H497-S501 PolarHBondContact CD2-O 3.33Å; H497-S501 PolarHBondContact N-O 3.29Å; H497-R503 VanDerWaalsContact NE2-CD 3.34Å; H497-R503 WeakPolarHBondContact NE2-CD 3.26Å; H497-I566 PolarHBondContact O-N 3.11Å
498	A	91.3	Very high	91.6	Very high	8 Å²	8	14.8 Å²	14.8	7%	0.066	8%	0.081	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-31.1	175.6	0	0	0	0	0	113	S430 P431 T433 G500 D562 A565	S430-A498 PolarHBondContact OG-N 2.72Å; P431-A498 HydrophobicContact CB-CB 4.3Å; P431-A498 HydrophobicContact CG-CB 4.38Å; P431-A498 PolarHBondContact O-N 3.01Å; T433-A498 HydrophobicContact CG2-CB 4.07Å; A498-G500 PolarHBondContact O-N 3.15Å; A498-G500 VanDerWaalsContact O-N 3.15Å; A498-D562 HydrophobicContact CB-CB 4.4Å; A498-A565 HydrophobicContact CB-CB 4.45Å; A498-A565 WeakPolarHBondContact O-CA 3.37Å; A498-A565 PolarHBondContact O-N 3.21Å
499	D	90.6	Very high	92.1	Very high	59 Å²	59	15 Å²	15	32%	0.316	8%	0.082	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.5	4.6	176.7	75.8	-17.8	0	0	0	114.5	S430 H497 S501	S430-D499 WeakPolarHBondContact OG-CB 3.4Å; S430-D499 PolarHBondContact OG-N 2.61Å; H497-D499 VanDerWaalsContact C-N 3.26Å; H497-D499 WeakPolarHBondContact CB-OD1 3.18Å; H497-D499 PolarHBondContact O-N 3.43Å; D499-S501 PolarHBondContact O-N 3.5Å; D499-S501 WeakPolarHBondContact OD1-CA 3.28Å; D499-S501 WeakPolarHBondContact OD1-CB 3.23Å; D499-S501 PolarHBondContact OD1-N 3.19Å; D499-S501 PolarHBondContact OD1-OG 3.2Å; D499-S501 PolarHBondContact OD2-OG 2.95Å
500	G	93	Very high	91.7	Very high	0 Å²	0	14.4 Å²	14.4	0%	0	8%	0.078	C	C	.	.	S	Bend	trans	73.4	11.6	-174.3	0	0	0	0	0	114.5	H497 A498 T520 L564	H497-G500 PolarHBondContact O-N 3.32Å; A498-G500 PolarHBondContact O-N 3.15Å; A498-G500 VanDerWaalsContact O-N 3.15Å; G500-T520 WeakPolarHBondContact CA-OG1 3.43Å; G500-T520 WeakPolarHBondContact O-CG2 3.36Å; G500-T520 PolarHBondContact O-N 2.87Å; G500-T520 PolarHBondContact O-OG1 3.42Å; G500-L564 WeakPolarHBondContact CA-O 3.34Å; G500-L564 PolarHBondContact N-O 3.31Å
501	S	94.1	Very high	91	Very high	0 Å²	0	14.3 Å²	14.3	0%	0	8%	0.078	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	148.1	172	73.4	0	0	0	0	112.6	H497 D499 K517 F518	H497-S501 PolarHBondContact CD2-O 3.33Å; H497-S501 PolarHBondContact N-O 3.29Å; D499-S501 PolarHBondContact O-N 3.5Å; D499-S501 WeakPolarHBondContact OD1-CA 3.28Å; D499-S501 WeakPolarHBondContact OD1-CB 3.23Å; D499-S501 PolarHBondContact OD1-N 3.19Å; D499-S501 PolarHBondContact OD1-OG 3.2Å; D499-S501 PolarHBondContact OD2-OG 2.95Å; S501-K517 VanDerWaalsContact CB-CE 3.41Å; S501-F518 CarbonylContact C-O 3.5Å; S501-F518 VanDerWaalsContact CA-O 3.27Å; S501-F518 WeakPolarHBondContact CA-O 3.48Å; S501-F518 WeakPolarHBondContact CB-O 3.42Å
502	V	95.6	Very high	90.6	Very high	0 Å²	0	13.8 Å²	13.8	0%	0	8%	0.076	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	125.7	169.3	-175.7	0	0	0	0	107.4	I494 T495 F504 K517 F518 I566 M569 L578 T580	I494-V502 HydrophobicContact CG2-CG1 3.43Å; I494-V502 VanDerWaalsContact CG2-CG1 3.43Å; T495-V502 CarbonylContact O-C 3.56Å; T495-V502 WeakPolarHBondContact O-CA 3.45Å; V502-F504 HydrophobicContact CG1-CD2 4.49Å; V502-F504 HydrophobicContact CG1-CE2 3.81Å; V502-F504 HydrophobicContact CG1-CZ 4.24Å; V502-K517 WeakPolarHBondContact O-CA 3.08Å; V502-F518 PolarHBondContact N-O 2.98Å; V502-F518 PolarHBondContact O-N 3.46Å; V502-I566 HydrophobicContact CG2-CG1 4.25Å; V502-M569 HydrophobicContact CG1-SD 3.94Å; V502-M569 HydrophobicContact CG2-SD 4.35Å; V502-L578 HydrophobicContact CB-CD2 4.49Å; V502-L578 HydrophobicContact CG1-CD2 3.95Å; V502-L578 HydrophobicContact CG2-CD2 4.48Å; V502-T580 HydrophobicContact CG2-CG2 3.85Å
503	R	93.8	Very high	90.2	Very high	19 Å²	19	15.9 Å²	15.9	7%	0.072	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	141.1	-177.8	-56.4	-178	-165.5	-166.8	4.1	110.4	D426 S429 I494 T495 H497 W505 Y516 K517	D426-R503 PolarHBondContact O-NH1 3.48Å; S429-R503 VanDerWaalsContact OG-CZ 3.23Å; S429-R503 PolarHBondContact OG-NH1 2.77Å; S429-R503 PolarHBondContact OG-NH2 3.4Å; I494-R503 CarbonylContact C-O 3.57Å; I494-R503 VanDerWaalsContact CA-O 3.29Å; I494-R503 WeakPolarHBondContact CA-O 3.31Å; T495-R503 PolarHBondContact N-O 2.84Å; T495-R503 PolarHBondContact O-N 3.28Å; H497-R503 VanDerWaalsContact NE2-CD 3.34Å; H497-R503 WeakPolarHBondContact NE2-CD 3.26Å; R503-W505 HydrophobicContact CB-CZ2 3.86Å; R503-W505 HydrophobicContact CG-CZ2 4.45Å; R503-Y516 WeakPolarHBondContact CA-O 3.24Å; R503-K517 HydrophobicContact CG-CB 4.44Å; R503-K517 HydrophobicContact CG-CD 4.21Å; R503-K517 HydrophobicContact CG-CG 4.06Å
504	F	94.7	Very high	89.8	Confident	1 Å²	1	19.1 Å²	19.1	0%	0.004	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	135.4	-178.3	-66.4	-105.6	0	0	0	107.9	F449 L492 I494 V502 L515 Y516 L578 Y687	F449-F504 HydrophobicContact CE1-CD1 4.09Å; F449-F504 HydrophobicContact CE1-CE1 4.12Å; F449-F504 AromaticContact CE2-CD1 3.87Å; F449-F504 HydrophobicContact CE2-CD1 3.87Å; F449-F504 HydrophobicContact CE2-CE1 4.23Å; F449-F504 AromaticContact CZ-CD1 3.64Å; F449-F504 HydrophobicContact CZ-CD1 3.64Å; F449-F504 AromaticContact CZ-CE1 3.62Å; F449-F504 HydrophobicContact CZ-CE1 3.62Å; F449-F504 HydrophobicContact CZ-CG 4.46Å; F449-F504 HydrophobicContact CZ-CZ 4.43Å; L492-F504 HydrophobicContact CD1-CB 4.37Å; L492-F504 HydrophobicContact CD1-CD1 4.34Å; L492-F504 HydrophobicContact CD2-CD1 4.31Å; I494-F504 HydrophobicContact CD1-CD1 3.97Å; I494-F504 HydrophobicContact CD1-CE1 3.57Å; I494-F504 HydrophobicContact CD1-CZ 4.39Å; I494-F504 HydrophobicContact CG1-CD1 3.77Å; I494-F504 HydrophobicContact CG1-CE1 3.86Å; I494-F504 HydrophobicContact CG2-CD1 4.42Å; I494-F504 HydrophobicContact CG2-CE1 4.19Å; I494-F504 HydrophobicContact CG2-CE2 4.47Å; I494-F504 HydrophobicContact CG2-CZ 4.2Å; V502-F504 HydrophobicContact CG1-CD2 4.49Å; V502-F504 HydrophobicContact CG1-CE2 3.81Å; V502-F504 HydrophobicContact CG1-CZ 4.24Å; F504-L515 HydrophobicContact CB-CB 4.12Å; F504-L515 WeakPolarHBondContact O-CB 3.47Å; F504-L515 PolarHBondContact O-N 3.33Å; F504-Y516 AromaticContact CD2-CD1 3.71Å; F504-Y516 HydrophobicContact CD2-CD1 3.71Å; F504-Y516 HydrophobicContact CD2-CG 4.45Å; F504-Y516 AromaticContact CE2-CD1 3.88Å; F504-Y516 HydrophobicContact CE2-CD1 3.88Å; F504-Y516 HydrophobicContact CE2-CE1 4.5Å; F504-Y516 PolarHBondContact N-O 2.89Å; F504-Y516 PolarHBondContact O-N 2.96Å; F504-L578 HydrophobicContact CE2-CD2 4.46Å; F504-L578 HydrophobicContact CZ-CD2 3.91Å; F504-Y687 AromaticContact CE1-CE2 3.67Å; F504-Y687 HydrophobicContact CE1-CE2 3.67Å; F504-Y687 HydrophobicContact CE2-CD2 4.01Å; F504-Y687 AromaticContact CE2-CE2 3.8Å; F504-Y687 HydrophobicContact CE2-CE2 3.8Å; F504-Y687 AromaticContact CZ-CD2 3.81Å; F504-Y687 HydrophobicContact CZ-CD2 3.81Å; F504-Y687 AromaticContact CZ-CE2 3.16Å; F504-Y687 HydrophobicContact CZ-CE2 3.16Å; F504-Y687 AromaticContact CZ-CZ 3.89Å
505	W	92.5	Very high	89.5	Confident	6 Å²	6	19.3 Å²	19.3	2%	0.023	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	130.3	-174.4	-45.4	87.8	0	0	0	110.3	P424 L427 I493 T495 R503 A507 L512 T513 P514	P424-W505 HydrophobicContact CB-CE3 4.5Å; P424-W505 HydrophobicContact CB-CZ3 3.94Å; L427-W505 HydrophobicContact CD2-CZ2 4.39Å; L427-W505 HydrophobicContact CG-CH2 4.17Å; L427-W505 HydrophobicContact CG-CZ2 4.28Å; I493-W505 HydrophobicContact CB-CB 4.23Å; I493-W505 PolarHBondContact N-O 2.8Å; I493-W505 PolarHBondContact O-N 2.77Å; T495-W505 PolarHBondContact OG1-NE1 3.07Å; R503-W505 HydrophobicContact CB-CZ2 3.86Å; R503-W505 HydrophobicContact CG-CZ2 4.45Å; W505-A507 PolarHBondContact O-N 2.94Å; W505-L512 HydrophobicContact CB-CD1 3.59Å; W505-L512 HydrophobicContact CB-CD2 4.33Å; W505-L512 HydrophobicContact CB-CG 3.93Å; W505-L512 HydrophobicContact CD2-CD2 4.2Å; W505-L512 HydrophobicContact CE3-CD2 4.01Å; W505-L512 HydrophobicContact CE3-CG 4.23Å; W505-L512 HydrophobicContact CG-CD1 4.41Å; W505-L512 HydrophobicContact CG-CD2 4.36Å; W505-L512 HydrophobicContact CG-CG 4.45Å; W505-T513 CarbonylContact C-O 3.57Å; W505-T513 VanDerWaalsContact CA-O 3.28Å; W505-T513 WeakPolarHBondContact CA-O 3.15Å; W505-P514 HydrophobicContact CE3-CB 3.95Å; W505-P514 HydrophobicContact CZ3-CB 3.81Å
506	D	92	Very high	89.3	Confident	17 Å²	17	20.5 Å²	20.5	9%	0.091	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	117.7	169.6	-162.6	-19.7	0	0	0	108.2	I446 Y450 S508 L512 T513 L515	I446-D506 WeakPolarHBondContact CG2-OD2 3.37Å; Y450-D506 PolarHBondContact OH-OD2 3.06Å; Y450-D506 VanDerWaalsContact OH-OD2 3.12Å; D506-S508 WeakPolarHBondContact OD1-CB 3.24Å; D506-S508 PolarHBondContact OD1-N 3.11Å; D506-S508 PolarHBondContact OD1-OG 3.23Å; D506-L512 WeakPolarHBondContact O-CA 3.37Å; D506-T513 PolarHBondContact N-O 3Å; D506-T513 PolarHBondContact O-N 3.11Å; D506-L515 HydrophobicContact CB-CD1 3.76Å; D506-L515 HydrophobicContact CB-CD2 3.89Å; D506-L515 HydrophobicContact CB-CG 3.76Å
507	A	91	Very high	89.2	Confident	1 Å²	1	22.9 Å²	22.9	1%	0.008	13%	0.126	C	C	.	.			trans	-114.3	13.8	177.9	0	0	0	0	0	111.8	E491 I493 W505 E509 L512	E491-A507 HydrophobicContact CB-CB 4.06Å; E491-A507 PolarHBondContact O-N 3.12Å; I493-A507 HydrophobicContact CD1-CB 3.7Å; I493-A507 HydrophobicContact CG1-CB 3.89Å; W505-A507 PolarHBondContact O-N 2.94Å; A507-E509 VanDerWaalsContact C-N 3.27Å; A507-E509 PolarHBondContact O-N 3.05Å; A507-L512 HydrophobicContact CB-CD1 3.93Å
508	S	87.3	Confident	89.2	Confident	23 Å²	23	23.1 Å²	23.1	16%	0.161	13%	0.127	C	C	.	.	S	Bend	trans	-69.1	-27.2	-175.9	-45.7	0	0	0	0	112.5	I446 E491 D506	I446-S508 WeakPolarHBondContact CD1-OG 3.26Å; E491-S508 PolarHBondContact N-OG 3.15Å; E491-S508 PolarHBondContact O-OG 3.09Å; D506-S508 WeakPolarHBondContact OD1-CB 3.24Å; D506-S508 PolarHBondContact OD1-N 3.11Å; D506-S508 PolarHBondContact OD1-OG 3.23Å
509	E	78.6	Confident	89.3	Confident	81 Å²	81	27.1 Å²	27.1	38%	0.379	14%	0.14	S	C	.	.	S	Bend	trans	-107.7	179.8	179.4	-59	-166.4	171.9	0	0	112.4	A507 S511	A507-E509 VanDerWaalsContact C-N 3.27Å; A507-E509 PolarHBondContact O-N 3.05Å; E509-S511 PolarHBondContact O-N 3.31Å
510	V	75.3	Confident	89.4	Confident	41 Å²	41	24.3 Å²	24.3	25%	0.248	13%	0.125	C	C	.	.	S	Bend	trans	-65.8	-29.9	175.4	-178.5	0	0	0	0	111.4	H52 G86 W482	H52-V510 PolarHBondContact CE1-O 3.43Å; H52-V510 PolarHBondContact ND1-O 3.36Å; G86-V510 WeakPolarHBondContact O-CG1 3.28Å; W482-V510 HydrophobicContact CE3-CG2 4.44Å
511	S	76.7	Confident	89.3	Confident	31 Å²	31	26.1 Å²	26.1	22%	0.217	14%	0.138	C	C	.	.	S	Bend	trans	-90.9	130.8	172.1	46.9	0	0	0	0	111	E509	E509-S511 PolarHBondContact O-N 3.31Å
512	L	85.5	Confident	89.1	Confident	2 Å²	2	29.6 Å²	29.6	1%	0.01	15%	0.153	C	C	.	.			trans	-73.1	133.8	165.8	-172	76.3	0	0	0	108.1	H52 P424 L427 I493 W505 D506 A507	H52-L512 HydrophobicContact CB-CB 3.8Å; H52-L512 HydrophobicContact CB-CD2 3.87Å; H52-L512 HydrophobicContact CB-CG 4.43Å; P424-L512 VanDerWaalsContact CD-O 3.23Å; P424-L512 WeakPolarHBondContact CD-O 3.38Å; P424-L512 HydrophobicContact CG-CB 3.9Å; P424-L512 HydrophobicContact CG-CD2 4.28Å; P424-L512 HydrophobicContact CG-CG 4.35Å; P424-L512 WeakPolarHBondContact CG-O 3.42Å; L427-L512 HydrophobicContact CD1-CD2 4Å; L427-L512 HydrophobicContact CD2-CD2 4.21Å; L427-L512 HydrophobicContact CG-CD2 4.45Å; I493-L512 HydrophobicContact CD1-CD1 4.01Å; W505-L512 HydrophobicContact CB-CD1 3.59Å; W505-L512 HydrophobicContact CB-CD2 4.33Å; W505-L512 HydrophobicContact CB-CG 3.93Å; W505-L512 HydrophobicContact CD2-CD2 4.2Å; W505-L512 HydrophobicContact CE3-CD2 4.01Å; W505-L512 HydrophobicContact CE3-CG 4.23Å; W505-L512 HydrophobicContact CG-CD1 4.41Å; W505-L512 HydrophobicContact CG-CD2 4.36Å; W505-L512 HydrophobicContact CG-CG 4.45Å; D506-L512 WeakPolarHBondContact O-CA 3.37Å; A507-L512 HydrophobicContact CB-CD1 3.93Å
513	T	85.5	Confident	88.9	Confident	45 Å²	45	29.7 Å²	29.7	28%	0.276	15%	0.154	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	129.2	-179	-54	0	0	0	0	110.5	W505 D506 L515	W505-T513 CarbonylContact C-O 3.57Å; W505-T513 VanDerWaalsContact CA-O 3.28Å; W505-T513 WeakPolarHBondContact CA-O 3.15Å; D506-T513 PolarHBondContact N-O 3Å; D506-T513 PolarHBondContact O-N 3.11Å; T513-L515 PolarHBondContact O-N 2.84Å
514	P	86.9	Confident	88.8	Confident	67 Å²	67	29 Å²	29	44%	0.435	15%	0.152	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	121.9	176.2	27.3	-31.6	0	0	0	109.9	W505	W505-P514 HydrophobicContact CE3-CB 3.95Å; W505-P514 HydrophobicContact CZ3-CB 3.81Å
515	L	89.5	Confident	88.2	Confident	5 Å²	5	31 Å²	31	3%	0.026	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	-51.6	-178.2	-71.8	177.6	0	0	0	112.7	I446 F449 Y450 S453 L492 F504 D506 T513	I446-L515 HydrophobicContact CG1-CD1 4.33Å; I446-L515 HydrophobicContact CG2-CD1 4.08Å; I446-L515 HydrophobicContact CG2-CD2 4.33Å; F449-L515 HydrophobicContact CB-CB 4.13Å; Y450-L515 HydrophobicContact CD1-CD2 4.01Å; Y450-L515 HydrophobicContact CD2-CD2 3.81Å; Y450-L515 HydrophobicContact CE1-CD2 3.54Å; Y450-L515 HydrophobicContact CE2-CD2 3.32Å; Y450-L515 HydrophobicContact CG-CD2 4.13Å; Y450-L515 WeakPolarHBondContact OH-CD2 3.48Å; S453-L515 WeakPolarHBondContact CB-O 2.95Å; S453-L515 PolarHBondContact OG-O 3.12Å; L492-L515 HydrophobicContact CD1-CD1 3.72Å; F504-L515 HydrophobicContact CB-CB 4.12Å; F504-L515 WeakPolarHBondContact O-CB 3.47Å; F504-L515 PolarHBondContact O-N 3.33Å; D506-L515 HydrophobicContact CB-CD1 3.76Å; D506-L515 HydrophobicContact CB-CD2 3.89Å; D506-L515 HydrophobicContact CB-CG 3.76Å; T513-L515 PolarHBondContact O-N 2.84Å
516	Y	92.3	Very high	87.1	Confident	25 Å²	25	36.8 Å²	36.8	10%	0.098	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157	151.8	-171.6	-179.6	-98.5	0	0	0	110.8	F449 V452 S453 R503 F504 F518 Y687	F449-Y516 HydrophobicContact CD1-CD1 4.48Å; F449-Y516 HydrophobicContact CD1-CG 4.17Å; V452-Y516 HydrophobicContact CG2-CD2 3.92Å; V452-Y516 HydrophobicContact CG2-CE2 4.11Å; S453-Y516 WeakPolarHBondContact OG-CD2 3.26Å; R503-Y516 WeakPolarHBondContact CA-O 3.24Å; F504-Y516 AromaticContact CD2-CD1 3.71Å; F504-Y516 HydrophobicContact CD2-CD1 3.71Å; F504-Y516 HydrophobicContact CD2-CG 4.45Å; F504-Y516 AromaticContact CE2-CD1 3.88Å; F504-Y516 HydrophobicContact CE2-CD1 3.88Å; F504-Y516 HydrophobicContact CE2-CE1 4.5Å; F504-Y516 PolarHBondContact N-O 2.89Å; F504-Y516 PolarHBondContact O-N 2.96Å; Y516-F518 HydrophobicContact CE1-CB 4.01Å; Y516-Y687 HydrophobicContact CD1-CD2 4.01Å; Y516-Y687 AromaticContact CE1-CD2 3.59Å; Y516-Y687 HydrophobicContact CE1-CD2 3.59Å; Y516-Y687 HydrophobicContact CE1-CG 4.32Å; Y516-Y687 PolarHBondContact OH-N 2.69Å
517	K	92.4	Very high	85.5	Confident	49 Å²	49	39.2 Å²	39.2	21%	0.213	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	121.6	176.7	-180	171.7	-174.8	174.6	0	111.5	S501 V502 R503 R519	S501-K517 VanDerWaalsContact CB-CE 3.41Å; V502-K517 WeakPolarHBondContact O-CA 3.08Å; R503-K517 HydrophobicContact CG-CB 4.44Å; R503-K517 HydrophobicContact CG-CD 4.21Å; R503-K517 HydrophobicContact CG-CG 4.06Å; K517-R519 VanDerWaalsContact CE-CZ 3.41Å; K517-R519 VanDerWaalsContact NZ-NH2 3.12Å
518	F	94.3	Very high	83.5	Confident	6 Å²	6	43.4 Å²	43.4	3%	0.026	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	148.3	166.9	-169.8	-103.2	0	0	0	110.3	S501 V502 Y516 T520 L523 L589 W683 Y687	S501-F518 CarbonylContact C-O 3.5Å; S501-F518 VanDerWaalsContact CA-O 3.27Å; S501-F518 WeakPolarHBondContact CA-O 3.48Å; S501-F518 WeakPolarHBondContact CB-O 3.42Å; V502-F518 PolarHBondContact N-O 2.98Å; V502-F518 PolarHBondContact O-N 3.46Å; Y516-F518 HydrophobicContact CE1-CB 4.01Å; F518-T520 HydrophobicContact CD1-CG2 4.21Å; F518-T520 HydrophobicContact CE1-CG2 4.04Å; F518-L523 HydrophobicContact CE1-CD1 4.42Å; F518-L523 HydrophobicContact CZ-CD1 4.42Å; F518-L589 HydrophobicContact CD1-CD1 3.44Å; F518-L589 VanDerWaalsContact CD1-CD1 3.44Å; F518-L589 HydrophobicContact CE1-CD1 3.34Å; F518-L589 HydrophobicContact CE1-CD2 3.74Å; F518-L589 HydrophobicContact CE1-CG 4.2Å; F518-L589 HydrophobicContact CE2-CD1 4.44Å; F518-L589 HydrophobicContact CE2-CD2 4.48Å; F518-L589 HydrophobicContact CG-CD1 4.06Å; F518-L589 HydrophobicContact CZ-CD1 3.88Å; F518-L589 HydrophobicContact CZ-CD2 3.64Å; F518-L589 HydrophobicContact CZ-CG 4.42Å; F518-W683 HydrophobicContact CE2-CE3 4.45Å; F518-W683 AromaticContact CE2-CZ3 3.91Å; F518-W683 HydrophobicContact CE2-CZ3 3.91Å; F518-W683 HydrophobicContact CZ-CZ3 4.12Å; F518-Y687 VanDerWaalsContact CE2-O 3.26Å; F518-Y687 WeakPolarHBondContact CE2-O 3.27Å
519	R	93.4	Very high	81.3	Confident	91 Å²	91	47.6 Å²	47.6	34%	0.343	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	112.5	174.9	-73.5	-175.4	173.5	93.8	-14.8	108.5	K517 S521 K522	K517-R519 VanDerWaalsContact CE-CZ 3.41Å; K517-R519 VanDerWaalsContact NZ-NH2 3.12Å; R519-S521 PolarHBondContact O-N 3.47Å; R519-K522 HydrophobicContact CB-CG 4.45Å; R519-K522 PolarHBondContact O-N 3.39Å
520	T	93.5	Very high	79.1	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	30%	0.295	C	S	.	.	G	3₁₀ helix	trans	-65.9	-26.3	179.4	61.2	0	0	0	0	111.8	G500 F518 K522 L523 F524 I566	G500-T520 WeakPolarHBondContact CA-OG1 3.43Å; G500-T520 WeakPolarHBondContact O-CG2 3.36Å; G500-T520 PolarHBondContact O-N 2.87Å; G500-T520 PolarHBondContact O-OG1 3.42Å; F518-T520 HydrophobicContact CD1-CG2 4.21Å; F518-T520 HydrophobicContact CE1-CG2 4.04Å; T520-K522 PolarHBondContact O-N 3.42Å; T520-L523 VanDerWaalsContact O-CB 3.24Å; T520-L523 WeakPolarHBondContact O-CB 3.18Å; T520-L523 WeakPolarHBondContact O-CG 3.45Å; T520-L523 PolarHBondContact O-N 2.83Å; T520-F524 VanDerWaalsContact O-CD2 3.27Å; T520-F524 WeakPolarHBondContact O-CD2 3.42Å; T520-I566 HydrophobicContact CG2-CD1 3.88Å
521	S	89.8	Confident	77	Confident	39 Å²	39	55.3 Å²	55.3	27%	0.273	31%	0.314	S	S	.	.	G	3₁₀ helix	trans	-53.5	-22.9	174.1	59.2	0	0	0	0	114.5	R519 L523 F524	R519-S521 PolarHBondContact O-N 3.47Å; S521-L523 PolarHBondContact O-N 3.34Å; S521-F524 PolarHBondContact O-N 3.26Å
522	K	91.3	Very high	74.6	Confident	72 Å²	72	58.5 Å²	58.5	31%	0.313	34%	0.336	S	S	.	.	G	3₁₀ helix	trans	-65.1	-22.3	172.4	-69.2	-172.9	170.8	-164.5	0	113.8	R519 T520 R677 W683	R519-K522 HydrophobicContact CB-CG 4.45Å; R519-K522 PolarHBondContact O-N 3.39Å; T520-K522 PolarHBondContact O-N 3.42Å; K522-R677 WeakPolarHBondContact O-CD 3.11Å; K522-R677 PolarHBondContact O-NE 2.86Å; K522-W683 HydrophobicContact CB-CH2 3.8Å; K522-W683 HydrophobicContact CB-CZ3 4.12Å; K522-W683 HydrophobicContact CD-CZ3 4.21Å
523	L	91	Very high	71.7	Confident	2 Å²	2	65 Å²	65	1%	0.01	37%	0.371	C	S	.	.	G	3₁₀ helix	trans	-82.3	-21.9	179.2	-58.3	170.4	0	0	0	112.1	F518 T520 S521 C587 L589 T600 V676 R677 W683 P689 V692	F518-L523 HydrophobicContact CE1-CD1 4.42Å; F518-L523 HydrophobicContact CZ-CD1 4.42Å; T520-L523 VanDerWaalsContact O-CB 3.24Å; T520-L523 WeakPolarHBondContact O-CB 3.18Å; T520-L523 WeakPolarHBondContact O-CG 3.45Å; T520-L523 PolarHBondContact O-N 2.83Å; S521-L523 PolarHBondContact O-N 3.34Å; L523-C587 HydrophobicContact CD1-CB 4.01Å; L523-L589 HydrophobicContact CD1-CD2 4.38Å; L523-T600 HydrophobicContact CD2-CG2 4.27Å; L523-V676 VanDerWaalsContact O-CG1 3.28Å; L523-V676 WeakPolarHBondContact O-CG1 3.35Å; L523-R677 PolarHBondContact O-N 2.83Å; L523-W683 HydrophobicContact CD2-CH2 3.38Å; L523-W683 HydrophobicContact CD2-CZ2 3.5Å; L523-W683 VanDerWaalsContact CD2-CZ2 3.5Å; L523-W683 HydrophobicContact CD2-CZ3 4.44Å; L523-W683 HydrophobicContact CG-CH2 4.13Å; L523-P689 HydrophobicContact CD1-CB 4.49Å; L523-P689 HydrophobicContact CD2-CB 3.46Å; L523-P689 VanDerWaalsContact CD2-CB 3.46Å; L523-P689 HydrophobicContact CD2-CG 3.53Å; L523-V692 HydrophobicContact CD1-CG2 4.2Å
524	F	91.2	Very high	69.1	Low	6 Å²	6	69.4 Å²	69.4	3%	0.026	40%	0.401	C	S	.	.	B	Isolated β-bridge	trans	-109.9	146.9	-169.5	-56	-66.9	0	0	0	111.8	T520 S521 L564 H585 V674 P675 V676 R677 V692	T520-F524 VanDerWaalsContact O-CD2 3.27Å; T520-F524 WeakPolarHBondContact O-CD2 3.42Å; S521-F524 PolarHBondContact O-N 3.26Å; F524-L564 HydrophobicContact CD2-CD2 3.55Å; F524-L564 HydrophobicContact CE2-CD2 3.9Å; F524-L564 HydrophobicContact CG-CD2 4.2Å; F524-H585 AromaticContact CE2-CD2 3.89Å; F524-H585 AromaticContact CE2-NE2 3.51Å; F524-H585 AromaticContact CZ-CD2 3.31Å; F524-H585 WeakPolarHBondContact CZ-CD2 3.45Å; F524-H585 AromaticContact CZ-NE2 3.44Å; F524-H585 WeakPolarHBondContact CZ-NE2 3.3Å; F524-V674 HydrophobicContact CB-CG1 4.06Å; F524-V674 HydrophobicContact CD1-CB 4.32Å; F524-V674 HydrophobicContact CD1-CG1 3.22Å; F524-V674 HydrophobicContact CD2-CG1 4.32Å; F524-V674 HydrophobicContact CE1-CB 4.4Å; F524-V674 HydrophobicContact CE1-CG1 3.62Å; F524-V674 HydrophobicContact CG-CG1 3.6Å; F524-V674 HydrophobicContact CZ-CG1 4.34Å; F524-P675 CarbonylContact C-O 3.56Å; F524-P675 VanDerWaalsContact CA-O 3.31Å; F524-P675 WeakPolarHBondContact CA-O 3.28Å; F524-P675 WeakPolarHBondContact CB-O 3.41Å; F524-V676 HydrophobicContact CD1-CG2 4.08Å; F524-V676 HydrophobicContact CE1-CG2 4.01Å; F524-R677 VanDerWaalsContact C-CG 3.46Å; F524-R677 WeakPolarHBondContact O-CG 3.32Å; F524-R677 PolarHBondContact O-NE 2.95Å; F524-R677 PolarHBondContact O-NH2 3.05Å; F524-V692 HydrophobicContact CE1-CG1 4.01Å; F524-V692 HydrophobicContact CZ-CG1 4.28Å
525	A	82.8	Confident	66.3	Low	42 Å²	42	71.9 Å²	71.9	35%	0.347	41%	0.414	S	S	.	.	P	Polyproline II helix	trans	-69.1	144	175.2	0	0	0	0	0	109.7	P675	A525-P675 HydrophobicContact CB-CB 4.15Å; A525-P675 HydrophobicContact CB-CG 4.09Å; A525-P675 PolarHBondContact N-O 3.25Å
526	N	69.8	Low	63.3	Low	127 Å²	127	80.3 Å²	80.3	68%	0.679	45%	0.454	S	S	*	.	P	Polyproline II helix	trans	-63.6	140.5	173.4	-73.6	-4.7	0	0	0	108.9
527	P	57.6	Low	60.1	Low	68 Å²	68	85.9 Å²	85.9	44%	0.442	49%	0.491	S	S	.	.	P	Polyproline II helix	trans	-56	141.6	169.1	17.1	-25	0	0	0	110.1	T529 L557	P527-T529 PolarHBondContact O-N 2.83Å; P527-L557 HydrophobicContact CB-CD1 3.75Å; P527-L557 HydrophobicContact CG-CD1 4.42Å
528	P	49.5	Very low	57	Low	89 Å²	89	86.3 Å²	86.3	58%	0.578	51%	0.509	S	S	*	.			trans	-60.2	107.4	173.4	23.8	-30.8	0	0	0	109	N530	P528-N530 PolarHBondContact O-N 2.75Å
529	T	41.5	Very low	53.7	Low	111 Å²	111	92.1 Å²	92.1	68%	0.681	55%	0.55	S	S	*	*			trans	-72.5	108.4	176.1	46.1	0	0	0	0	109	P527 T531	P527-T529 PolarHBondContact O-N 2.83Å; T529-T531 VanDerWaalsContact C-N 3.3Å; T529-T531 PolarHBondContact O-N 3.45Å; T529-T531 PolarHBondContact O-OG1 3.08Å; T529-T531 VanDerWaalsContact O-OG1 3.08Å
530	N	32.1	Very low	50.6	Low	179 Å²	179	94 Å²	94	96%	0.957	57%	0.572	S	S	*	*			trans	-58	91.5	169.1	-91.6	-15.4	0	0	0	109.6	P528	P528-N530 PolarHBondContact O-N 2.75Å
531	T	30.4	Very low	47.4	Very low	106 Å²	106	98.7 Å²	98.7	65%	0.65	61%	0.605	S	S	*	*			trans	-115.4	112.9	176.6	-33.1	0	0	0	0	108.2	T529	T529-T531 VanDerWaalsContact C-N 3.3Å; T529-T531 PolarHBondContact O-N 3.45Å; T529-T531 PolarHBondContact O-OG1 3.08Å; T529-T531 VanDerWaalsContact O-OG1 3.08Å
532	S	25.8	Very low	44.5	Very low	97 Å²	97	105.1 Å²	105.1	68%	0.678	64%	0.635	S	S	*	*	S	Bend	trans	60.2	116.3	155.9	59.1	0	0	0	0	120.5
533	N	25.8	Very low	41.7	Very low	138 Å²	138	105.8 Å²	105.8	74%	0.738	65%	0.649	S	S	*	*			trans	79.8	101.8	149.2	-62	-15	0	0	0	118.9	V535	N533-V535 HydrophobicContact CB-CG2 4.41Å; N533-V535 PolarHBondContact O-N 3.47Å; N533-V535 VanDerWaalsContact O-N 3.1Å
534	P	31.1	Very low	38.8	Very low	139 Å²	139	112.4 Å²	112.4	90%	0.903	68%	0.684	S	S	*	*			trans	-78.5	88.3	160.2	32.7	-25.9	0	0	0	108
535	V	27.2	Very low	36.1	Very low	119 Å²	119	116 Å²	116	72%	0.721	72%	0.715	S	S	*	*			trans	-105.4	120.1	165.4	177.3	0	0	0	0	108.3	N533 T537	N533-V535 HydrophobicContact CB-CG2 4.41Å; N533-V535 PolarHBondContact O-N 3.47Å; N533-V535 VanDerWaalsContact O-N 3.1Å; V535-T537 PolarHBondContact O-N 2.85Å
536	E	25.6	Very low	34.1	Very low	182 Å²	182	123.8 Å²	123.8	85%	0.85	74%	0.741	S	S	*	*			trans	-37.4	120.7	177.5	-60	172.3	152.2	0	0	113.6
537	T	26.7	Very low	33.1	Very low	142 Å²	142	122.2 Å²	122.2	87%	0.871	73%	0.733	S	S	*	*			trans	-161	113	145.6	15.7	0	0	0	0	110.5	V535	V535-T537 PolarHBondContact O-N 2.85Å
538	G	25.7	Very low	32.8	Very low	58 Å²	58	123.3 Å²	123.3	60%	0.598	73%	0.734	S	S	*	*			trans	57.2	94.3	139.7	0	0	0	0	0	118.5	T540	G538-T540 PolarHBondContact O-N 3.41Å
539	S	26.8	Very low	32.9	Very low	128 Å²	128	120.9 Å²	120.9	90%	0.895	72%	0.716	S	S	*	*			trans	10	83.7	137.5	61.1	0	0	0	0	116.4
540	T	26.4	Very low	33.6	Very low	129 Å²	129	118 Å²	118	79%	0.791	70%	0.704	S	S	*	*			trans	-117.5	120	149	34	0	0	0	0	106.6	G538 L542	G538-T540 PolarHBondContact O-N 3.41Å; T540-L542 PolarHBondContact O-N 2.9Å
541	S	26.8	Very low	34.4	Very low	99 Å²	99	116.2 Å²	116.2	69%	0.692	69%	0.69	S	S	*	*			trans	-48.1	124.9	-177.1	42.5	0	0	0	0	111.8	S543	S541-S543 PolarHBondContact O-N 2.79Å
542	L	29.2	Very low	35.4	Very low	174 Å²	174	113.3 Å²	113.3	91%	0.911	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.8	27.8	174.4	-80.6	146.4	0	0	0	114	T540	T540-L542 PolarHBondContact O-N 2.9Å
543	S	32.1	Very low	36.6	Very low	86 Å²	86	108.9 Å²	108.9	60%	0.601	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.1	-10.9	-175.5	57.3	0	0	0	0	114.8	S541	S541-S543 PolarHBondContact O-N 2.79Å
544	D	30.9	Very low	37.6	Very low	142 Å²	142	104.8 Å²	104.8	76%	0.759	62%	0.618	S	S	*	*			trans	-106.9	9.3	-169.2	-73.5	-3	0	0	0	115	K546	D544-K546 PolarHBondContact O-N 2.64Å
545	A	33.6	Very low	38.5	Very low	82 Å²	82	102.2 Å²	102.2	68%	0.678	60%	0.596	S	S	*	*			trans	-76.2	87.8	167.7	0	0	0	0	0	109.8	D547	A545-D547 PolarHBondContact O-N 3.42Å
546	K	41.8	Very low	39.5	Very low	204 Å²	204	97.7 Å²	97.7	89%	0.887	57%	0.568	S	S	*	*			trans	-59.6	-4.7	-177.4	-89.6	-178.3	177	174.8	0	116.7	D544	D544-K546 PolarHBondContact O-N 2.64Å
547	D	48	Very low	40.6	Very low	95 Å²	95	91.8 Å²	91.8	51%	0.508	54%	0.542	S	S	.	.			trans	-114	95.7	179.2	-83.8	-40.8	0	0	0	111.4	A545 N549 A550	A545-D547 PolarHBondContact O-N 3.42Å; D547-N549 PolarHBondContact O-N 3.47Å; D547-N549 VanDerWaalsContact O-N 3.08Å; D547-A550 HydrophobicContact CB-CB 4.18Å; D547-A550 WeakPolarHBondContact O-CB 3.25Å; D547-A550 PolarHBondContact O-N 2.94Å
548	I	51.6	Low	41.6	Very low	91 Å²	91	90.5 Å²	90.5	47%	0.467	53%	0.534	S	S	.	.	H	α-helix	trans	-52.3	-28.6	170.5	57.8	166.4	0	0	0	112.6	Y552 R668	I548-Y552 WeakPolarHBondContact O-CD2 3.25Å; I548-R668 WeakPolarHBondContact CD1-O 3.22Å
549	N	52.7	Low	42.6	Very low	37 Å²	37	92.1 Å²	92.1	20%	0.198	53%	0.532	C	S	.	.	H	α-helix	trans	-75.8	-23	-178	-73.9	-40.7	0	0	0	113.2	D547 Q551 Y552 S553 V672	D547-N549 PolarHBondContact O-N 3.47Å; D547-N549 VanDerWaalsContact O-N 3.08Å; N549-Q551 VanDerWaalsContact C-N 3.28Å; N549-Q551 PolarHBondContact O-N 3.33Å; N549-Y552 PolarHBondContact O-N 2.81Å; N549-S553 PolarHBondContact O-N 2.94Å; N549-S553 VanDerWaalsContact O-N 3.09Å; N549-V672 PolarHBondContact OD1-N 3.47Å
550	A	54.9	Low	43.9	Very low	52 Å²	52	90.9 Å²	90.9	43%	0.43	51%	0.512	S	S	.	.	H	α-helix	trans	-62.6	-37.5	179.8	0	0	0	0	0	111.6	D547 S553	D547-A550 HydrophobicContact CB-CB 4.18Å; D547-A550 WeakPolarHBondContact O-CB 3.25Å; D547-A550 PolarHBondContact O-N 2.94Å; A550-S553 PolarHBondContact O-OG 3.04Å
551	Q	48.8	Very low	45.6	Very low	140 Å²	140	90 Å²	90	65%	0.654	51%	0.511	S	S	*	.	H	α-helix	trans	-68.6	-35.7	-179	-133.3	174.6	37	0	0	113	N549 S554	N549-Q551 VanDerWaalsContact C-N 3.28Å; N549-Q551 PolarHBondContact O-N 3.33Å; Q551-S554 PolarHBondContact O-OG 3.05Å
552	Y	51.2	Low	48.1	Very low	45 Å²	45	88.8 Å²	88.8	18%	0.176	50%	0.497	C	S	.	.	H	α-helix	trans	-79.9	-31.4	179	-63.4	-64	0	0	0	113	I548 N549 S554 I555 L556 R671 L717	I548-Y552 WeakPolarHBondContact O-CD2 3.25Å; N549-Y552 PolarHBondContact O-N 2.81Å; Y552-S554 VanDerWaalsContact C-N 3.34Å; Y552-S554 PolarHBondContact O-N 3.21Å; Y552-I555 PolarHBondContact O-N 2.95Å; Y552-L556 PolarHBondContact O-N 2.93Å; Y552-R671 VanDerWaalsContact CE1-NH1 3.31Å; Y552-R671 VanDerWaalsContact CZ-CZ 3.42Å; Y552-R671 VanDerWaalsContact OH-CZ 3.26Å; Y552-R671 PolarHBondContact OH-NH1 3.37Å; Y552-R671 PolarHBondContact OH-NH2 3.15Å; Y552-L717 HydrophobicContact CD1-CD1 3.82Å; Y552-L717 HydrophobicContact CD1-CD2 3.46Å; Y552-L717 VanDerWaalsContact CD1-CD2 3.46Å; Y552-L717 HydrophobicContact CD1-CG 4.26Å; Y552-L717 HydrophobicContact CE1-CD1 4.35Å; Y552-L717 HydrophobicContact CE1-CD2 3.73Å; Y552-L717 HydrophobicContact CG-CD2 4.36Å
553	S	52.2	Low	50.8	Low	5 Å²	5	82.1 Å²	82.1	4%	0.035	46%	0.464	C	S	.	.	H	α-helix	trans	-59.4	-42	-179.8	66.6	0	0	0	0	112.4	N549 A550 L557	N549-S553 PolarHBondContact O-N 2.94Å; N549-S553 VanDerWaalsContact O-N 3.09Å; A550-S553 PolarHBondContact O-OG 3.04Å; S553-L557 WeakPolarHBondContact O-CB 3.35Å; S553-L557 WeakPolarHBondContact O-CD1 3.33Å; S553-L557 WeakPolarHBondContact O-CG 3.25Å; S553-L557 PolarHBondContact O-N 3.31Å
554	S	47.3	Very low	53.6	Low	51 Å²	51	79.7 Å²	79.7	36%	0.357	44%	0.444	S	S	.	.	H	α-helix	trans	-69.8	-36.3	-178.7	60.4	0	0	0	0	113.9	Q551 Y552 T558	Q551-S554 PolarHBondContact O-OG 3.05Å; Y552-S554 VanDerWaalsContact C-N 3.34Å; Y552-S554 PolarHBondContact O-N 3.21Å; S554-T558 WeakPolarHBondContact O-CG2 3.29Å
555	I	49.9	Very low	56.6	Low	86 Å²	86	73.1 Å²	73.1	44%	0.441	41%	0.41	S	S	.	.	H	α-helix	trans	-72	-39.5	-175.7	-62.7	173	0	0	0	110.5	Y552 T558 L717	Y552-I555 PolarHBondContact O-N 2.95Å; I555-T558 PolarHBondContact O-N 2.95Å; I555-T558 PolarHBondContact O-OG1 2.9Å; I555-L717 HydrophobicContact CG2-CD1 4.32Å
556	L	47	Very low	59.5	Low	24 Å²	24	69.2 Å²	69.2	13%	0.126	38%	0.378	C	S	.	.	H	α-helix	trans	-90.3	-22.5	-175.6	-73.8	164.6	0	0	0	114.5	Y552 T558 T559 F673 L717	Y552-L556 PolarHBondContact O-N 2.93Å; L556-T558 PolarHBondContact O-N 2.93Å; L556-T559 HydrophobicContact CD2-CG2 3.98Å; L556-T559 WeakPolarHBondContact CD2-OG1 3.44Å; L556-T559 PolarHBondContact O-N 3.26Å; L556-T559 PolarHBondContact O-OG1 2.84Å; L556-F673 HydrophobicContact CD1-CD1 3.44Å; L556-F673 VanDerWaalsContact CD1-CD1 3.44Å; L556-F673 HydrophobicContact CD1-CD2 4.46Å; L556-F673 HydrophobicContact CD1-CE1 3.19Å; L556-F673 HydrophobicContact CD1-CE2 4.28Å; L556-F673 HydrophobicContact CD1-CG 4.1Å; L556-F673 HydrophobicContact CD1-CZ 3.65Å; L556-L717 HydrophobicContact CD1-CB 4.17Å; L556-L717 HydrophobicContact CD1-CD1 4.28Å; L556-L717 HydrophobicContact CD2-CB 4.34Å; L556-L717 HydrophobicContact CG-CD1 4.38Å
557	L	49.7	Very low	62.1	Low	58 Å²	58	62.5 Å²	62.5	30%	0.304	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-11.9	165.6	-71.8	166.7	0	0	0	112.3	P527 S553 P563	P527-L557 HydrophobicContact CB-CD1 3.75Å; P527-L557 HydrophobicContact CG-CD1 4.42Å; S553-L557 WeakPolarHBondContact O-CB 3.35Å; S553-L557 WeakPolarHBondContact O-CD1 3.33Å; S553-L557 WeakPolarHBondContact O-CG 3.25Å; S553-L557 PolarHBondContact O-N 3.31Å; L557-P563 HydrophobicContact CD2-CB 3.75Å; L557-P563 HydrophobicContact CD2-CG 3.4Å
558	T	47.2	Very low	64.4	Low	114 Å²	114	61.4 Å²	61.4	70%	0.699	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.2	-16.6	169.4	75.9	0	0	0	0	114.4	S554 I555 L556	S554-T558 WeakPolarHBondContact O-CG2 3.29Å; I555-T558 PolarHBondContact O-N 2.95Å; I555-T558 PolarHBondContact O-OG1 2.9Å; L556-T558 PolarHBondContact O-N 2.93Å
559	T	47.2	Very low	66.6	Low	93 Å²	93	57.8 Å²	57.8	57%	0.571	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.8	-31.6	-175.1	59.5	0	0	0	0	114.2	L556	L556-T559 HydrophobicContact CD2-CG2 3.98Å; L556-T559 WeakPolarHBondContact CD2-OG1 3.44Å; L556-T559 PolarHBondContact O-N 3.26Å; L556-T559 PolarHBondContact O-OG1 2.84Å
560	E	54	Low	68.7	Low	102 Å²	102	58.1 Å²	58.1	48%	0.477	32%	0.322	S	S	.	.	S	Bend	trans	-105	131.2	177.5	-74.7	-87.2	138.6	0	0	109.6	D562	E560-D562 VanDerWaalsContact C-N 3.28Å; E560-D562 PolarHBondContact O-N 3.28Å
561	S	61.8	Low	70.7	Confident	109 Å²	109	56.7 Å²	56.7	76%	0.762	31%	0.306	S	S	*	.	S	Bend	trans	-65.7	-29	-176.5	69.2	0	0	0	0	113.3
562	D	79.2	Confident	73	Confident	74 Å²	74	50.8 Å²	50.8	40%	0.396	28%	0.279	S	S	.	.			trans	-151.4	76.2	-171.9	-61	-72.7	0	0	0	112.7	A498 E560 L564 A565	A498-D562 HydrophobicContact CB-CB 4.4Å; E560-D562 VanDerWaalsContact C-N 3.28Å; E560-D562 PolarHBondContact O-N 3.28Å; D562-L564 PolarHBondContact O-N 3.04Å; D562-A565 HydrophobicContact CB-CB 3.93Å; D562-A565 WeakPolarHBondContact O-CB 3.24Å; D562-A565 PolarHBondContact O-N 3.14Å
563	P	85.1	Confident	75	Confident	34 Å²	34	50.1 Å²	50.1	22%	0.221	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-18.8	-174	28.8	-41.4	0	0	0	115	L557 H585	L557-P563 HydrophobicContact CD2-CB 3.75Å; L557-P563 HydrophobicContact CD2-CG 3.4Å; P563-H585 PolarHBondContact O-CE1 2.81Å
564	L	91.6	Very high	76.9	Confident	36 Å²	36	52.8 Å²	52.8	19%	0.188	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.6	2.7	179.4	-60.2	-177.2	0	0	0	112.8	G500 F524 D562 I566 V674	G500-L564 WeakPolarHBondContact CA-O 3.34Å; G500-L564 PolarHBondContact N-O 3.31Å; F524-L564 HydrophobicContact CD2-CD2 3.55Å; F524-L564 HydrophobicContact CE2-CD2 3.9Å; F524-L564 HydrophobicContact CG-CD2 4.2Å; D562-L564 PolarHBondContact O-N 3.04Å; L564-I566 PolarHBondContact O-N 3.19Å; L564-V674 HydrophobicContact CD2-CG1 4.34Å
565	A	93.6	Very high	79.2	Confident	4 Å²	4	50.7 Å²	50.7	3%	0.033	28%	0.281	C	S	.	.			trans	-58.4	129.2	-177.7	0	0	0	0	0	112.1	T433 A498 D562 H567 S582	T433-A565 HydrophobicContact CG2-CB 4.46Å; A498-A565 HydrophobicContact CB-CB 4.45Å; A498-A565 WeakPolarHBondContact O-CA 3.37Å; A498-A565 PolarHBondContact O-N 3.21Å; D562-A565 HydrophobicContact CB-CB 3.93Å; D562-A565 WeakPolarHBondContact O-CB 3.24Å; D562-A565 PolarHBondContact O-N 3.14Å; A565-H567 PolarHBondContact O-N 2.98Å; A565-S582 VanDerWaalsContact O-CA 3.23Å; A565-S582 WeakPolarHBondContact O-CA 3.46Å; A565-S582 WeakPolarHBondContact O-CB 3.25Å; A565-S582 PolarHBondContact O-OG 3.4Å
566	I	95.7	Very high	81.3	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	26%	0.261	C	S	.	.			trans	-80.5	100.9	-178.8	-53.3	-58.8	0	0	0	110	T433 S434 H497 V502 T520 L564 M569	T433-I566 VanDerWaalsContact CB-O 3.28Å; T433-I566 WeakPolarHBondContact CB-O 3.45Å; T433-I566 PolarHBondContact OG1-O 3.21Å; S434-I566 WeakPolarHBondContact CB-O 3.44Å; H497-I566 PolarHBondContact O-N 3.11Å; V502-I566 HydrophobicContact CG2-CG1 4.25Å; T520-I566 HydrophobicContact CG2-CD1 3.88Å; L564-I566 PolarHBondContact O-N 3.19Å; I566-M569 HydrophobicContact CG2-CG 3.47Å; I566-M569 VanDerWaalsContact CG2-CG 3.47Å; I566-M569 HydrophobicContact CG2-SD 3.89Å
567	H	94.9	Very high	83.7	Confident	62 Å²	62	47 Å²	47	29%	0.287	26%	0.261	S	S	.	.			trans	-85.2	-38.7	179.2	-65.1	-53.4	0	0	0	113	S434 A565 A581 S583	S434-H567 WeakPolarHBondContact CB-O 3.45Å; S434-H567 PolarHBondContact OG-O 2.84Å; A565-H567 PolarHBondContact O-N 2.98Å; H567-A581 PolarHBondContact N-O 2.92Å; H567-S583 PolarHBondContact CD2-N 2.82Å
568	F	97	Very high	86	Confident	72 Å²	72	44.3 Å²	44.3	32%	0.316	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	145.7	-179.1	-52.7	-86.8	0	0	0	111.5	T580 A581 I723 T724 I726	F568-T580 CarbonylContact O-C 3.43Å; F568-T580 WeakPolarHBondContact O-CA 3.3Å; F568-A581 HydrophobicContact CB-CB 4.17Å; F568-A581 HydrophobicContact CD2-CB 4.34Å; F568-A581 PolarHBondContact N-O 3.41Å; F568-A581 VanDerWaalsContact N-O 3.12Å; F568-A581 PolarHBondContact O-N 3.45Å; F568-I723 VanDerWaalsContact CE2-O 3.28Å; F568-I723 WeakPolarHBondContact CE2-O 3.47Å; F568-T724 WeakPolarHBondContact CE1-O 3.44Å; F568-T724 WeakPolarHBondContact CZ-O 3.37Å; F568-I726 HydrophobicContact CB-CD1 3.64Å; F568-I726 HydrophobicContact CB-CG1 3.6Å; F568-I726 HydrophobicContact CG-CG1 4.48Å
569	M	97.4	Very high	88.4	Confident	15 Å²	15	38.9 Å²	38.9	7%	0.074	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	137.8	172.7	-61.4	-174	-68.6	0	0	109.1	L436 I494 G496 V502 I566 L579 T580	L436-M569 HydrophobicContact CD1-CB 3.65Å; L436-M569 HydrophobicContact CG-CB 4.1Å; L436-M569 HydrophobicContact CG-CE 4.21Å; I494-M569 HydrophobicContact CG2-CE 4.26Å; I494-M569 HydrophobicContact CG2-SD 4.08Å; I494-M569 WeakPolarHBondContact O-CE 3.35Å; G496-M569 VanDerWaalsContact N-CE 3.3Å; V502-M569 HydrophobicContact CG1-SD 3.94Å; V502-M569 HydrophobicContact CG2-SD 4.35Å; I566-M569 HydrophobicContact CG2-CG 3.47Å; I566-M569 VanDerWaalsContact CG2-CG 3.47Å; I566-M569 HydrophobicContact CG2-SD 3.89Å; M569-L579 CarbonylContact C-O 3.56Å; M569-L579 WeakPolarHBondContact CA-O 3.34Å; M569-T580 HydrophobicContact CG-CG2 4.28Å
570	H	97.4	Very high	90.9	Very high	45 Å²	45	34.4 Å²	34.4	21%	0.208	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	116.1	166.5	-173.5	130.4	0	0	0	107.5	L579 I726 M728	H570-L579 HydrophobicContact CB-CB 4.28Å; H570-L579 PolarHBondContact N-O 2.82Å; H570-L579 PolarHBondContact O-N 3.34Å; H570-I726 HydrophobicContact CB-CD1 4.33Å; H570-M728 PolarHBondContact NE2-O 3.4Å
571	F	97.4	Very high	92.9	Very high	22 Å²	22	29.6 Å²	29.6	10%	0.096	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	122.6	179.7	177.3	-119.9	0	0	0	110.5	L436 L438 L445 L492 I494 K577 L578 Y687	L436-F571 HydrophobicContact CD1-CB 3.65Å; L438-F571 HydrophobicContact CD1-CD1 3.84Å; L438-F571 HydrophobicContact CD1-CE1 4.39Å; L438-F571 HydrophobicContact CD2-CD1 3.61Å; L438-F571 HydrophobicContact CD2-CE1 3.73Å; L438-F571 HydrophobicContact CG-CD1 4.4Å; L445-F571 HydrophobicContact CD1-CZ 4.17Å; L445-F571 HydrophobicContact CD2-CE1 3.95Å; L445-F571 HydrophobicContact CD2-CZ 4Å; L492-F571 HydrophobicContact CD2-CE1 4.02Å; I494-F571 HydrophobicContact CD1-CB 3.98Å; I494-F571 HydrophobicContact CD1-CD1 3.5Å; I494-F571 HydrophobicContact CD1-CD2 4.27Å; I494-F571 HydrophobicContact CD1-CE1 4.05Å; I494-F571 HydrophobicContact CD1-CG 3.63Å; F571-K577 WeakPolarHBondContact CD2-O 3.26Å; F571-L578 HydrophobicContact CB-CD1 4.12Å; F571-L578 HydrophobicContact CD2-CB 4.25Å; F571-L578 HydrophobicContact CD2-CD1 4.4Å; F571-Y687 WeakPolarHBondContact CE2-OH 3.29Å
572	C	96.2	Very high	94.6	Very high	15 Å²	15	24.4 Å²	24.4	10%	0.101	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	106.2	173.9	177.2	0	0	0	0	109	D574 S575 R576 K577 M728 S730	C572-D574 VanDerWaalsContact C-N 3.3Å; C572-D574 PolarHBondContact O-N 2.83Å; C572-S575 WeakPolarHBondContact CB-OG 3.32Å; C572-S575 PolarHBondContact SG-OG 3.26Å; C572-R576 WeakPolarHBondContact O-CA 3.48Å; C572-R576 PolarHBondContact O-N 2.99Å; C572-K577 PolarHBondContact N-O 2.8Å; C572-K577 PolarHBondContact O-N 2.92Å; C572-M728 HydrophobicContact CB-CE 3.93Å; C572-S730 PolarHBondContact SG-OG 3.48Å
573	S	93.3	Very high	95.2	Very high	31 Å²	31	21.4 Å²	21.4	22%	0.217	11%	0.112	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-37.5	-179	51.5	0	0	0	0	113.2
574	D	92.3	Very high	95.5	Very high	61 Å²	61	20.7 Å²	20.7	33%	0.326	11%	0.107	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-43.4	-174	-57.8	-30.8	0	0	0	112.2	C572 S956 E957 W959	C572-D574 VanDerWaalsContact C-N 3.3Å; C572-D574 PolarHBondContact O-N 2.83Å; D574-S956 WeakPolarHBondContact OD2-CB 3.21Å; D574-S956 PolarHBondContact OD2-OG 3.34Å; D574-E957 CarbonylContact C-O 3.52Å; D574-W959 WeakPolarHBondContact O-CB 3.48Å; D574-W959 PolarHBondContact O-N 2.97Å
575	S	94.5	Very high	95.6	Very high	8 Å²	8	19 Å²	19	6%	0.056	10%	0.098	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.3	-10.9	179.6	70.1	0	0	0	0	113.4	C572 K577 S730 E957	C572-S575 WeakPolarHBondContact CB-OG 3.32Å; C572-S575 PolarHBondContact SG-OG 3.26Å; S575-K577 PolarHBondContact O-N 3.24Å; S575-K577 VanDerWaalsContact O-N 3.15Å; S575-K577 WeakPolarHBondContact OG-CB 3.41Å; S575-K577 WeakPolarHBondContact OG-CG 3.46Å; S575-K577 PolarHBondContact OG-N 2.97Å; S575-S730 VanDerWaalsContact OG-CB 3.3Å; S575-S730 WeakPolarHBondContact OG-CB 3.33Å; S575-S730 PolarHBondContact OG-OG 3.47Å; S575-E957 VanDerWaalsContact CA-O 3.28Å; S575-E957 WeakPolarHBondContact CA-O 3.18Å; S575-E957 WeakPolarHBondContact CB-O 3.06Å; S575-E957 PolarHBondContact N-O 3.37Å
576	R	95.3	Very high	95.8	Very high	5 Å²	5	18.8 Å²	18.8	2%	0.019	10%	0.096	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.9	18.6	-171.3	-52.6	-174.7	179.9	162.1	5.2	114.6	D444 L445 C572 F591 Y687 W959	D444-R576 IonicContact OD1-NH2 3.65Å; D444-R576 PolarHBondContact OD1-NH2 2.95Å; D444-R576 IonicContact OD2-CZ 3.72Å; D444-R576 IonicContact OD2-NH2 2.74Å; D444-R576 PolarHBondContact OD2-NH2 2.93Å; L445-R576 HydrophobicContact CD1-CG 3.85Å; C572-R576 WeakPolarHBondContact O-CA 3.48Å; C572-R576 PolarHBondContact O-N 2.99Å; R576-F591 HydrophobicContact CB-CB 3.8Å; R576-Y687 WeakPolarHBondContact O-CE1 3.32Å; R576-Y687 PolarHBondContact O-OH 3.49Å; R576-Y687 VanDerWaalsContact O-OH 3.08Å; R576-W959 HydrophobicContact CG-CB 4.19Å; R576-W959 HydrophobicContact CG-CG 4.03Å; R576-W959 VanDerWaalsContact NH1-CZ2 3.28Å
577	K	96.6	Very high	95.9	Very high	28 Å²	28	18.9 Å²	18.9	12%	0.122	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	136.1	174.6	-64.4	-178.3	179.4	96.4	0	109.8	F571 C572 S575 L589 M728 E957	F571-K577 WeakPolarHBondContact CD2-O 3.26Å; C572-K577 PolarHBondContact N-O 2.8Å; C572-K577 PolarHBondContact O-N 2.92Å; S575-K577 PolarHBondContact O-N 3.24Å; S575-K577 VanDerWaalsContact O-N 3.15Å; S575-K577 WeakPolarHBondContact OG-CB 3.41Å; S575-K577 WeakPolarHBondContact OG-CG 3.46Å; S575-K577 PolarHBondContact OG-N 2.97Å; K577-L589 WeakPolarHBondContact CA-O 3.13Å; K577-M728 HydrophobicContact CB-CE 3.63Å; K577-M728 HydrophobicContact CB-SD 4.06Å; K577-M728 HydrophobicContact CD-SD 4.46Å; K577-E957 IonicContact NZ-OE2 3.19Å; K577-E957 PolarHBondContact NZ-OE2 3.08Å
578	L	98.1	Very high	96.1	Very high	0 Å²	0	15.9 Å²	15.9	0%	0	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	121.3	177.2	172	64.4	0	0	0	108.9	V502 F504 F571 T580 L589 Y687	V502-L578 HydrophobicContact CB-CD2 4.49Å; V502-L578 HydrophobicContact CG1-CD2 3.95Å; V502-L578 HydrophobicContact CG2-CD2 4.48Å; F504-L578 HydrophobicContact CE2-CD2 4.46Å; F504-L578 HydrophobicContact CZ-CD2 3.91Å; F571-L578 HydrophobicContact CB-CD1 4.12Å; F571-L578 HydrophobicContact CD2-CB 4.25Å; F571-L578 HydrophobicContact CD2-CD1 4.4Å; L578-T580 HydrophobicContact CD1-CG2 4.17Å; L578-T580 HydrophobicContact CD2-CG2 4.02Å; L578-T580 HydrophobicContact CG-CG2 3.91Å; L578-L589 HydrophobicContact CB-CB 4.4Å; L578-L589 HydrophobicContact CD2-CD1 4.08Å; L578-L589 HydrophobicContact CG-CD1 4.48Å; L578-L589 PolarHBondContact N-O 3.28Å; L578-L589 PolarHBondContact O-N 3.22Å; L578-Y687 HydrophobicContact CB-CD1 4.22Å; L578-Y687 HydrophobicContact CB-CE1 3.61Å
579	L	98.6	Very high	96.1	Very high	0 Å²	0	12.5 Å²	12.5	0%	0	7%	0.068	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	125.3	170.2	176.2	63.5	0	0	0	108.9	M569 H570 C587 L588 I726 M728 M735	M569-L579 CarbonylContact C-O 3.56Å; M569-L579 WeakPolarHBondContact CA-O 3.34Å; H570-L579 HydrophobicContact CB-CB 4.28Å; H570-L579 PolarHBondContact N-O 2.82Å; H570-L579 PolarHBondContact O-N 3.34Å; L579-C587 WeakPolarHBondContact CA-O 2.87Å; L579-L588 HydrophobicContact CB-CD1 4.26Å; L579-L588 HydrophobicContact CD1-CB 4.26Å; L579-I726 HydrophobicContact CD2-CB 4Å; L579-I726 HydrophobicContact CD2-CD1 4.11Å; L579-I726 HydrophobicContact CG-CD1 3.93Å; L579-M728 HydrophobicContact CB-SD 4.49Å; L579-M728 HydrophobicContact CD2-CB 4.17Å; L579-M735 HydrophobicContact CD1-CE 3.38Å; L579-M735 HydrophobicContact CD1-SD 4.24Å; L579-M735 HydrophobicContact CD2-CB 4.31Å; L579-M735 HydrophobicContact CD2-CE 3.99Å; L579-M735 HydrophobicContact CG-CE 4.34Å
580	T	98.4	Very high	96	Very high	0 Å²	0	13.6 Å²	13.6	0%	0	7%	0.073	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	147	174.1	64.6	0	0	0	0	110.5	V502 F568 M569 L578 T586 C587	V502-T580 HydrophobicContact CG2-CG2 3.85Å; F568-T580 CarbonylContact O-C 3.43Å; F568-T580 WeakPolarHBondContact O-CA 3.3Å; M569-T580 HydrophobicContact CG-CG2 4.28Å; L578-T580 HydrophobicContact CD1-CG2 4.17Å; L578-T580 HydrophobicContact CD2-CG2 4.02Å; L578-T580 HydrophobicContact CG-CG2 3.91Å; T580-T586 CarbonylContact O-C 3.5Å; T580-T586 WeakPolarHBondContact O-CA 3.49Å; T580-T586 WeakPolarHBondContact O-CB 3.28Å; T580-C587 PolarHBondContact N-O 2.82Å; T580-C587 PolarHBondContact O-N 3.27Å; T580-C587 WeakPolarHBondContact OG1-CB 3.45Å; T580-C587 PolarHBondContact OG1-O 3.34Å
581	A	97.5	Very high	95.9	Very high	0 Å²	0	11.7 Å²	11.7	0%	0	6%	0.064	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	134.5	171.5	0	0	0	0	0	111.6	H567 F568 H585 T586 I723 I726	H567-A581 PolarHBondContact N-O 2.92Å; F568-A581 HydrophobicContact CB-CB 4.17Å; F568-A581 HydrophobicContact CD2-CB 4.34Å; F568-A581 PolarHBondContact N-O 3.41Å; F568-A581 VanDerWaalsContact N-O 3.12Å; F568-A581 PolarHBondContact O-N 3.45Å; A581-H585 WeakPolarHBondContact CA-O 3.36Å; A581-T586 HydrophobicContact CB-CG2 3.82Å; A581-I723 HydrophobicContact CB-CD1 4.37Å; A581-I723 HydrophobicContact CB-CG2 3.98Å; A581-I726 HydrophobicContact CB-CD1 4.04Å; A581-I726 HydrophobicContact CB-CG2 3.76Å
582	S	95.5	Very high	95.6	Very high	0 Å²	0	11.1 Å²	11.1	0%	0	6%	0.063	C	C	.	.			trans	-97	-168.7	163.5	-43.8	0	0	0	0	108.7	A565 T584 H585	A565-S582 VanDerWaalsContact O-CA 3.23Å; A565-S582 WeakPolarHBondContact O-CA 3.46Å; A565-S582 WeakPolarHBondContact O-CB 3.25Å; A565-S582 PolarHBondContact O-OG 3.4Å; S582-T584 VanDerWaalsContact C-N 3.3Å; S582-T584 PolarHBondContact O-N 2.99Å; S582-H585 WeakPolarHBondContact CB-CE1 3.28Å; S582-H585 WeakPolarHBondContact CB-NE2 3.41Å; S582-H585 PolarHBondContact N-O 3.5Å; S582-H585 PolarHBondContact OG-CE1 3.08Å; S582-H585 PolarHBondContact OG-NE2 3.05Å
583	S	92.1	Very high	95.3	Very high	11 Å²	11	15.1 Å²	15.1	8%	0.077	8%	0.076	C	C	.	.	S	Bend	trans	-60.3	-38.3	-178.1	53.6	0	0	0	0	112.8	H567 S722 I723	H567-S583 PolarHBondContact CD2-N 2.82Å; S583-S722 CarbonylContact O-C 3.41Å; S583-S722 WeakPolarHBondContact O-CA 3.46Å; S583-I723 PolarHBondContact O-N 3.05Å
584	T	91.6	Very high	95.1	Very high	19 Å²	19	20.2 Å²	20.2	12%	0.117	9%	0.09	C	C	.	.	S	Bend	trans	-127.6	2.7	-170.2	55.8	0	0	0	0	114.8	S582 V695 P720	S582-T584 VanDerWaalsContact C-N 3.3Å; S582-T584 PolarHBondContact O-N 2.99Å; T584-V695 WeakPolarHBondContact O-CB 3.44Å; T584-V695 PolarHBondContact O-N 3.22Å; T584-P720 HydrophobicContact CG2-CB 4.48Å; T584-P720 HydrophobicContact CG2-CG 3.71Å
585	H	95	Very high	95	Very high	1 Å²	1	23.1 Å²	23.1	1%	0.005	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	158	-178.5	63.9	-89.2	0	0	0	112.6	F524 P563 A581 S582 C693 R694	F524-H585 AromaticContact CE2-CD2 3.89Å; F524-H585 AromaticContact CE2-NE2 3.51Å; F524-H585 AromaticContact CZ-CD2 3.31Å; F524-H585 WeakPolarHBondContact CZ-CD2 3.45Å; F524-H585 AromaticContact CZ-NE2 3.44Å; F524-H585 WeakPolarHBondContact CZ-NE2 3.3Å; P563-H585 PolarHBondContact O-CE1 2.81Å; A581-H585 WeakPolarHBondContact CA-O 3.36Å; S582-H585 WeakPolarHBondContact CB-CE1 3.28Å; S582-H585 WeakPolarHBondContact CB-NE2 3.41Å; S582-H585 PolarHBondContact N-O 3.5Å; S582-H585 PolarHBondContact OG-CE1 3.08Å; S582-H585 PolarHBondContact OG-NE2 3.05Å; H585-C693 CarbonylContact C-O 3.58Å; H585-C693 VanDerWaalsContact CA-O 3.23Å; H585-C693 WeakPolarHBondContact CA-O 2.99Å; H585-C693 WeakPolarHBondContact CB-O 3.33Å; H585-R694 HydrophobicContact CB-CG 4.42Å
586	T	97.8	Very high	94.9	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	148.8	172.6	68.3	0	0	0	0	111.2	T580 A581 V692 C693 I723 I726 M735 I737	T580-T586 CarbonylContact O-C 3.5Å; T580-T586 WeakPolarHBondContact O-CA 3.49Å; T580-T586 WeakPolarHBondContact O-CB 3.28Å; A581-T586 HydrophobicContact CB-CG2 3.82Å; T586-V692 CarbonylContact O-C 3.55Å; T586-V692 WeakPolarHBondContact O-CA 3.29Å; T586-C693 PolarHBondContact N-O 2.98Å; T586-C693 PolarHBondContact O-N 3.12Å; T586-C693 WeakPolarHBondContact OG1-CB 3.22Å; T586-I723 HydrophobicContact CG2-CD1 3.64Å; T586-I726 HydrophobicContact CG2-CG2 4.13Å; T586-M735 WeakPolarHBondContact OG1-CE 3.45Å; T586-I737 HydrophobicContact CG2-CD1 3.86Å; T586-I737 HydrophobicContact CG2-CG1 4.04Å; T586-I737 HydrophobicContact CG2-CG2 4.41Å
587	C	97.8	Very high	94.8	Very high	1 Å²	1	30.8 Å²	30.8	1%	0.007	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	118.9	173.4	-57.6	0	0	0	0	108.8	L523 L579 T580 L589	L523-C587 HydrophobicContact CD1-CB 4.01Å; L579-C587 WeakPolarHBondContact CA-O 2.87Å; T580-C587 PolarHBondContact N-O 2.82Å; T580-C587 PolarHBondContact O-N 3.27Å; T580-C587 WeakPolarHBondContact OG1-CB 3.45Å; T580-C587 PolarHBondContact OG1-O 3.34Å; C587-L589 HydrophobicContact CB-CD2 4.31Å
588	L	98.4	Very high	94.6	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	124.1	169.8	-179.9	59.4	0	0	0	109.3	L579 L690 L691 M728 M735 Y748	L579-L588 HydrophobicContact CB-CD1 4.26Å; L579-L588 HydrophobicContact CD1-CB 4.26Å; L588-L690 HydrophobicContact CD2-CD2 3.76Å; L588-L690 HydrophobicContact CD2-CG 4.36Å; L588-L690 HydrophobicContact CG-CB 4.24Å; L588-L690 HydrophobicContact CG-CD2 4.16Å; L588-L690 PolarHBondContact O-N 2.98Å; L588-L691 HydrophobicContact CB-CB 4.28Å; L588-L691 PolarHBondContact N-O 2.81Å; L588-L691 PolarHBondContact O-N 3.46Å; L588-M728 HydrophobicContact CD1-CE 4.43Å; L588-M728 HydrophobicContact CD1-SD 3.36Å; L588-M728 WeakPolarHBondContact CD1-SD 3.41Å; L588-M735 HydrophobicContact CB-SD 4.48Å; L588-M735 HydrophobicContact CD2-SD 4.23Å; L588-Y748 HydrophobicContact CD2-CD1 3.79Å; L588-Y748 HydrophobicContact CD2-CD2 3.58Å; L588-Y748 HydrophobicContact CD2-CE1 4.39Å; L588-Y748 HydrophobicContact CD2-CE2 4.24Å; L588-Y748 HydrophobicContact CD2-CG 3.35Å
589	L	97.5	Very high	94.3	Very high	0 Å²	0	37 Å²	37	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	144.9	-175.5	-48	174	0	0	0	109.8	F518 L523 K577 L578 C587 Y687 Q688 P689	F518-L589 HydrophobicContact CD1-CD1 3.44Å; F518-L589 VanDerWaalsContact CD1-CD1 3.44Å; F518-L589 HydrophobicContact CE1-CD1 3.34Å; F518-L589 HydrophobicContact CE1-CD2 3.74Å; F518-L589 HydrophobicContact CE1-CG 4.2Å; F518-L589 HydrophobicContact CE2-CD1 4.44Å; F518-L589 HydrophobicContact CE2-CD2 4.48Å; F518-L589 HydrophobicContact CG-CD1 4.06Å; F518-L589 HydrophobicContact CZ-CD1 3.88Å; F518-L589 HydrophobicContact CZ-CD2 3.64Å; F518-L589 HydrophobicContact CZ-CG 4.42Å; L523-L589 HydrophobicContact CD1-CD2 4.38Å; K577-L589 WeakPolarHBondContact CA-O 3.13Å; L578-L589 HydrophobicContact CB-CB 4.4Å; L578-L589 HydrophobicContact CD2-CD1 4.08Å; L578-L589 HydrophobicContact CG-CD1 4.48Å; L578-L589 PolarHBondContact N-O 3.28Å; L578-L589 PolarHBondContact O-N 3.22Å; C587-L589 HydrophobicContact CB-CD2 4.31Å; L589-Y687 HydrophobicContact CB-CD1 3.71Å; L589-Y687 HydrophobicContact CB-CE1 4.48Å; L589-Y687 HydrophobicContact CB-CG 4.44Å; L589-Q688 WeakPolarHBondContact CA-O 3.24Å; L589-P689 HydrophobicContact CD2-CB 4.17Å
590	H	94.5	Very high	94	Very high	38 Å²	38	37.3 Å²	37.3	18%	0.176	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	150.3	171.7	83	-72.4	0	0	0	110.2	Y687 Q688	H590-Y687 WeakPolarHBondContact O-CA 3.48Å; H590-Q688 PolarHBondContact N-O 2.66Å; H590-Q688 PolarHBondContact ND1-O 3.31Å; H590-Q688 PolarHBondContact O-N 2.74Å
591	F	95	Very high	93.8	Very high	5 Å²	5	38.9 Å²	38.9	2%	0.022	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	127.8	178.6	-175.2	-89.4	0	0	0	111	A448 F449 V452 R576 R593 Y687 W959	A448-F591 HydrophobicContact CB-CE1 3.98Å; A448-F591 HydrophobicContact CB-CZ 4.14Å; F449-F591 HydrophobicContact CD1-CD2 4.21Å; F449-F591 AromaticContact CD1-CE2 3.58Å; F449-F591 HydrophobicContact CD1-CE2 3.58Å; F449-F591 HydrophobicContact CD1-CZ 4.33Å; F449-F591 AromaticContact CE1-CD2 3.65Å; F449-F591 HydrophobicContact CE1-CD2 3.65Å; F449-F591 AromaticContact CE1-CE2 3.51Å; F449-F591 HydrophobicContact CE1-CE2 3.51Å; F449-F591 HydrophobicContact CE1-CZ 4.48Å; F449-F591 HydrophobicContact CZ-CD2 4.46Å; V452-F591 HydrophobicContact CG1-CE2 4.45Å; V452-F591 HydrophobicContact CG1-CZ 3.83Å; V452-F591 HydrophobicContact CG2-CE2 3.83Å; V452-F591 HydrophobicContact CG2-CZ 3.83Å; R576-F591 HydrophobicContact CB-CB 3.8Å; F591-R593 HydrophobicContact CE1-CG 4.09Å; F591-Y687 HydrophobicContact CB-CD1 4.35Å; F591-Y687 HydrophobicContact CB-CE1 4.01Å; F591-Y687 HydrophobicContact CD2-CD2 4.18Å; F591-Y687 HydrophobicContact CD2-CE2 4.08Å; F591-W959 HydrophobicContact CD1-CZ2 4.48Å; F591-W959 PolarHBondContact O-NE1 2.85Å
592	S	92.6	Very high	93.6	Very high	10 Å²	10	41.6 Å²	41.6	7%	0.07	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	139.4	177.1	176.4	0	0	0	0	111.1	R594 G686	S592-R594 PolarHBondContact O-N 3.24Å; S592-R594 PolarHBondContact OG-N 2.87Å; S592-R594 VanDerWaalsContact OG-N 3.14Å; S592-R594 PolarHBondContact OG-O 2.92Å; S592-G686 PolarHBondContact N-O 3.41Å; S592-G686 PolarHBondContact O-N 2.8Å
593	R	90	Very high	93.6	Very high	100 Å²	100	43 Å²	43	38%	0.377	21%	0.209	S	C	.	.	S	Bend	trans	-81	-3.1	172.7	-71	178.2	169	168.3	-2.9	113.4	V452 F591 D961	V452-R593 HydrophobicContact CG1-CG 4.47Å; F591-R593 HydrophobicContact CE1-CG 4.09Å; R593-D961 IonicContact NH1-OD2 3.79Å; R593-D961 PolarHBondContact NH1-OD2 3.01Å
594	R	88.5	Confident	93.6	Very high	137 Å²	137	45.3 Å²	45.3	52%	0.517	22%	0.221	S	C	.	.	S	Bend	trans	-112.7	144.6	-178.6	-61.3	-179.1	-177.3	-176	-0.5	110.1	S592 Q688 I964	S592-R594 PolarHBondContact O-N 3.24Å; S592-R594 PolarHBondContact OG-N 2.87Å; S592-R594 VanDerWaalsContact OG-N 3.14Å; S592-R594 PolarHBondContact OG-O 2.92Å; R594-Q688 PolarHBondContact O-NE2 2.45Å; R594-I964 PolarHBondContact NH1-O 2.59Å
595	E	90	Very high	93.6	Very high	122 Å²	122	44.6 Å²	44.6	57%	0.57	22%	0.216	S	C	*	.			trans	-71.5	152.9	165.9	60.3	-172.8	-151.1	0	0	111.4	H682 W683	E595-H682 IonicContact OE2-CE1 3.71Å; E595-W683 CarbonylContact C-O 3.52Å; E595-W683 WeakPolarHBondContact CA-O 3.35Å; E595-W683 WeakPolarHBondContact CB-O 3.19Å
596	I	92.2	Very high	93.3	Very high	66 Å²	66	47 Å²	47	34%	0.338	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	149	178.5	-166.8	163.1	0	0	0	110.2	L598 W683	I596-L598 HydrophobicContact CD1-CD2 4.18Å; I596-L598 HydrophobicContact CG1-CB 4.48Å; I596-L598 HydrophobicContact CG1-CD2 4.41Å; I596-L598 HydrophobicContact CG2-CD2 3.67Å; I596-L598 HydrophobicContact CG2-CG 4.23Å; I596-W683 HydrophobicContact CG2-CB 4.1Å; I596-W683 PolarHBondContact N-O 2.84Å; I596-W683 PolarHBondContact O-N 3.44Å
597	N	93.6	Very high	92.6	Very high	108 Å²	108	47 Å²	47	58%	0.578	23%	0.229	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-103.9	114.7	165.2	-61	-52.7	0	0	0	107.6	H681 H682	N597-H681 WeakPolarHBondContact CA-O 3.35Å; N597-H682 WeakPolarHBondContact OD1-CA 3.47Å; N597-H682 VanDerWaalsContact OD1-CB 3.26Å; N597-H682 WeakPolarHBondContact OD1-CB 3.49Å; N597-H682 PolarHBondContact OD1-ND1 2.97Å; N597-H682 VanDerWaalsContact OD1-ND1 3.09Å
598	L	91.6	Very high	91.5	Very high	37 Å²	37	47.8 Å²	47.8	19%	0.194	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	153.9	179.3	71.1	81.9	0	0	0	111.2	I596 S680 H681 P689	I596-L598 HydrophobicContact CD1-CD2 4.18Å; I596-L598 HydrophobicContact CG1-CB 4.48Å; I596-L598 HydrophobicContact CG1-CD2 4.41Å; I596-L598 HydrophobicContact CG2-CD2 3.67Å; I596-L598 HydrophobicContact CG2-CG 4.23Å; L598-S680 PolarHBondContact N-OG 2.62Å; L598-H681 PolarHBondContact N-O 2.83Å; L598-H681 VanDerWaalsContact N-O 3.14Å; L598-H681 PolarHBondContact O-N 3.09Å; L598-P689 HydrophobicContact CD1-CG 4.21Å
599	E	91.6	Very high	90.2	Very high	121 Å²	121	50.1 Å²	50.1	57%	0.565	25%	0.245	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-89.4	127.7	168.5	178.2	167	-148.9	0	0	109.4	S601 G679	E599-S601 PolarHBondContact O-N 3.44Å; E599-G679 PolarHBondContact OE1-N 2.95Å; E599-G679 VanDerWaalsContact OE1-N 3.14Å
600	T	91.9	Very high	88.3	Confident	8 Å²	8	55.6 Å²	55.6	5%	0.049	27%	0.274	C	S	.	.	P	Polyproline II helix	trans	-69	123.7	-179.3	-59	0	0	0	0	109.6	L523 P689 V692	L523-T600 HydrophobicContact CD2-CG2 4.27Å; T600-P689 HydrophobicContact CG2-CB 3.94Å; T600-P689 HydrophobicContact CG2-CG 4.34Å; T600-P689 WeakPolarHBondContact OG1-CG 3.36Å; T600-V692 HydrophobicContact CG2-CB 4.45Å; T600-V692 HydrophobicContact CG2-CG2 3.66Å
601	S	94.3	Very high	86.2	Confident	32 Å²	32	56 Å²	56	22%	0.224	29%	0.288	C	S	.	.	P	Polyproline II helix	trans	-74	139.7	174.6	-59.8	0	0	0	0	111.3	E599 V692 K751	E599-S601 PolarHBondContact O-N 3.44Å; S601-V692 PolarHBondContact O-N 2.96Å; S601-K751 WeakPolarHBondContact OG-CE 3.43Å; S601-K751 PolarHBondContact OG-NZ 3.44Å
602	V	94.7	Very high	84	Confident	58 Å²	58	58.2 Å²	58.2	35%	0.352	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	135.9	-177.9	-172.8	0	0	0	0	109.1	V676 V692 R694	V602-V676 HydrophobicContact CG1-CG2 4.06Å; V602-V676 HydrophobicContact CG2-CB 3.82Å; V602-V676 HydrophobicContact CG2-CG1 3.65Å; V602-V676 HydrophobicContact CG2-CG2 3.86Å; V602-V692 CarbonylContact C-O 3.53Å; V602-V692 VanDerWaalsContact CA-O 3.32Å; V602-V692 WeakPolarHBondContact CA-O 3.37Å; V602-R694 HydrophobicContact CG1-CG 4.5Å
603	L	94.6	Very high	81.5	Confident	28 Å²	28	64 Å²	64	15%	0.147	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	119.1	174.3	177.1	67.4	0	0	0	109	I605 L691 V692 C693 R694 V746 C753	L603-I605 HydrophobicContact CD2-CD1 4.3Å; L603-I605 HydrophobicContact CD2-CG1 4.29Å; L603-I605 HydrophobicContact CG-CG1 4.11Å; L603-L691 HydrophobicContact CB-CD1 4.07Å; L603-V692 PolarHBondContact N-O 3.36Å; L603-C693 CarbonylContact O-C 3.42Å; L603-C693 WeakPolarHBondContact O-CA 3.41Å; L603-R694 PolarHBondContact O-N 3.03Å; L603-V746 HydrophobicContact CD2-CG1 3.61Å; L603-V746 HydrophobicContact CD2-CG2 4.19Å; L603-C753 HydrophobicContact CD2-CB 4.37Å
604	D	93.5	Very high	79	Confident	61 Å²	61	66.6 Å²	66.6	33%	0.326	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	133.6	175.5	-60.4	-26.5	0	0	0	109.6	L670 V672 R694	D604-L670 HydrophobicContact CB-CD2 3.64Å; D604-V672 HydrophobicContact CB-CG1 4.3Å; D604-R694 IonicContact OD1-CZ 3.43Å; D604-R694 IonicContact OD1-NE 3.39Å; D604-R694 PolarHBondContact OD1-NE 3.31Å; D604-R694 IonicContact OD1-NH2 3.21Å; D604-R694 PolarHBondContact OD1-NH2 2.77Å; D604-R694 IonicContact OD2-CZ 3.61Å; D604-R694 IonicContact OD2-NE 3.7Å; D604-R694 IonicContact OD2-NH2 2.78Å; D604-R694 PolarHBondContact OD2-NH2 2.86Å
605	I	91.1	Very high	76.5	Confident	4 Å²	4	64.9 Å²	64.9	2%	0.021	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	117.1	-173.7	-54.1	176	0	0	0	108.1	L603 M607 C693 R694 V695 G696 I737 A744 V746	L603-I605 HydrophobicContact CD2-CD1 4.3Å; L603-I605 HydrophobicContact CD2-CG1 4.29Å; L603-I605 HydrophobicContact CG-CG1 4.11Å; I605-M607 HydrophobicContact CG2-CG 3.76Å; I605-M607 HydrophobicContact CG2-SD 4.43Å; I605-M607 PolarHBondContact O-N 2.95Å; I605-C693 HydrophobicContact CD1-CB 3.79Å; I605-R694 PolarHBondContact N-O 2.88Å; I605-V695 WeakPolarHBondContact O-CA 3.46Å; I605-G696 PolarHBondContact O-N 2.76Å; I605-I737 HydrophobicContact CD1-CD1 3.85Å; I605-A744 HydrophobicContact CD1-CB 4.44Å; I605-A744 HydrophobicContact CG2-CB 3.75Å; I605-V746 HydrophobicContact CD1-CG2 3.55Å
606	N	87.3	Confident	73.8	Confident	51 Å²	51	62 Å²	62	27%	0.273	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	116.1	168.2	-177.8	23.2	0	0	0	109.7	A608 L670 L698 S756	N606-A608 WeakPolarHBondContact OD1-CB 3.47Å; N606-A608 PolarHBondContact OD1-N 2.95Å; N606-A608 PolarHBondContact OD1-O 3.46Å; N606-L670 HydrophobicContact CB-CD1 3.89Å; N606-L698 WeakPolarHBondContact ND2-CD1 3.1Å; N606-S756 PolarHBondContact O-OG 2.88Å
607	M	84.8	Confident	70.6	Confident	0 Å²	0	66.1 Å²	66.1	0%	0	37%	0.37	C	S	.	.			trans	-121.3	12.3	171.4	-57.5	-174.6	73.1	0	0	112	I605 Y609 V695 P721 I737 S739 G742 A744	I605-M607 HydrophobicContact CG2-CG 3.76Å; I605-M607 HydrophobicContact CG2-SD 4.43Å; I605-M607 PolarHBondContact O-N 2.95Å; M607-Y609 HydrophobicContact CB-CE2 4.35Å; M607-Y609 WeakPolarHBondContact O-CD2 3.33Å; M607-Y609 WeakPolarHBondContact O-CE2 3.34Å; M607-V695 HydrophobicContact CB-CG1 3.92Å; M607-V695 HydrophobicContact CG-CG1 4.1Å; M607-V695 HydrophobicContact SD-CG1 4.14Å; M607-V695 HydrophobicContact SD-CG2 3.94Å; M607-P721 HydrophobicContact CB-CG 4.33Å; M607-P721 WeakPolarHBondContact O-CG 3.21Å; M607-I737 WeakPolarHBondContact CE-O 2.99Å; M607-I737 HydrophobicContact SD-CG2 4.21Å; M607-S739 WeakPolarHBondContact CE-OG 3.32Å; M607-G742 WeakPolarHBondContact CE-O 3.19Å; M607-A744 HydrophobicContact CE-CB 4.17Å; M607-A744 HydrophobicContact SD-CB 4.15Å
608	A	73.6	Confident	67.3	Low	18 Å²	18	65.6 Å²	65.6	15%	0.149	38%	0.381	C	S	.	.			trans	-81.4	114.7	168.6	0	0	0	0	0	108.4	N606 I697	N606-A608 WeakPolarHBondContact OD1-CB 3.47Å; N606-A608 PolarHBondContact OD1-N 2.95Å; N606-A608 PolarHBondContact OD1-O 3.46Å; A608-I697 HydrophobicContact CB-CB 4.18Å; A608-I697 HydrophobicContact CB-CD1 4.25Å; A608-I697 HydrophobicContact CB-CG1 3.71Å
609	Y	72.2	Confident	64.2	Low	48 Å²	48	73.8 Å²	73.8	19%	0.188	41%	0.411	C	S	.	.			trans	-106.6	153.3	175	-52.6	-76.8	0	0	0	108.5	M607 G611 F741 S756 I757 S758	M607-Y609 HydrophobicContact CB-CE2 4.35Å; M607-Y609 WeakPolarHBondContact O-CD2 3.33Å; M607-Y609 WeakPolarHBondContact O-CE2 3.34Å; Y609-G611 PolarHBondContact O-N 3.45Å; Y609-F741 HydrophobicContact CD2-CB 3.76Å; Y609-F741 HydrophobicContact CE2-CB 4.34Å; Y609-S756 PolarHBondContact OH-OG 2.91Å; Y609-I757 VanDerWaalsContact CE1-C 3.5Å; Y609-I757 WeakPolarHBondContact OH-CA 3.27Å; Y609-I757 PolarHBondContact OH-N 2.92Å; Y609-I757 PolarHBondContact OH-O 2.9Å; Y609-I757 VanDerWaalsContact OH-O 3.05Å; Y609-S758 VanDerWaalsContact CZ-N 3.33Å
610	D	56.9	Low	60.8	Low	116 Å²	116	73.3 Å²	73.3	62%	0.62	42%	0.421	S	S	*	.	S	Bend	trans	-61.5	28.6	-172.7	-79.2	-20.4	0	0	0	116.5	L612	D610-L612 PolarHBondContact O-N 3.18Å
611	G	50.2	Low	57.8	Low	46 Å²	46	79.3 Å²	79.3	47%	0.474	46%	0.458	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.3	3.4	166.4	0	0	0	0	0	114.5	Y609	Y609-G611 PolarHBondContact O-N 3.45Å
612	L	47.9	Very low	54.5	Low	52 Å²	52	80.9 Å²	80.9	27%	0.272	48%	0.479	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.6	-14.6	-176.8	-78	167.5	0	0	0	114.3	D610 D614 I615 I697 I718	D610-L612 PolarHBondContact O-N 3.18Å; L612-D614 PolarHBondContact O-N 2.67Å; L612-I615 HydrophobicContact CD2-CD1 4.23Å; L612-I615 PolarHBondContact O-N 2.9Å; L612-I697 HydrophobicContact CD1-CD1 3.88Å; L612-I718 HydrophobicContact CD1-CD1 4.31Å; L612-I718 HydrophobicContact CD1-CG2 4.36Å; L612-I718 HydrophobicContact CD2-CD1 4Å; L612-I718 HydrophobicContact CD2-CG2 4.21Å
613	D	40.8	Very low	51	Low	131 Å²	131	84.9 Å²	84.9	70%	0.701	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-24.3	-176.2	-77.8	-17	0	0	0	113.8
614	D	38	Very low	47.7	Very low	155 Å²	155	89.7 Å²	89.7	83%	0.829	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.1	-6.1	179.9	-88	-22.4	0	0	0	114.1	L612 G616	L612-D614 PolarHBondContact O-N 2.67Å; D614-G616 PolarHBondContact O-N 2.96Å; D614-G616 VanDerWaalsContact O-N 3.12Å
615	I	36.3	Very low	44.3	Very low	100 Å²	100	95.7 Å²	95.7	51%	0.513	55%	0.553	S	S	.	*			trans	-89.7	50.4	171.9	-46	179.7	0	0	0	109	L612 F617	L612-I615 HydrophobicContact CD2-CD1 4.23Å; L612-I615 PolarHBondContact O-N 2.9Å; I615-F617 HydrophobicContact CG2-CD2 4.44Å; I615-F617 HydrophobicContact CG2-CE2 4.05Å; I615-F617 PolarHBondContact O-N 3.36Å
616	G	32.1	Very low	41.2	Very low	61 Å²	61	100.8 Å²	100.8	63%	0.629	59%	0.589	S	S	*	*			trans	-74.5	99.7	165.8	0	0	0	0	0	108.8	D614 A618	D614-G616 PolarHBondContact O-N 2.96Å; D614-G616 VanDerWaalsContact O-N 3.12Å; G616-A618 VanDerWaalsContact C-N 3.32Å; G616-A618 PolarHBondContact O-N 2.81Å
617	F	26.5	Very low	38.1	Very low	153 Å²	153	105.9 Å²	105.9	67%	0.671	62%	0.616	S	S	*	*			trans	-53.7	98.9	164.4	-76.2	-91	0	0	0	108.4	I615 Y619	I615-F617 HydrophobicContact CG2-CD2 4.44Å; I615-F617 HydrophobicContact CG2-CE2 4.05Å; I615-F617 PolarHBondContact O-N 3.36Å; F617-Y619 VanDerWaalsContact C-N 3.31Å; F617-Y619 PolarHBondContact O-N 3.04Å
618	A	23.3	Very low	35.2	Very low	98 Å²	98	113.1 Å²	113.1	81%	0.81	65%	0.654	S	S	*	*			trans	-64.3	93.5	175.6	0	0	0	0	0	108.3	G616 S620	G616-A618 VanDerWaalsContact C-N 3.32Å; G616-A618 PolarHBondContact O-N 2.81Å; A618-S620 PolarHBondContact O-N 2.8Å
619	Y	25.9	Very low	32.9	Very low	208 Å²	208	120.2 Å²	120.2	82%	0.816	68%	0.684	S	S	*	*			trans	-61.6	111.2	162.2	-83.5	-81.5	0	0	0	107.4	F617 T621	F617-Y619 VanDerWaalsContact C-N 3.31Å; F617-Y619 PolarHBondContact O-N 3.04Å; Y619-T621 VanDerWaalsContact C-N 3.3Å; Y619-T621 PolarHBondContact O-N 2.54Å
620	S	21.9	Very low	30.5	Very low	112 Å²	112	125 Å²	125	78%	0.783	71%	0.712	S	S	*	*			trans	-53.3	88.4	165.5	53.6	0	0	0	0	110.3	A618 G622	A618-S620 PolarHBondContact O-N 2.8Å; S620-G622 PolarHBondContact O-N 2.74Å
621	T	27.9	Very low	28.8	Very low	134 Å²	134	125.8 Å²	125.8	82%	0.822	72%	0.717	S	S	*	*			trans	-78.7	101.5	153.4	53.6	0	0	0	0	106.2	Y619	Y619-T621 VanDerWaalsContact C-N 3.3Å; Y619-T621 PolarHBondContact O-N 2.54Å
622	G	24.7	Very low	27.4	Very low	64 Å²	64	130 Å²	130	66%	0.66	73%	0.733	S	S	*	*			trans	-58.8	158.6	-177.4	0	0	0	0	0	113.9	S620	S620-G622 PolarHBondContact O-N 2.74Å
623	D	22.1	Very low	26.3	Very low	142 Å²	142	132.2 Å²	132.2	76%	0.759	76%	0.759	S	S	*	*			trans	30.1	120.7	144.1	-81.3	-29.9	0	0	0	117.5
624	T	25	Very low	25.2	Very low	129 Å²	129	134.7 Å²	134.7	79%	0.791	77%	0.767	S	S	*	*				-169.3	125	95.1	-61.8	0	0	0	0	109.4
625	F	21.4	Very low	24.6	Very low	188 Å²	188	134.8 Å²	134.8	83%	0.825	77%	0.767	S	S	*	*			trans	-61.4	128.4	165	-75.1	-100.5	0	0	0	111
626	S	26.1	Very low	24	Very low	111 Å²	111	136.1 Å²	136.1	78%	0.776	78%	0.78	S	S	*	*			trans	-166.8	118.5	140.9	-4.1	0	0	0	0	110.9
627	D	22.8	Very low	23.5	Very low	157 Å²	157	143.1 Å²	143.1	84%	0.84	79%	0.793	S	S	*	*			trans	-52.5	137.4	146.7	-65.1	-53.4	0	0	0	109.5
628	D	24.7	Very low	23.3	Very low	152 Å²	152	139.1 Å²	139.1	81%	0.813	80%	0.795	S	S	*	*				-179.3	151.6	105.4	-127.3	-22.6	0	0	0	112.6
629	H	23.3	Very low	23.3	Very low	168 Å²	168	141.9 Å²	141.9	78%	0.778	80%	0.796	S	S	*	*			trans	-65	145	172.3	-72.2	-97.6	0	0	0	112.6
630	L	22.4	Very low	23.2	Very low	149 Å²	149	138.6 Å²	138.6	78%	0.78	80%	0.798	S	S	*	*				156.5	122.4	125.6	-86.4	154.2	0	0	0	114.3
631	N	20.5	Very low	23.3	Very low	132 Å²	132	139.1 Å²	139.1	71%	0.706	80%	0.796	S	S	*	*				57.9	126.2	127.7	-75.1	-6.6	0	0	0	123.6
632	T	20.9	Very low	23.1	Very low	133 Å²	133	142.8 Å²	142.8	82%	0.816	80%	0.801	S	S	*	*			trans	64.3	108.5	136.7	46.7	0	0	0	0	119.7
633	A	25.4	Very low	23	Very low	100 Å²	100	146.5 Å²	146.5	83%	0.826	81%	0.806	S	S	*	*				-154.5	111.1	128.4	0	0	0	0	0	109.9
634	E	19	Very low	23.1	Very low	183 Å²	183	146.1 Å²	146.1	86%	0.855	81%	0.808	S	S	*	*			trans	-55.8	132.7	153.1	-62.2	172.1	137.8	0	0	108.8
635	N	23.9	Very low	23.1	Very low	156 Å²	156	145.8 Å²	145.8	83%	0.834	81%	0.806	S	S	*	*			trans	-174.9	134.2	130.5	-107.5	-35.7	0	0	0	115
636	V	23.9	Very low	23.2	Very low	129 Å²	129	146 Å²	146	78%	0.782	81%	0.81	S	S	*	*			trans	77.5	88.7	160.8	-164.9	0	0	0	0	117.6
637	F	21.1	Very low	23	Very low	207 Å²	207	149.7 Å²	149.7	91%	0.908	82%	0.815	S	S	*	*			trans	-65.6	123.5	157.6	-80.3	-96.4	0	0	0	111
638	G	24.2	Very low	22.9	Very low	69 Å²	69	147.4 Å²	147.4	71%	0.711	81%	0.811	S	S	*	*			trans	-145	104.2	167	0	0	0	0	0	109.3	V640	G638-V640 PolarHBondContact O-N 3.35Å
639	N	22.8	Very low	22.8	Very low	156 Å²	156	147.8 Å²	147.8	83%	0.834	81%	0.812	S	S	*	*			trans	-57	117.6	-176.6	-67	-31.9	0	0	0	112.7
640	V	23.1	Very low	22.8	Very low	140 Å²	140	145.4 Å²	145.4	85%	0.848	81%	0.811	S	S	*	*			trans	-136.1	120	151.5	-179.8	0	0	0	0	108.8	G638	G638-V640 PolarHBondContact O-N 3.35Å
641	T	24.8	Very low	22.7	Very low	123 Å²	123	147.2 Å²	147.2	76%	0.755	82%	0.816	S	S	*	*			trans	-62.9	140.9	177.1	38.9	0	0	0	0	111.8	D643	T641-D643 PolarHBondContact O-N 3.22Å
642	K	23.9	Very low	22.9	Very low	210 Å²	210	147 Å²	147	91%	0.913	82%	0.819	S	S	*	*			trans	-55.6	102.7	175.1	-70.8	174	173.6	177.7	0	111.2
643	D	22	Very low	23.1	Very low	143 Å²	143	145.9 Å²	145.9	77%	0.765	82%	0.816	S	S	*	*			trans	-140	123.1	153.7	-89.5	-35.8	0	0	0	109.1	T641	T641-D643 PolarHBondContact O-N 3.22Å
644	T	24.2	Very low	23.2	Very low	134 Å²	134	146.7 Å²	146.7	82%	0.822	82%	0.816	S	S	*	*	S	Bend	trans	82.9	132.6	160	-27.2	0	0	0	0	118.3
645	V	24.9	Very low	23.7	Very low	121 Å²	121	140.5 Å²	140.5	73%	0.733	80%	0.801	S	S	*	*			trans	89.3	69.6	169.2	-154.2	0	0	0	0	117.3
646	Q	22.6	Very low	24	Very low	194 Å²	194	135.1 Å²	135.1	91%	0.907	78%	0.776	S	S	*	*			trans	-126.4	99.7	137.6	-93.9	-178.6	-25.5	0	0	107.7	S648	Q646-S648 PolarHBondContact O-N 2.87Å; Q646-S648 VanDerWaalsContact O-N 3.11Å
647	Q	22.6	Very low	24.4	Very low	188 Å²	188	134.3 Å²	134.3	88%	0.879	77%	0.771	S	S	*	*			trans	-65.5	99.3	166.3	-89.1	171.1	-45.8	0	0	108.4
648	S	21.8	Very low	25	Very low	109 Å²	109	127.8 Å²	127.8	76%	0.762	75%	0.751	S	S	*	*			trans	-84.5	122.8	165.1	54.1	0	0	0	0	109.2	Q646	Q646-S648 PolarHBondContact O-N 2.87Å; Q646-S648 VanDerWaalsContact O-N 3.11Å
649	L	22.3	Very low	25.4	Very low	160 Å²	160	126.6 Å²	126.6	84%	0.838	73%	0.732	S	S	*	*			trans	-51.8	138.9	170.7	-72.1	130.9	0	0	0	110.9	H651	L649-H651 PolarHBondContact O-N 3.21Å
650	P	22.8	Very low	25.7	Very low	118 Å²	118	124.1 Å²	124.1	77%	0.766	71%	0.711	S	S	*	*			trans	-72.7	114.2	-178.9	27	-30.6	0	0	0	111.1	V652	P650-V652 PolarHBondContact O-N 3.2Å
651	H	20.9	Very low	26	Very low	187 Å²	187	125.5 Å²	125.5	87%	0.866	71%	0.709	S	S	*	*			trans	-61.9	107.2	163	-92.9	-81.8	0	0	0	109.6	L649	L649-H651 PolarHBondContact O-N 3.21Å
652	V	24.5	Very low	26.3	Very low	128 Å²	128	123.9 Å²	123.9	78%	0.776	70%	0.702	S	S	*	*			trans	-86.3	119.8	165.8	-176.3	0	0	0	0	107.3	P650	P650-V652 PolarHBondContact O-N 3.2Å
653	S	24.7	Very low	26.4	Very low	109 Å²	109	118.8 Å²	118.8	76%	0.762	70%	0.699	S	S	*	*			trans	-76.2	129.7	-179.4	-58.4	0	0	0	0	110.1	G655	S653-G655 PolarHBondContact O-N 2.75Å
654	S	28.4	Very low	26.7	Very low	116 Å²	116	115.3 Å²	115.3	81%	0.811	69%	0.686	S	S	*	*			trans	-61.9	90.2	174.1	49.6	0	0	0	0	111.3
655	G	29.6	Very low	27.2	Very low	54 Å²	54	114.7 Å²	114.7	56%	0.557	69%	0.685	S	S	*	*			trans	-125	135.9	172.7	0	0	0	0	0	109.4	S653 V657	S653-G655 PolarHBondContact O-N 2.75Å; G655-V657 PolarHBondContact O-N 3.2Å; G655-V657 VanDerWaalsContact O-N 3.08Å
656	S	30.1	Very low	27.7	Very low	42 Å²	42	114 Å²	114	29%	0.294	68%	0.68	S	S	.	*			trans	-40.7	117	170.8	-50.9	0	0	0	0	110.6	S658 R765	S656-S658 VanDerWaalsContact C-N 3.29Å; S656-S658 PolarHBondContact O-N 3.11Å; S656-R765 PolarHBondContact OG-NH2 3.32Å
657	V	31.5	Very low	28.8	Very low	113 Å²	113	110.5 Å²	110.5	69%	0.685	67%	0.668	S	S	*	*			trans	-75.9	86.4	177.2	-172.2	0	0	0	0	108.1	G655 S659	G655-V657 PolarHBondContact O-N 3.2Å; G655-V657 VanDerWaalsContact O-N 3.08Å; V657-S659 PolarHBondContact O-N 3.41Å
658	S	33.4	Very low	29.9	Very low	69 Å²	69	111.4 Å²	111.4	48%	0.483	66%	0.664	S	S	.	*			trans	-69.6	122.1	158.6	57.9	0	0	0	0	107.4	S656 Y660	S656-S658 VanDerWaalsContact C-N 3.29Å; S656-S658 PolarHBondContact O-N 3.11Å; S658-Y660 PolarHBondContact O-N 3.16Å
659	S	33.6	Very low	31.8	Very low	44 Å²	44	110 Å²	110	31%	0.308	65%	0.647	S	S	.	*	S	Bend	trans	-65.6	19.1	-167.4	52.8	0	0	0	0	117.2	V657 Q661 C753	V657-S659 PolarHBondContact O-N 3.41Å; S659-Q661 PolarHBondContact O-N 3.45Å; S659-C753 PolarHBondContact OG-O 2.98Å
660	Y	27.6	Very low	34.3	Very low	104 Å²	104	103.1 Å²	103.1	41%	0.408	61%	0.612	S	S	.	*	T	Hydrogen-bonded Turn	trans	-79.1	8.7	175.5	-82	-73.2	0	0	0	115.7	S658 V921 P922	S658-Y660 PolarHBondContact O-N 3.16Å; Y660-V921 HydrophobicContact CE1-CG1 3.76Å; Y660-V921 VanDerWaalsContact OH-CG1 3.31Å; Y660-V921 WeakPolarHBondContact OH-CG1 3.31Å; Y660-P922 VanDerWaalsContact CE2-O 3.29Å; Y660-P922 WeakPolarHBondContact CE2-O 3.05Å; Y660-P922 VanDerWaalsContact CZ-O 3.24Å; Y660-P922 WeakPolarHBondContact OH-CA 3.16Å; Y660-P922 WeakPolarHBondContact OH-CD 3.2Å; Y660-P922 VanDerWaalsContact OH-N 3.17Å; Y660-P922 PolarHBondContact OH-O 2.79Å
661	Q	29.6	Very low	36.8	Very low	170 Å²	170	100 Å²	100	79%	0.794	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-134.2	30.6	172.1	-72.1	-171.8	-10	0	0	114.3	S659 A663	S659-Q661 PolarHBondContact O-N 3.45Å; Q661-A663 PolarHBondContact O-N 2.66Å
662	S	31	Very low	39.6	Very low	89 Å²	89	91.1 Å²	91.1	62%	0.622	54%	0.544	S	S	*	.			trans	-82.2	8.6	163.3	65.7	0	0	0	0	113.8	S664	S662-S664 PolarHBondContact O-N 3.4Å
663	A	26.8	Very low	42.1	Very low	103 Å²	103	86 Å²	86	85%	0.851	51%	0.511	S	S	*	.			trans	-90.1	52.2	162.3	0	0	0	0	0	111.1	Q661	Q661-A663 PolarHBondContact O-N 2.66Å
664	S	27	Very low	44.8	Very low	70 Å²	70	81.4 Å²	81.4	49%	0.49	48%	0.478	S	S	.	.	S	Bend	trans	-148.1	135.6	157.8	67.7	0	0	0	0	109	S662 T666	S662-S664 PolarHBondContact O-N 3.4Å; S664-T666 PolarHBondContact O-N 3.04Å
665	P	35.6	Very low	47.5	Very low	121 Å²	121	78 Å²	78	79%	0.786	45%	0.453	S	S	*	.	S	Bend	trans	-82	82.2	-164.3	33.1	-33.8	0	0	0	111.3
666	T	35.6	Very low	50.3	Low	105 Å²	105	76.1 Å²	76.1	64%	0.644	43%	0.431	S	S	*	.			trans	-126.7	16.6	155.6	57.7	0	0	0	0	112.1	S664 R668	S664-T666 PolarHBondContact O-N 3.04Å; T666-R668 PolarHBondContact O-N 2.89Å
667	D	44.7	Very low	53.1	Low	122 Å²	122	78.4 Å²	78.4	65%	0.652	43%	0.433	S	S	*	.	G	3₁₀ helix	trans	-71.6	1.5	170.9	-142.3	12	0	0	0	112.7	D669	D667-D669 VanDerWaalsContact C-N 3.28Å; D667-D669 PolarHBondContact O-N 2.8Å
668	R	46.9	Very low	55.7	Low	207 Å²	207	80.5 Å²	80.5	78%	0.781	44%	0.435	S	S	*	.	G	3₁₀ helix	trans	-76.2	-12.5	178.4	-75.2	-170.6	175.2	-174.9	-0.4	113.7	I548 T666	I548-R668 WeakPolarHBondContact CD1-O 3.22Å; T666-R668 PolarHBondContact O-N 2.89Å
669	D	61.6	Low	58.3	Low	78 Å²	78	78.5 Å²	78.5	42%	0.417	43%	0.426	S	S	.	.	G	3₁₀ helix	trans	-102.4	-2.4	-173.4	-65	-30.1	0	0	0	114.1	D667 R671 G699	D667-D669 VanDerWaalsContact C-N 3.28Å; D667-D669 PolarHBondContact O-N 2.8Å; D669-R671 PolarHBondContact O-N 3.17Å; D669-R671 VanDerWaalsContact O-N 3.16Å; D669-G699 PolarHBondContact O-N 2.94Å
670	L	73.9	Confident	61	Low	17 Å²	17	80.2 Å²	80.2	9%	0.089	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	110.1	177.6	-171	67.1	0	0	0	110.3	D604 N606 V672	D604-L670 HydrophobicContact CB-CD2 3.64Å; N606-L670 HydrophobicContact CB-CD1 3.89Å; L670-V672 HydrophobicContact CG-CG1 4.49Å
671	R	75.2	Confident	64	Low	51 Å²	51	78 Å²	78	19%	0.192	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	124.1	178.1	-61.4	-172.2	-173.7	-176.5	3.8	109.9	Y552 D669 G696 I697	Y552-R671 VanDerWaalsContact CE1-NH1 3.31Å; Y552-R671 VanDerWaalsContact CZ-CZ 3.42Å; Y552-R671 VanDerWaalsContact OH-CZ 3.26Å; Y552-R671 PolarHBondContact OH-NH1 3.37Å; Y552-R671 PolarHBondContact OH-NH2 3.15Å; D669-R671 PolarHBondContact O-N 3.17Å; D669-R671 VanDerWaalsContact O-N 3.16Å; R671-G696 WeakPolarHBondContact O-CA 3.32Å; R671-I697 HydrophobicContact CB-CG2 4.19Å; R671-I697 PolarHBondContact N-O 3.19Å; R671-I697 PolarHBondContact O-N 3.2Å
672	V	80.7	Confident	67	Low	2 Å²	2	75 Å²	75	1%	0.012	42%	0.417	C	S	.	.			trans	-126	135.4	177.8	-71	0	0	0	0	109.1	N549 D604 L670 R694	N549-V672 PolarHBondContact OD1-N 3.47Å; D604-V672 HydrophobicContact CB-CG1 4.3Å; L670-V672 HydrophobicContact CG-CG1 4.49Å; V672-R694 HydrophobicContact CB-CB 4.28Å; V672-R694 HydrophobicContact CG1-CB 3.97Å; V672-R694 VanDerWaalsContact CG2-CZ 3.5Å
673	F	76.7	Confident	69.9	Low	20 Å²	20	71.1 Å²	71.1	9%	0.088	39%	0.388	C	S	.	.	S	Bend	trans	-95.3	-9.7	-166.8	-61.7	-58.6	0	0	0	115.3	L556 I697 P720	L556-F673 HydrophobicContact CD1-CD1 3.44Å; L556-F673 VanDerWaalsContact CD1-CD1 3.44Å; L556-F673 HydrophobicContact CD1-CD2 4.46Å; L556-F673 HydrophobicContact CD1-CE1 3.19Å; L556-F673 HydrophobicContact CD1-CE2 4.28Å; L556-F673 HydrophobicContact CD1-CG 4.1Å; L556-F673 HydrophobicContact CD1-CZ 3.65Å; F673-I697 HydrophobicContact CE2-CG2 4.34Å; F673-I697 HydrophobicContact CZ-CG2 4.26Å; F673-P720 HydrophobicContact CD2-CG 3.12Å; F673-P720 HydrophobicContact CE2-CB 4.31Å; F673-P720 HydrophobicContact CE2-CG 3.21Å; F673-P720 HydrophobicContact CG-CG 4.43Å
674	V	80.6	Confident	72.9	Confident	13 Å²	13	68.2 Å²	68.2	8%	0.079	36%	0.361	C	S	.	.	S	Bend	trans	-113.8	111.1	177.3	-166.3	0	0	0	0	110.3	F524 L564 V676 R694	F524-V674 HydrophobicContact CB-CG1 4.06Å; F524-V674 HydrophobicContact CD1-CB 4.32Å; F524-V674 HydrophobicContact CD1-CG1 3.22Å; F524-V674 HydrophobicContact CD2-CG1 4.32Å; F524-V674 HydrophobicContact CE1-CB 4.4Å; F524-V674 HydrophobicContact CE1-CG1 3.62Å; F524-V674 HydrophobicContact CG-CG1 3.6Å; F524-V674 HydrophobicContact CZ-CG1 4.34Å; L564-V674 HydrophobicContact CD2-CG1 4.34Å; V674-V676 PolarHBondContact O-N 2.86Å; V674-R694 WeakPolarHBondContact O-CD 3.35Å; V674-R694 PolarHBondContact O-NH1 2.73Å
675	P	85.4	Confident	76.1	Confident	43 Å²	43	66.2 Å²	66.2	28%	0.279	35%	0.347	S	S	.	.	P	Polyproline II helix	trans	-73.4	127.2	174.5	28.4	-32.2	0	0	0	110.6	F524 A525	F524-P675 CarbonylContact C-O 3.56Å; F524-P675 VanDerWaalsContact CA-O 3.31Å; F524-P675 WeakPolarHBondContact CA-O 3.28Å; F524-P675 WeakPolarHBondContact CB-O 3.41Å; A525-P675 HydrophobicContact CB-CB 4.15Å; A525-P675 HydrophobicContact CB-CG 4.09Å; A525-P675 PolarHBondContact N-O 3.25Å
676	V	87.9	Confident	78.9	Confident	16 Å²	16	60.5 Å²	60.5	10%	0.097	31%	0.309	C	S	.	.	B	Isolated β-bridge	trans	-88.4	141.4	173.5	-173	0	0	0	0	108.8	L523 F524 V602 V674 Q678 V692	L523-V676 VanDerWaalsContact O-CG1 3.28Å; L523-V676 WeakPolarHBondContact O-CG1 3.35Å; F524-V676 HydrophobicContact CD1-CG2 4.08Å; F524-V676 HydrophobicContact CE1-CG2 4.01Å; V602-V676 HydrophobicContact CG1-CG2 4.06Å; V602-V676 HydrophobicContact CG2-CB 3.82Å; V602-V676 HydrophobicContact CG2-CG1 3.65Å; V602-V676 HydrophobicContact CG2-CG2 3.86Å; V674-V676 PolarHBondContact O-N 2.86Å; V676-Q678 PolarHBondContact O-N 2.72Å; V676-V692 HydrophobicContact CG2-CG1 3.96Å
677	R	88.8	Confident	81.8	Confident	90 Å²	90	55.6 Å²	55.6	34%	0.34	28%	0.279	S	S	.	.	P	Polyproline II helix	trans	-63.7	129.3	174.6	-59.7	-174.8	-176.5	-167.3	-5.2	109.9	K522 L523 F524 H681	K522-R677 WeakPolarHBondContact O-CD 3.11Å; K522-R677 PolarHBondContact O-NE 2.86Å; L523-R677 PolarHBondContact O-N 2.83Å; F524-R677 VanDerWaalsContact C-CG 3.46Å; F524-R677 WeakPolarHBondContact O-CG 3.32Å; F524-R677 PolarHBondContact O-NE 2.95Å; F524-R677 PolarHBondContact O-NH2 3.05Å; R677-H681 VanDerWaalsContact CB-NE2 3.26Å; R677-H681 WeakPolarHBondContact CB-NE2 3.44Å
678	Q	86.3	Confident	84.2	Confident	156 Å²	156	49.8 Å²	49.8	73%	0.729	25%	0.248	S	C	*	.	P	Polyproline II helix	trans	-88.6	152	177.4	-64.7	-173.9	-5	0	0	111.2	V676 H681	V676-Q678 PolarHBondContact O-N 2.72Å; Q678-H681 PolarHBondContact O-NE2 3.42Å
679	G	88.9	Confident	86.5	Confident	28 Å²	28	40.1 Å²	40.1	29%	0.289	21%	0.212	S	C	.	.	S	Bend	trans	91.6	175.2	177.4	0	0	0	0	0	114.7	E599 H681	E599-G679 PolarHBondContact OE1-N 2.95Å; E599-G679 VanDerWaalsContact OE1-N 3.14Å; G679-H681 PolarHBondContact O-CD2 3.42Å
680	S	90.8	Very high	88.1	Confident	79 Å²	79	38.8 Å²	38.8	55%	0.552	20%	0.204	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-77.7	130.4	-179.7	-170.8	0	0	0	0	111	L598	L598-S680 PolarHBondContact N-OG 2.62Å
681	H	90.3	Very high	89.2	Confident	57 Å²	57	38 Å²	38	26%	0.264	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	147.9	178.1	-64.7	-60.6	0	0	0	111.5	N597 L598 R677 Q678 G679	N597-H681 WeakPolarHBondContact CA-O 3.35Å; L598-H681 PolarHBondContact N-O 2.83Å; L598-H681 VanDerWaalsContact N-O 3.14Å; L598-H681 PolarHBondContact O-N 3.09Å; R677-H681 VanDerWaalsContact CB-NE2 3.26Å; R677-H681 WeakPolarHBondContact CB-NE2 3.44Å; Q678-H681 PolarHBondContact O-NE2 3.42Å; G679-H681 PolarHBondContact O-CD2 3.42Å
682	H	91.5	Very high	90.3	Very high	107 Å²	107	35.5 Å²	35.5	50%	0.495	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	122.9	174.7	179.5	67.6	0	0	0	111.3	E595 N597	E595-H682 IonicContact OE2-CE1 3.71Å; N597-H682 WeakPolarHBondContact OD1-CA 3.47Å; N597-H682 VanDerWaalsContact OD1-CB 3.26Å; N597-H682 WeakPolarHBondContact OD1-CB 3.49Å; N597-H682 PolarHBondContact OD1-ND1 2.97Å; N597-H682 VanDerWaalsContact OD1-ND1 3.09Å
683	W	92.1	Very high	91	Very high	8 Å²	8	35.4 Å²	35.4	3%	0.03	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	120.7	176.7	-65.9	97.9	0	0	0	110.6	F518 K522 L523 E595 I596 Q688 P689	F518-W683 HydrophobicContact CE2-CE3 4.45Å; F518-W683 AromaticContact CE2-CZ3 3.91Å; F518-W683 HydrophobicContact CE2-CZ3 3.91Å; F518-W683 HydrophobicContact CZ-CZ3 4.12Å; K522-W683 HydrophobicContact CB-CH2 3.8Å; K522-W683 HydrophobicContact CB-CZ3 4.12Å; K522-W683 HydrophobicContact CD-CZ3 4.21Å; L523-W683 HydrophobicContact CD2-CH2 3.38Å; L523-W683 HydrophobicContact CD2-CZ2 3.5Å; L523-W683 VanDerWaalsContact CD2-CZ2 3.5Å; L523-W683 HydrophobicContact CD2-CZ3 4.44Å; L523-W683 HydrophobicContact CG-CH2 4.13Å; E595-W683 CarbonylContact C-O 3.52Å; E595-W683 WeakPolarHBondContact CA-O 3.35Å; E595-W683 WeakPolarHBondContact CB-O 3.19Å; I596-W683 HydrophobicContact CG2-CB 4.1Å; I596-W683 PolarHBondContact N-O 2.84Å; I596-W683 PolarHBondContact O-N 3.44Å; W683-Q688 HydrophobicContact CB-CB 4.42Å; W683-Q688 HydrophobicContact CB-CG 3.96Å; W683-P689 VanDerWaalsContact CD2-CD 3.47Å; W683-P689 HydrophobicContact CD2-CG 4.09Å; W683-P689 VanDerWaalsContact CE2-CD 3.46Å; W683-P689 HydrophobicContact CH2-CG 4.15Å; W683-P689 HydrophobicContact CZ2-CG 3.57Å
684	P	91.6	Very high	91.9	Very high	43 Å²	43	36.2 Å²	36.2	28%	0.279	19%	0.193	S	C	.	.			trans	-71.2	173.2	177.5	31.7	-36.1	0	0	0	111.5	Q688	P684-Q688 PolarHBondContact O-NE2 3.27Å
685	P	92.8	Very high	92.4	Very high	28 Å²	28	35.7 Å²	35.7	18%	0.182	19%	0.189	C	C	.	.	S	Bend	trans	-55.2	143.8	168.9	-24	36.7	0	0	0	111.7	V452	V452-P685 HydrophobicContact CB-CB 4.16Å; V452-P685 HydrophobicContact CG1-CB 3.75Å
686	G	94.2	Very high	92.4	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	122.1	-145.9	-174.8	0	0	0	0	0	111.5	S592	S592-G686 PolarHBondContact N-O 3.41Å; S592-G686 PolarHBondContact O-N 2.8Å
687	Y	96.1	Very high	92.1	Very high	3 Å²	3	33.6 Å²	33.6	1%	0.012	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75	130.8	175.7	-83.2	-73.4	0	0	0	112.6	F449 F504 Y516 F518 F571 R576 L578 L589 H590 F591	F449-Y687 HydrophobicContact CE1-CD2 4.21Å; F449-Y687 AromaticContact CE1-CE2 3.5Å; F449-Y687 HydrophobicContact CE1-CE2 3.5Å; F449-Y687 VanDerWaalsContact CE1-CE2 3.5Å; F449-Y687 AromaticContact CZ-CE2 3.8Å; F449-Y687 HydrophobicContact CZ-CE2 3.8Å; F504-Y687 AromaticContact CE1-CE2 3.67Å; F504-Y687 HydrophobicContact CE1-CE2 3.67Å; F504-Y687 HydrophobicContact CE2-CD2 4.01Å; F504-Y687 AromaticContact CE2-CE2 3.8Å; F504-Y687 HydrophobicContact CE2-CE2 3.8Å; F504-Y687 AromaticContact CZ-CD2 3.81Å; F504-Y687 HydrophobicContact CZ-CD2 3.81Å; F504-Y687 AromaticContact CZ-CE2 3.16Å; F504-Y687 HydrophobicContact CZ-CE2 3.16Å; F504-Y687 AromaticContact CZ-CZ 3.89Å; Y516-Y687 HydrophobicContact CD1-CD2 4.01Å; Y516-Y687 AromaticContact CE1-CD2 3.59Å; Y516-Y687 HydrophobicContact CE1-CD2 3.59Å; Y516-Y687 HydrophobicContact CE1-CG 4.32Å; Y516-Y687 PolarHBondContact OH-N 2.69Å; F518-Y687 VanDerWaalsContact CE2-O 3.26Å; F518-Y687 WeakPolarHBondContact CE2-O 3.27Å; F571-Y687 WeakPolarHBondContact CE2-OH 3.29Å; R576-Y687 WeakPolarHBondContact O-CE1 3.32Å; R576-Y687 PolarHBondContact O-OH 3.49Å; R576-Y687 VanDerWaalsContact O-OH 3.08Å; L578-Y687 HydrophobicContact CB-CD1 4.22Å; L578-Y687 HydrophobicContact CB-CE1 3.61Å; L589-Y687 HydrophobicContact CB-CD1 3.71Å; L589-Y687 HydrophobicContact CB-CE1 4.48Å; L589-Y687 HydrophobicContact CB-CG 4.44Å; H590-Y687 WeakPolarHBondContact O-CA 3.48Å; F591-Y687 HydrophobicContact CB-CD1 4.35Å; F591-Y687 HydrophobicContact CB-CE1 4.01Å; F591-Y687 HydrophobicContact CD2-CD2 4.18Å; F591-Y687 HydrophobicContact CD2-CE2 4.08Å
688	Q	95.1	Very high	91.3	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	144	-177.7	-55.7	175.7	-16	0	0	109.7	L589 H590 R594 W683 P684	L589-Q688 WeakPolarHBondContact CA-O 3.24Å; H590-Q688 PolarHBondContact N-O 2.66Å; H590-Q688 PolarHBondContact ND1-O 3.31Å; H590-Q688 PolarHBondContact O-N 2.74Å; R594-Q688 PolarHBondContact O-NE2 2.45Å; W683-Q688 HydrophobicContact CB-CB 4.42Å; W683-Q688 HydrophobicContact CB-CG 3.96Å; P684-Q688 PolarHBondContact O-NE2 3.27Å
689	P	95.9	Very high	90.1	Very high	3 Å²	3	26.8 Å²	26.8	2%	0.019	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	138.4	-175.6	30.6	-35.8	0	0	0	112.5	L523 L589 L598 T600 W683	L523-P689 HydrophobicContact CD1-CB 4.49Å; L523-P689 HydrophobicContact CD2-CB 3.46Å; L523-P689 VanDerWaalsContact CD2-CB 3.46Å; L523-P689 HydrophobicContact CD2-CG 3.53Å; L589-P689 HydrophobicContact CD2-CB 4.17Å; L598-P689 HydrophobicContact CD1-CG 4.21Å; T600-P689 HydrophobicContact CG2-CB 3.94Å; T600-P689 HydrophobicContact CG2-CG 4.34Å; T600-P689 WeakPolarHBondContact OG1-CG 3.36Å; W683-P689 VanDerWaalsContact CD2-CD 3.47Å; W683-P689 HydrophobicContact CD2-CG 4.09Å; W683-P689 VanDerWaalsContact CE2-CD 3.46Å; W683-P689 HydrophobicContact CH2-CG 4.15Å; W683-P689 HydrophobicContact CZ2-CG 3.57Å
690	L	95.3	Very high	88.3	Confident	50 Å²	50	31.8 Å²	31.8	26%	0.262	17%	0.173	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	-46.1	172.4	-177.3	61.5	0	0	0	111.3	L588 Y748	L588-L690 HydrophobicContact CD2-CD2 3.76Å; L588-L690 HydrophobicContact CD2-CG 4.36Å; L588-L690 HydrophobicContact CG-CB 4.24Å; L588-L690 HydrophobicContact CG-CD2 4.16Å; L588-L690 PolarHBondContact O-N 2.98Å; L690-Y748 HydrophobicContact CD2-CD2 4Å; L690-Y748 HydrophobicContact CD2-CE2 4.42Å
691	L	97.7	Very high	85.9	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154	138.8	-178	-177.9	62.9	0	0	0	110.6	L588 L603 V746 K751	L588-L691 HydrophobicContact CB-CB 4.28Å; L588-L691 PolarHBondContact N-O 2.81Å; L588-L691 PolarHBondContact O-N 3.46Å; L603-L691 HydrophobicContact CB-CD1 4.07Å; L691-V746 HydrophobicContact CD2-CG1 3.96Å; L691-K751 HydrophobicContact CD1-CB 4.4Å; L691-K751 HydrophobicContact CD1-CG 4.39Å
692	V	97.3	Very high	83.3	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	123.7	166.5	174	0	0	0	0	108.1	L523 F524 T586 T600 S601 V602 L603 V676 R694	L523-V692 HydrophobicContact CD1-CG2 4.2Å; F524-V692 HydrophobicContact CE1-CG1 4.01Å; F524-V692 HydrophobicContact CZ-CG1 4.28Å; T586-V692 CarbonylContact O-C 3.55Å; T586-V692 WeakPolarHBondContact O-CA 3.29Å; T600-V692 HydrophobicContact CG2-CB 4.45Å; T600-V692 HydrophobicContact CG2-CG2 3.66Å; S601-V692 PolarHBondContact O-N 2.96Å; V602-V692 CarbonylContact C-O 3.53Å; V602-V692 VanDerWaalsContact CA-O 3.32Å; V602-V692 WeakPolarHBondContact CA-O 3.37Å; L603-V692 PolarHBondContact N-O 3.36Å; V676-V692 HydrophobicContact CG2-CG1 3.96Å; V692-R694 HydrophobicContact CG1-CG 4.21Å
693	C	96.9	Very high	80.3	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	128.1	170.9	-55.4	0	0	0	0	110.3	H585 T586 L603 I605 I737	H585-C693 CarbonylContact C-O 3.58Å; H585-C693 VanDerWaalsContact CA-O 3.23Å; H585-C693 WeakPolarHBondContact CA-O 2.99Å; H585-C693 WeakPolarHBondContact CB-O 3.33Å; T586-C693 PolarHBondContact N-O 2.98Å; T586-C693 PolarHBondContact O-N 3.12Å; T586-C693 WeakPolarHBondContact OG1-CB 3.22Å; L603-C693 CarbonylContact O-C 3.42Å; L603-C693 WeakPolarHBondContact O-CA 3.41Å; I605-C693 HydrophobicContact CD1-CB 3.79Å; C693-I737 HydrophobicContact CB-CD1 3.8Å
694	R	94.4	Very high	77.4	Confident	36 Å²	36	45.7 Å²	45.7	14%	0.136	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	129.6	176.7	-59.6	-177.5	-68.1	-178.3	2.7	110	H585 V602 L603 D604 I605 V672 V674 V692	H585-R694 HydrophobicContact CB-CG 4.42Å; V602-R694 HydrophobicContact CG1-CG 4.5Å; L603-R694 PolarHBondContact O-N 3.03Å; D604-R694 IonicContact OD1-CZ 3.43Å; D604-R694 IonicContact OD1-NE 3.39Å; D604-R694 PolarHBondContact OD1-NE 3.31Å; D604-R694 IonicContact OD1-NH2 3.21Å; D604-R694 PolarHBondContact OD1-NH2 2.77Å; D604-R694 IonicContact OD2-CZ 3.61Å; D604-R694 IonicContact OD2-NE 3.7Å; D604-R694 IonicContact OD2-NH2 2.78Å; D604-R694 PolarHBondContact OD2-NH2 2.86Å; I605-R694 PolarHBondContact N-O 2.88Å; V672-R694 HydrophobicContact CB-CB 4.28Å; V672-R694 HydrophobicContact CG1-CB 3.97Å; V672-R694 VanDerWaalsContact CG2-CZ 3.5Å; V674-R694 WeakPolarHBondContact O-CD 3.35Å; V674-R694 PolarHBondContact O-NH1 2.73Å; V692-R694 HydrophobicContact CG1-CG 4.21Å
695	V	91.6	Very high	74.4	Confident	2 Å²	2	50.9 Å²	50.9	1%	0.012	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	121.6	173.7	-177.6	0	0	0	0	107.9	T584 I605 M607 P720 P721 I723	T584-V695 WeakPolarHBondContact O-CB 3.44Å; T584-V695 PolarHBondContact O-N 3.22Å; I605-V695 WeakPolarHBondContact O-CA 3.46Å; M607-V695 HydrophobicContact CB-CG1 3.92Å; M607-V695 HydrophobicContact CG-CG1 4.1Å; M607-V695 HydrophobicContact SD-CG1 4.14Å; M607-V695 HydrophobicContact SD-CG2 3.94Å; V695-P720 HydrophobicContact CG1-CB 4.16Å; V695-P721 HydrophobicContact CG1-CB 4.38Å; V695-P721 HydrophobicContact CG1-CG 4.48Å; V695-I723 HydrophobicContact CG2-CD1 3.98Å; V695-I723 HydrophobicContact CG2-CG1 3.89Å
696	G	85.9	Confident	71.4	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	167.9	-179.4	0	0	0	0	0	113.2	I605 R671	I605-G696 PolarHBondContact O-N 2.76Å; R671-G696 WeakPolarHBondContact O-CA 3.32Å
697	I	80.1	Confident	68.4	Low	16 Å²	16	66 Å²	66	8%	0.082	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	139.5	171.1	-175	160.7	0	0	0	109.3	A608 L612 R671 F673 G699 I718	A608-I697 HydrophobicContact CB-CB 4.18Å; A608-I697 HydrophobicContact CB-CD1 4.25Å; A608-I697 HydrophobicContact CB-CG1 3.71Å; L612-I697 HydrophobicContact CD1-CD1 3.88Å; R671-I697 HydrophobicContact CB-CG2 4.19Å; R671-I697 PolarHBondContact N-O 3.19Å; R671-I697 PolarHBondContact O-N 3.2Å; F673-I697 HydrophobicContact CE2-CG2 4.34Å; F673-I697 HydrophobicContact CZ-CG2 4.26Å; I697-G699 PolarHBondContact O-N 2.96Å; I697-I718 HydrophobicContact CD1-CB 4.04Å; I697-I718 HydrophobicContact CD1-CG2 3.7Å
698	L	73.5	Confident	65.6	Low	90 Å²	90	70.7 Å²	70.7	47%	0.471	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.1	125.8	172.1	-87.1	142.7	0	0	0	109.4	N606 L700	N606-L698 WeakPolarHBondContact ND2-CD1 3.1Å; L698-L700 PolarHBondContact O-N 3.05Å; L698-L700 VanDerWaalsContact O-N 3.08Å
699	G	59.8	Low	62.5	Low	13 Å²	13	74 Å²	74	13%	0.134	40%	0.397	C	S	.	.			trans	-64.8	107.7	170.7	0	0	0	0	0	109.5	D669 I697 S701	D669-G699 PolarHBondContact O-N 2.94Å; I697-G699 PolarHBondContact O-N 2.96Å; G699-S701 PolarHBondContact O-N 2.99Å; G699-S701 VanDerWaalsContact O-N 3.07Å
700	L	51.9	Low	59.7	Low	133 Å²	133	81.3 Å²	81.3	70%	0.696	44%	0.441	S	S	*	.			trans	-65.2	109.5	164.3	-65.6	174.4	0	0	0	107.2	L698 F702	L698-L700 PolarHBondContact O-N 3.05Å; L698-L700 VanDerWaalsContact O-N 3.08Å; L700-F702 VanDerWaalsContact C-N 3.28Å; L700-F702 PolarHBondContact O-N 2.85Å
701	S	40.8	Very low	56.8	Low	96 Å²	96	83.4 Å²	83.4	67%	0.671	45%	0.453	S	S	*	.			trans	-68.7	86.3	172.8	59	0	0	0	0	109.1	G699 E703	G699-S701 PolarHBondContact O-N 2.99Å; G699-S701 VanDerWaalsContact O-N 3.07Å; S701-E703 PolarHBondContact O-N 3.36Å
702	F	34.5	Very low	53.9	Low	181 Å²	181	88.8 Å²	88.8	79%	0.794	49%	0.487	S	S	*	.			trans	-80.4	47.2	162.3	-141.2	-92	0	0	0	109.7	L700 S704	L700-F702 VanDerWaalsContact C-N 3.28Å; L700-F702 PolarHBondContact O-N 2.85Å; F702-S704 VanDerWaalsContact C-N 3.34Å; F702-S704 PolarHBondContact O-N 3.49Å
703	E	29.6	Very low	50.9	Low	188 Å²	188	94.2 Å²	94.2	88%	0.879	52%	0.521	S	S	*	.			trans	-98.5	56.4	172	-74.9	-160.5	160.1	0	0	109.9	S701	S701-E703 PolarHBondContact O-N 3.36Å
704	S	31.1	Very low	47.9	Very low	78 Å²	78	98 Å²	98	55%	0.545	55%	0.552	S	S	.	*	S	Bend	trans	-151	113.7	156	65.3	0	0	0	0	109	F702	F702-S704 VanDerWaalsContact C-N 3.34Å; F702-S704 PolarHBondContact O-N 3.49Å
705	N	27.7	Very low	45.4	Very low	151 Å²	151	99.8 Å²	99.8	81%	0.807	57%	0.57	S	S	*	*	S	Bend	trans	95.8	32.4	167.3	-51.4	-48.2	0	0	0	119.9
706	L	29.9	Very low	43	Very low	124 Å²	124	104.6 Å²	104.6	65%	0.649	60%	0.602	S	S	*	*			trans	-126	62.3	158.4	-132.5	76.4	0	0	0	112	S708 S709	L706-S708 PolarHBondContact O-N 3.11Å; L706-S709 VanDerWaalsContact CD2-OG 3.23Å; L706-S709 WeakPolarHBondContact CD2-OG 3.26Å
707	K	32	Very low	41.7	Very low	221 Å²	221	106 Å²	106	96%	0.961	61%	0.61	S	S	*	*			trans	-76.7	18.8	163.8	-90.2	-173.3	177	179.3	0	112.9
708	S	35.9	Very low	41.1	Very low	103 Å²	103	108.6 Å²	108.6	72%	0.72	62%	0.623	S	S	*	*	S	Bend	trans	-152	62.8	-175.9	64.5	0	0	0	0	113.2	L706	L706-S708 PolarHBondContact O-N 3.11Å
709	S	31.2	Very low	41.1	Very low	70 Å²	70	108.3 Å²	108.3	49%	0.49	63%	0.627	S	S	.	*			trans	-162.7	117.8	152	58	0	0	0	0	110	L706 D711	L706-S709 VanDerWaalsContact CD2-OG 3.23Å; L706-S709 WeakPolarHBondContact CD2-OG 3.26Å; S709-D711 PolarHBondContact O-N 3Å
710	T	37.6	Very low	42	Very low	155 Å²	155	108.1 Å²	108.1	95%	0.951	62%	0.623	S	S	*	*			trans	-76.7	25.1	-177.4	11.5	0	0	0	0	114.2	P712	T710-P712 WeakPolarHBondContact O-CD 3.24Å
711	D	33	Very low	43.7	Very low	95 Å²	95	102 Å²	102	51%	0.508	59%	0.592	S	S	.	*			trans	-112.1	96.8	179	-152.2	-20.2	0	0	0	111.2	S709 T713	S709-D711 PolarHBondContact O-N 3Å; D711-T713 PolarHBondContact O-N 2.99Å; D711-T713 VanDerWaalsContact O-N 3.11Å; D711-T713 PolarHBondContact OD1-N 3.26Å; D711-T713 PolarHBondContact OD1-OG1 2.94Å
712	P	37	Very low	46.1	Very low	112 Å²	112	99.5 Å²	99.5	73%	0.727	57%	0.574	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.1	-1.1	179.9	27.5	-33.1	0	0	0	113.7	T710	T710-P712 WeakPolarHBondContact O-CD 3.24Å
713	T	35.1	Very low	49	Very low	115 Å²	115	91.2 Å²	91.2	71%	0.706	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87	-8.5	-178.7	64.1	0	0	0	0	114.5	D711	D711-T713 PolarHBondContact O-N 2.99Å; D711-T713 VanDerWaalsContact O-N 3.11Å; D711-T713 PolarHBondContact OD1-N 3.26Å; D711-T713 PolarHBondContact OD1-OG1 2.94Å
714	A	34.5	Very low	52.2	Low	79 Å²	79	83.4 Å²	83.4	65%	0.653	50%	0.503	S	S	*	.			trans	-95.2	2	-168.5	0	0	0	0	0	116.2	C716	A714-C716 PolarHBondContact O-N 3.47Å
715	S	41.4	Very low	55.3	Low	73 Å²	73	79.9 Å²	79.9	51%	0.51	48%	0.479	S	S	.	.	S	Bend	trans	-74	99.3	168.7	66.6	0	0	0	0	108.7	L717	S715-L717 VanDerWaalsContact C-N 3.33Å; S715-L717 PolarHBondContact O-N 2.9Å
716	C	41	Very low	58.7	Low	103 Å²	103	73.6 Å²	73.6	70%	0.696	45%	0.445	S	S	*	.			trans	-57	95.2	173	-167.4	0	0	0	0	109.1	A714 I718	A714-C716 PolarHBondContact O-N 3.47Å; C716-I718 PolarHBondContact O-N 2.95Å
717	L	57.4	Low	61.9	Low	30 Å²	30	67.8 Å²	67.8	16%	0.157	42%	0.415	C	S	.	.			trans	-79	105.5	179	-83.3	157	0	0	0	108.2	Y552 I555 L556 S715 P719	Y552-L717 HydrophobicContact CD1-CD1 3.82Å; Y552-L717 HydrophobicContact CD1-CD2 3.46Å; Y552-L717 VanDerWaalsContact CD1-CD2 3.46Å; Y552-L717 HydrophobicContact CD1-CG 4.26Å; Y552-L717 HydrophobicContact CE1-CD1 4.35Å; Y552-L717 HydrophobicContact CE1-CD2 3.73Å; Y552-L717 HydrophobicContact CG-CD2 4.36Å; I555-L717 HydrophobicContact CG2-CD1 4.32Å; L556-L717 HydrophobicContact CD1-CB 4.17Å; L556-L717 HydrophobicContact CD1-CD1 4.28Å; L556-L717 HydrophobicContact CD2-CB 4.34Å; L556-L717 HydrophobicContact CG-CD1 4.38Å; S715-L717 VanDerWaalsContact C-N 3.33Å; S715-L717 PolarHBondContact O-N 2.9Å; L717-P719 WeakPolarHBondContact O-CD 3.39Å
718	I	68.6	Low	64.9	Low	71 Å²	71	57.4 Å²	57.4	36%	0.364	37%	0.37	S	S	.	.	P	Polyproline II helix	trans	-68.2	120.8	169.8	-62.4	161.4	0	0	0	107.7	L612 I697 C716	L612-I718 HydrophobicContact CD1-CD1 4.31Å; L612-I718 HydrophobicContact CD1-CG2 4.36Å; L612-I718 HydrophobicContact CD2-CD1 4Å; L612-I718 HydrophobicContact CD2-CG2 4.21Å; I697-I718 HydrophobicContact CD1-CB 4.04Å; I697-I718 HydrophobicContact CD1-CG2 3.7Å; C716-I718 PolarHBondContact O-N 2.95Å
719	P	72.7	Confident	67.8	Low	83 Å²	83	52.5 Å²	52.5	54%	0.539	34%	0.336	S	S	.	.	P	Polyproline II helix	trans	-67.8	158.7	175.4	29.6	-34.4	0	0	0	110.5	L717	L717-P719 WeakPolarHBondContact O-CD 3.39Å
720	P	80.1	Confident	70.7	Confident	10 Å²	10	49.5 Å²	49.5	7%	0.065	31%	0.314	C	S	.	.	P	Polyproline II helix	trans	-70.2	163	177.3	7.2	13.7	0	0	0	108.8	T584 F673 V695 S722	T584-P720 HydrophobicContact CG2-CB 4.48Å; T584-P720 HydrophobicContact CG2-CG 3.71Å; F673-P720 HydrophobicContact CD2-CG 3.12Å; F673-P720 HydrophobicContact CE2-CB 4.31Å; F673-P720 HydrophobicContact CE2-CG 3.21Å; F673-P720 HydrophobicContact CG-CG 4.43Å; V695-P720 HydrophobicContact CG1-CB 4.16Å; P720-S722 PolarHBondContact O-N 2.75Å
721	P	85.8	Confident	73.3	Confident	5 Å²	5	44.5 Å²	44.5	3%	0.032	29%	0.289	C	S	.	.	P	Polyproline II helix	trans	-51.2	129.7	170.2	-27	35.9	0	0	0	112.5	M607 V695 F741	M607-P721 HydrophobicContact CB-CG 4.33Å; M607-P721 WeakPolarHBondContact O-CG 3.21Å; V695-P721 HydrophobicContact CG1-CB 4.38Å; V695-P721 HydrophobicContact CG1-CG 4.48Å; P721-F741 HydrophobicContact CB-CD2 3.62Å; P721-F741 HydrophobicContact CB-CE2 4Å; P721-F741 HydrophobicContact CG-CD2 3.5Å; P721-F741 HydrophobicContact CG-CE2 3.89Å
722	S	91.3	Very high	76	Confident	43 Å²	43	41.3 Å²	41.3	30%	0.301	27%	0.27	S	S	.	.	P	Polyproline II helix	trans	-65.9	137.7	170.6	-64.9	0	0	0	0	110.4	S583 P720 S739 E740	S583-S722 CarbonylContact O-C 3.41Å; S583-S722 WeakPolarHBondContact O-CA 3.46Å; P720-S722 PolarHBondContact O-N 2.75Å; S722-S739 VanDerWaalsContact O-CA 3.25Å; S722-S739 WeakPolarHBondContact O-CA 3.3Å; S722-S739 VanDerWaalsContact O-CB 3.31Å; S722-S739 WeakPolarHBondContact O-CB 3.37Å; S722-E740 PolarHBondContact O-N 3.03Å
723	I	95.9	Very high	78.6	Confident	6 Å²	6	36.3 Å²	36.3	3%	0.031	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	131	169.9	-62.2	172.7	0	0	0	108.1	F568 A581 S583 T586 V695 I726 I737 G738	F568-I723 VanDerWaalsContact CE2-O 3.28Å; F568-I723 WeakPolarHBondContact CE2-O 3.47Å; A581-I723 HydrophobicContact CB-CD1 4.37Å; A581-I723 HydrophobicContact CB-CG2 3.98Å; S583-I723 PolarHBondContact O-N 3.05Å; T586-I723 HydrophobicContact CG2-CD1 3.64Å; V695-I723 HydrophobicContact CG2-CD1 3.98Å; V695-I723 HydrophobicContact CG2-CG1 3.89Å; I723-I726 HydrophobicContact CG2-CG2 3.89Å; I723-I737 HydrophobicContact CD1-CG2 4.11Å; I723-I737 HydrophobicContact CG1-CG2 3.95Å; I723-I737 HydrophobicContact CG2-CG2 4.05Å; I723-G738 WeakPolarHBondContact CA-O 3.49Å
724	T	96.2	Very high	81.4	Confident	24 Å²	24	30.8 Å²	30.8	15%	0.147	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	-15.8	-174.2	55.7	0	0	0	0	113.4	F568 G738 S739 E740 T877 I878	F568-T724 WeakPolarHBondContact CE1-O 3.44Å; F568-T724 WeakPolarHBondContact CZ-O 3.37Å; T724-G738 PolarHBondContact N-O 3.06Å; T724-G738 PolarHBondContact OG1-O 2.99Å; T724-S739 VanDerWaalsContact OG1-C 3.24Å; T724-S739 WeakPolarHBondContact OG1-CA 3.38Å; T724-S739 PolarHBondContact OG1-O 3.29Å; T724-E740 HydrophobicContact CG2-CG 3.74Å; T724-T877 HydrophobicContact CG2-CG2 3.68Å; T724-I878 VanDerWaalsContact CB-O 3.23Å; T724-I878 WeakPolarHBondContact CB-O 3.29Å; T724-I878 PolarHBondContact OG1-O 3.27Å
725	A	97.5	Very high	84.4	Confident	5 Å²	5	27 Å²	27	4%	0.041	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155	148.1	174.5	0	0	0	0	0	110.9	G738 I878 I881	A725-G738 PolarHBondContact N-O 3.21Å; A725-G738 PolarHBondContact O-N 3.26Å; A725-I878 HydrophobicContact CB-CG2 4.17Å; A725-I881 HydrophobicContact CB-CD1 3.82Å; A725-I881 HydrophobicContact CB-CG1 3.98Å
726	I	98.1	Very high	87	Confident	19 Å²	19	23.6 Å²	23.6	10%	0.097	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	149.8	171.9	53.9	165.4	0	0	0	111.1	F568 H570 L579 A581 T586 I723 A736	F568-I726 HydrophobicContact CB-CD1 3.64Å; F568-I726 HydrophobicContact CB-CG1 3.6Å; F568-I726 HydrophobicContact CG-CG1 4.48Å; H570-I726 HydrophobicContact CB-CD1 4.33Å; L579-I726 HydrophobicContact CD2-CB 4Å; L579-I726 HydrophobicContact CD2-CD1 4.11Å; L579-I726 HydrophobicContact CG-CD1 3.93Å; A581-I726 HydrophobicContact CB-CD1 4.04Å; A581-I726 HydrophobicContact CB-CG2 3.76Å; T586-I726 HydrophobicContact CG2-CG2 4.13Å; I723-I726 HydrophobicContact CG2-CG2 3.89Å; I726-A736 WeakPolarHBondContact CA-O 3.43Å
727	S	97.6	Very high	89.8	Confident	2 Å²	2	18.7 Å²	18.7	1%	0.014	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151	155.7	172.8	-159.6	0	0	0	0	111	M735 A736 I881	S727-M735 CarbonylContact O-C 3.58Å; S727-M735 VanDerWaalsContact O-CA 3.28Å; S727-M735 WeakPolarHBondContact O-CA 3.29Å; S727-A736 PolarHBondContact N-O 3.34Å; S727-A736 PolarHBondContact O-N 3.23Å; S727-I881 VanDerWaalsContact CB-O 3.27Å; S727-I881 WeakPolarHBondContact CB-O 3.36Å; S727-I881 PolarHBondContact OG-O 3.44Å
728	M	95.9	Very high	91.6	Very high	2 Å²	2	17.2 Å²	17.2	1%	0.01	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	141.2	179.5	-179.7	-178.3	57.8	0	0	110.3	H570 C572 K577 L579 L588 M735 Y748	H570-M728 PolarHBondContact NE2-O 3.4Å; C572-M728 HydrophobicContact CB-CE 3.93Å; K577-M728 HydrophobicContact CB-CE 3.63Å; K577-M728 HydrophobicContact CB-SD 4.06Å; K577-M728 HydrophobicContact CD-SD 4.46Å; L579-M728 HydrophobicContact CB-SD 4.49Å; L579-M728 HydrophobicContact CD2-CB 4.17Å; L588-M728 HydrophobicContact CD1-CE 4.43Å; L588-M728 HydrophobicContact CD1-SD 3.36Å; L588-M728 WeakPolarHBondContact CD1-SD 3.41Å; M728-M735 HydrophobicContact CB-CB 4.37Å; M728-M735 HydrophobicContact CG-CB 4.44Å; M728-Y748 HydrophobicContact CG-CE1 3.91Å; M728-Y748 HydrophobicContact SD-CE1 4.29Å
729	S	95	Very high	92.8	Very high	1 Å²	1	13.9 Å²	13.9	1%	0.007	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	118.3	164.1	169.5	0	0	0	0	109	F732 G733 L734 Y748 P955	S729-F732 WeakPolarHBondContact OG-CB 3.38Å; S729-F732 WeakPolarHBondContact OG-CD2 2.96Å; S729-F732 WeakPolarHBondContact OG-CG 3.44Å; S729-F732 PolarHBondContact OG-N 3.19Å; S729-F732 VanDerWaalsContact OG-N 3.09Å; S729-G733 PolarHBondContact O-N 3.5Å; S729-L734 PolarHBondContact N-O 3.02Å; S729-L734 PolarHBondContact O-N 3.14Å; S729-Y748 PolarHBondContact O-OH 2.95Å; S729-P955 PolarHBondContact OG-O 2.77Å
730	S	93.9	Very high	93.6	Very high	6 Å²	6	13.5 Å²	13.5	4%	0.042	8%	0.083	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-29	176.4	57.9	0	0	0	0	112.4	C572 S575 Y748 P955 S956 E957	C572-S730 PolarHBondContact SG-OG 3.48Å; S575-S730 VanDerWaalsContact OG-CB 3.3Å; S575-S730 WeakPolarHBondContact OG-CB 3.33Å; S575-S730 PolarHBondContact OG-OG 3.47Å; S730-Y748 VanDerWaalsContact CA-OH 3.27Å; S730-Y748 WeakPolarHBondContact CA-OH 3.13Å; S730-Y748 PolarHBondContact O-OH 3.47Å; S730-P955 PolarHBondContact N-O 3.2Å; S730-S956 WeakPolarHBondContact OG-CA 3.27Å; S730-S956 WeakPolarHBondContact OG-CB 3.28Å; S730-E957 PolarHBondContact OG-N 2.85Å
731	A	91.2	Very high	94	Very high	51 Å²	51	16.4 Å²	16.4	42%	0.421	10%	0.095	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-36.8	176	0	0	0	0	0	112.9	P955	A731-P955 HydrophobicContact CB-CB 3.75Å; A731-P955 PolarHBondContact N-O 3.15Å
732	F	90.3	Very high	94.2	Very high	27 Å²	27	16.2 Å²	16.2	12%	0.118	9%	0.094	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.4	-11.3	-177	-57.1	-30.4	0	0	0	113.9	S729 L734 F883 E885 P897 P955	S729-F732 WeakPolarHBondContact OG-CB 3.38Å; S729-F732 WeakPolarHBondContact OG-CD2 2.96Å; S729-F732 WeakPolarHBondContact OG-CG 3.44Å; S729-F732 PolarHBondContact OG-N 3.19Å; S729-F732 VanDerWaalsContact OG-N 3.09Å; F732-L734 HydrophobicContact CB-CB 4.21Å; F732-L734 HydrophobicContact CB-CD1 4.14Å; F732-L734 HydrophobicContact CB-CG 3.84Å; F732-L734 WeakPolarHBondContact O-CG 3.34Å; F732-L734 PolarHBondContact O-N 2.49Å; F732-F883 HydrophobicContact CD2-CD1 4.1Å; F732-E885 HydrophobicContact CE1-CG 4.27Å; F732-E885 HydrophobicContact CZ-CG 3.73Å; F732-P897 HydrophobicContact CD1-CB 4.28Å; F732-P897 HydrophobicContact CD1-CG 4.08Å; F732-P897 HydrophobicContact CD2-CB 3.88Å; F732-P897 HydrophobicContact CE1-CB 4.11Å; F732-P897 HydrophobicContact CE1-CG 3.93Å; F732-P897 HydrophobicContact CE2-CB 3.69Å; F732-P897 HydrophobicContact CE2-CG 4.42Å; F732-P897 HydrophobicContact CG-CB 4.16Å; F732-P897 HydrophobicContact CG-CG 4.38Å; F732-P897 HydrophobicContact CZ-CB 3.79Å; F732-P897 HydrophobicContact CZ-CG 4.08Å; F732-P955 HydrophobicContact CE1-CB 3.99Å; F732-P955 HydrophobicContact CE1-CG 4.17Å; F732-P955 HydrophobicContact CE2-CB 4.19Å; F732-P955 HydrophobicContact CE2-CG 3.84Å; F732-P955 HydrophobicContact CZ-CB 3.81Å; F732-P955 HydrophobicContact CZ-CG 3.51Å
733	G	91.3	Very high	94.3	Very high	7 Å²	7	14.2 Å²	14.2	7%	0.072	8%	0.08	C	C	.	.	T	Hydrogen-bonded Turn	trans	70.7	17.6	-171.4	0	0	0	0	0	113.5	S729 Y748	S729-G733 PolarHBondContact O-N 3.5Å; G733-Y748 VanDerWaalsContact CA-CZ 3.41Å; G733-Y748 WeakPolarHBondContact CA-OH 3.44Å; G733-Y748 VanDerWaalsContact O-CD1 3.23Å; G733-Y748 WeakPolarHBondContact O-CD1 3.46Å; G733-Y748 WeakPolarHBondContact O-CE1 3.39Å; G733-Y748 PolarHBondContact O-N 3.05Å
734	L	94.6	Very high	94.2	Very high	0 Å²	0	14 Å²	14	0%	0	8%	0.079	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	144.6	-171	-57	-173	0	0	0	113.1	S729 F732 V746 D747 Y748 L754 F883 L913 Y915	S729-L734 PolarHBondContact N-O 3.02Å; S729-L734 PolarHBondContact O-N 3.14Å; F732-L734 HydrophobicContact CB-CB 4.21Å; F732-L734 HydrophobicContact CB-CD1 4.14Å; F732-L734 HydrophobicContact CB-CG 3.84Å; F732-L734 WeakPolarHBondContact O-CG 3.34Å; F732-L734 PolarHBondContact O-N 2.49Å; L734-V746 WeakPolarHBondContact CA-O 3.16Å; L734-D747 HydrophobicContact CD2-CB 4.01Å; L734-Y748 VanDerWaalsContact C-CE1 3.43Å; L734-Y748 WeakPolarHBondContact O-CE1 3.4Å; L734-L754 HydrophobicContact CD1-CD1 4.33Å; L734-L754 HydrophobicContact CD2-CD1 3.37Å; L734-L754 HydrophobicContact CG-CD1 4.46Å; L734-F883 HydrophobicContact CB-CE1 3.82Å; L734-F883 HydrophobicContact CB-CZ 3.82Å; L734-F883 HydrophobicContact CD1-CE1 4.12Å; L734-L913 HydrophobicContact CD1-CD1 3.71Å; L734-Y915 HydrophobicContact CD1-CE1 4.42Å
735	M	96.1	Very high	94.2	Very high	0 Å²	0	12.9 Å²	12.9	0%	0	7%	0.072	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	157	165.6	63.4	-175.4	-81	0	0	110.3	L579 T586 L588 S727 M728 I737 V746 Y748	L579-M735 HydrophobicContact CD1-CE 3.38Å; L579-M735 HydrophobicContact CD1-SD 4.24Å; L579-M735 HydrophobicContact CD2-CB 4.31Å; L579-M735 HydrophobicContact CD2-CE 3.99Å; L579-M735 HydrophobicContact CG-CE 4.34Å; T586-M735 WeakPolarHBondContact OG1-CE 3.45Å; L588-M735 HydrophobicContact CB-SD 4.48Å; L588-M735 HydrophobicContact CD2-SD 4.23Å; S727-M735 CarbonylContact O-C 3.58Å; S727-M735 VanDerWaalsContact O-CA 3.28Å; S727-M735 WeakPolarHBondContact O-CA 3.29Å; M728-M735 HydrophobicContact CB-CB 4.37Å; M728-M735 HydrophobicContact CG-CB 4.44Å; M735-I737 HydrophobicContact CE-CD1 4.02Å; M735-I737 HydrophobicContact CE-CG1 4.06Å; M735-V746 HydrophobicContact CG-CB 3.73Å; M735-V746 HydrophobicContact CG-CG1 4.21Å; M735-V746 PolarHBondContact N-O 3.17Å; M735-V746 PolarHBondContact O-N 3.49Å; M735-Y748 HydrophobicContact CB-CD1 4.04Å; M735-Y748 HydrophobicContact CG-CD1 4.04Å; M735-Y748 HydrophobicContact SD-CD1 4.38Å
736	A	97.5	Very high	94	Very high	0 Å²	0	12.6 Å²	12.6	0%	0	7%	0.07	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	139.1	179	0	0	0	0	0	110	I726 S727 I743 A744 I881 F883 L899	I726-A736 WeakPolarHBondContact CA-O 3.43Å; S727-A736 PolarHBondContact N-O 3.34Å; S727-A736 PolarHBondContact O-N 3.23Å; A736-I743 HydrophobicContact CB-CD1 4.48Å; A736-A744 CarbonylContact C-O 3.54Å; A736-A744 VanDerWaalsContact CA-O 3.26Å; A736-A744 WeakPolarHBondContact CA-O 3.4Å; A736-I881 HydrophobicContact CB-CD1 4.23Å; A736-I881 HydrophobicContact CB-CG2 3.84Å; A736-F883 HydrophobicContact CB-CE2 3.84Å; A736-F883 HydrophobicContact CB-CZ 3.87Å; A736-L899 HydrophobicContact CB-CD1 4.22Å; A736-L899 HydrophobicContact CB-CD2 4.31Å
737	I	98.1	Very high	93.8	Very high	0 Å²	0	11.9 Å²	11.9	0%	0	7%	0.066	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	113.8	-178.6	-55.2	172.5	0	0	0	107	T586 I605 M607 C693 I723 M735 I743 A744	T586-I737 HydrophobicContact CG2-CD1 3.86Å; T586-I737 HydrophobicContact CG2-CG1 4.04Å; T586-I737 HydrophobicContact CG2-CG2 4.41Å; I605-I737 HydrophobicContact CD1-CD1 3.85Å; M607-I737 WeakPolarHBondContact CE-O 2.99Å; M607-I737 HydrophobicContact SD-CG2 4.21Å; C693-I737 HydrophobicContact CB-CD1 3.8Å; I723-I737 HydrophobicContact CD1-CG2 4.11Å; I723-I737 HydrophobicContact CG1-CG2 3.95Å; I723-I737 HydrophobicContact CG2-CG2 4.05Å; M735-I737 HydrophobicContact CE-CD1 4.02Å; M735-I737 HydrophobicContact CE-CG1 4.06Å; I737-I743 CarbonylContact O-C 3.47Å; I737-I743 WeakPolarHBondContact O-CA 3.25Å; I737-I743 WeakPolarHBondContact O-CG1 3.3Å; I737-A744 PolarHBondContact N-O 3.24Å; I737-A744 PolarHBondContact O-N 3.2Å
738	G	96.4	Very high	93.6	Very high	0 Å²	0	12 Å²	12	0%	0	7%	0.066	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	143.2	171.5	0	0	0	0	0	110.5	I723 T724 A725	I723-G738 WeakPolarHBondContact CA-O 3.49Å; T724-G738 PolarHBondContact N-O 3.06Å; T724-G738 PolarHBondContact OG1-O 2.99Å; A725-G738 PolarHBondContact N-O 3.21Å; A725-G738 PolarHBondContact O-N 3.26Å
739	S	94.1	Very high	93.4	Very high	0 Å²	0	15.6 Å²	15.6	0%	0	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	-178.4	172.7	75.6	0	0	0	0	111.1	M607 S722 T724 F741 G742 I878	M607-S739 WeakPolarHBondContact CE-OG 3.32Å; S722-S739 VanDerWaalsContact O-CA 3.25Å; S722-S739 WeakPolarHBondContact O-CA 3.3Å; S722-S739 VanDerWaalsContact O-CB 3.31Å; S722-S739 WeakPolarHBondContact O-CB 3.37Å; T724-S739 VanDerWaalsContact OG1-C 3.24Å; T724-S739 WeakPolarHBondContact OG1-CA 3.38Å; T724-S739 PolarHBondContact OG1-O 3.29Å; S739-F741 PolarHBondContact O-N 3.2Å; S739-F741 PolarHBondContact OG-N 2.95Å; S739-G742 PolarHBondContact N-O 2.79Å; S739-G742 PolarHBondContact OG-N 3.4Å; S739-G742 PolarHBondContact OG-O 3.13Å; S739-I878 PolarHBondContact O-N 2.91Å; S739-I878 VanDerWaalsContact O-N 3.13Å
740	E	88.3	Confident	93.2	Very high	75 Å²	75	18.9 Å²	18.9	35%	0.35	10%	0.103	S	C	.	.	S	Bend	trans	-57.9	-29.8	172.1	-66.1	179.6	169.3	0	0	113.6	S722 T724 C875 T877	S722-E740 PolarHBondContact O-N 3.03Å; T724-E740 HydrophobicContact CG2-CG 3.74Å; E740-C875 PolarHBondContact O-SG 3.28Å; E740-T877 HydrophobicContact CG-CG2 4.41Å; E740-T877 WeakPolarHBondContact O-CA 3.27Å; E740-T877 PolarHBondContact O-OG1 3.18Å
741	F	88	Confident	93.1	Very high	72 Å²	72	22.9 Å²	22.9	32%	0.316	12%	0.12	S	C	.	.	S	Bend	trans	-111.9	-13	-173.2	-54.1	-79.9	0	0	0	115	Y609 P721 S739 S758 S759 C875	Y609-F741 HydrophobicContact CD2-CB 3.76Å; Y609-F741 HydrophobicContact CE2-CB 4.34Å; P721-F741 HydrophobicContact CB-CD2 3.62Å; P721-F741 HydrophobicContact CB-CE2 4Å; P721-F741 HydrophobicContact CG-CD2 3.5Å; P721-F741 HydrophobicContact CG-CE2 3.89Å; S739-F741 PolarHBondContact O-N 3.2Å; S739-F741 PolarHBondContact OG-N 2.95Å; F741-S758 WeakPolarHBondContact O-CA 3.32Å; F741-S759 PolarHBondContact O-N 2.82Å; F741-S759 PolarHBondContact O-OG 3.47Å; F741-C875 HydrophobicContact CD1-CB 4.49Å; F741-C875 WeakPolarHBondContact CD1-SG 3.38Å
742	G	90.7	Very high	93	Very high	1 Å²	1	22.4 Å²	22.4	1%	0.01	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	176.4	-162.9	-177.4	0	0	0	0	0	114.6	M607 S739 I757 S759 I878	M607-G742 WeakPolarHBondContact CE-O 3.19Å; S739-G742 PolarHBondContact N-O 2.79Å; S739-G742 PolarHBondContact OG-N 3.4Å; S739-G742 PolarHBondContact OG-O 3.13Å; G742-I757 VanDerWaalsContact CA-O 3.29Å; G742-I757 WeakPolarHBondContact CA-O 3.37Å; G742-S759 WeakPolarHBondContact CA-OG 3.45Å; G742-I878 VanDerWaalsContact O-CG1 3.28Å; G742-I878 WeakPolarHBondContact O-CG1 3.46Å
743	I	94	Very high	93	Very high	1 Å²	1	22.2 Å²	22.2	1%	0.005	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	142.4	-176.8	-168.4	172.1	0	0	0	111.1	A736 I737 I757 L762 I878 I881 L899 I901	A736-I743 HydrophobicContact CB-CD1 4.48Å; I737-I743 CarbonylContact O-C 3.47Å; I737-I743 WeakPolarHBondContact O-CA 3.25Å; I737-I743 WeakPolarHBondContact O-CG1 3.3Å; I743-I757 HydrophobicContact CG2-CG2 3.68Å; I743-I757 PolarHBondContact N-O 3.4Å; I743-I757 PolarHBondContact O-N 3.47Å; I743-L762 HydrophobicContact CG2-CD2 4.31Å; I743-I878 HydrophobicContact CB-CG1 4.31Å; I743-I881 HydrophobicContact CD1-CD1 3.79Å; I743-I881 HydrophobicContact CD1-CG1 4.14Å; I743-I881 HydrophobicContact CD1-CG2 4.5Å; I743-I881 HydrophobicContact CG1-CD1 4.27Å; I743-L899 HydrophobicContact CD1-CD2 4.06Å; I743-I901 HydrophobicContact CD1-CD1 3.62Å; I743-I901 HydrophobicContact CD1-CG1 3.8Å; I743-I901 HydrophobicContact CD1-CG2 4.42Å; I743-I901 HydrophobicContact CG2-CD1 4.26Å
744	A	94.4	Very high	92.8	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	138.3	169.3	0	0	0	0	0	110.6	I605 M607 A736 I737 L755	I605-A744 HydrophobicContact CD1-CB 4.44Å; I605-A744 HydrophobicContact CG2-CB 3.75Å; M607-A744 HydrophobicContact CE-CB 4.17Å; M607-A744 HydrophobicContact SD-CB 4.15Å; A736-A744 CarbonylContact C-O 3.54Å; A736-A744 VanDerWaalsContact CA-O 3.26Å; A736-A744 WeakPolarHBondContact CA-O 3.4Å; I737-A744 PolarHBondContact N-O 3.24Å; I737-A744 PolarHBondContact O-N 3.2Å; A744-L755 CarbonylContact C-O 3.6Å; A744-L755 WeakPolarHBondContact CA-O 3.41Å
745	V	94.4	Very high	92.4	Very high	1 Å²	1	23.2 Å²	23.2	1%	0.006	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	126.6	171.5	-175.9	0	0	0	0	107.5	C753 L754 L755 L899	V745-C753 CarbonylContact O-C 3.2Å; V745-L754 HydrophobicContact CB-CB 4.41Å; V745-L754 HydrophobicContact CG1-CB 4.4Å; V745-L754 HydrophobicContact CG1-CD1 4.03Å; V745-L754 WeakPolarHBondContact O-CA 3.4Å; V745-L754 WeakPolarHBondContact O-CB 3.28Å; V745-L754 PolarHBondContact O-N 2.68Å; V745-L755 HydrophobicContact CB-CB 4.42Å; V745-L755 PolarHBondContact N-O 3.28Å; V745-L755 PolarHBondContact O-N 2.89Å; V745-L899 HydrophobicContact CG2-CD2 3.58Å
746	V	94.9	Very high	92.1	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	128.6	-174	178	0	0	0	0	108.7	L603 I605 L691 L734 M735 Y748	L603-V746 HydrophobicContact CD2-CG1 3.61Å; L603-V746 HydrophobicContact CD2-CG2 4.19Å; I605-V746 HydrophobicContact CD1-CG2 3.55Å; L691-V746 HydrophobicContact CD2-CG1 3.96Å; L734-V746 WeakPolarHBondContact CA-O 3.16Å; M735-V746 HydrophobicContact CG-CB 3.73Å; M735-V746 HydrophobicContact CG-CG1 4.21Å; M735-V746 PolarHBondContact N-O 3.17Å; M735-V746 PolarHBondContact O-N 3.49Å; V746-Y748 PolarHBondContact O-N 2.97Å
747	D	93.1	Very high	91.7	Very high	3 Å²	3	24.3 Å²	24.3	2%	0.016	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82	105.3	162.4	-176.3	-34.8	0	0	0	107.2	L734 V749 H750 K751 F752 L754	L734-D747 HydrophobicContact CD2-CB 4.01Å; D747-V749 VanDerWaalsContact C-N 3.33Å; D747-V749 WeakPolarHBondContact OD1-CA 3.21Å; D747-V749 WeakPolarHBondContact OD1-CB 3.44Å; D747-V749 PolarHBondContact OD1-N 2.9Å; D747-H750 VanDerWaalsContact CG-ND1 3.3Å; D747-H750 IonicContact OD1-CG 2.9Å; D747-H750 PolarHBondContact OD1-N 2.84Å; D747-H750 IonicContact OD1-ND1 2.74Å; D747-H750 PolarHBondContact OD1-ND1 3.36Å; D747-H750 IonicContact OD2-CE1 3.77Å; D747-H750 IonicContact OD2-CG 3.22Å; D747-H750 IonicContact OD2-ND1 3.86Å; D747-H750 PolarHBondContact OD2-ND1 3.01Å; D747-K751 VanDerWaalsContact O-CA 3.23Å; D747-K751 WeakPolarHBondContact O-CA 3.5Å; D747-K751 PolarHBondContact O-N 2.83Å; D747-F752 HydrophobicContact CB-CD1 4.16Å; D747-F752 HydrophobicContact CB-CE1 3.63Å; D747-F752 HydrophobicContact CB-CE2 4.26Å; D747-F752 HydrophobicContact CB-CZ 3.6Å; D747-F752 PolarHBondContact N-O 2.94Å; D747-F752 PolarHBondContact O-N 2.86Å; D747-L754 HydrophobicContact CB-CD1 3.89Å; D747-L754 HydrophobicContact CB-CG 4Å
748	Y	94.4	Very high	91.2	Very high	5 Å²	5	24.7 Å²	24.7	2%	0.02	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.5	-12.5	-177.5	64.8	-108.9	0	0	0	112.7	L588 L690 M728 S729 S730 G733 L734 M735 V746	L588-Y748 HydrophobicContact CD2-CD1 3.79Å; L588-Y748 HydrophobicContact CD2-CD2 3.58Å; L588-Y748 HydrophobicContact CD2-CE1 4.39Å; L588-Y748 HydrophobicContact CD2-CE2 4.24Å; L588-Y748 HydrophobicContact CD2-CG 3.35Å; L690-Y748 HydrophobicContact CD2-CD2 4Å; L690-Y748 HydrophobicContact CD2-CE2 4.42Å; M728-Y748 HydrophobicContact CG-CE1 3.91Å; M728-Y748 HydrophobicContact SD-CE1 4.29Å; S729-Y748 PolarHBondContact O-OH 2.95Å; S730-Y748 VanDerWaalsContact CA-OH 3.27Å; S730-Y748 WeakPolarHBondContact CA-OH 3.13Å; S730-Y748 PolarHBondContact O-OH 3.47Å; G733-Y748 VanDerWaalsContact CA-CZ 3.41Å; G733-Y748 WeakPolarHBondContact CA-OH 3.44Å; G733-Y748 VanDerWaalsContact O-CD1 3.23Å; G733-Y748 WeakPolarHBondContact O-CD1 3.46Å; G733-Y748 WeakPolarHBondContact O-CE1 3.39Å; G733-Y748 PolarHBondContact O-N 3.05Å; L734-Y748 VanDerWaalsContact C-CE1 3.43Å; L734-Y748 WeakPolarHBondContact O-CE1 3.4Å; M735-Y748 HydrophobicContact CB-CD1 4.04Å; M735-Y748 HydrophobicContact CG-CD1 4.04Å; M735-Y748 HydrophobicContact SD-CD1 4.38Å; V746-Y748 PolarHBondContact O-N 2.97Å
749	V	90.9	Very high	90.6	Very high	77 Å²	77	24.8 Å²	24.8	47%	0.467	13%	0.125	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.9	-47.7	175.5	175.8	0	0	0	0	109.2	D747	D747-V749 VanDerWaalsContact C-N 3.33Å; D747-V749 WeakPolarHBondContact OD1-CA 3.21Å; D747-V749 WeakPolarHBondContact OD1-CB 3.44Å; D747-V749 PolarHBondContact OD1-N 2.9Å
750	H	90.5	Very high	90	Very high	71 Å²	71	27.6 Å²	27.6	33%	0.329	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.8	-4.7	178.3	-57.8	107.7	0	0	0	113.4	D747 F752	D747-H750 VanDerWaalsContact CG-ND1 3.3Å; D747-H750 IonicContact OD1-CG 2.9Å; D747-H750 PolarHBondContact OD1-N 2.84Å; D747-H750 IonicContact OD1-ND1 2.74Å; D747-H750 PolarHBondContact OD1-ND1 3.36Å; D747-H750 IonicContact OD2-CE1 3.77Å; D747-H750 IonicContact OD2-CG 3.22Å; D747-H750 IonicContact OD2-ND1 3.86Å; D747-H750 PolarHBondContact OD2-ND1 3.01Å; H750-F752 HydrophobicContact CB-CD1 3.47Å; H750-F752 VanDerWaalsContact CB-CD1 3.47Å; H750-F752 HydrophobicContact CB-CE1 3.36Å
751	K	92.1	Very high	89.6	Confident	90 Å²	90	27.1 Å²	27.1	39%	0.391	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	62	46.4	171.9	-55.1	171.2	178	177.6	0	114.2	S601 L691 D747	S601-K751 WeakPolarHBondContact OG-CE 3.43Å; S601-K751 PolarHBondContact OG-NZ 3.44Å; L691-K751 HydrophobicContact CD1-CB 4.4Å; L691-K751 HydrophobicContact CD1-CG 4.39Å; D747-K751 VanDerWaalsContact O-CA 3.23Å; D747-K751 WeakPolarHBondContact O-CA 3.5Å; D747-K751 PolarHBondContact O-N 2.83Å
752	F	89	Confident	89.1	Confident	40 Å²	40	23.8 Å²	23.8	18%	0.175	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	154.8	176.1	73	-90.3	0	0	0	111.8	D747 H750 L754 P922	D747-F752 HydrophobicContact CB-CD1 4.16Å; D747-F752 HydrophobicContact CB-CE1 3.63Å; D747-F752 HydrophobicContact CB-CE2 4.26Å; D747-F752 HydrophobicContact CB-CZ 3.6Å; D747-F752 PolarHBondContact N-O 2.94Å; D747-F752 PolarHBondContact O-N 2.86Å; H750-F752 HydrophobicContact CB-CD1 3.47Å; H750-F752 VanDerWaalsContact CB-CD1 3.47Å; H750-F752 HydrophobicContact CB-CE1 3.36Å; F752-L754 HydrophobicContact CE2-CB 4.32Å; F752-L754 HydrophobicContact CE2-CD2 3.38Å; F752-L754 HydrophobicContact CE2-CG 3.57Å; F752-L754 HydrophobicContact CZ-CD2 3.52Å; F752-L754 HydrophobicContact CZ-CG 3.89Å; F752-L754 PolarHBondContact O-N 2.99Å; F752-P922 HydrophobicContact CD1-CG 4.42Å; F752-P922 HydrophobicContact CD2-CG 4.39Å; F752-P922 HydrophobicContact CE1-CG 3.5Å; F752-P922 HydrophobicContact CE2-CB 4.3Å; F752-P922 HydrophobicContact CE2-CG 3.5Å; F752-P922 VanDerWaalsContact CE2-CG 3.5Å; F752-P922 HydrophobicContact CZ-CB 3.98Å; F752-P922 HydrophobicContact CZ-CG 3.02Å
753	C	89.9	Confident	88.4	Confident	23 Å²	23	25.9 Å²	25.9	16%	0.155	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	114.9	174.9	-170.6	0	0	0	0	109.7	L603 S659 V745 L755	L603-C753 HydrophobicContact CD2-CB 4.37Å; S659-C753 PolarHBondContact OG-O 2.98Å; V745-C753 CarbonylContact O-C 3.2Å; C753-L755 PolarHBondContact SG-O 2.71Å
754	L	87.1	Confident	87.3	Confident	14 Å²	14	30 Å²	30	7%	0.073	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	-37.2	176.4	-78.7	162.3	0	0	0	112	L734 V745 D747 F752 Q925	L734-L754 HydrophobicContact CD1-CD1 4.33Å; L734-L754 HydrophobicContact CD2-CD1 3.37Å; L734-L754 HydrophobicContact CG-CD1 4.46Å; V745-L754 HydrophobicContact CB-CB 4.41Å; V745-L754 HydrophobicContact CG1-CB 4.4Å; V745-L754 HydrophobicContact CG1-CD1 4.03Å; V745-L754 WeakPolarHBondContact O-CA 3.4Å; V745-L754 WeakPolarHBondContact O-CB 3.28Å; V745-L754 PolarHBondContact O-N 2.68Å; D747-L754 HydrophobicContact CB-CD1 3.89Å; D747-L754 HydrophobicContact CB-CG 4Å; F752-L754 HydrophobicContact CE2-CB 4.32Å; F752-L754 HydrophobicContact CE2-CD2 3.38Å; F752-L754 HydrophobicContact CE2-CG 3.57Å; F752-L754 HydrophobicContact CZ-CD2 3.52Å; F752-L754 HydrophobicContact CZ-CG 3.89Å; F752-L754 PolarHBondContact O-N 2.99Å; L754-Q925 PolarHBondContact O-NE2 3.09Å; L754-Q925 PolarHBondContact O-OE1 3.49Å; L754-Q925 VanDerWaalsContact O-OE1 3.05Å
755	L	87.1	Confident	85.6	Confident	15 Å²	15	35.8 Å²	35.8	8%	0.079	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.6	136.3	-176.4	177.5	67.7	0	0	0	108.4	A744 V745 C753 I757 Y927	A744-L755 CarbonylContact C-O 3.6Å; A744-L755 WeakPolarHBondContact CA-O 3.41Å; V745-L755 HydrophobicContact CB-CB 4.42Å; V745-L755 PolarHBondContact N-O 3.28Å; V745-L755 PolarHBondContact O-N 2.89Å; C753-L755 PolarHBondContact SG-O 2.71Å; L755-I757 HydrophobicContact CD1-CB 4.28Å; L755-I757 HydrophobicContact CD2-CG2 3.95Å; L755-I757 HydrophobicContact CG-CB 4.33Å; L755-I757 HydrophobicContact CG-CG2 4.11Å; L755-Y927 HydrophobicContact CD1-CD1 4.17Å; L755-Y927 HydrophobicContact CD1-CE1 3.52Å; L755-Y927 HydrophobicContact CD2-CD1 3.83Å; L755-Y927 HydrophobicContact CD2-CE1 3.75Å; L755-Y927 HydrophobicContact CD2-CG 4.35Å; L755-Y927 HydrophobicContact CG-CE1 4.29Å
756	S	89.3	Confident	83.5	Confident	20 Å²	20	37.8 Å²	37.8	14%	0.14	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	115.3	163.6	-162.3	0	0	0	0	107	N606 Y609	N606-S756 PolarHBondContact O-OG 2.88Å; Y609-S756 PolarHBondContact OH-OG 2.91Å
757	I	88.3	Confident	81.2	Confident	2 Å²	2	41 Å²	41	1%	0.01	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	139.2	-175.9	-173.9	159.8	0	0	0	112.3	Y609 G742 I743 L755 D761 L762 Y927	Y609-I757 VanDerWaalsContact CE1-C 3.5Å; Y609-I757 WeakPolarHBondContact OH-CA 3.27Å; Y609-I757 PolarHBondContact OH-N 2.92Å; Y609-I757 PolarHBondContact OH-O 2.9Å; Y609-I757 VanDerWaalsContact OH-O 3.05Å; G742-I757 VanDerWaalsContact CA-O 3.29Å; G742-I757 WeakPolarHBondContact CA-O 3.37Å; I743-I757 HydrophobicContact CG2-CG2 3.68Å; I743-I757 PolarHBondContact N-O 3.4Å; I743-I757 PolarHBondContact O-N 3.47Å; L755-I757 HydrophobicContact CD1-CB 4.28Å; L755-I757 HydrophobicContact CD2-CG2 3.95Å; L755-I757 HydrophobicContact CG-CB 4.33Å; L755-I757 HydrophobicContact CG-CG2 4.11Å; I757-D761 HydrophobicContact CD1-CB 3.73Å; I757-D761 HydrophobicContact CG1-CB 3.65Å; I757-L762 HydrophobicContact CG2-CD1 4.3Å; I757-Y927 WeakPolarHBondContact CD1-OH 3.34Å
758	S	88.2	Confident	78.6	Confident	9 Å²	9	46.6 Å²	46.6	6%	0.063	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	147.2	174.1	78.4	0	0	0	0	110.8	Y609 F741 S760 D761 L762	Y609-S758 VanDerWaalsContact CZ-N 3.33Å; F741-S758 WeakPolarHBondContact O-CA 3.32Å; S758-S760 PolarHBondContact O-N 3.12Å; S758-D761 PolarHBondContact O-N 2.72Å; S758-D761 VanDerWaalsContact OG-CB 3.31Å; S758-D761 WeakPolarHBondContact OG-CB 3.37Å; S758-D761 PolarHBondContact OG-N 2.85Å; S758-D761 PolarHBondContact OG-OD2 2.82Å; S758-L762 WeakPolarHBondContact O-CB 3.31Å; S758-L762 PolarHBondContact O-N 2.88Å
759	S	85.1	Confident	75.4	Confident	2 Å²	2	53.3 Å²	53.3	1%	0.014	30%	0.298	C	S	.	.	H	α-helix	trans	-59.4	-33.1	174.5	-63.6	0	0	0	0	111.8	F741 G742 L762 L763 E876	F741-S759 PolarHBondContact O-N 2.82Å; F741-S759 PolarHBondContact O-OG 3.47Å; G742-S759 WeakPolarHBondContact CA-OG 3.45Å; S759-L762 PolarHBondContact O-N 2.88Å; S759-L763 WeakPolarHBondContact O-CD1 3.33Å; S759-L763 VanDerWaalsContact O-CG 3.23Å; S759-L763 WeakPolarHBondContact O-CG 3.36Å; S759-L763 PolarHBondContact O-N 2.79Å; S759-L763 VanDerWaalsContact O-N 3.12Å; S759-E876 WeakPolarHBondContact CB-O 3.28Å; S759-E876 PolarHBondContact OG-O 3.37Å
760	S	80.3	Confident	72.2	Confident	59 Å²	59	55.3 Å²	55.3	41%	0.413	31%	0.306	S	S	.	.	H	α-helix	trans	-63.9	-44.9	175.9	-58.5	0	0	0	0	112.5	S758 L762 L763 S764	S758-S760 PolarHBondContact O-N 3.12Å; S760-L762 VanDerWaalsContact C-N 3.33Å; S760-L763 PolarHBondContact O-N 2.86Å; S760-S764 WeakPolarHBondContact O-CB 3.08Å; S760-S764 PolarHBondContact O-N 3.34Å; S760-S764 PolarHBondContact O-OG 3.2Å
761	D	79.2	Confident	69	Low	64 Å²	64	58.3 Å²	58.3	34%	0.342	33%	0.329	S	S	.	.	H	α-helix	trans	-70.4	-33.2	177.7	-66.6	-35.5	0	0	0	112.2	I757 S758 L763 S764 R765	I757-D761 HydrophobicContact CD1-CB 3.73Å; I757-D761 HydrophobicContact CG1-CB 3.65Å; S758-D761 PolarHBondContact O-N 2.72Å; S758-D761 VanDerWaalsContact OG-CB 3.31Å; S758-D761 WeakPolarHBondContact OG-CB 3.37Å; S758-D761 PolarHBondContact OG-N 2.85Å; S758-D761 PolarHBondContact OG-OD2 2.82Å; D761-L763 VanDerWaalsContact C-N 3.27Å; D761-L763 PolarHBondContact O-N 2.93Å; D761-S764 WeakPolarHBondContact CA-OG 3.28Å; D761-S764 PolarHBondContact O-OG 2.92Å; D761-R765 WeakPolarHBondContact O-CG 3.08Å; D761-R765 PolarHBondContact O-N 3.17Å
762	L	78.3	Confident	65.8	Low	2 Å²	2	57.7 Å²	57.7	1%	0.01	35%	0.348	C	S	.	.	H	α-helix	trans	-64.7	-34	175.8	-170.2	65.3	0	0	0	111.5	I743 I757 S758 S759 S760 I901 L909 L911 I929	I743-L762 HydrophobicContact CG2-CD2 4.31Å; I757-L762 HydrophobicContact CG2-CD1 4.3Å; S758-L762 WeakPolarHBondContact O-CB 3.31Å; S758-L762 PolarHBondContact O-N 2.88Å; S759-L762 PolarHBondContact O-N 2.88Å; S760-L762 VanDerWaalsContact C-N 3.33Å; L762-I901 HydrophobicContact CD2-CD1 3.94Å; L762-L909 HydrophobicContact CD2-CD1 3.58Å; L762-L909 HydrophobicContact CG-CD1 3.77Å; L762-L909 HydrophobicContact CG-CD2 4.49Å; L762-L911 HydrophobicContact CD1-CD1 4.15Å; L762-L911 HydrophobicContact CD1-CD2 3.98Å; L762-I929 WeakPolarHBondContact O-CD1 3.44Å
763	L	75.8	Confident	62.7	Low	45 Å²	45	61 Å²	61	24%	0.236	38%	0.376	C	S	.	.	H	α-helix	trans	-89.6	-30.4	-179	-67.9	165.1	0	0	0	113.7	S759 S760 D761 R765 E876 C907 L909	S759-L763 WeakPolarHBondContact O-CD1 3.33Å; S759-L763 VanDerWaalsContact O-CG 3.23Å; S759-L763 WeakPolarHBondContact O-CG 3.36Å; S759-L763 PolarHBondContact O-N 2.79Å; S759-L763 VanDerWaalsContact O-N 3.12Å; S760-L763 PolarHBondContact O-N 2.86Å; D761-L763 VanDerWaalsContact C-N 3.27Å; D761-L763 PolarHBondContact O-N 2.93Å; L763-R765 VanDerWaalsContact C-N 3.28Å; L763-R765 PolarHBondContact O-N 3.09Å; L763-E876 HydrophobicContact CD1-CB 4.14Å; L763-E876 HydrophobicContact CD1-CG 3.87Å; L763-E876 WeakPolarHBondContact CD1-OE2 3.46Å; L763-C907 HydrophobicContact CD2-CB 3.98Å; L763-C907 VanDerWaalsContact CD2-SG 3.56Å; L763-L909 HydrophobicContact CD2-CD1 4.03Å; L763-L909 HydrophobicContact CD2-CD2 4.42Å
764	S	70.6	Confident	59.5	Low	89 Å²	89	65.8 Å²	65.8	62%	0.622	41%	0.41	S	S	*	.	H	α-helix	trans	-70.1	-26.2	179.4	67.8	0	0	0	0	112.8	S760 D761 G766	S760-S764 WeakPolarHBondContact O-CB 3.08Å; S760-S764 PolarHBondContact O-N 3.34Å; S760-S764 PolarHBondContact O-OG 3.2Å; D761-S764 WeakPolarHBondContact CA-OG 3.28Å; D761-S764 PolarHBondContact O-OG 2.92Å; S764-G766 PolarHBondContact O-N 2.8Å; S764-G766 VanDerWaalsContact O-N 3.13Å
765	R	58.8	Low	56.4	Low	120 Å²	120	69.3 Å²	69.3	45%	0.453	44%	0.441	S	S	.	.	S	Bend	trans	-80.5	82.3	172.9	-69.2	-179	166.7	170.2	4.4	109.9	S656 D761 L763 Y927 I929	S656-R765 PolarHBondContact OG-NH2 3.32Å; D761-R765 WeakPolarHBondContact O-CG 3.08Å; D761-R765 PolarHBondContact O-N 3.17Å; L763-R765 VanDerWaalsContact C-N 3.28Å; L763-R765 PolarHBondContact O-N 3.09Å; R765-Y927 PolarHBondContact NH1-OH 3.06Å; R765-I929 HydrophobicContact CB-CD1 3.81Å; R765-I929 WeakPolarHBondContact O-CD1 3.46Å
766	G	51.4	Low	53.4	Low	44 Å²	44	75 Å²	75	45%	0.454	48%	0.482	S	S	.	.			trans	-56.8	162.3	172	0	0	0	0	0	113	S764 I768	S764-G766 PolarHBondContact O-N 2.8Å; S764-G766 VanDerWaalsContact O-N 3.13Å; G766-I768 PolarHBondContact O-N 2.78Å
767	P	46.3	Very low	50.1	Low	66 Å²	66	77 Å²	77	43%	0.429	51%	0.505	S	S	.	.			trans	-59.7	131.8	178.2	23.6	-31.7	0	0	0	111.1	N769	P767-N769 PolarHBondContact O-N 3.45Å
768	I	37.6	Very low	46.9	Very low	121 Å²	121	85.6 Å²	85.6	62%	0.621	55%	0.545	S	S	*	.			trans	-79.8	114.8	175	-57.6	173.9	0	0	0	107.8	G766 L770	G766-I768 PolarHBondContact O-N 2.78Å; I768-L770 HydrophobicContact CG2-CD2 4.49Å; I768-L770 HydrophobicContact CG2-CG 4.26Å; I768-L770 PolarHBondContact O-N 3.15Å
769	N	26.9	Very low	43.7	Very low	147 Å²	147	91.4 Å²	91.4	79%	0.786	58%	0.58	S	S	*	*			trans	-62.6	94.5	171.4	-77.6	-25.3	0	0	0	110	P767 T771	P767-N769 PolarHBondContact O-N 3.45Å; N769-T771 VanDerWaalsContact C-N 3.25Å; N769-T771 PolarHBondContact O-N 2.73Å
770	L	24.5	Very low	40.5	Very low	119 Å²	119	99.8 Å²	99.8	62%	0.623	62%	0.616	S	S	*	*			trans	-88.7	55.1	172	-73.6	166.4	0	0	0	110.9	I768	I768-L770 HydrophobicContact CG2-CD2 4.49Å; I768-L770 HydrophobicContact CG2-CG 4.26Å; I768-L770 PolarHBondContact O-N 3.15Å
771	T	23.2	Very low	37.8	Very low	134 Å²	134	106.6 Å²	106.6	82%	0.822	64%	0.639	S	S	*	*			trans	-134.6	94.1	164.1	57.7	0	0	0	0	108.4	N769	N769-T771 VanDerWaalsContact C-N 3.25Å; N769-T771 PolarHBondContact O-N 2.73Å
772	G	24.1	Very low	34.9	Very low	76 Å²	76	109.2 Å²	109.2	78%	0.784	66%	0.661	S	S	*	*			trans	-176.2	47.1	-177.5	0	0	0	0	0	112.6
773	S	24.6	Very low	32.2	Very low	110 Å²	110	117 Å²	117	77%	0.769	70%	0.703	S	S	*	*			trans	-68.2	124.2	150.8	58.5	0	0	0	0	107.4	A775	S773-A775 PolarHBondContact O-N 3.2Å
774	S	22.8	Very low	29.5	Very low	124 Å²	124	123 Å²	123	87%	0.867	73%	0.729	S	S	*	*	S	Bend	trans	-25.9	100.7	162	46.6	0	0	0	0	114.5
775	A	23.1	Very low	27.1	Very low	88 Å²	88	125.4 Å²	125.4	73%	0.727	74%	0.735	S	S	*	*			trans	-157.2	108.4	150.4	0	0	0	0	0	107.5	S773 G777	S773-A775 PolarHBondContact O-N 3.2Å; A775-G777 PolarHBondContact O-N 2.87Å
776	S	22.7	Very low	25.3	Very low	135 Å²	135	127.2 Å²	127.2	94%	0.944	75%	0.754	S	S	*	*			trans	-40.8	109.3	164.2	48.1	0	0	0	0	110.8
777	G	20.6	Very low	23.8	Very low	60 Å²	60	130.1 Å²	130.1	62%	0.619	77%	0.768	S	S	*	*			trans	-169.3	73.6	-178.1	0	0	0	0	0	109.4	A775 V779	A775-G777 PolarHBondContact O-N 2.87Å; G777-V779 PolarHBondContact O-N 2.84Å
778	E	21	Very low	22.5	Very low	183 Å²	183	132.5 Å²	132.5	86%	0.855	79%	0.786	S	S	*	*			trans	-47.3	108	165.4	-94.4	-179.9	135.7	0	0	110.1	K780	E778-K780 PolarHBondContact O-N 3.03Å
779	V	21.1	Very low	21.8	Very low	131 Å²	131	131.6 Å²	131.6	79%	0.794	80%	0.796	S	S	*	*			trans	-87.6	100.8	157.6	178.6	0	0	0	0	106.5	G777 F781	G777-V779 PolarHBondContact O-N 2.84Å; V779-F781 PolarHBondContact O-N 3.19Å
780	K	18.8	Very low	21.5	Very low	178 Å²	178	128.3 Å²	128.3	77%	0.774	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-51.8	123.4	174.8	-69.3	174.7	174.8	177.4	0	111.2	E778	E778-K780 PolarHBondContact O-N 3.03Å
781	F	22.4	Very low	21.4	Very low	202 Å²	202	128.5 Å²	128.5	89%	0.886	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-103.6	127.3	142.1	-88.4	-82.5	0	0	0	107.9	V779 D783	V779-F781 PolarHBondContact O-N 3.19Å; F781-D783 PolarHBondContact O-N 2.95Å
782	C	18.7	Very low	21.4	Very low	119 Å²	119	127.9 Å²	127.9	80%	0.804	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-60.7	120.5	179.1	-68.5	0	0	0	0	110.8
783	D	21.2	Very low	21.3	Very low	166 Å²	166	129.9 Å²	129.9	89%	0.888	81%	0.806	S	S	*	*				-154.3	139.2	115.6	-101.6	-25	0	0	0	111.4	F781	F781-D783 PolarHBondContact O-N 2.95Å
784	Q	19.4	Very low	21.1	Very low	170 Å²	170	131.7 Å²	131.7	79%	0.794	81%	0.807	S	S	*	*			trans	-77	152.4	-178.2	-66.2	177.8	1.4	0	0	110.8
785	N	19.5	Very low	21.1	Very low	140 Å²	140	129.6 Å²	129.6	75%	0.749	80%	0.797	S	S	*	*			trans	75.7	90.1	164.1	-56.8	-20.4	0	0	0	117.2
786	N	21.3	Very low	21	Very low	159 Å²	159	132.4 Å²	132.4	85%	0.85	80%	0.8	S	S	*	*				-173.1	128.8	94.5	-110.1	-21.2	0	0	0	111.4
787	S	19.1	Very low	21	Very low	105 Å²	105	131.1 Å²	131.1	73%	0.734	79%	0.786	S	S	*	*			trans	-61.6	130.7	165.4	47.6	0	0	0	0	111.6
788	S	20.7	Very low	20.9	Very low	116 Å²	116	134.2 Å²	134.2	81%	0.811	80%	0.797	S	S	*	*				151.9	146.1	123.9	57.3	0	0	0	0	114
789	A	22.3	Very low	21	Very low	101 Å²	101	131.6 Å²	131.6	84%	0.835	79%	0.788	S	S	*	*			trans	75.9	105.5	162.4	0	0	0	0	0	118
790	G	21	Very low	21.1	Very low	79 Å²	79	132.5 Å²	132.5	81%	0.814	79%	0.786	S	S	*	*			trans	-70.2	156.8	171.5	0	0	0	0	0	113.8
791	S	22.4	Very low	21.2	Very low	122 Å²	122	130.6 Å²	130.6	85%	0.853	79%	0.785	S	S	*	*			trans	-159	151.1	151.5	-151.1	0	0	0	0	110.2
792	T	21.8	Very low	21.1	Very low	122 Å²	122	128.1 Å²	128.1	75%	0.748	78%	0.781	S	S	*	*			trans	-64	126.9	-159.5	49.1	0	0	0	0	115.4	L794	T792-L794 PolarHBondContact O-N 2.66Å
793	S	22.5	Very low	21.2	Very low	117 Å²	117	131.6 Å²	131.6	82%	0.818	79%	0.785	S	S	*	*			trans	-77.6	101.7	169.2	65.7	0	0	0	0	111.1	A795	S793-A795 PolarHBondContact O-N 3.27Å
794	L	21	Very low	21.2	Very low	149 Å²	149	130.6 Å²	130.6	78%	0.78	79%	0.785	S	S	*	*			trans	-79.2	86.3	161.6	-83.3	153.7	0	0	0	108.8	T792 N796	T792-L794 PolarHBondContact O-N 2.66Å; L794-N796 PolarHBondContact O-N 3.43Å
795	A	22.6	Very low	21.4	Very low	80 Å²	80	127.1 Å²	127.1	66%	0.661	79%	0.786	S	S	*	*			trans	-88	88.6	165.4	0	0	0	0	0	108.7	S793 T797	S793-A795 PolarHBondContact O-N 3.27Å; A795-T797 VanDerWaalsContact C-N 3.27Å; A795-T797 PolarHBondContact O-N 3.15Å
796	N	20.7	Very low	21.4	Very low	147 Å²	147	128.8 Å²	128.8	79%	0.786	79%	0.791	S	S	*	*			trans	-71.7	84.3	169	-77.3	-16	0	0	0	109.4	L794	L794-N796 PolarHBondContact O-N 3.43Å
797	T	22.6	Very low	21.3	Very low	107 Å²	107	129.9 Å²	129.9	66%	0.656	79%	0.788	S	S	*	*			trans	-89.3	112.1	164.7	-53.4	0	0	0	0	107.4	A795 I799	A795-T797 VanDerWaalsContact C-N 3.27Å; A795-T797 PolarHBondContact O-N 3.15Å; T797-I799 VanDerWaalsContact C-N 3.32Å; T797-I799 HydrophobicContact CG2-CG1 4.19Å; T797-I799 PolarHBondContact O-N 3.39Å
798	C	19.9	Very low	21.4	Very low	126 Å²	126	131.9 Å²	131.9	85%	0.851	79%	0.791	S	S	*	*			trans	-67	92.6	168.8	-82.1	0	0	0	0	109.1
799	I	22.1	Very low	21.5	Very low	127 Å²	127	133.3 Å²	133.3	65%	0.651	80%	0.795	S	S	*	*			trans	-81.4	110.2	165.5	-59.2	178	0	0	0	106.9	T797 N801	T797-I799 VanDerWaalsContact C-N 3.32Å; T797-I799 HydrophobicContact CG2-CG1 4.19Å; T797-I799 PolarHBondContact O-N 3.39Å; I799-N801 VanDerWaalsContact C-N 3.33Å; I799-N801 WeakPolarHBondContact CG2-OD1 2.93Å; I799-N801 PolarHBondContact O-N 3.48Å
800	I	22.3	Very low	21.5	Very low	150 Å²	150	136.2 Å²	136.2	77%	0.769	79%	0.79	S	S	*	*			trans	-73.8	91.8	167.4	-59.4	173.6	0	0	0	106.7	N802	I800-N802 PolarHBondContact O-N 3.24Å
801	N	20.9	Very low	21.5	Very low	139 Å²	139	136.4 Å²	136.4	74%	0.743	78%	0.779	S	S	*	*			trans	-74.8	102.1	174.6	-91.9	-6.8	0	0	0	110.2	I799 Q803	I799-N801 VanDerWaalsContact C-N 3.33Å; I799-N801 WeakPolarHBondContact CG2-OD1 2.93Å; I799-N801 PolarHBondContact O-N 3.48Å; N801-Q803 PolarHBondContact O-N 3.2Å
802	N	20.6	Very low	21.4	Very low	150 Å²	150	137.9 Å²	137.9	80%	0.802	78%	0.778	S	S	*	*			trans	-81.9	89.2	158.8	-86.2	-13.2	0	0	0	108.8	I800	I800-N802 PolarHBondContact O-N 3.24Å
803	Q	21.2	Very low	21.4	Very low	191 Å²	191	136.4 Å²	136.4	89%	0.893	77%	0.772	S	S	*	*			trans	-165.1	90.4	159.1	-109.1	171.8	51.7	0	0	109.4	N801	N801-Q803 PolarHBondContact O-N 3.2Å
804	T	22.3	Very low	21.4	Very low	145 Å²	145	138.5 Å²	138.5	89%	0.89	77%	0.774	S	S	*	*			trans	-115	142.3	155.2	42.2	0	0	0	0	108.8
805	A	22.3	Very low	21.5	Very low	97 Å²	97	135.6 Å²	135.6	80%	0.802	77%	0.772	S	S	*	*			trans	84.1	80.7	174	0	0	0	0	0	117
806	M	19.5	Very low	21.4	Very low	176 Å²	176	137.6 Å²	137.6	87%	0.867	78%	0.775	S	S	*	*				-164.2	114.7	117	-86.4	-122.2	-92.8	0	0	112
807	K	19.8	Very low	21.4	Very low	181 Å²	181	138.8 Å²	138.8	79%	0.787	78%	0.776	S	S	*	*			trans	37.6	111.5	145.7	-69.3	176.6	175.9	175.7	0	119.3
808	N	21.2	Very low	21.3	Very low	147 Å²	147	138.6 Å²	138.6	79%	0.786	78%	0.78	S	S	*	*				165.1	102.8	111.2	-87.3	-23.4	0	0	0	109.6
809	V	23	Very low	21.4	Very low	147 Å²	147	137.7 Å²	137.7	89%	0.891	77%	0.774	S	S	*	*			trans	-116.7	111.4	155.8	176.5	0	0	0	0	106.8
810	H	22.8	Very low	21.3	Very low	161 Å²	161	140.2 Å²	140.2	75%	0.745	78%	0.783	S	S	*	*			trans	-71.9	125.6	165.4	-105.4	61.2	0	0	0	109.2
811	S	19.6	Very low	21.2	Very low	84 Å²	84	138.1 Å²	138.1	59%	0.587	78%	0.782	S	S	*	*			trans	34.9	113.8	136.6	59.6	0	0	0	0	119
812	N	21.9	Very low	21.2	Very low	152 Å²	152	136.4 Å²	136.4	81%	0.813	78%	0.781	S	S	*	*				-161.7	124.7	114.2	-99.5	-12.2	0	0	0	112.7
813	S	21.7	Very low	21.2	Very low	91 Å²	91	134 Å²	134	64%	0.636	78%	0.776	S	S	*	*			trans	55.1	122.2	142.8	59.8	0	0	0	0	121.9
814	D	21.3	Very low	21.3	Very low	162 Å²	162	131 Å²	131	87%	0.866	77%	0.771	S	S	*	*			trans	69.2	128.7	140.1	-51.2	-22.2	0	0	0	117
815	A	23	Very low	21.3	Very low	88 Å²	88	127.6 Å²	127.6	73%	0.727	77%	0.765	S	S	*	*			cis	-166.5	149.4	19.1	0	0	0	0	0	109.9
816	V	21.1	Very low	21.3	Very low	121 Å²	121	133.1 Å²	133.1	73%	0.733	77%	0.767	S	S	*	*			trans	66.8	117.1	137.2	177.8	0	0	0	0	121.6
817	Q	20.6	Very low	21.4	Very low	172 Å²	172	131.3 Å²	131.3	80%	0.804	77%	0.766	S	S	*	*			trans	78.6	114.8	143.6	-85.8	169.7	-19.2	0	0	123.1
818	S	19.8	Very low	21.5	Very low	104 Å²	104	127.6 Å²	127.6	73%	0.727	76%	0.758	S	S	*	*			trans	36.9	133.7	130.4	61.3	0	0	0	0	118.9
819	S	22.2	Very low	21.4	Very low	106 Å²	106	131.5 Å²	131.5	74%	0.741	76%	0.762	S	S	*	*			cis	-173.8	142.7	39.4	43.6	0	0	0	0	110.3
820	E	19.7	Very low	21.4	Very low	180 Å²	180	134.7 Å²	134.7	84%	0.841	76%	0.76	S	S	*	*			trans	31.9	126.2	140.7	-65.7	-179.8	162.5	0	0	123.4
821	S	19.8	Very low	21.3	Very low	106 Å²	106	133 Å²	133	74%	0.741	76%	0.76	S	S	*	*				94.7	127	127.2	74.4	0	0	0	0	122
822	S	22	Very low	21.4	Very low	103 Å²	103	137.4 Å²	137.4	72%	0.72	78%	0.776	S	S	*	*			trans	84.2	109.7	143.2	71.9	0	0	0	0	121.1
823	S	21.3	Very low	21.3	Very low	101 Å²	101	136.4 Å²	136.4	71%	0.706	78%	0.776	S	S	*	*			trans	28.4	118.1	132.3	60.4	0	0	0	0	120
824	T	22.5	Very low	21.2	Very low	126 Å²	126	143.6 Å²	143.6	77%	0.773	79%	0.789	S	S	*	*				174	149.5	118.3	29.6	0	0	0	0	110.3
825	G	21.6	Very low	21.3	Very low	75 Å²	75	140.7 Å²	140.7	77%	0.773	79%	0.788	S	S	*	*			trans	-69.9	150.2	-166.6	0	0	0	0	0	115.6
826	Y	23.2	Very low	21.3	Very low	213 Å²	213	142.6 Å²	142.6	84%	0.835	79%	0.79	S	S	*	*			trans	-124.5	113.9	173	-74.3	-78.1	0	0	0	110.9	T828	Y826-T828 PolarHBondContact O-N 3.31Å
827	T	20.5	Very low	21.3	Very low	137 Å²	137	143.3 Å²	143.3	84%	0.84	80%	0.795	S	S	*	*			trans	-64.1	118.8	168	-54.1	0	0	0	0	110.2	R829	T827-R829 PolarHBondContact O-N 3.05Å
828	T	22	Very low	21.4	Very low	104 Å²	104	141.7 Å²	141.7	64%	0.638	80%	0.797	S	S	*	*			trans	-81.1	107.1	177.9	-44.4	0	0	0	0	110.4	Y826 Y830	Y826-T828 PolarHBondContact O-N 3.31Å; T828-Y830 HydrophobicContact CG2-CD2 4.08Å; T828-Y830 HydrophobicContact CG2-CE2 3.54Å
829	R	20.1	Very low	21.3	Very low	228 Å²	228	146.4 Å²	146.4	86%	0.86	80%	0.804	S	S	*	*			trans	-81.2	125.3	165.5	-65	-173.2	-160.6	156	4.3	109.1	T827	T827-R829 PolarHBondContact O-N 3.05Å
830	Y	23.1	Very low	21.5	Very low	214 Å²	214	146.8 Å²	146.8	84%	0.839	81%	0.807	S	S	*	*			trans	-97.8	116.5	168.4	-76.9	-84.9	0	0	0	109.6	T828	T828-Y830 HydrophobicContact CG2-CD2 4.08Å; T828-Y830 HydrophobicContact CG2-CE2 3.54Å
831	V	20.2	Very low	21.6	Very low	125 Å²	125	147.5 Å²	147.5	76%	0.758	81%	0.81	S	S	*	*			trans	-91.9	113.9	174.4	174.7	0	0	0	0	108.1	T833	V831-T833 PolarHBondContact O-N 3.02Å
832	L	22.1	Very low	21.7	Very low	178 Å²	178	150.7 Å²	150.7	93%	0.932	82%	0.818	S	S	*	*			trans	-74.8	116.1	175.4	-148	84.7	0	0	0	109
833	T	20.2	Very low	21.6	Very low	131 Å²	131	155.3 Å²	155.3	80%	0.804	83%	0.825	S	S	*	*			trans	-93.3	127.3	-177.3	-39.1	0	0	0	0	110.5	V831 A835	V831-T833 PolarHBondContact O-N 3.02Å; T833-A835 PolarHBondContact O-N 3.23Å
834	R	19.4	Very low	21.5	Very low	241 Å²	241	160.5 Å²	160.5	91%	0.909	83%	0.83	S	S	*	*			trans	-71.5	114.2	-178.8	-163.6	177.5	-170.2	171.1	3.2	110.2
835	A	23.1	Very low	21.5	Very low	101 Å²	101	159.4 Å²	159.4	84%	0.835	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-77.8	124.5	174.7	0	0	0	0	0	110.6	T833	T833-A835 PolarHBondContact O-N 3.23Å
836	T	21.9	Very low	21.4	Very low	128 Å²	128	163.8 Å²	163.8	79%	0.785	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-78.7	144.3	-177.6	37.8	0	0	0	0	112.4
837	T	21.4	Very low	21.4	Very low	136 Å²	136	158.8 Å²	158.8	83%	0.834	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-59.2	127	176.1	46.8	0	0	0	0	112.8
838	V	22.4	Very low	21.4	Very low	139 Å²	139	160.4 Å²	160.4	84%	0.842	83%	0.825	S	S	*	*			trans	-111.7	117.2	162.3	-177	0	0	0	0	108.5
839	K	19.7	Very low	21.2	Very low	202 Å²	202	163.8 Å²	163.8	88%	0.878	83%	0.834	S	S	*	*			trans	-71.2	131.6	171.6	-68.3	173.2	175.3	176.6	0	109
840	S	24.5	Very low	21.2	Very low	115 Å²	115	163 Å²	163	80%	0.804	84%	0.836	S	S	*	*			trans	-136.1	130.9	160	57.6	0	0	0	0	110.1
841	E	21.6	Very low	20.9	Very low	194 Å²	194	158.7 Å²	158.7	91%	0.907	84%	0.836	S	S	*	*			trans	-69.5	131.6	-163.3	-63.6	168.7	136.2	0	0	113.9
842	L	22.9	Very low	21	Very low	173 Å²	173	158.4 Å²	158.4	91%	0.906	84%	0.84	S	S	*	*			trans	-96.3	106.7	174.8	-175.9	66	0	0	0	109.9	R844	L842-R844 PolarHBondContact O-N 3.06Å
843	K	20.8	Very low	20.9	Very low	200 Å²	200	157 Å²	157	87%	0.87	83%	0.833	S	S	*	*			trans	-80.5	103.8	168.4	-83.3	-176.6	179.5	175	0	110.9
844	R	19	Very low	21	Very low	211 Å²	211	158.7 Å²	158.7	80%	0.796	84%	0.836	S	S	*	*			trans	-4.5	116.7	146.2	-159.6	178.1	-149	167.1	4.6	117	L842	L842-R844 PolarHBondContact O-N 3.06Å
845	A	22.8	Very low	21.2	Very low	102 Å²	102	152.7 Å²	152.7	84%	0.843	83%	0.831	S	S	*	*			trans	-143.6	122.7	144.5	0	0	0	0	0	109.7
846	K	18.6	Very low	21.2	Very low	167 Å²	167	156.8 Å²	156.8	73%	0.726	83%	0.833	S	S	*	*			trans	-86.5	145.1	175.5	-68.2	172.2	170.1	-178.6	0	108.9
847	S	22	Very low	21.4	Very low	109 Å²	109	160.1 Å²	160.1	76%	0.762	84%	0.837	S	S	*	*				154.9	133.9	121.4	54.4	0	0	0	0	114.9
848	Q	21.4	Very low	21.5	Very low	171 Å²	171	159 Å²	159	80%	0.799	84%	0.835	S	S	*	*			trans	67	108.5	143.4	-88.3	172.4	-46.8	0	0	123.7
849	E	18.2	Very low	21.6	Very low	175 Å²	175	160.5 Å²	160.5	82%	0.818	83%	0.832	S	S	*	*				17	117.8	122.8	-68.1	179.7	139.9	0	0	119.6
850	K	19.1	Very low	22	Very low	211 Å²	211	157.5 Å²	157.5	92%	0.917	83%	0.833	S	S	*	*				-173.5	147	115.5	-108.9	174.6	179.6	176.5	0	113
851	C	18.5	Very low	21.9	Very low	124 Å²	124	154.9 Å²	154.9	84%	0.838	82%	0.824	S	S	*	*			trans	-72.3	139.8	-177.6	-158.7	0	0	0	0	113.3
852	S	21.6	Very low	22	Very low	118 Å²	118	151 Å²	151	83%	0.825	82%	0.819	S	S	*	*			trans	-179	146.3	142.5	35.1	0	0	0	0	112.9
853	D	20.5	Very low	22.1	Very low	149 Å²	149	151 Å²	151	80%	0.797	82%	0.819	S	S	*	*			trans	-59.9	137	-174.4	-57.6	-68.2	0	0	0	115.4
854	L	21.9	Very low	22.2	Very low	167 Å²	167	146.8 Å²	146.8	87%	0.874	81%	0.81	S	S	*	*			trans	164.3	142	130.9	-103.5	98.7	0	0	0	110.3
855	S	24	Very low	22.6	Very low	114 Å²	114	142.1 Å²	142.1	80%	0.797	82%	0.817	S	S	*	*			trans	76.7	92.9	171.3	74.7	0	0	0	0	118.4
856	Q	23.4	Very low	22.5	Very low	188 Å²	188	141.7 Å²	141.7	88%	0.879	81%	0.808	S	S	*	*			trans	-103.4	84	162	-75.5	-176.2	-12.9	0	0	109.8
857	F	24.7	Very low	22.9	Very low	197 Å²	197	139.3 Å²	139.3	86%	0.864	81%	0.812	S	S	*	*			trans	-95.8	106.9	148.1	-89.2	-82.9	0	0	0	106.3	H859	F857-H859 PolarHBondContact O-N 2.75Å; F857-H859 VanDerWaalsContact O-N 3.17Å
858	S	24.6	Very low	23.1	Very low	112 Å²	112	140 Å²	140	78%	0.783	82%	0.816	S	S	*	*			trans	-79.6	97.9	-174.6	-15.2	0	0	0	0	109.4
859	H	24.8	Very low	23.8	Very low	171 Å²	171	137.5 Å²	137.5	79%	0.792	82%	0.818	S	S	*	*			trans	-68.6	138.4	155.3	-73.2	-67.5	0	0	0	109	F857 G861	F857-H859 PolarHBondContact O-N 2.75Å; F857-H859 VanDerWaalsContact O-N 3.17Å; H859-G861 PolarHBondContact O-N 3.39Å
860	P	26.6	Very low	24.5	Very low	139 Å²	139	136.7 Å²	136.7	90%	0.903	82%	0.819	S	S	*	*	S	Bend	trans	-76.9	92	177.6	30.7	-29.9	0	0	0	108.5
861	G	23.1	Very low	25.1	Very low	60 Å²	60	133.7 Å²	133.7	62%	0.619	81%	0.813	S	S	*	*			trans	-152.4	101.9	177.5	0	0	0	0	0	111	H859	H859-G861 PolarHBondContact O-N 3.39Å
862	S	22.9	Very low	26	Very low	112 Å²	112	135.3 Å²	135.3	78%	0.783	81%	0.813	S	S	*	*			trans	48.1	82.4	151	170.7	0	0	0	0	116.6
863	L	25.2	Very low	27	Very low	174 Å²	174	135.4 Å²	135.4	91%	0.911	80%	0.804	S	S	*	*			trans	-97.5	120.1	149.4	-75.7	172.2	0	0	0	108.5
864	T	23.9	Very low	28.5	Very low	112 Å²	112	133.3 Å²	133.3	69%	0.687	79%	0.792	S	S	*	*			trans	-40.8	128.2	-179.9	46.3	0	0	0	0	113.5	S866	T864-S866 PolarHBondContact O-N 2.63Å; T864-S866 VanDerWaalsContact O-N 3.08Å
865	A	26.2	Very low	30.6	Very low	113 Å²	113	127.5 Å²	127.5	93%	0.934	77%	0.765	S	S	*	*			trans	-57.3	108.1	165.1	0	0	0	0	0	109.7
866	S	21.4	Very low	33.5	Very low	93 Å²	93	122.5 Å²	122.5	65%	0.65	73%	0.729	S	S	*	*			trans	-134.7	116.7	165.9	55.5	0	0	0	0	109.6	T864	T864-S866 PolarHBondContact O-N 2.63Å; T864-S866 VanDerWaalsContact O-N 3.08Å
867	S	26.3	Very low	36.8	Very low	116 Å²	116	115.2 Å²	115.2	81%	0.811	70%	0.698	S	S	*	*	S	Bend	trans	75	119	166.1	57.5	0	0	0	0	120.2
868	S	27.7	Very low	40.2	Very low	123 Å²	123	105.9 Å²	105.9	86%	0.86	66%	0.657	S	S	*	*			trans	80.3	102.2	173.6	68.6	0	0	0	0	116.5
869	S	35.4	Very low	43.6	Very low	120 Å²	120	104.5 Å²	104.5	84%	0.839	64%	0.637	S	S	*	*			trans	-113.5	47.3	-167	52	0	0	0	0	112.8
870	L	32	Very low	47	Very low	158 Å²	158	97.6 Å²	97.6	83%	0.827	61%	0.606	S	S	*	*	S	Bend	trans	-137	126.5	169.7	-74	161.2	0	0	0	106.5
871	D	33.2	Very low	50.3	Low	148 Å²	148	91.5 Å²	91.5	79%	0.791	57%	0.566	S	S	*	*			trans	97.4	27.1	172.3	-47	-21.5	0	0	0	119.9	L873	D871-L873 PolarHBondContact O-N 3.26Å
872	N	36.5	Very low	53.8	Low	158 Å²	158	90 Å²	90	85%	0.845	54%	0.544	S	S	*	.			trans	-80.7	59	165.1	-88	-21.1	0	0	0	112.3	N874	N872-N874 PolarHBondContact O-N 3.07Å; N872-N874 VanDerWaalsContact O-N 3.1Å
873	L	42.2	Very low	57.3	Low	120 Å²	120	84.7 Å²	84.7	63%	0.628	51%	0.507	S	S	*	.			trans	-69	101.3	159.5	-79.2	153.5	0	0	0	107.3	D871 C875	D871-L873 PolarHBondContact O-N 3.26Å; L873-C875 PolarHBondContact O-N 2.62Å
874	N	53.5	Low	60.4	Low	104 Å²	104	76.7 Å²	76.7	56%	0.556	47%	0.465	S	S	*	.			trans	-69	19.8	-178.9	-93.1	-25.8	0	0	0	114.5	N872	N872-N874 PolarHBondContact O-N 3.07Å; N872-N874 VanDerWaalsContact O-N 3.1Å
875	C	65.7	Low	63.3	Low	46 Å²	46	73.3 Å²	73.3	31%	0.311	44%	0.442	S	S	.	.			trans	-74	127.2	-176.5	-164.7	0	0	0	0	111.8	E740 F741 L873	E740-C875 PolarHBondContact O-SG 3.28Å; F741-C875 HydrophobicContact CD1-CB 4.49Å; F741-C875 WeakPolarHBondContact CD1-SG 3.38Å; L873-C875 PolarHBondContact O-N 2.62Å
876	E	83.8	Confident	65.5	Low	8 Å²	8	68.5 Å²	68.5	4%	0.037	40%	0.399	C	S	.	.			trans	-110	119.9	173.4	-78.7	-162.4	-171.8	0	0	110.3	S759 L763 T903 R905 R934	S759-E876 WeakPolarHBondContact CB-O 3.28Å; S759-E876 PolarHBondContact OG-O 3.37Å; L763-E876 HydrophobicContact CD1-CB 4.14Å; L763-E876 HydrophobicContact CD1-CG 3.87Å; L763-E876 WeakPolarHBondContact CD1-OE2 3.46Å; E876-T903 VanDerWaalsContact OE2-CB 3.28Å; E876-T903 WeakPolarHBondContact OE2-CB 3.32Å; E876-T903 PolarHBondContact OE2-OG1 3.02Å; E876-R905 HydrophobicContact CG-CB 4.05Å; E876-R905 HydrophobicContact CG-CG 3.77Å; E876-R905 VanDerWaalsContact OE1-CB 3.28Å; E876-R905 WeakPolarHBondContact OE1-CB 3.34Å; E876-R905 VanDerWaalsContact OE1-CD 3.31Å; E876-R905 WeakPolarHBondContact OE1-CD 3.24Å; E876-R905 IonicContact OE1-NE 2.69Å; E876-R934 IonicContact OE1-CZ 3.87Å; E876-R934 IonicContact OE1-NH1 3.48Å; E876-R934 PolarHBondContact OE1-NH1 3.13Å; E876-R934 IonicContact OE1-NH2 2.71Å; E876-R934 PolarHBondContact OE1-NH2 3.44Å; E876-R934 IonicContact OE2-NH1 3.96Å
877	T	93	Very high	67.6	Low	36 Å²	36	65.4 Å²	65.4	22%	0.221	38%	0.375	C	S	.	.			trans	-76.2	138	176.3	-57.6	0	0	0	0	111.3	T724 E740 K879 T903 S904	T724-T877 HydrophobicContact CG2-CG2 3.68Å; E740-T877 HydrophobicContact CG-CG2 4.41Å; E740-T877 WeakPolarHBondContact O-CA 3.27Å; E740-T877 PolarHBondContact O-OG1 3.18Å; T877-K879 HydrophobicContact CG2-CD 4.25Å; T877-T903 CarbonylContact O-C 3.01Å; T877-T903 VanDerWaalsContact O-CA 3.25Å; T877-T903 WeakPolarHBondContact O-CA 3.4Å; T877-S904 PolarHBondContact N-OG 2.85Å; T877-S904 PolarHBondContact O-N 2.86Å
878	I	95.8	Very high	69.3	Low	0 Å²	0	61.5 Å²	61.5	0%	0	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	125.7	173	-53.7	-54.4	0	0	0	109.5	T724 A725 S739 G742 I743 I881 I901 T903	T724-I878 VanDerWaalsContact CB-O 3.23Å; T724-I878 WeakPolarHBondContact CB-O 3.29Å; T724-I878 PolarHBondContact OG1-O 3.27Å; A725-I878 HydrophobicContact CB-CG2 4.17Å; S739-I878 PolarHBondContact O-N 2.91Å; S739-I878 VanDerWaalsContact O-N 3.13Å; G742-I878 VanDerWaalsContact O-CG1 3.28Å; G742-I878 WeakPolarHBondContact O-CG1 3.46Å; I743-I878 HydrophobicContact CB-CG1 4.31Å; I878-I881 HydrophobicContact CG2-CD1 3.93Å; I878-I881 HydrophobicContact CG2-CG1 3.77Å; I878-I901 HydrophobicContact CD1-CG2 3.78Å; I878-I901 HydrophobicContact CG2-CG2 3.98Å; I878-T903 HydrophobicContact CD1-CG2 4.18Å
879	K	95.8	Very high	70.7	Confident	83 Å²	83	58.8 Å²	58.8	36%	0.361	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	-33.6	-174.4	-63.6	-67.4	-64.7	-142.4	0	113.9	T877 G902 D938 I939	T877-K879 HydrophobicContact CG2-CD 4.25Å; K879-G902 PolarHBondContact N-O 2.81Å; K879-D938 WeakPolarHBondContact CE-OD2 3.18Å; K879-D938 HydrophobicContact CG-CB 4.33Å; K879-D938 IonicContact NZ-OD2 3.99Å; K879-D938 PolarHBondContact NZ-OD2 2.86Å; K879-I939 VanDerWaalsContact CB-O 3.23Å; K879-I939 WeakPolarHBondContact CB-O 3.42Å
880	T	96.5	Very high	71.6	Confident	26 Å²	26	60.9 Å²	60.9	16%	0.16	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149	147	-179.7	-178.4	0	0	0	0	111.1	G902 I939 I942	T880-G902 PolarHBondContact N-O 2.86Å; T880-G902 PolarHBondContact O-N 3.39Å; T880-I939 HydrophobicContact CG2-CB 4.18Å; T880-I939 HydrophobicContact CG2-CG2 3.54Å; T880-I942 HydrophobicContact CG2-CD1 3.71Å; T880-I942 HydrophobicContact CG2-CG1 3.83Å
881	I	97.3	Very high	72.2	Confident	11 Å²	11	62.6 Å²	62.6	6%	0.056	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	129.3	-177.9	-55.7	167.6	0	0	0	109.5	A725 S727 A736 I743 I878 L899 W900	A725-I881 HydrophobicContact CB-CD1 3.82Å; A725-I881 HydrophobicContact CB-CG1 3.98Å; S727-I881 VanDerWaalsContact CB-O 3.27Å; S727-I881 WeakPolarHBondContact CB-O 3.36Å; S727-I881 PolarHBondContact OG-O 3.44Å; A736-I881 HydrophobicContact CB-CD1 4.23Å; A736-I881 HydrophobicContact CB-CG2 3.84Å; I743-I881 HydrophobicContact CD1-CD1 3.79Å; I743-I881 HydrophobicContact CD1-CG1 4.14Å; I743-I881 HydrophobicContact CD1-CG2 4.5Å; I743-I881 HydrophobicContact CG1-CD1 4.27Å; I878-I881 HydrophobicContact CG2-CD1 3.93Å; I878-I881 HydrophobicContact CG2-CG1 3.77Å; I881-L899 HydrophobicContact CG2-CD1 3.3Å; I881-L899 HydrophobicContact CG2-CG 4.11Å; I881-W900 CarbonylContact C-O 3.51Å; I881-W900 VanDerWaalsContact CA-O 3.29Å; I881-W900 WeakPolarHBondContact CA-O 3.27Å
882	L	96.5	Very high	72.8	Confident	28 Å²	28	60.4 Å²	60.4	15%	0.147	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	122.8	178.8	175.5	75.7	0	0	0	111.2	W900 I942 L944 S954	L882-W900 HydrophobicContact CB-CB 4.19Å; L882-W900 PolarHBondContact N-O 2.81Å; L882-W900 PolarHBondContact O-N 3.38Å; L882-I942 HydrophobicContact CD2-CB 4.49Å; L882-I942 HydrophobicContact CD2-CG2 3.93Å; L882-L944 HydrophobicContact CD2-CD1 4.5Å; L882-S954 WeakPolarHBondContact CD1-OG 3.44Å
883	F	95.5	Very high	73.5	Confident	1 Å²	1	57.8 Å²	57.8	0%	0.004	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	137.5	164.9	-75.5	-80	0	0	0	110.8	F732 L734 A736 N898 L899 L913 S954	F732-F883 HydrophobicContact CD2-CD1 4.1Å; L734-F883 HydrophobicContact CB-CE1 3.82Å; L734-F883 HydrophobicContact CB-CZ 3.82Å; L734-F883 HydrophobicContact CD1-CE1 4.12Å; A736-F883 HydrophobicContact CB-CE2 3.84Å; A736-F883 HydrophobicContact CB-CZ 3.87Å; F883-N898 CarbonylContact C-O 3.53Å; F883-N898 WeakPolarHBondContact CA-O 3.5Å; F883-L899 HydrophobicContact CD1-CD1 3.81Å; F883-L899 HydrophobicContact CD2-CD1 4.09Å; F883-L899 HydrophobicContact CE1-CD1 3.68Å; F883-L899 HydrophobicContact CE2-CD1 3.95Å; F883-L899 HydrophobicContact CG-CD1 4.02Å; F883-L899 HydrophobicContact CZ-CD1 3.75Å; F883-L913 HydrophobicContact CE1-CD1 4.03Å; F883-S954 WeakPolarHBondContact O-CB 3.38Å; F883-S954 PolarHBondContact O-OG 3.02Å
884	S	91.4	Very high	74.3	Confident	6 Å²	6	56.8 Å²	56.8	4%	0.042	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.7	173.2	-179.1	63.5	0	0	0	0	112	N898 W900	S884-N898 PolarHBondContact N-O 2.78Å; S884-N898 PolarHBondContact O-N 2.81Å; S884-W900 PolarHBondContact OG-NE1 2.86Å
885	E	83.9	Confident	75	Confident	42 Å²	42	57.5 Å²	57.5	20%	0.196	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	127.3	168.1	-72.4	177.3	165.4	0	0	110.2	F732 F895 P955	F732-E885 HydrophobicContact CE1-CG 4.27Å; F732-E885 HydrophobicContact CZ-CG 3.73Å; E885-F895 HydrophobicContact CB-CB 4.3Å; E885-F895 HydrophobicContact CB-CD1 3.86Å; E885-F895 HydrophobicContact CB-CG 4.44Å; E885-F895 HydrophobicContact CG-CB 4.39Å; E885-P955 HydrophobicContact CG-CG 3.72Å
886	W	71.7	Confident	75.2	Confident	12 Å²	12	56.5 Å²	56.5	5%	0.045	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	136.1	174.3	179.4	-88.6	0	0	0	110.5	V896 N898 W900 L1094 P1095	W886-V896 PolarHBondContact N-O 3.34Å; W886-V896 VanDerWaalsContact N-O 3.08Å; W886-V896 PolarHBondContact O-N 2.84Å; W886-V896 VanDerWaalsContact O-N 3.11Å; W886-N898 HydrophobicContact CB-CB 4.03Å; W886-N898 WeakPolarHBondContact CB-ND2 3.42Å; W886-W900 HydrophobicContact CE3-CH2 4.45Å; W886-W900 AromaticContact CE3-CZ2 3.83Å; W886-W900 HydrophobicContact CE3-CZ2 3.83Å; W886-W900 AromaticContact CZ3-CH2 3.84Å; W886-W900 HydrophobicContact CZ3-CH2 3.84Å; W886-W900 AromaticContact CZ3-CZ2 3.66Å; W886-W900 HydrophobicContact CZ3-CZ2 3.66Å; W886-L1094 HydrophobicContact CE3-CD1 4.06Å; W886-L1094 HydrophobicContact CH2-CB 4.38Å; W886-L1094 HydrophobicContact CH2-CD1 4.35Å; W886-L1094 HydrophobicContact CH2-CD2 3.68Å; W886-L1094 HydrophobicContact CH2-CG 4.35Å; W886-L1094 HydrophobicContact CZ3-CB 4.31Å; W886-L1094 HydrophobicContact CZ3-CD1 3.54Å; W886-L1094 HydrophobicContact CZ3-CD2 3.61Å; W886-L1094 HydrophobicContact CZ3-CG 4.01Å; W886-P1095 HydrophobicContact CZ2-CB 4.13Å
887	I	66.7	Low	75.1	Confident	27 Å²	27	57.4 Å²	57.4	14%	0.138	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	111.5	170.3	-60.3	169.3	0	0	0	107.5	L893 F895 R1078	I887-L893 HydrophobicContact CG2-CD2 3.65Å; I887-F895 HydrophobicContact CD1-CE1 4.06Å; I887-F895 HydrophobicContact CG1-CD1 3.97Å; I887-F895 HydrophobicContact CG1-CE1 3.52Å; I887-F895 HydrophobicContact CG1-CZ 4.35Å; I887-R1078 HydrophobicContact CD1-CB 4.24Å
888	S	62.3	Low	74.8	Confident	34 Å²	34	55.7 Å²	55.7	24%	0.238	27%	0.273	C	S	.	.			trans	-59.3	142.6	174.4	-168.3	0	0	0	0	110.6	R890	S888-R890 PolarHBondContact O-N 2.82Å; S888-R890 PolarHBondContact OG-N 3.46Å
889	P	56.8	Low	74.7	Confident	67 Å²	67	55.7 Å²	55.7	44%	0.435	27%	0.273	S	S	.	.	S	Bend	trans	-66.3	-13	171.8	-12	23.9	0	0	0	113.6	E1075 P1095	P889-E1075 VanDerWaalsContact CB-OE1 3.28Å; P889-E1075 WeakPolarHBondContact CB-OE1 3.3Å; P889-P1095 HydrophobicContact CG-CB 4.11Å
890	R	52.9	Low	74.7	Confident	164 Å²	164	51.8 Å²	51.8	62%	0.619	26%	0.256	S	S	*	.	S	Bend	trans	-75.3	152.2	-177.4	-65.4	-171.7	178.2	-176.3	-1.5	111.5	S888 D892	S888-R890 PolarHBondContact O-N 2.82Å; S888-R890 PolarHBondContact OG-N 3.46Å; R890-D892 CarbonylContact O-C 3.55Å; R890-D892 PolarHBondContact O-N 2.87Å
891	Q	45.8	Very low	74.6	Confident	194 Å²	194	50.5 Å²	50.5	91%	0.907	25%	0.249	S	C	*	.	S	Bend	trans	-49.9	-33	-170.6	-70.6	177.4	-15.1	0	0	114.6	L893	Q891-L893 PolarHBondContact O-N 3.06Å
892	D	46.4	Very low	74.6	Confident	101 Å²	101	50 Å²	50	54%	0.54	25%	0.246	S	C	.	.	S	Bend	trans	-83.5	106	171.8	-56.1	-43.3	0	0	0	109.4	R890 H894	R890-D892 CarbonylContact O-C 3.55Å; R890-D892 PolarHBondContact O-N 2.87Å; D892-H894 WeakPolarHBondContact CB-CD2 3.4Å; D892-H894 WeakPolarHBondContact CB-NE2 3.26Å; D892-H894 PolarHBondContact O-N 2.9Å
893	L	50.8	Low	74.6	Confident	103 Å²	103	48.7 Å²	48.7	54%	0.539	24%	0.239	S	C	.	.			trans	-64	61.7	174.7	-70.7	166.2	0	0	0	111.8	I887 Q891	I887-L893 HydrophobicContact CG2-CD2 3.65Å; Q891-L893 PolarHBondContact O-N 3.06Å
894	H	58.3	Low	74.5	Confident	100 Å²	100	49.9 Å²	49.9	46%	0.463	25%	0.248	S	C	.	.			trans	-88.1	122.4	173.3	-68.1	-60.7	0	0	0	109.5	D892 V896	D892-H894 WeakPolarHBondContact CB-CD2 3.4Å; D892-H894 WeakPolarHBondContact CB-NE2 3.26Å; D892-H894 PolarHBondContact O-N 2.9Å; H894-V896 PolarHBondContact O-N 2.84Å
895	F	67.5	Low	74.4	Confident	118 Å²	118	55.1 Å²	55.1	52%	0.518	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	125.9	167.7	-67	-77.7	0	0	0	109.2	E885 I887	E885-F895 HydrophobicContact CB-CB 4.3Å; E885-F895 HydrophobicContact CB-CD1 3.86Å; E885-F895 HydrophobicContact CB-CG 4.44Å; E885-F895 HydrophobicContact CG-CB 4.39Å; I887-F895 HydrophobicContact CD1-CE1 4.06Å; I887-F895 HydrophobicContact CG1-CD1 3.97Å; I887-F895 HydrophobicContact CG1-CE1 3.52Å; I887-F895 HydrophobicContact CG1-CZ 4.35Å
896	V	71.7	Confident	74.8	Confident	26 Å²	26	53.1 Å²	53.1	16%	0.158	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	133.9	175.6	-175.9	0	0	0	0	108.4	W886 H894 N898 K914	W886-V896 PolarHBondContact N-O 3.34Å; W886-V896 VanDerWaalsContact N-O 3.08Å; W886-V896 PolarHBondContact O-N 2.84Å; W886-V896 VanDerWaalsContact O-N 3.11Å; H894-V896 PolarHBondContact O-N 2.84Å; V896-N898 PolarHBondContact O-N 2.94Å; V896-N898 PolarHBondContact O-ND2 3.44Å; V896-K914 HydrophobicContact CG1-CG 4.45Å
897	P	81.4	Confident	75.9	Confident	27 Å²	27	53 Å²	53	18%	0.175	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.7	125.9	172.2	-24.4	34.1	0	0	0	110.8	F732 L913	F732-P897 HydrophobicContact CD1-CB 4.28Å; F732-P897 HydrophobicContact CD1-CG 4.08Å; F732-P897 HydrophobicContact CD2-CB 3.88Å; F732-P897 HydrophobicContact CE1-CB 4.11Å; F732-P897 HydrophobicContact CE1-CG 3.93Å; F732-P897 HydrophobicContact CE2-CB 3.69Å; F732-P897 HydrophobicContact CE2-CG 4.42Å; F732-P897 HydrophobicContact CG-CB 4.16Å; F732-P897 HydrophobicContact CG-CG 4.38Å; F732-P897 HydrophobicContact CZ-CB 3.79Å; F732-P897 HydrophobicContact CZ-CG 4.08Å; P897-L913 HydrophobicContact CB-CB 4.32Å; P897-L913 WeakPolarHBondContact O-CB 3.19Å; P897-L913 PolarHBondContact O-N 3.28Å
898	N	86.8	Confident	77.2	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	140.1	-177.8	-91.5	-100.5	0	0	0	111.9	F883 S884 W886 V896 L911 N912	F883-N898 CarbonylContact C-O 3.53Å; F883-N898 WeakPolarHBondContact CA-O 3.5Å; S884-N898 PolarHBondContact N-O 2.78Å; S884-N898 PolarHBondContact O-N 2.81Å; W886-N898 HydrophobicContact CB-CB 4.03Å; W886-N898 WeakPolarHBondContact CB-ND2 3.42Å; V896-N898 PolarHBondContact O-N 2.94Å; V896-N898 PolarHBondContact O-ND2 3.44Å; N898-L911 WeakPolarHBondContact CA-O 3.12Å; N898-L911 PolarHBondContact OD1-O 3.18Å; N898-N912 VanDerWaalsContact CG-OD1 3.3Å; N898-N912 PolarHBondContact ND2-OD1 3.26Å; N898-N912 PolarHBondContact OD1-OD1 3.42Å
899	L	92.9	Very high	78.5	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	114.7	177.4	-173.7	65.7	0	0	0	109.6	A736 I743 V745 I881 F883 I901 L911 L913	A736-L899 HydrophobicContact CB-CD1 4.22Å; A736-L899 HydrophobicContact CB-CD2 4.31Å; I743-L899 HydrophobicContact CD1-CD2 4.06Å; V745-L899 HydrophobicContact CG2-CD2 3.58Å; I881-L899 HydrophobicContact CG2-CD1 3.3Å; I881-L899 HydrophobicContact CG2-CG 4.11Å; F883-L899 HydrophobicContact CD1-CD1 3.81Å; F883-L899 HydrophobicContact CD2-CD1 4.09Å; F883-L899 HydrophobicContact CE1-CD1 3.68Å; F883-L899 HydrophobicContact CE2-CD1 3.95Å; F883-L899 HydrophobicContact CG-CD1 4.02Å; F883-L899 HydrophobicContact CZ-CD1 3.75Å; L899-I901 HydrophobicContact CD2-CD1 4.29Å; L899-I901 HydrophobicContact CD2-CG1 4.38Å; L899-I901 HydrophobicContact CG-CD1 4.5Å; L899-I901 HydrophobicContact CG-CG1 4.15Å; L899-L911 HydrophobicContact CB-CB 4.28Å; L899-L911 HydrophobicContact CD2-CD1 4.47Å; L899-L911 PolarHBondContact N-O 3.3Å; L899-L911 PolarHBondContact O-N 2.97Å; L899-L913 HydrophobicContact CB-CD1 4.23Å; L899-L913 HydrophobicContact CB-CG 4.43Å
900	W	94.9	Very high	80	Confident	0 Å²	0	47 Å²	47	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	133.7	173.4	-63.4	89	0	0	0	110.2	I881 L882 S884 W886 V908 L909 A910 Y933 I942 L1081 L1094	I881-W900 CarbonylContact C-O 3.51Å; I881-W900 VanDerWaalsContact CA-O 3.29Å; I881-W900 WeakPolarHBondContact CA-O 3.27Å; L882-W900 HydrophobicContact CB-CB 4.19Å; L882-W900 PolarHBondContact N-O 2.81Å; L882-W900 PolarHBondContact O-N 3.38Å; S884-W900 PolarHBondContact OG-NE1 2.86Å; W886-W900 HydrophobicContact CE3-CH2 4.45Å; W886-W900 AromaticContact CE3-CZ2 3.83Å; W886-W900 HydrophobicContact CE3-CZ2 3.83Å; W886-W900 AromaticContact CZ3-CH2 3.84Å; W886-W900 HydrophobicContact CZ3-CH2 3.84Å; W886-W900 AromaticContact CZ3-CZ2 3.66Å; W886-W900 HydrophobicContact CZ3-CZ2 3.66Å; W900-V908 HydrophobicContact CE3-CG1 3.94Å; W900-V908 HydrophobicContact CZ3-CG1 4.39Å; W900-L909 CarbonylContact C-O 3.24Å; W900-L909 VanDerWaalsContact CA-O 3.32Å; W900-L909 WeakPolarHBondContact CA-O 3.39Å; W900-A910 HydrophobicContact CD2-CB 4.09Å; W900-A910 HydrophobicContact CE3-CB 3.73Å; W900-A910 HydrophobicContact CH2-CB 3.77Å; W900-A910 HydrophobicContact CZ2-CB 4.14Å; W900-A910 HydrophobicContact CZ3-CB 3.57Å; W900-Y933 HydrophobicContact CH2-CE2 4.35Å; W900-Y933 HydrophobicContact CZ3-CD2 4.44Å; W900-Y933 AromaticContact CZ3-CE2 3.88Å; W900-Y933 HydrophobicContact CZ3-CE2 3.88Å; W900-I942 HydrophobicContact CB-CD1 4.13Å; W900-I942 HydrophobicContact CB-CG2 4Å; W900-I942 HydrophobicContact CG-CG2 4.27Å; W900-L1081 HydrophobicContact CD2-CD1 4.15Å; W900-L1081 HydrophobicContact CE3-CD1 4.09Å; W900-L1081 HydrophobicContact CE3-CD2 4.12Å; W900-L1081 HydrophobicContact CH2-CD1 4.11Å; W900-L1081 HydrophobicContact CH2-CD2 3.53Å; W900-L1081 HydrophobicContact CH2-CG 4.38Å; W900-L1081 HydrophobicContact CZ2-CD1 4.15Å; W900-L1081 HydrophobicContact CZ2-CD2 4.35Å; W900-L1081 HydrophobicContact CZ3-CD1 4.06Å; W900-L1081 HydrophobicContact CZ3-CD2 3.37Å; W900-L1081 HydrophobicContact CZ3-CG 4.36Å; W900-L1094 HydrophobicContact CH2-CD1 4.37Å; W900-L1094 HydrophobicContact CZ2-CD1 4.05Å
901	I	95.9	Very high	81.7	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	124.7	-174.5	-55.8	168.1	0	0	0	108.3	I743 L762 I878 L899 V908 L909 L911	I743-I901 HydrophobicContact CD1-CD1 3.62Å; I743-I901 HydrophobicContact CD1-CG1 3.8Å; I743-I901 HydrophobicContact CD1-CG2 4.42Å; I743-I901 HydrophobicContact CG2-CD1 4.26Å; L762-I901 HydrophobicContact CD2-CD1 3.94Å; I878-I901 HydrophobicContact CD1-CG2 3.78Å; I878-I901 HydrophobicContact CG2-CG2 3.98Å; L899-I901 HydrophobicContact CD2-CD1 4.29Å; L899-I901 HydrophobicContact CD2-CG1 4.38Å; L899-I901 HydrophobicContact CG-CD1 4.5Å; L899-I901 HydrophobicContact CG-CG1 4.15Å; I901-V908 CarbonylContact O-C 3.59Å; I901-V908 VanDerWaalsContact O-CA 3.24Å; I901-V908 WeakPolarHBondContact O-CA 3.45Å; I901-L909 HydrophobicContact CB-CB 4.31Å; I901-L909 PolarHBondContact N-O 3Å; I901-L909 PolarHBondContact O-N 2.92Å; I901-L911 HydrophobicContact CD1-CD1 3.59Å; I901-L911 HydrophobicContact CD1-CG 3.98Å
902	G	96.3	Very high	83.4	Confident	0 Å²	0	31.1 Å²	31.1	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	138.6	173.1	0	0	0	0	0	111.7	K879 T880 C907	K879-G902 PolarHBondContact N-O 2.81Å; T880-G902 PolarHBondContact N-O 2.86Å; T880-G902 PolarHBondContact O-N 3.39Å; G902-C907 CarbonylContact C-O 3.46Å; G902-C907 WeakPolarHBondContact CA-O 3.29Å
903	T	95.7	Very high	85.1	Confident	1 Å²	1	27.2 Å²	27.2	1%	0.006	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	166.9	-176.5	76.8	0	0	0	0	113.5	E876 T877 I878 R905 G906 C907 L909 I939	E876-T903 VanDerWaalsContact OE2-CB 3.28Å; E876-T903 WeakPolarHBondContact OE2-CB 3.32Å; E876-T903 PolarHBondContact OE2-OG1 3.02Å; T877-T903 CarbonylContact O-C 3.01Å; T877-T903 VanDerWaalsContact O-CA 3.25Å; T877-T903 WeakPolarHBondContact O-CA 3.4Å; I878-T903 HydrophobicContact CD1-CG2 4.18Å; T903-R905 VanDerWaalsContact C-N 3.28Å; T903-R905 PolarHBondContact O-N 3.31Å; T903-G906 PolarHBondContact O-N 3.27Å; T903-C907 HydrophobicContact CG2-CB 4.09Å; T903-C907 PolarHBondContact N-O 2.94Å; T903-C907 WeakPolarHBondContact OG1-CB 3.37Å; T903-C907 PolarHBondContact OG1-N 3.28Å; T903-C907 VanDerWaalsContact OG1-N 3.13Å; T903-L909 HydrophobicContact CG2-CD1 4.47Å; T903-I939 PolarHBondContact O-N 2.9Å
904	S	94.2	Very high	86	Confident	26 Å²	26	28.3 Å²	28.3	18%	0.182	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65	-25.5	176.7	57.2	0	0	0	0	113.7	T877 G906 D938	T877-S904 PolarHBondContact N-OG 2.85Å; T877-S904 PolarHBondContact O-N 2.86Å; S904-G906 VanDerWaalsContact C-N 3.26Å; S904-G906 PolarHBondContact O-N 3.23Å; S904-D938 WeakPolarHBondContact CA-OD1 3.22Å; S904-D938 WeakPolarHBondContact O-CA 3.01Å; S904-D938 PolarHBondContact O-N 2.93Å
905	R	90.5	Very high	86	Confident	116 Å²	116	26.3 Å²	26.3	44%	0.438	12%	0.122	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.7	9.7	176.5	-60.8	178.6	65.4	178.4	2.2	113.3	E876 T903 R934	E876-R905 HydrophobicContact CG-CB 4.05Å; E876-R905 HydrophobicContact CG-CG 3.77Å; E876-R905 VanDerWaalsContact OE1-CB 3.28Å; E876-R905 WeakPolarHBondContact OE1-CB 3.34Å; E876-R905 VanDerWaalsContact OE1-CD 3.31Å; E876-R905 WeakPolarHBondContact OE1-CD 3.24Å; E876-R905 IonicContact OE1-NE 2.69Å; T903-R905 VanDerWaalsContact C-N 3.28Å; T903-R905 PolarHBondContact O-N 3.31Å; R905-R934 VanDerWaalsContact CB-NH1 3.34Å; R905-R934 VanDerWaalsContact CB-NH2 3.31Å; R905-R934 PolarHBondContact O-NE 2.74Å; R905-R934 VanDerWaalsContact O-NE 3.16Å; R905-R934 PolarHBondContact O-NH1 2.98Å; R905-R934 VanDerWaalsContact O-NH1 3.11Å; R905-R934 PolarHBondContact O-NH2 3.04Å
906	G	92.3	Very high	85	Confident	0 Å²	0	28.8 Å²	28.8	0%	0	13%	0.127	C	C	.	.	S	Bend	trans	83.9	18.9	176.7	0	0	0	0	0	114.3	T903 S904 R934 L935 G937	T903-G906 PolarHBondContact O-N 3.27Å; S904-G906 VanDerWaalsContact C-N 3.26Å; S904-G906 PolarHBondContact O-N 3.23Å; G906-R934 CarbonylContact O-C 3.55Å; G906-R934 WeakPolarHBondContact O-CA 3.32Å; G906-L935 PolarHBondContact O-N 2.85Å; G906-G937 WeakPolarHBondContact CA-O 3.07Å; G906-G937 PolarHBondContact N-O 3.47Å
907	C	92.9	Very high	83.7	Confident	8 Å²	8	29.7 Å²	29.7	5%	0.054	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	139.1	169.8	-92.4	0	0	0	0	110.8	L763 G902 T903 L932 Y933 R934 I939	L763-C907 HydrophobicContact CD2-CB 3.98Å; L763-C907 VanDerWaalsContact CD2-SG 3.56Å; G902-C907 CarbonylContact C-O 3.46Å; G902-C907 WeakPolarHBondContact CA-O 3.29Å; T903-C907 HydrophobicContact CG2-CB 4.09Å; T903-C907 PolarHBondContact N-O 2.94Å; T903-C907 WeakPolarHBondContact OG1-CB 3.37Å; T903-C907 PolarHBondContact OG1-N 3.28Å; T903-C907 VanDerWaalsContact OG1-N 3.13Å; C907-L932 HydrophobicContact CB-CD1 4.35Å; C907-Y933 CarbonylContact C-O 3.56Å; C907-Y933 WeakPolarHBondContact CA-O 3.46Å; C907-R934 VanDerWaalsContact SG-CD 3.52Å; C907-R934 PolarHBondContact SG-NH1 3.46Å; C907-I939 WeakPolarHBondContact O-CG1 3.41Å
908	V	94.2	Very high	81.6	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	119.4	166.8	-178	0	0	0	0	108.8	W900 I901 L932 Y933 L935 I939 I942 L1083	W900-V908 HydrophobicContact CE3-CG1 3.94Å; W900-V908 HydrophobicContact CZ3-CG1 4.39Å; I901-V908 CarbonylContact O-C 3.59Å; I901-V908 VanDerWaalsContact O-CA 3.24Å; I901-V908 WeakPolarHBondContact O-CA 3.45Å; V908-L932 CarbonylContact O-C 3.57Å; V908-L932 WeakPolarHBondContact O-CA 3.41Å; V908-Y933 HydrophobicContact CB-CD2 4.27Å; V908-Y933 HydrophobicContact CG1-CD2 4.33Å; V908-Y933 PolarHBondContact N-O 3.22Å; V908-Y933 PolarHBondContact O-N 3.38Å; V908-L935 HydrophobicContact CG2-CD1 4.44Å; V908-I939 HydrophobicContact CG2-CD1 3.61Å; V908-I939 HydrophobicContact CG2-CG1 3.69Å; V908-I939 HydrophobicContact CG2-CG2 4.1Å; V908-I942 HydrophobicContact CG1-CD1 3.87Å; V908-L1083 HydrophobicContact CB-CD1 4.42Å; V908-L1083 HydrophobicContact CG1-CD1 4.5Å; V908-L1083 HydrophobicContact CG1-CD2 3.93Å; V908-L1083 HydrophobicContact CG2-CD1 4.15Å; V908-L1083 HydrophobicContact CG2-CD2 4.1Å
909	L	91	Very high	79.6	Confident	2 Å²	2	40.5 Å²	40.5	1%	0.01	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	138.3	-178.5	-66.5	141.1	0	0	0	109.7	L762 L763 W900 I901 T903 I929 L932	L762-L909 HydrophobicContact CD2-CD1 3.58Å; L762-L909 HydrophobicContact CG-CD1 3.77Å; L762-L909 HydrophobicContact CG-CD2 4.49Å; L763-L909 HydrophobicContact CD2-CD1 4.03Å; L763-L909 HydrophobicContact CD2-CD2 4.42Å; W900-L909 CarbonylContact C-O 3.24Å; W900-L909 VanDerWaalsContact CA-O 3.32Å; W900-L909 WeakPolarHBondContact CA-O 3.39Å; I901-L909 HydrophobicContact CB-CB 4.31Å; I901-L909 PolarHBondContact N-O 3Å; I901-L909 PolarHBondContact O-N 2.92Å; T903-L909 HydrophobicContact CG2-CD1 4.47Å; L909-I929 HydrophobicContact CD2-CG2 4.2Å; L909-L932 HydrophobicContact CD2-CD1 3.62Å; L909-L932 HydrophobicContact CG-CD1 3.9Å
910	A	88.6	Confident	77.4	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	121	170.1	0	0	0	0	0	110.1	W900 I929 A930 S931	W900-A910 HydrophobicContact CD2-CB 4.09Å; W900-A910 HydrophobicContact CE3-CB 3.73Å; W900-A910 HydrophobicContact CH2-CB 3.77Å; W900-A910 HydrophobicContact CZ2-CB 4.14Å; W900-A910 HydrophobicContact CZ3-CB 3.57Å; A910-I929 WeakPolarHBondContact O-CA 3.24Å; A910-A930 HydrophobicContact CB-CB 4.14Å; A910-A930 PolarHBondContact O-N 3.05Å; A910-S931 PolarHBondContact N-O 3.1Å
911	L	86.7	Confident	75	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	117.1	173.7	-55.4	-175.6	0	0	0	110	L762 N898 L899 I901 L913 Y927 I929	L762-L911 HydrophobicContact CD1-CD1 4.15Å; L762-L911 HydrophobicContact CD1-CD2 3.98Å; N898-L911 WeakPolarHBondContact CA-O 3.12Å; N898-L911 PolarHBondContact OD1-O 3.18Å; L899-L911 HydrophobicContact CB-CB 4.28Å; L899-L911 HydrophobicContact CD2-CD1 4.47Å; L899-L911 PolarHBondContact N-O 3.3Å; L899-L911 PolarHBondContact O-N 2.97Å; I901-L911 HydrophobicContact CD1-CD1 3.59Å; I901-L911 HydrophobicContact CD1-CG 3.98Å; L911-L913 HydrophobicContact CB-CD2 4.38Å; L911-L913 PolarHBondContact O-N 3.17Å; L911-Y927 HydrophobicContact CD2-CD2 3.97Å; L911-I929 HydrophobicContact CD2-CG1 3.53Å
912	N	83.4	Confident	72.7	Confident	26 Å²	26	47.9 Å²	47.9	14%	0.139	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	112.4	164.2	-84.9	-55.8	0	0	0	108.6	N898 K914 Y927 C928 A930	N898-N912 VanDerWaalsContact CG-OD1 3.3Å; N898-N912 PolarHBondContact ND2-OD1 3.26Å; N898-N912 PolarHBondContact OD1-OD1 3.42Å; N912-K914 PolarHBondContact O-N 2.94Å; N912-Y927 WeakPolarHBondContact O-CA 3.38Å; N912-C928 PolarHBondContact N-O 2.66Å; N912-C928 VanDerWaalsContact N-O 3.09Å; N912-C928 PolarHBondContact O-N 2.81Å; N912-A930 WeakPolarHBondContact ND2-CB 3.45Å
913	L	80.8	Confident	70	Confident	19 Å²	19	51.2 Å²	51.2	10%	0.099	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	102.2	177.6	-57.4	176.9	0	0	0	108.9	L734 F883 P897 L899 L911	L734-L913 HydrophobicContact CD1-CD1 3.71Å; F883-L913 HydrophobicContact CE1-CD1 4.03Å; P897-L913 HydrophobicContact CB-CB 4.32Å; P897-L913 WeakPolarHBondContact O-CB 3.19Å; P897-L913 PolarHBondContact O-N 3.28Å; L899-L913 HydrophobicContact CB-CD1 4.23Å; L899-L913 HydrophobicContact CB-CG 4.43Å; L911-L913 HydrophobicContact CB-CD2 4.38Å; L911-L913 PolarHBondContact O-N 3.17Å
914	K	69.1	Low	67.4	Low	125 Å²	125	57.2 Å²	57.2	54%	0.543	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	111	167.1	-62.5	-177.6	179.3	-178.7	0	108.7	V896 N912 S926	V896-K914 HydrophobicContact CG1-CG 4.45Å; N912-K914 PolarHBondContact O-N 2.94Å; K914-S926 WeakPolarHBondContact CB-O 3.31Å; K914-S926 PolarHBondContact N-O 2.88Å; K914-S926 PolarHBondContact O-N 2.96Å; K914-S926 VanDerWaalsContact O-O 3.07Å
915	Y	60.1	Low	65.4	Low	59 Å²	59	58.3 Å²	58.3	23%	0.231	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	141.5	169.4	67	-87.3	0	0	0	109.7	L734 V917	L734-Y915 HydrophobicContact CD1-CE1 4.42Å; Y915-V917 HydrophobicContact CD2-CG2 3.74Å; Y915-V917 HydrophobicContact CE2-CG2 3.66Å
916	R	45.3	Very low	63.5	Low	169 Å²	169	56.2 Å²	56.2	64%	0.638	29%	0.286	S	S	*	.			trans	-103.6	131.7	169	-69.4	-172.1	176.4	-176.4	-1.4	108	P922 I923	R916-P922 CarbonylContact O-C 3.52Å; R916-P922 WeakPolarHBondContact O-CA 3.34Å; R916-I923 PolarHBondContact O-N 3.36Å
917	V	44.9	Very low	62.2	Low	45 Å²	45	58.2 Å²	58.2	27%	0.273	29%	0.294	S	S	.	.			trans	-99.3	117	166.9	-174.6	0	0	0	0	106.7	Y915	Y915-V917 HydrophobicContact CD2-CG2 3.74Å; Y915-V917 HydrophobicContact CE2-CG2 3.66Å
918	L	37.9	Very low	60.6	Low	101 Å²	101	59.5 Å²	59.5	53%	0.529	30%	0.302	S	S	.	.	B	Isolated β-bridge	trans	-123.3	126.1	170.2	-148.3	95.1	0	0	0	107.5	N920 V921 I923	L918-N920 VanDerWaalsContact C-N 3.31Å; L918-N920 PolarHBondContact O-N 2.86Å; L918-V921 PolarHBondContact N-O 2.83Å; L918-V921 PolarHBondContact O-N 3.06Å; L918-I923 HydrophobicContact CB-CD1 3.6Å; L918-I923 HydrophobicContact CB-CG1 4.03Å; L918-I923 HydrophobicContact CD2-CD1 3.86Å; L918-I923 HydrophobicContact CG-CD1 4.37Å
919	N	43.4	Very low	59.2	Low	154 Å²	154	60.1 Å²	60.1	82%	0.824	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.4	47.3	-179.1	-64.3	-12.3	0	0	0	114.1	V921	N919-V921 PolarHBondContact O-N 3.29Å; N919-V921 VanDerWaalsContact O-N 3.13Å
920	N	47.3	Very low	58.1	Low	71 Å²	71	61.1 Å²	61.1	38%	0.38	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.8	16.3	-178.2	-64.7	-4.4	0	0	0	115.3	L918	L918-N920 VanDerWaalsContact C-N 3.31Å; L918-N920 PolarHBondContact O-N 2.86Å
921	V	44.8	Very low	57.4	Low	70 Å²	70	61.2 Å²	61.2	42%	0.424	32%	0.315	S	S	.	.	B	Isolated β-bridge	trans	-122.5	130.1	174.8	-176.9	0	0	0	0	109.3	Y660 L918 N919 I923	Y660-V921 HydrophobicContact CE1-CG1 3.76Å; Y660-V921 VanDerWaalsContact OH-CG1 3.31Å; Y660-V921 WeakPolarHBondContact OH-CG1 3.31Å; L918-V921 PolarHBondContact N-O 2.83Å; L918-V921 PolarHBondContact O-N 3.06Å; N919-V921 PolarHBondContact O-N 3.29Å; N919-V921 VanDerWaalsContact O-N 3.13Å; V921-I923 PolarHBondContact O-N 2.97Å
922	P	47.6	Very low	57.1	Low	14 Å²	14	64.8 Å²	64.8	9%	0.091	33%	0.333	C	S	.	.			trans	-72.7	71.8	-175.3	-11.8	22.7	0	0	0	114.7	Y660 F752 R916 N924	Y660-P922 VanDerWaalsContact CE2-O 3.29Å; Y660-P922 WeakPolarHBondContact CE2-O 3.05Å; Y660-P922 VanDerWaalsContact CZ-O 3.24Å; Y660-P922 WeakPolarHBondContact OH-CA 3.16Å; Y660-P922 WeakPolarHBondContact OH-CD 3.2Å; Y660-P922 VanDerWaalsContact OH-N 3.17Å; Y660-P922 PolarHBondContact OH-O 2.79Å; F752-P922 HydrophobicContact CD1-CG 4.42Å; F752-P922 HydrophobicContact CD2-CG 4.39Å; F752-P922 HydrophobicContact CE1-CG 3.5Å; F752-P922 HydrophobicContact CE2-CB 4.3Å; F752-P922 HydrophobicContact CE2-CG 3.5Å; F752-P922 VanDerWaalsContact CE2-CG 3.5Å; F752-P922 HydrophobicContact CZ-CB 3.98Å; F752-P922 HydrophobicContact CZ-CG 3.02Å; R916-P922 CarbonylContact O-C 3.52Å; R916-P922 WeakPolarHBondContact O-CA 3.34Å; P922-N924 PolarHBondContact O-N 3.5Å; P922-N924 VanDerWaalsContact O-N 3.12Å
923	I	39.6	Very low	57.4	Low	70 Å²	70	64.6 Å²	64.6	36%	0.359	33%	0.331	S	S	.	.			trans	-69.4	117.5	-169.8	-50.6	-177.2	0	0	0	109.7	R916 L918 V921	R916-I923 PolarHBondContact O-N 3.36Å; L918-I923 HydrophobicContact CB-CD1 3.6Å; L918-I923 HydrophobicContact CB-CG1 4.03Å; L918-I923 HydrophobicContact CD2-CD1 3.86Å; L918-I923 HydrophobicContact CG-CD1 4.37Å; V921-I923 PolarHBondContact O-N 2.97Å
924	N	41.9	Very low	57.9	Low	126 Å²	126	68.5 Å²	68.5	67%	0.674	34%	0.344	S	S	*	.			trans	70.9	109.9	179.3	-59.9	-35.7	0	0	0	117.1	P922	P922-N924 PolarHBondContact O-N 3.5Å; P922-N924 VanDerWaalsContact O-N 3.12Å
925	Q	50.8	Low	59.1	Low	50 Å²	50	62.9 Å²	62.9	23%	0.234	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	110.3	171.3	-65.9	161	3.5	0	0	109.3	L754	L754-Q925 PolarHBondContact O-NE2 3.09Å; L754-Q925 PolarHBondContact O-OE1 3.49Å; L754-Q925 VanDerWaalsContact O-OE1 3.05Å
926	S	51.5	Low	60.6	Low	71 Å²	71	68.5 Å²	68.5	50%	0.497	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	110.9	161.9	90.1	0	0	0	0	108	K914	K914-S926 WeakPolarHBondContact CB-O 3.31Å; K914-S926 PolarHBondContact N-O 2.88Å; K914-S926 PolarHBondContact O-N 2.96Å; K914-S926 VanDerWaalsContact O-O 3.07Å
927	Y	63.7	Low	62.8	Low	43 Å²	43	61.6 Å²	61.6	17%	0.169	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	144.2	157.5	60.9	-84.6	0	0	0	107.7	L755 I757 R765 L911 N912	L755-Y927 HydrophobicContact CD1-CD1 4.17Å; L755-Y927 HydrophobicContact CD1-CE1 3.52Å; L755-Y927 HydrophobicContact CD2-CD1 3.83Å; L755-Y927 HydrophobicContact CD2-CE1 3.75Å; L755-Y927 HydrophobicContact CD2-CG 4.35Å; L755-Y927 HydrophobicContact CG-CE1 4.29Å; I757-Y927 WeakPolarHBondContact CD1-OH 3.34Å; R765-Y927 PolarHBondContact NH1-OH 3.06Å; L911-Y927 HydrophobicContact CD2-CD2 3.97Å; N912-Y927 WeakPolarHBondContact O-CA 3.38Å
928	C	60.3	Low	65.3	Low	35 Å²	35	60.9 Å²	60.9	24%	0.236	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	132.1	169.9	-173.1	0	0	0	0	107.5	N912 A930	N912-C928 PolarHBondContact N-O 2.66Å; N912-C928 VanDerWaalsContact N-O 3.09Å; N912-C928 PolarHBondContact O-N 2.81Å; C928-A930 PolarHBondContact O-N 3.48Å; C928-A930 VanDerWaalsContact O-N 3.15Å
929	I	65.2	Low	68.1	Low	12 Å²	12	56.1 Å²	56.1	6%	0.062	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	111.2	167.6	-68.8	161.6	0	0	0	106.4	L762 R765 L909 A910 L911	L762-I929 WeakPolarHBondContact O-CD1 3.44Å; R765-I929 HydrophobicContact CB-CD1 3.81Å; R765-I929 WeakPolarHBondContact O-CD1 3.46Å; L909-I929 HydrophobicContact CD2-CG2 4.2Å; A910-I929 WeakPolarHBondContact O-CA 3.24Å; L911-I929 HydrophobicContact CD2-CG1 3.53Å
930	A	66.4	Low	70.7	Confident	24 Å²	24	50.4 Å²	50.4	20%	0.198	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	-33.7	-173.4	0	0	0	0	0	112	A910 N912 C928 Q1097	A910-A930 HydrophobicContact CB-CB 4.14Å; A910-A930 PolarHBondContact O-N 3.05Å; N912-A930 WeakPolarHBondContact ND2-CB 3.45Å; C928-A930 PolarHBondContact O-N 3.48Å; C928-A930 VanDerWaalsContact O-N 3.15Å; A930-Q1097 PolarHBondContact O-NE2 3.4Å
931	S	73.9	Confident	73.1	Confident	2 Å²	2	48.6 Å²	48.6	1%	0.014	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	146	-176.5	-47.5	0	0	0	0	110.1	A910 Q1097	A910-S931 PolarHBondContact N-O 3.1Å; S931-Q1097 PolarHBondContact OG-NE2 2.95Å
932	L	82.4	Confident	75.6	Confident	74 Å²	74	45.6 Å²	45.6	39%	0.387	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	118.7	172.4	176.2	63.8	0	0	0	109.4	C907 V908 L909	C907-L932 HydrophobicContact CB-CD1 4.35Å; V908-L932 CarbonylContact O-C 3.57Å; V908-L932 WeakPolarHBondContact O-CA 3.41Å; L909-L932 HydrophobicContact CD2-CD1 3.62Å; L909-L932 HydrophobicContact CG-CD1 3.9Å
933	Y	88.4	Confident	78	Confident	23 Å²	23	45.3 Å²	45.3	9%	0.09	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	143.6	173	-52.3	-87.6	0	0	0	110.4	W900 C907 V908 L1081 L1083 V1092	W900-Y933 HydrophobicContact CH2-CE2 4.35Å; W900-Y933 HydrophobicContact CZ3-CD2 4.44Å; W900-Y933 AromaticContact CZ3-CE2 3.88Å; W900-Y933 HydrophobicContact CZ3-CE2 3.88Å; C907-Y933 CarbonylContact C-O 3.56Å; C907-Y933 WeakPolarHBondContact CA-O 3.46Å; V908-Y933 HydrophobicContact CB-CD2 4.27Å; V908-Y933 HydrophobicContact CG1-CD2 4.33Å; V908-Y933 PolarHBondContact N-O 3.22Å; V908-Y933 PolarHBondContact O-N 3.38Å; Y933-L1081 HydrophobicContact CD2-CD2 4.26Å; Y933-L1081 HydrophobicContact CE2-CD2 3.71Å; Y933-L1083 HydrophobicContact CD2-CD1 4.15Å; Y933-L1083 HydrophobicContact CG-CD1 4.03Å; Y933-V1092 HydrophobicContact CD1-CG2 4.4Å; Y933-V1092 HydrophobicContact CE1-CB 4.43Å; Y933-V1092 HydrophobicContact CE1-CG1 3.79Å; Y933-V1092 HydrophobicContact CE1-CG2 4.04Å
934	R	91.3	Very high	80.6	Confident	101 Å²	101	42.2 Å²	42.2	38%	0.381	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	123	172.7	-165.4	68.2	165.8	-172.3	-10.6	111.1	E876 R905 G906 C907 R1090	E876-R934 IonicContact OE1-CZ 3.87Å; E876-R934 IonicContact OE1-NH1 3.48Å; E876-R934 PolarHBondContact OE1-NH1 3.13Å; E876-R934 IonicContact OE1-NH2 2.71Å; E876-R934 PolarHBondContact OE1-NH2 3.44Å; E876-R934 IonicContact OE2-NH1 3.96Å; R905-R934 VanDerWaalsContact CB-NH1 3.34Å; R905-R934 VanDerWaalsContact CB-NH2 3.31Å; R905-R934 PolarHBondContact O-NE 2.74Å; R905-R934 VanDerWaalsContact O-NE 3.16Å; R905-R934 PolarHBondContact O-NH1 2.98Å; R905-R934 VanDerWaalsContact O-NH1 3.11Å; R905-R934 PolarHBondContact O-NH2 3.04Å; G906-R934 CarbonylContact O-C 3.55Å; G906-R934 WeakPolarHBondContact O-CA 3.32Å; C907-R934 VanDerWaalsContact SG-CD 3.52Å; C907-R934 PolarHBondContact SG-NH1 3.46Å; R934-R1090 PolarHBondContact O-NH1 2.81Å; R934-R1090 PolarHBondContact O-NH2 2.91Å
935	L	93.8	Very high	83.1	Confident	6 Å²	6	36.2 Å²	36.2	3%	0.031	18%	0.183	C	C	.	.			trans	-116	166.6	174.8	-74.8	75.2	0	0	0	110.4	G906 V908 I939 L1083 Q1088 R1090	G906-L935 PolarHBondContact O-N 2.85Å; V908-L935 HydrophobicContact CG2-CD1 4.44Å; L935-I939 HydrophobicContact CB-CD1 3.93Å; L935-I939 HydrophobicContact CD1-CD1 4.42Å; L935-I939 HydrophobicContact CD2-CD1 4.29Å; L935-I939 HydrophobicContact CG-CD1 4.43Å; L935-L1083 HydrophobicContact CD1-CD1 4.04Å; L935-L1083 HydrophobicContact CD2-CB 4.03Å; L935-Q1088 HydrophobicContact CB-CG 4.34Å; L935-Q1088 HydrophobicContact CD2-CG 4.27Å; L935-Q1088 HydrophobicContact CG-CG 4.46Å; L935-R1090 HydrophobicContact CD2-CG 4.39Å
936	R	92	Very high	85	Confident	177 Å²	177	35 Å²	35	67%	0.668	18%	0.178	S	C	*	.	S	Bend	trans	-88.7	129.4	173.6	-67.3	-172	179.9	-175.8	1.4	110.4	S1085 K1087	R936-S1085 WeakPolarHBondContact O-CB 3.38Å; R936-S1085 PolarHBondContact O-OG 2.89Å; R936-K1087 HydrophobicContact CB-CB 4.39Å
937	G	92.7	Very high	86.7	Confident	25 Å²	25	36 Å²	36	26%	0.258	18%	0.178	S	C	.	.	S	Bend	trans	79.9	173.3	-179.6	0	0	0	0	0	113.5	G906	G906-G937 WeakPolarHBondContact CA-O 3.07Å; G906-G937 PolarHBondContact N-O 3.47Å
938	D	96	Very high	87.8	Confident	29 Å²	29	37.4 Å²	37.4	16%	0.155	19%	0.191	C	C	.	.			trans	-55.6	140.7	-177.6	-65.5	20	0	0	0	111.3	K879 S904 I940 S1085 E1086	K879-D938 WeakPolarHBondContact CE-OD2 3.18Å; K879-D938 HydrophobicContact CG-CB 4.33Å; K879-D938 IonicContact NZ-OD2 3.99Å; K879-D938 PolarHBondContact NZ-OD2 2.86Å; S904-D938 WeakPolarHBondContact CA-OD1 3.22Å; S904-D938 WeakPolarHBondContact O-CA 3.01Å; S904-D938 PolarHBondContact O-N 2.93Å; D938-I940 HydrophobicContact CB-CD1 4.14Å; D938-I940 PolarHBondContact O-N 3.41Å; D938-S1085 CarbonylContact O-C 3.46Å; D938-S1085 WeakPolarHBondContact O-CA 3.3Å; D938-S1085 WeakPolarHBondContact O-CB 3.32Å; D938-E1086 HydrophobicContact CB-CG 3.79Å; D938-E1086 PolarHBondContact N-OE2 2.64Å; D938-E1086 PolarHBondContact O-N 3.28Å
939	I	97.9	Very high	89.1	Confident	1 Å²	1	36.2 Å²	36.2	1%	0.005	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	120.9	169	-54.9	-56.7	0	0	0	109.1	K879 T880 T903 C907 V908 L935 I942	K879-I939 VanDerWaalsContact CB-O 3.23Å; K879-I939 WeakPolarHBondContact CB-O 3.42Å; T880-I939 HydrophobicContact CG2-CB 4.18Å; T880-I939 HydrophobicContact CG2-CG2 3.54Å; T903-I939 PolarHBondContact O-N 2.9Å; C907-I939 WeakPolarHBondContact O-CG1 3.41Å; V908-I939 HydrophobicContact CG2-CD1 3.61Å; V908-I939 HydrophobicContact CG2-CG1 3.69Å; V908-I939 HydrophobicContact CG2-CG2 4.1Å; L935-I939 HydrophobicContact CB-CD1 3.93Å; L935-I939 HydrophobicContact CD1-CD1 4.42Å; L935-I939 HydrophobicContact CD2-CD1 4.29Å; L935-I939 HydrophobicContact CG-CD1 4.43Å; I939-I942 HydrophobicContact CG2-CD1 4.2Å; I939-I942 HydrophobicContact CG2-CG1 3.92Å
940	I	97.3	Very high	90.3	Very high	34 Å²	34	38.2 Å²	38.2	17%	0.174	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	-36.9	-176	-57.2	-57.3	0	0	0	111.7	D938 C1084 E1086 V1111 A1114	D938-I940 HydrophobicContact CB-CD1 4.14Å; D938-I940 PolarHBondContact O-N 3.41Å; I940-C1084 PolarHBondContact N-O 3.26Å; I940-E1086 HydrophobicContact CD1-CG 3.81Å; I940-E1086 HydrophobicContact CG1-CG 4.02Å; I940-V1111 HydrophobicContact CG2-CG1 4.37Å; I940-A1114 HydrophobicContact CG2-CB 3.99Å
941	H	97.9	Very high	91.6	Very high	34 Å²	34	38.2 Å²	38.2	16%	0.157	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151	142	-175.9	-174.2	-91.4	0	0	0	112.4	S943 C1084 A1114 V1116	H941-S943 VanDerWaalsContact CE1-CB 3.45Å; H941-S943 WeakPolarHBondContact CE1-CB 3.49Å; H941-S943 PolarHBondContact CE1-OG 3.32Å; H941-C1084 HydrophobicContact CB-CB 4.19Å; H941-C1084 PolarHBondContact N-O 3.47Å; H941-C1084 VanDerWaalsContact N-O 3.1Å; H941-C1084 PolarHBondContact O-N 3.35Å; H941-A1114 HydrophobicContact CB-CB 3.77Å; H941-A1114 PolarHBondContact CD2-O 3.27Å; H941-V1116 PolarHBondContact CE1-N 3.42Å
942	I	97.9	Very high	92.4	Very high	6 Å²	6	40.7 Å²	40.7	3%	0.031	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	133.2	173.8	-57.6	173.2	0	0	0	107.3	T880 L882 W900 V908 I939 L1081 L1083	T880-I942 HydrophobicContact CG2-CD1 3.71Å; T880-I942 HydrophobicContact CG2-CG1 3.83Å; L882-I942 HydrophobicContact CD2-CB 4.49Å; L882-I942 HydrophobicContact CD2-CG2 3.93Å; W900-I942 HydrophobicContact CB-CD1 4.13Å; W900-I942 HydrophobicContact CB-CG2 4Å; W900-I942 HydrophobicContact CG-CG2 4.27Å; V908-I942 HydrophobicContact CG1-CD1 3.87Å; I939-I942 HydrophobicContact CG2-CD1 4.2Å; I939-I942 HydrophobicContact CG2-CG1 3.92Å; I942-L1081 HydrophobicContact CG2-CD1 3.79Å; I942-L1083 HydrophobicContact CB-CD2 4.42Å; I942-L1083 HydrophobicContact CG1-CD2 4.03Å; I942-L1083 HydrophobicContact CG2-CD2 3.97Å
943	S	96.7	Very high	92.7	Very high	9 Å²	9	41.8 Å²	41.8	6%	0.063	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	163.3	172.5	53.8	0	0	0	0	111.8	H941 V1082 V1116	H941-S943 VanDerWaalsContact CE1-CB 3.45Å; H941-S943 WeakPolarHBondContact CE1-CB 3.49Å; H941-S943 PolarHBondContact CE1-OG 3.32Å; S943-V1082 PolarHBondContact N-O 3.14Å; S943-V1082 VanDerWaalsContact N-O 3.08Å; S943-V1082 PolarHBondContact O-N 2.96Å; S943-V1116 WeakPolarHBondContact OG-CG2 3.48Å
944	L	95.4	Very high	92.8	Very high	5 Å²	5	42 Å²	42	3%	0.026	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	144.8	177.3	-70.8	159.2	0	0	0	110.6	L882 L952 L1080 L1081 L1094	L882-L944 HydrophobicContact CD2-CD1 4.5Å; L944-L952 HydrophobicContact CB-CB 4.05Å; L944-L952 HydrophobicContact CB-CD1 4.18Å; L944-L952 PolarHBondContact O-N 3.24Å; L944-L1080 CarbonylContact C-O 3.59Å; L944-L1080 VanDerWaalsContact CA-O 3.31Å; L944-L1080 WeakPolarHBondContact CA-O 3.41Å; L944-L1081 HydrophobicContact CD2-CB 4.14Å; L944-L1081 HydrophobicContact CD2-CD1 3.93Å; L944-L1081 HydrophobicContact CG-CD1 4.41Å; L944-L1094 HydrophobicContact CD2-CD1 3.64Å
945	L	94.5	Very high	92.8	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	151.8	167.4	-48.6	174.7	0	0	0	109.6	D950 I951 Q1079 L1080 V1082 V1116 L1147	L945-D950 CarbonylContact C-O 3.53Å; L945-D950 WeakPolarHBondContact CA-O 3.11Å; L945-I951 HydrophobicContact CD2-CB 4.42Å; L945-I951 HydrophobicContact CD2-CG1 4.07Å; L945-Q1079 CarbonylContact O-C 3.59Å; L945-Q1079 VanDerWaalsContact O-CA 3.24Å; L945-Q1079 WeakPolarHBondContact O-CA 3.21Å; L945-L1080 HydrophobicContact CB-CB 4.17Å; L945-L1080 HydrophobicContact CD1-CB 4.5Å; L945-L1080 PolarHBondContact N-O 3.43Å; L945-L1080 PolarHBondContact O-N 3.4Å; L945-V1082 HydrophobicContact CD1-CG2 3.98Å; L945-V1082 HydrophobicContact CG-CG2 4.06Å; L945-V1116 HydrophobicContact CD2-CG1 4.1Å; L945-L1147 HydrophobicContact CD1-CB 4.13Å; L945-L1147 HydrophobicContact CD1-CD1 4.2Å
946	D	90.4	Very high	92.6	Very high	25 Å²	25	39.6 Å²	39.6	13%	0.134	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	-175.6	166.9	69	18	0	0	0	112	T948 G949 D950 L952	D946-T948 VanDerWaalsContact CG-OG1 3.32Å; D946-T948 PolarHBondContact O-N 3.34Å; D946-T948 VanDerWaalsContact OD1-CA 3.31Å; D946-T948 WeakPolarHBondContact OD1-CA 3.19Å; D946-T948 WeakPolarHBondContact OD1-CB 3.1Å; D946-T948 PolarHBondContact OD1-N 2.89Å; D946-T948 PolarHBondContact OD1-OG1 2.75Å; D946-T948 PolarHBondContact OD2-OG1 3.17Å; D946-G949 PolarHBondContact O-N 2.97Å; D946-G949 PolarHBondContact OD1-N 3.49Å; D946-D950 PolarHBondContact N-O 2.64Å; D946-D950 PolarHBondContact OD1-N 3.44Å; D946-L952 HydrophobicContact CB-CD1 4.2Å; D946-L952 HydrophobicContact CB-CD2 4.05Å; D946-L952 HydrophobicContact CB-CG 4.07Å
947	N	86.1	Confident	92.4	Very high	92 Å²	92	35.2 Å²	35.2	49%	0.492	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71	-9	178.7	66.2	-15.4	0	0	0	114.2	I33 R1078	I33-N947 HydrophobicContact CG2-CB 4.14Å; I33-N947 WeakPolarHBondContact CG2-O 3.22Å; N947-R1078 PolarHBondContact N-O 2.82Å; N947-R1078 VanDerWaalsContact N-O 3.17Å
948	T	86.9	Confident	92.1	Very high	72 Å²	72	40.8 Å²	40.8	44%	0.442	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.3	-8	173.6	74.3	0	0	0	0	112.3	D946	D946-T948 VanDerWaalsContact CG-OG1 3.32Å; D946-T948 PolarHBondContact O-N 3.34Å; D946-T948 VanDerWaalsContact OD1-CA 3.31Å; D946-T948 WeakPolarHBondContact OD1-CA 3.19Å; D946-T948 WeakPolarHBondContact OD1-CB 3.1Å; D946-T948 PolarHBondContact OD1-N 2.89Å; D946-T948 PolarHBondContact OD1-OG1 2.75Å; D946-T948 PolarHBondContact OD2-OG1 3.17Å
949	G	88.8	Confident	91.6	Very high	9 Å²	9	42.1 Å²	42.1	9%	0.093	22%	0.222	C	C	.	.	S	Bend	trans	85.1	9.4	-175.3	0	0	0	0	0	114	D946 S1131	D946-G949 PolarHBondContact O-N 2.97Å; D946-G949 PolarHBondContact OD1-N 3.49Å; G949-S1131 VanDerWaalsContact O-CB 3.28Å; G949-S1131 WeakPolarHBondContact O-CB 3.5Å; G949-S1131 PolarHBondContact O-OG 2.66Å
950	D	90.1	Very high	90.5	Very high	54 Å²	54	45.6 Å²	45.6	29%	0.289	24%	0.241	S	C	.	.			trans	-81.2	145.9	174.6	-102.6	-44	0	0	0	111.4	L945 D946 L952 R1118	L945-D950 CarbonylContact C-O 3.53Å; L945-D950 WeakPolarHBondContact CA-O 3.11Å; D946-D950 PolarHBondContact N-O 2.64Å; D946-D950 PolarHBondContact OD1-N 3.44Å; D950-L952 PolarHBondContact O-N 3.02Å; D950-R1118 IonicContact OD1-CZ 2.66Å; D950-R1118 IonicContact OD1-NE 3.87Å; D950-R1118 PolarHBondContact OD1-NE 3.36Å; D950-R1118 VanDerWaalsContact OD1-NE 3.09Å; D950-R1118 IonicContact OD1-NH2 3.46Å; D950-R1118 PolarHBondContact OD1-NH2 2.88Å
951	I	92.3	Very high	88.9	Confident	24 Å²	24	47.5 Å²	47.5	12%	0.123	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	124.3	179.9	-47.3	176.1	0	0	0	109.9	L945 P953 V1116 R1118	L945-I951 HydrophobicContact CD2-CB 4.42Å; L945-I951 HydrophobicContact CD2-CG1 4.07Å; I951-P953 WeakPolarHBondContact O-CD 3.15Å; I951-V1116 HydrophobicContact CD1-CB 4.36Å; I951-V1116 HydrophobicContact CD1-CG1 3.73Å; I951-V1116 HydrophobicContact CG1-CG1 3.82Å; I951-R1118 HydrophobicContact CD1-CG 3.99Å; I951-R1118 HydrophobicContact CG1-CG 4.41Å; I951-R1118 VanDerWaalsContact N-NH2 3.14Å; I951-R1118 PolarHBondContact O-NH2 3.37Å
952	L	91.7	Very high	86.8	Confident	54 Å²	54	48.9 Å²	48.9	28%	0.283	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	111.6	170.5	-71.7	171.8	0	0	0	109.7	L944 D946 D950 Q1079	L944-L952 HydrophobicContact CB-CB 4.05Å; L944-L952 HydrophobicContact CB-CD1 4.18Å; L944-L952 PolarHBondContact O-N 3.24Å; D946-L952 HydrophobicContact CB-CD1 4.2Å; D946-L952 HydrophobicContact CB-CD2 4.05Å; D946-L952 HydrophobicContact CB-CG 4.07Å; D950-L952 PolarHBondContact O-N 3.02Å; L952-Q1079 HydrophobicContact CD1-CG 3.9Å
953	P	89.4	Confident	84.5	Confident	98 Å²	98	55.2 Å²	55.2	64%	0.636	29%	0.289	S	S	*	.	P	Polyproline II helix	trans	-71.5	162.3	177.7	31.5	-35	0	0	0	111.3	I951	I951-P953 WeakPolarHBondContact O-CD 3.15Å
954	S	90	Very high	82	Confident	28 Å²	28	58.8 Å²	58.8	20%	0.196	31%	0.307	C	S	.	.	P	Polyproline II helix	trans	-60.2	138.1	168.1	-72.1	0	0	0	0	110.3	L882 F883 S956	L882-S954 WeakPolarHBondContact CD1-OG 3.44Å; F883-S954 WeakPolarHBondContact O-CB 3.38Å; F883-S954 PolarHBondContact O-OG 3.02Å; S954-S956 PolarHBondContact O-N 3.5Å
955	P	90.1	Very high	79.1	Confident	18 Å²	18	62 Å²	62	12%	0.117	33%	0.33	C	S	.	.	P	Polyproline II helix	trans	-54.8	125.2	-178.8	-30	37.9	0	0	0	112.2	S729 S730 A731 F732 E885	S729-P955 PolarHBondContact OG-O 2.77Å; S730-P955 PolarHBondContact N-O 3.2Å; A731-P955 HydrophobicContact CB-CB 3.75Å; A731-P955 PolarHBondContact N-O 3.15Å; F732-P955 HydrophobicContact CE1-CB 3.99Å; F732-P955 HydrophobicContact CE1-CG 4.17Å; F732-P955 HydrophobicContact CE2-CB 4.19Å; F732-P955 HydrophobicContact CE2-CG 3.84Å; F732-P955 HydrophobicContact CZ-CB 3.81Å; F732-P955 HydrophobicContact CZ-CG 3.51Å; E885-P955 HydrophobicContact CG-CG 3.72Å
956	S	89.9	Confident	76.1	Confident	37 Å²	37	69.8 Å²	69.8	26%	0.259	36%	0.364	S	S	.	.			trans	-127.3	145.6	-174.7	62.1	0	0	0	0	113	D574 S730 S954	D574-S956 WeakPolarHBondContact OD2-CB 3.21Å; D574-S956 PolarHBondContact OD2-OG 3.34Å; S730-S956 WeakPolarHBondContact OG-CA 3.27Å; S730-S956 WeakPolarHBondContact OG-CB 3.28Å; S954-S956 PolarHBondContact O-N 3.5Å
957	E	88.8	Confident	73.2	Confident	85 Å²	85	72.7 Å²	72.7	40%	0.397	40%	0.4	S	S	.	.	P	Polyproline II helix	trans	-88.5	139.4	167.5	-178.8	-170	-164	0	0	109.1	D574 S575 K577 S730	D574-E957 CarbonylContact C-O 3.52Å; S575-E957 VanDerWaalsContact CA-O 3.28Å; S575-E957 WeakPolarHBondContact CA-O 3.18Å; S575-E957 WeakPolarHBondContact CB-O 3.06Å; S575-E957 PolarHBondContact N-O 3.37Å; K577-E957 IonicContact NZ-OE2 3.19Å; K577-E957 PolarHBondContact NZ-OE2 3.08Å; S730-E957 PolarHBondContact OG-N 2.85Å
958	R	86.6	Confident	70.4	Confident	142 Å²	142	69.5 Å²	69.5	54%	0.536	39%	0.388	S	S	.	.	P	Polyproline II helix	trans	-75.1	138.8	172.5	-73.8	-176.9	171.9	168.4	-5.8	111.1	D960 T1029	R958-D960 PolarHBondContact O-N 3.39Å; R958-T1029 PolarHBondContact NE-OG1 2.97Å; R958-T1029 PolarHBondContact NH2-OG1 2.59Å
959	W	83.9	Confident	67.7	Low	58 Å²	58	71 Å²	71	22%	0.22	40%	0.398	C	S	.	.	P	Polyproline II helix	trans	-65.4	130.9	175.3	-178.9	79.8	0	0	0	111.1	D574 R576 F591 D961	D574-W959 WeakPolarHBondContact O-CB 3.48Å; D574-W959 PolarHBondContact O-N 2.97Å; R576-W959 HydrophobicContact CG-CB 4.19Å; R576-W959 HydrophobicContact CG-CG 4.03Å; R576-W959 VanDerWaalsContact NH1-CZ2 3.28Å; F591-W959 HydrophobicContact CD1-CZ2 4.48Å; F591-W959 PolarHBondContact O-NE1 2.85Å; W959-D961 HydrophobicContact CH2-CB 4.32Å; W959-D961 WeakPolarHBondContact CH2-OD1 3.12Å; W959-D961 VanDerWaalsContact CH2-OD2 3.26Å; W959-D961 WeakPolarHBondContact CH2-OD2 3.43Å; W959-D961 WeakPolarHBondContact CZ2-OD1 3.43Å
960	D	76.7	Confident	65	Low	73 Å²	73	74.9 Å²	74.9	39%	0.39	43%	0.429	S	S	.	.			trans	-133.6	123.4	177.8	-179.3	9	0	0	0	110.7	R958 S962 Y963	R958-D960 PolarHBondContact O-N 3.39Å; D960-S962 VanDerWaalsContact CG-OG 3.23Å; D960-S962 PolarHBondContact O-N 2.61Å; D960-S962 WeakPolarHBondContact OD1-CB 3.43Å; D960-S962 PolarHBondContact OD1-N 3.03Å; D960-S962 PolarHBondContact OD1-OG 3.37Å; D960-S962 PolarHBondContact OD2-OG 3.49Å; D960-Y963 HydrophobicContact CB-CD2 3.83Å; D960-Y963 HydrophobicContact CB-CE2 4.13Å; D960-Y963 WeakPolarHBondContact OD2-CD2 3.47Å; D960-Y963 VanDerWaalsContact OD2-CE2 3.22Å; D960-Y963 WeakPolarHBondContact OD2-CE2 3.21Å
961	D	63.7	Low	62.2	Low	75 Å²	75	75.9 Å²	75.9	40%	0.401	44%	0.44	S	S	.	.	G	3₁₀ helix	trans	-66	-20.8	175.4	-100.1	-26.5	0	0	0	112.2	R593 W959	R593-D961 IonicContact NH1-OD2 3.79Å; R593-D961 PolarHBondContact NH1-OD2 3.01Å; W959-D961 HydrophobicContact CH2-CB 4.32Å; W959-D961 WeakPolarHBondContact CH2-OD1 3.12Å; W959-D961 VanDerWaalsContact CH2-OD2 3.26Å; W959-D961 WeakPolarHBondContact CH2-OD2 3.43Å; W959-D961 WeakPolarHBondContact CZ2-OD1 3.43Å
962	S	53.9	Low	59.2	Low	63 Å²	63	80.7 Å²	80.7	44%	0.441	46%	0.462	S	S	.	.	G	3₁₀ helix	trans	-77.5	-27.9	-166.9	88.5	0	0	0	0	114.9	D960 I964 S965	D960-S962 VanDerWaalsContact CG-OG 3.23Å; D960-S962 PolarHBondContact O-N 2.61Å; D960-S962 WeakPolarHBondContact OD1-CB 3.43Å; D960-S962 PolarHBondContact OD1-N 3.03Å; D960-S962 PolarHBondContact OD1-OG 3.37Å; D960-S962 PolarHBondContact OD2-OG 3.49Å; S962-I964 PolarHBondContact O-N 3.27Å; S962-I964 VanDerWaalsContact O-N 3.15Å; S962-S965 WeakPolarHBondContact O-CB 3.33Å; S962-S965 PolarHBondContact O-N 2.82Å; S962-S965 VanDerWaalsContact O-N 3.09Å; S962-S965 PolarHBondContact O-OG 3.23Å
963	Y	48.2	Very low	56.4	Low	138 Å²	138	83.8 Å²	83.8	54%	0.541	48%	0.478	S	S	.	.	G	3₁₀ helix	trans	-65.4	-20.4	-171.7	-85.7	-91.5	0	0	0	114.5	D960	D960-Y963 HydrophobicContact CB-CD2 3.83Å; D960-Y963 HydrophobicContact CB-CE2 4.13Å; D960-Y963 WeakPolarHBondContact OD2-CD2 3.47Å; D960-Y963 VanDerWaalsContact OD2-CE2 3.22Å; D960-Y963 WeakPolarHBondContact OD2-CE2 3.21Å
964	I	44.5	Very low	53.7	Low	84 Å²	84	81.5 Å²	81.5	43%	0.431	46%	0.464	S	S	.	.	G	3₁₀ helix	trans	-101.3	2.2	-179.2	-49.4	176.5	0	0	0	111.5	R594 S962 K966	R594-I964 PolarHBondContact NH1-O 2.59Å; S962-I964 PolarHBondContact O-N 3.27Å; S962-I964 VanDerWaalsContact O-N 3.15Å; I964-K966 VanDerWaalsContact C-N 3.32Å; I964-K966 PolarHBondContact O-N 3.04Å
965	S	35.6	Very low	50.9	Low	73 Å²	73	87.3 Å²	87.3	51%	0.51	49%	0.486	S	S	.	.	S	Bend	trans	-72.5	-20.7	179.4	68.2	0	0	0	0	114.4	S962	S962-S965 WeakPolarHBondContact O-CB 3.33Å; S962-S965 PolarHBondContact O-N 2.82Å; S962-S965 VanDerWaalsContact O-N 3.09Å; S962-S965 PolarHBondContact O-OG 3.23Å
966	K	30.6	Very low	47.9	Very low	163 Å²	163	93.4 Å²	93.4	71%	0.709	51%	0.513	S	S	*	.	S	Bend	trans	-97.1	105.9	174	-65.3	-177.8	-178.1	177.3	0	107.9	I964 G968	I964-K966 VanDerWaalsContact C-N 3.32Å; I964-K966 PolarHBondContact O-N 3.04Å; K966-G968 PolarHBondContact O-N 2.82Å
967	G	30.1	Very low	45	Very low	87 Å²	87	94 Å²	94	90%	0.897	52%	0.521	S	S	*	.			trans	-66.5	49.6	173.2	0	0	0	0	0	113.5
968	G	27.1	Very low	42.2	Very low	24 Å²	24	92.5 Å²	92.5	25%	0.247	52%	0.519	C	S	.	.			trans	-72.7	128.9	170.3	0	0	0	0	0	108.8	K966 E972	K966-G968 PolarHBondContact O-N 2.82Å; G968-E972 WeakPolarHBondContact CA-OE2 3.28Å
969	T	29.9	Very low	39.3	Very low	105 Å²	105	92 Å²	92	64%	0.644	53%	0.527	S	S	*	.			trans	-55.4	155.8	173.9	57.8	0	0	0	0	109.8	S971 E972	T969-S971 PolarHBondContact O-N 3.33Å; T969-E972 PolarHBondContact O-N 3.14Å
970	A	32.9	Very low	36.6	Very low	90 Å²	90	95.3 Å²	95.3	74%	0.744	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.1	-17.4	-176.6	0	0	0	0	0	115.6
971	S	31.2	Very low	34.1	Very low	75 Å²	75	94.3 Å²	94.3	52%	0.524	55%	0.546	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.5	-24.1	174.6	179.1	0	0	0	0	115.5	T969 S974	T969-S971 PolarHBondContact O-N 3.33Å; S971-S974 PolarHBondContact O-OG 2.88Å
972	E	28	Very low	32.4	Very low	124 Å²	124	95.5 Å²	95.5	58%	0.579	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.1	-26.2	178.9	-80.6	-174	146.4	0	0	112.6	G968 T969 S974 K975	G968-E972 WeakPolarHBondContact CA-OE2 3.28Å; T969-E972 PolarHBondContact O-N 3.14Å; E972-S974 VanDerWaalsContact C-N 3.25Å; E972-S974 PolarHBondContact O-N 2.66Å; E972-K975 PolarHBondContact O-N 3.46Å; E972-K975 VanDerWaalsContact O-N 3.15Å
973	L	33.7	Very low	31	Very low	120 Å²	120	97.7 Å²	97.7	63%	0.628	58%	0.575	S	S	*	*	G	3₁₀ helix	trans	-61.3	-28.9	177.2	-81.4	145.7	0	0	0	113.4	K975	L973-K975 VanDerWaalsContact C-N 3.34Å; L973-K975 PolarHBondContact O-N 2.79Å
974	S	33.1	Very low	29.8	Very low	49 Å²	49	95.1 Å²	95.1	34%	0.343	58%	0.577	S	S	.	*	G	3₁₀ helix	trans	-78.4	-13.4	178.3	65	0	0	0	0	114.2	S971 E972	S971-S974 PolarHBondContact O-OG 2.88Å; E972-S974 VanDerWaalsContact C-N 3.25Å; E972-S974 PolarHBondContact O-N 2.66Å
975	K	29.7	Very low	28.9	Very low	151 Å²	151	96.9 Å²	96.9	66%	0.657	59%	0.586	S	S	*	*	G	3₁₀ helix	trans	-93.6	-15	-176.2	-71.4	-176.2	-179.8	175.4	0	114.4	E972 L973 S978	E972-K975 PolarHBondContact O-N 3.46Å; E972-K975 VanDerWaalsContact O-N 3.15Å; L973-K975 VanDerWaalsContact C-N 3.34Å; L973-K975 PolarHBondContact O-N 2.79Å; K975-S978 PolarHBondContact O-OG 2.85Å
976	Q	27.6	Very low	28.3	Very low	146 Å²	146	98.8 Å²	98.8	68%	0.682	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.6	-28.4	-174.6	-139.9	157.4	16.4	0	0	113.1	S978	Q976-S978 PolarHBondContact O-N 3.34Å
977	A	29.3	Very low	27.9	Very low	50 Å²	50	96.8 Å²	96.8	41%	0.413	61%	0.605	S	S	.	*	G	3₁₀ helix	trans	-68.1	-24.1	168	0	0	0	0	0	112.6	L979 I980	A977-L979 VanDerWaalsContact C-N 3.28Å; A977-L979 PolarHBondContact O-N 3.08Å; A977-I980 PolarHBondContact O-N 3.1Å
978	S	30	Very low	27.6	Very low	53 Å²	53	101 Å²	101	37%	0.371	60%	0.601	S	S	.	*	G	3₁₀ helix	trans	-71.2	-14.2	-177.5	60.2	0	0	0	0	114.9	K975 Q976	K975-S978 PolarHBondContact O-OG 2.85Å; Q976-S978 PolarHBondContact O-N 3.34Å
979	L	25.8	Very low	27.4	Very low	131 Å²	131	103.4 Å²	103.4	69%	0.686	63%	0.626	S	S	*	*	G	3₁₀ helix	trans	-91.3	-7.8	179.4	-77.7	167.3	0	0	0	114.1	A977	A977-L979 VanDerWaalsContact C-N 3.28Å; A977-L979 PolarHBondContact O-N 3.08Å
980	I	25.8	Very low	27.1	Very low	127 Å²	127	104.5 Å²	104.5	65%	0.651	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106	-12	-178.3	-58.1	178.8	0	0	0	111.9	A977 C982	A977-I980 PolarHBondContact O-N 3.1Å; I980-C982 PolarHBondContact O-N 3.5Å; I980-C982 VanDerWaalsContact O-N 3.13Å
981	S	26	Very low	26.5	Very low	53 Å²	53	105.5 Å²	105.5	37%	0.371	63%	0.634	S	S	.	*	S	Bend	trans	-81.1	91.6	171.1	-56.8	0	0	0	0	111
982	C	26.9	Very low	26.1	Very low	100 Å²	100	108.7 Å²	108.7	68%	0.676	64%	0.644	S	S	*	*			trans	60.9	52.6	157.4	-52	0	0	0	0	117	I980 S984	I980-C982 PolarHBondContact O-N 3.5Å; I980-C982 VanDerWaalsContact O-N 3.13Å; C982-S984 VanDerWaalsContact C-N 3.27Å; C982-S984 PolarHBondContact O-N 2.9Å
983	S	24.9	Very low	25.7	Very low	109 Å²	109	111.1 Å²	111.1	76%	0.762	66%	0.655	S	S	*	*			trans	-89.6	37.6	168.4	73	0	0	0	0	113.9
984	S	22.5	Very low	25.1	Very low	84 Å²	84	110.8 Å²	110.8	59%	0.587	66%	0.658	S	S	*	*			trans	-135.4	61.7	170.4	64.8	0	0	0	0	110.2	C982	C982-S984 VanDerWaalsContact C-N 3.27Å; C982-S984 PolarHBondContact O-N 2.9Å
985	I	26.2	Very low	24.6	Very low	120 Å²	120	115.4 Å²	115.4	62%	0.615	68%	0.679	S	S	*	*			trans	-104	96.5	154.5	-62.2	177.4	0	0	0	105	S987	I985-S987 PolarHBondContact O-N 2.85Å
986	C	22.8	Very low	24.1	Very low	114 Å²	114	112.8 Å²	112.8	77%	0.77	69%	0.685	S	S	*	*			trans	-50.9	120.8	161.9	-66.7	0	0	0	0	107.3	E988	C986-E988 VanDerWaalsContact C-N 3.3Å; C986-E988 PolarHBondContact O-N 3.38Å
987	S	23	Very low	23.8	Very low	121 Å²	121	113 Å²	113	85%	0.846	69%	0.691	S	S	*	*			trans	-65	99.4	162.3	-59.4	0	0	0	0	106.3	I985 G989	I985-S987 PolarHBondContact O-N 2.85Å; S987-G989 PolarHBondContact O-N 2.77Å
988	E	23	Very low	23.5	Very low	174 Å²	174	114.4 Å²	114.4	81%	0.813	70%	0.702	S	S	*	*			trans	-53.7	133.2	166.8	-83.7	-176.4	136.7	0	0	109.2	C986 T990	C986-E988 VanDerWaalsContact C-N 3.3Å; C986-E988 PolarHBondContact O-N 3.38Å; E988-T990 PolarHBondContact O-N 2.85Å
989	G	22.1	Very low	23.2	Very low	76 Å²	76	122.8 Å²	122.8	78%	0.784	73%	0.728	S	S	*	*			trans	-58.6	125	-168	0	0	0	0	0	113.4	S987	S987-G989 PolarHBondContact O-N 2.77Å
990	T	24	Very low	23	Very low	128 Å²	128	122 Å²	122	79%	0.785	73%	0.733	S	S	*	*			trans	-97	98	140.4	19.9	0	0	0	0	107	E988 I992	E988-T990 PolarHBondContact O-N 2.85Å; T990-I992 VanDerWaalsContact C-N 3.35Å; T990-I992 PolarHBondContact O-N 2.84Å
991	S	21.3	Very low	23	Very low	111 Å²	111	120.9 Å²	120.9	78%	0.776	74%	0.736	S	S	*	*			trans	-58.2	95.9	165.7	53.3	0	0	0	0	108.9
992	I	23.5	Very low	22.7	Very low	141 Å²	141	124.3 Å²	124.3	72%	0.723	76%	0.756	S	S	*	*			trans	-109.9	94.7	161.9	-59.3	-179.8	0	0	0	106.2	T990 T994	T990-I992 VanDerWaalsContact C-N 3.35Å; T990-I992 PolarHBondContact O-N 2.84Å; I992-T994 PolarHBondContact O-N 2.86Å
993	H	19.5	Very low	22.5	Very low	175 Å²	175	126.2 Å²	126.2	81%	0.81	76%	0.759	S	S	*	*			trans	-46.6	124	153.5	-86.8	-95.2	0	0	0	108.5
994	T	21.1	Very low	22.4	Very low	113 Å²	113	126.9 Å²	126.9	69%	0.693	76%	0.758	S	S	*	*			trans	-168.3	118.1	132.5	19.1	0	0	0	0	110.5	I992	I992-T994 PolarHBondContact O-N 2.86Å
995	N	21.4	Very low	22.3	Very low	146 Å²	146	126 Å²	126	78%	0.781	76%	0.763	S	S	*	*			trans	59.2	90.7	145.2	-59.3	-10.3	0	0	0	118.1	D997	N995-D997 PolarHBondContact O-N 2.94Å
996	A	20.3	Very low	22.2	Very low	96 Å²	96	130.5 Å²	130.5	79%	0.793	78%	0.779	S	S	*	*				-53.1	116.4	129.9	0	0	0	0	0	108.9
997	D	21.5	Very low	22.1	Very low	152 Å²	152	134.3 Å²	134.3	81%	0.813	78%	0.782	S	S	*	*			trans	-155.8	122.1	140.1	-95.5	-32.1	0	0	0	109.4	N995	N995-D997 PolarHBondContact O-N 2.94Å
998	A	22.2	Very low	22.1	Very low	78 Å²	78	133.9 Å²	133.9	65%	0.645	78%	0.779	S	S	*	*			trans	36.5	113.6	146.6	0	0	0	0	0	118.4
999	Y	24	Very low	22.1	Very low	230 Å²	230	131.4 Å²	131.4	90%	0.902	78%	0.78	S	S	*	*				-153.2	104.6	114.6	-97.4	-73.4	0	0	0	109.4
1000	S	20.6	Very low	22.1	Very low	114 Å²	114	132 Å²	132	80%	0.797	79%	0.785	S	S	*	*			trans	-67.6	120.4	152.5	55.1	0	0	0	0	108.5
1001	S	26	Very low	22.1	Very low	103 Å²	103	129.9 Å²	129.9	72%	0.72	79%	0.789	S	S	*	*			trans	-144.1	102.6	149	61.7	0	0	0	0	109.5
1002	T	20.5	Very low	22.1	Very low	126 Å²	126	128.9 Å²	128.9	77%	0.773	80%	0.797	S	S	*	*			trans	-32	126.9	138.5	46.2	0	0	0	0	111.1
1003	D	22.6	Very low	22.1	Very low	139 Å²	139	125.5 Å²	125.5	74%	0.743	80%	0.796	S	S	*	*				-173.1	137.4	117.9	-110.3	-18.2	0	0	0	113.8
1004	T	22.3	Very low	22.3	Very low	123 Å²	123	122.1 Å²	122.1	76%	0.755	79%	0.792	S	S	*	*			trans	32.3	118.2	141.7	64	0	0	0	0	118.1
1005	G	21.4	Very low	22.5	Very low	67 Å²	67	123 Å²	123	69%	0.691	80%	0.798	S	S	*	*				96.7	83.9	61.1	0	0	0	0	0	109.8
1006	F	23.5	Very low	22.7	Very low	214 Å²	214	128.1 Å²	128.1	94%	0.939	81%	0.806	S	S	*	*			trans	-138.6	140.2	159.1	-106.8	-88.1	0	0	0	111.7
1007	K	21.1	Very low	22.9	Very low	194 Å²	194	127.1 Å²	127.1	84%	0.843	80%	0.797	S	S	*	*			trans	-72.5	147.1	-162.7	-73	166.1	168.2	174.1	0	115.1
1008	S	21.7	Very low	23	Very low	111 Å²	111	126.2 Å²	126.2	78%	0.776	79%	0.792	S	S	*	*				52.6	109.6	125.7	179.2	0	0	0	0	120.6
1009	C	23.8	Very low	23	Very low	123 Å²	123	132 Å²	132	83%	0.831	80%	0.803	S	S	*	*				-179.2	110.5	112.7	47.9	0	0	0	0	108.9
1010	G	22.7	Very low	22.9	Very low	87 Å²	87	130.1 Å²	130.1	90%	0.897	80%	0.802	S	S	*	*				99.2	114.3	108.7	0	0	0	0	0	112.8
1011	G	22.9	Very low	23.1	Very low	84 Å²	84	128.6 Å²	128.6	87%	0.866	79%	0.791	S	S	*	*			trans	107.2	42.8	163.8	0	0	0	0	0	117.9
1012	G	21.5	Very low	23	Very low	91 Å²	91	129.9 Å²	129.9	94%	0.938	80%	0.795	S	S	*	*			trans	-99.5	76.7	172.7	0	0	0	0	0	112.7
1013	G	23.2	Very low	23.1	Very low	69 Å²	69	132.5 Å²	132.5	71%	0.711	80%	0.8	S	S	*	*			trans	-121	119.7	168.4	0	0	0	0	0	109.9
1014	S	24.9	Very low	23	Very low	105 Å²	105	136.8 Å²	136.8	73%	0.734	81%	0.806	S	S	*	*			trans	73.9	70.7	171.1	-152	0	0	0	0	118.1
1015	V	24.9	Very low	23.2	Very low	132 Å²	132	139.5 Å²	139.5	80%	0.8	81%	0.81	S	S	*	*			trans	-129.5	47.8	152.2	-167.4	0	0	0	0	109.6
1016	R	24.4	Very low	23.3	Very low	252 Å²	252	141.4 Å²	141.4	95%	0.951	81%	0.805	S	S	*	*	S	Bend	trans	-124.3	6.9	169.3	-91.5	-172.3	178.5	179.4	-0	114.6
1017	A	24.9	Very low	23.4	Very low	75 Å²	75	136.1 Å²	136.1	62%	0.62	79%	0.79	S	S	*	*	S	Bend	trans	-110.1	2.2	176.3	0	0	0	0	0	114.9
1018	L	22.8	Very low	23.9	Very low	133 Å²	133	133 Å²	133	70%	0.696	78%	0.781	S	S	*	*	S	Bend	trans	-105.8	20.6	-176.4	-71.4	175.2	0	0	0	114.8
1019	K	22.8	Very low	24.3	Very low	201 Å²	201	130.5 Å²	130.5	87%	0.874	76%	0.761	S	S	*	*	S	Bend	trans	-98.8	-11.1	171.6	-140.5	178	-178.6	-176.1	0	113.9
1020	E	22.2	Very low	24.6	Very low	189 Å²	189	128.4 Å²	128.4	88%	0.883	75%	0.745	S	S	*	*	S	Bend	trans	-101.6	-3.5	177.2	-83.6	178.6	154.1	0	0	114.5
1021	S	24.3	Very low	24.7	Very low	82 Å²	82	132.1 Å²	132.1	57%	0.573	74%	0.739	S	S	*	*	G	3₁₀ helix	trans	-87.7	-9.2	178.5	-179.7	0	0	0	0	114.6	M1023	S1021-M1023 PolarHBondContact O-N 2.85Å
1022	V	24.9	Very low	24.8	Very low	131 Å²	131	133.8 Å²	133.8	79%	0.794	73%	0.732	S	S	*	*	G	3₁₀ helix	trans	-82.8	2.3	-175.5	-178.8	0	0	0	0	112.6
1023	M	22.6	Very low	25.1	Very low	180 Å²	180	133.7 Å²	133.7	89%	0.887	72%	0.717	S	S	*	*	G	3₁₀ helix	trans	-109	14.8	-179.3	-137.9	161.9	-174.4	0	0	114.7	S1021 Q1025	S1021-M1023 PolarHBondContact O-N 2.85Å; M1023-Q1025 PolarHBondContact O-N 2.83Å
1024	R	21	Very low	25	Very low	229 Å²	229	139 Å²	139	86%	0.864	73%	0.728	S	S	*	*			trans	-94.9	82.8	162.8	-70.7	-168.4	-179.9	-177.3	1	109.1	N1026	R1024-N1026 PolarHBondContact O-N 3.24Å
1025	Q	25	Very low	25	Very low	180 Å²	180	139.9 Å²	139.9	84%	0.841	73%	0.729	S	S	*	*			trans	-45.3	119.6	154.8	-111	163.7	-27.4	0	0	107.6	M1023 T1027	M1023-Q1025 PolarHBondContact O-N 2.83Å; Q1025-T1027 PolarHBondContact O-N 2.87Å
1026	N	24.5	Very low	24.9	Very low	108 Å²	108	138.9 Å²	138.9	58%	0.578	73%	0.728	S	S	*	*			trans	-51.7	118	164.1	-98	3	0	0	0	106.5	R1024 I1028	R1024-N1026 PolarHBondContact O-N 3.24Å; N1026-I1028 VanDerWaalsContact C-N 3.28Å; N1026-I1028 PolarHBondContact O-N 2.84Å
1027	T	24.8	Very low	24.8	Very low	103 Å²	103	133.9 Å²	133.9	63%	0.632	73%	0.726	S	S	*	*			trans	-68	89.1	-177.2	-45.6	0	0	0	0	108.3	Q1025 T1029	Q1025-T1027 PolarHBondContact O-N 2.87Å; T1027-T1029 VanDerWaalsContact C-N 3.29Å; T1027-T1029 HydrophobicContact CG2-CG2 4.22Å; T1027-T1029 PolarHBondContact O-N 2.94Å
1028	I	31.5	Very low	24.8	Very low	127 Å²	127	135.7 Å²	135.7	65%	0.651	73%	0.733	S	S	*	*			trans	-62.9	100.4	156.2	-61.7	173.2	0	0	0	104.4	N1026 T1030	N1026-I1028 VanDerWaalsContact C-N 3.28Å; N1026-I1028 PolarHBondContact O-N 2.84Å; I1028-T1030 PolarHBondContact O-N 2.91Å
1029	T	30	Very low	24.7	Very low	60 Å²	60	132.3 Å²	132.3	37%	0.368	73%	0.731	S	S	.	*			trans	-73.3	93.8	173.5	13.9	0	0	0	0	108.9	R958 T1027	R958-T1029 PolarHBondContact NE-OG1 2.97Å; R958-T1029 PolarHBondContact NH2-OG1 2.59Å; T1027-T1029 VanDerWaalsContact C-N 3.29Å; T1027-T1029 HydrophobicContact CG2-CG2 4.22Å; T1027-T1029 PolarHBondContact O-N 2.94Å
1030	T	30.2	Very low	24.6	Very low	79 Å²	79	132.3 Å²	132.3	49%	0.485	73%	0.734	S	S	.	*			trans	-82.2	117.9	146.1	46.6	0	0	0	0	106.2	I1028 T1032	I1028-T1030 PolarHBondContact O-N 2.91Å; T1030-T1032 PolarHBondContact O-N 3.17Å
1031	H	25.2	Very low	24.5	Very low	165 Å²	165	128.7 Å²	128.7	76%	0.764	73%	0.73	S	S	*	*			trans	-65.2	88.4	170.5	-75.8	-91.6	0	0	0	108
1032	T	25.8	Very low	24.5	Very low	119 Å²	119	130.2 Å²	130.2	73%	0.73	74%	0.74	S	S	*	*			trans	-93.3	131.4	160.8	41	0	0	0	0	107.3	T1030 L1034	T1030-T1032 PolarHBondContact O-N 3.17Å; T1032-L1034 PolarHBondContact O-N 3.2Å
1033	S	27.3	Very low	24.3	Very low	88 Å²	88	129.2 Å²	129.2	62%	0.615	73%	0.734	S	S	*	*			trans	-48.1	126.7	-167.2	43	0	0	0	0	114.7	T1035	S1033-T1035 PolarHBondContact O-N 3.37Å
1034	L	21.5	Very low	24.3	Very low	182 Å²	182	127.1 Å²	127.1	95%	0.953	73%	0.725	S	S	*	*			trans	-63.3	96	163.3	-77.3	152.8	0	0	0	108.4	T1032	T1032-L1034 PolarHBondContact O-N 3.2Å
1035	T	24.5	Very low	24.4	Very low	123 Å²	123	123.7 Å²	123.7	76%	0.755	72%	0.724	S	S	*	*			trans	-84.2	125.3	164.6	45.4	0	0	0	0	108.9	S1033 T1037	S1033-T1035 PolarHBondContact O-N 3.37Å; T1035-T1037 PolarHBondContact O-N 3.09Å
1036	S	23.6	Very low	24.2	Very low	110 Å²	110	119.4 Å²	119.4	77%	0.769	71%	0.713	S	S	*	*			trans	-48.6	127.3	-178.2	49.6	0	0	0	0	113.3	S1038	S1036-S1038 PolarHBondContact O-N 2.64Å; S1036-S1038 VanDerWaalsContact O-N 3.16Å
1037	T	21.1	Very low	24.2	Very low	148 Å²	148	122.2 Å²	122.2	91%	0.908	73%	0.728	S	S	*	*			trans	-64.2	104.6	169.8	49.1	0	0	0	0	111.1	T1035	T1035-T1037 PolarHBondContact O-N 3.09Å
1038	S	24.5	Very low	24.1	Very low	112 Å²	112	123 Å²	123	78%	0.783	73%	0.733	S	S	*	*			trans	-115.3	114.6	149.9	54.7	0	0	0	0	107.7	S1036	S1036-S1038 PolarHBondContact O-N 2.64Å; S1036-S1038 VanDerWaalsContact O-N 3.16Å
1039	G	20.7	Very low	23.8	Very low	63 Å²	63	125.2 Å²	125.2	65%	0.649	74%	0.743	S	S	*	*			trans	-74.5	138.9	-178.8	0	0	0	0	0	111.5
1040	H	21.9	Very low	23.4	Very low	200 Å²	200	127.3 Å²	127.3	93%	0.926	76%	0.76	S	S	*	*			trans	-151.1	125.3	138.4	-86.8	-63.6	0	0	0	108.8
1041	S	19.7	Very low	23	Very low	114 Å²	114	127.6 Å²	127.6	80%	0.797	78%	0.778	S	S	*	*			trans	-88.6	130	-178.5	-163.7	0	0	0	0	109.4
1042	S	24.8	Very low	23	Very low	114 Å²	114	123.9 Å²	123.9	80%	0.797	79%	0.785	S	S	*	*			trans	-157	79.3	162.6	62.8	0	0	0	0	111.9
1043	T	21.3	Very low	22.8	Very low	109 Å²	109	121.5 Å²	121.5	67%	0.669	78%	0.784	S	S	*	*				16.8	118.9	123.4	-37.3	0	0	0	0	119.4
1044	I	21.4	Very low	22.5	Very low	136 Å²	136	123 Å²	123	70%	0.697	79%	0.794	S	S	*	*			trans	61.5	126.6	134.7	-56.8	173	0	0	0	119
1045	L	23	Very low	22.6	Very low	158 Å²	158	120.2 Å²	120.2	83%	0.827	79%	0.785	S	S	*	*				-170.4	119.3	115.9	-95	168.7	0	0	0	113
1046	S	20.2	Very low	22.4	Very low	89 Å²	89	123.1 Å²	123.1	62%	0.622	79%	0.788	S	S	*	*			trans	-63.6	146.6	158.1	47.9	0	0	0	0	111.9
1047	N	25.4	Very low	22.4	Very low	167 Å²	167	126 Å²	126	89%	0.893	79%	0.789	S	S	*	*			trans	-141.4	123	156.9	-104.9	-0.3	0	0	0	112.2
1048	T	21.8	Very low	22.5	Very low	119 Å²	119	124.6 Å²	124.6	73%	0.73	79%	0.786	S	S	*	*			trans	-113.1	131.6	173.1	32.4	0	0	0	0	108.5
1049	M	25.6	Very low	22.5	Very low	174 Å²	174	125.4 Å²	125.4	86%	0.857	79%	0.791	S	S	*	*			trans	-161.6	117.5	158.6	-77.6	-72.5	106.6	0	0	105.3
1050	S	21.9	Very low	22.6	Very low	105 Å²	105	125.9 Å²	125.9	73%	0.734	80%	0.796	S	S	*	*				79.8	118.5	55.6	74.7	0	0	0	0	115.5
1051	G	22.3	Very low	22.7	Very low	84 Å²	84	122.5 Å²	122.5	87%	0.866	79%	0.789	S	S	*	*			trans	126.2	116.8	135.8	0	0	0	0	0	120.6
1052	G	24	Very low	22.9	Very low	87 Å²	87	123.6 Å²	123.6	90%	0.897	79%	0.791	S	S	*	*			trans	93.4	138.3	149	0	0	0	0	0	117.1
1053	G	21.6	Very low	22.9	Very low	70 Å²	70	121.4 Å²	121.4	72%	0.722	79%	0.787	S	S	*	*			cis	141	123.5	5.7	0	0	0	0	0	111.5
1054	S	23	Very low	23	Very low	118 Å²	118	123.7 Å²	123.7	83%	0.825	80%	0.795	S	S	*	*			trans	90	117.6	155.7	79.4	0	0	0	0	123.3
1055	T	21.9	Very low	23.2	Very low	125 Å²	125	124 Å²	124	77%	0.767	80%	0.798	S	S	*	*				81	104.5	126.7	-49.4	0	0	0	0	123.4
1056	F	22.1	Very low	23.3	Very low	184 Å²	184	122 Å²	122	81%	0.807	80%	0.797	S	S	*	*			trans	52.9	127.9	137	-86.5	-94.1	0	0	0	124.2
1057	Q	22.2	Very low	23.7	Very low	169 Å²	169	123.1 Å²	123.1	79%	0.79	80%	0.802	S	S	*	*			trans	101.3	121.8	133.9	-106.7	172	48.1	0	0	120.9
1058	S	24.4	Very low	23.6	Very low	120 Å²	120	122 Å²	122	84%	0.839	80%	0.802	S	S	*	*			trans	104.6	123.4	147.6	77.6	0	0	0	0	118.9
1059	S	22.9	Very low	24	Very low	129 Å²	129	122.6 Å²	122.6	90%	0.902	81%	0.805	S	S	*	*			trans	-68.2	138	174.8	-45.6	0	0	0	0	111.5
1060	G	24.6	Very low	24.2	Very low	73 Å²	73	119.7 Å²	119.7	75%	0.753	80%	0.802	S	S	*	*			trans	171.3	86.7	175.8	0	0	0	0	0	112.6
1061	T	23.6	Very low	24.5	Very low	128 Å²	128	124.9 Å²	124.9	79%	0.785	81%	0.811	S	S	*	*			trans	-14.8	153.2	159	51	0	0	0	0	119.9
1062	T	23.9	Very low	24.8	Very low	137 Å²	137	123.9 Å²	123.9	84%	0.84	80%	0.801	S	S	*	*			trans	79.8	98	160.5	66.1	0	0	0	0	118.6
1063	G	24.7	Very low	25.3	Very low	69 Å²	69	130 Å²	130	71%	0.711	80%	0.803	S	S	*	*				91.6	95.6	118.2	0	0	0	0	0	115.1
1064	L	23.8	Very low	26.2	Very low	157 Å²	157	133.3 Å²	133.3	82%	0.822	80%	0.803	S	S	*	*			trans	-167.1	125	142.3	-96.9	144.8	0	0	0	109.2
1065	D	25	Very low	27.6	Very low	142 Å²	142	133.3 Å²	133.3	76%	0.759	79%	0.79	S	S	*	*			trans	55.6	86.7	149.2	-56.4	-17.1	0	0	0	118.6
1066	S	25.6	Very low	29.7	Very low	116 Å²	116	130.7 Å²	130.7	81%	0.811	78%	0.775	S	S	*	*			trans	-63.9	130.1	156.7	-39.2	0	0	0	0	109.4
1067	P	27.4	Very low	32.3	Very low	113 Å²	113	122.3 Å²	122.3	73%	0.734	74%	0.739	S	S	*	*			trans	-68	138.1	-173.3	27.9	-33.6	0	0	0	110.5	T1069	P1067-T1069 VanDerWaalsContact C-N 3.34Å; P1067-T1069 PolarHBondContact O-N 3.14Å
1068	T	24.5	Very low	35.1	Very low	144 Å²	144	120 Å²	120	88%	0.883	72%	0.723	S	S	*	*			trans	-56.2	86.7	174.2	38	0	0	0	0	111.9	S1070	T1068-S1070 PolarHBondContact O-N 3.09Å
1069	T	29.7	Very low	38.2	Very low	131 Å²	131	115.2 Å²	115.2	80%	0.804	69%	0.688	S	S	*	*			trans	-67.6	110.4	159	36.1	0	0	0	0	108.2	P1067 K1071	P1067-T1069 VanDerWaalsContact C-N 3.34Å; P1067-T1069 PolarHBondContact O-N 3.14Å; T1069-K1071 PolarHBondContact O-N 3.09Å
1070	S	28.9	Very low	41.6	Very low	113 Å²	113	109.1 Å²	109.1	79%	0.79	65%	0.645	S	S	*	*			trans	-28.4	111.4	173.4	49.8	0	0	0	0	114.5	T1068 G1072	T1068-S1070 PolarHBondContact O-N 3.09Å; S1070-G1072 PolarHBondContact O-N 2.92Å
1071	K	28	Very low	45	Very low	214 Å²	214	105.7 Å²	105.7	93%	0.93	61%	0.609	S	S	*	*			trans	-58.3	125.2	151.6	-73.2	178	174.6	178.7	0	108	T1069	T1069-K1071 PolarHBondContact O-N 3.09Å
1072	G	29.7	Very low	48.5	Very low	62 Å²	62	99.6 Å²	99.6	64%	0.639	57%	0.572	S	S	*	*			trans	141.9	86.2	161.9	0	0	0	0	0	115.5	S1070	S1070-G1072 PolarHBondContact O-N 2.92Å
1073	F	34.9	Very low	52	Low	215 Å²	215	93 Å²	93	94%	0.943	53%	0.532	S	S	*	.			trans	-113.2	106.9	135.7	-87.1	-84.7	0	0	0	106	E1075	F1073-E1075 PolarHBondContact O-N 2.72Å
1074	I	39.3	Very low	55.6	Low	140 Å²	140	89.8 Å²	89.8	72%	0.718	50%	0.498	S	S	*	.			trans	-66.1	116.1	170.7	-64.8	167.8	0	0	0	105.7	C1076	I1074-C1076 VanDerWaalsContact C-N 3.34Å; I1074-C1076 PolarHBondContact O-N 3.15Å
1075	E	52	Low	59.1	Low	119 Å²	119	82.3 Å²	82.3	56%	0.556	46%	0.459	S	S	*	.			trans	-55.1	101.6	162.2	-78.6	175.5	159	0	0	107.3	P889 F1073	P889-E1075 VanDerWaalsContact CB-OE1 3.28Å; P889-E1075 WeakPolarHBondContact CB-OE1 3.3Å; F1073-E1075 PolarHBondContact O-N 2.72Å
1076	C	67.2	Low	62.5	Low	69 Å²	69	77 Å²	77	47%	0.466	43%	0.429	S	S	.	.			trans	-90.9	128	175.3	-180	0	0	0	0	107.8	I1074 R1078	I1074-C1076 VanDerWaalsContact C-N 3.34Å; I1074-C1076 PolarHBondContact O-N 3.15Å; C1076-R1078 PolarHBondContact O-N 3.09Å
1077	D	76.8	Confident	66	Low	9 Å²	9	74.1 Å²	74.1	5%	0.048	40%	0.402	C	S	.	.			trans	-61.8	134.4	173.6	-72.5	-40.3	0	0	0	110	I33 A1093 L1094 S1096	I33-D1077 HydrophobicContact CD1-CB 3.87Å; I33-D1077 WeakPolarHBondContact CD1-O 3.37Å; I33-D1077 HydrophobicContact CG1-CB 3.98Å; I33-D1077 VanDerWaalsContact CG1-O 3.3Å; I33-D1077 WeakPolarHBondContact CG1-O 3.35Å; D1077-A1093 HydrophobicContact CB-CB 3.92Å; D1077-A1093 VanDerWaalsContact CG-CB 3.47Å; D1077-A1093 WeakPolarHBondContact OD2-CB 3.19Å; D1077-L1094 CarbonylContact C-O 3.6Å; D1077-L1094 VanDerWaalsContact CA-O 3.28Å; D1077-L1094 WeakPolarHBondContact CA-O 3.44Å; D1077-S1096 WeakPolarHBondContact OD1-CB 3.36Å; D1077-S1096 PolarHBondContact OD1-N 2.91Å; D1077-S1096 PolarHBondContact OD1-OG 3.49Å; D1077-S1096 WeakPolarHBondContact OD2-CB 3.18Å; D1077-S1096 PolarHBondContact OD2-OG 3.45Å
1078	R	80.8	Confident	69.3	Low	121 Å²	121	70 Å²	70	46%	0.457	37%	0.373	S	S	.	.			trans	-122.3	-15.8	-175.8	-66.5	-173	-180	-176.4	0.5	114.2	I887 N947 C1076 L1094	I887-R1078 HydrophobicContact CD1-CB 4.24Å; N947-R1078 PolarHBondContact N-O 2.82Å; N947-R1078 VanDerWaalsContact N-O 3.17Å; C1076-R1078 PolarHBondContact O-N 3.09Å; R1078-L1094 PolarHBondContact N-O 3.48Å
1079	Q	89.7	Confident	72.8	Confident	19 Å²	19	63.2 Å²	63.2	9%	0.089	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	153.5	-177.2	-67	177	-18.7	0	0	109.9	L945 L952 L1094	L945-Q1079 CarbonylContact O-C 3.59Å; L945-Q1079 VanDerWaalsContact O-CA 3.24Å; L945-Q1079 WeakPolarHBondContact O-CA 3.21Å; L952-Q1079 HydrophobicContact CD1-CG 3.9Å; Q1079-L1094 HydrophobicContact CB-CB 4.26Å; Q1079-L1094 PolarHBondContact N-O 3.44Å; Q1079-L1094 PolarHBondContact O-N 2.95Å
1080	L	93.8	Very high	76.1	Confident	1 Å²	1	59.9 Å²	59.9	1%	0.005	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	125.3	174.1	-59.6	179.7	0	0	0	110.4	I33 I35 L944 L945 V1091 V1092 A1093 L1100 P1148	I33-L1080 HydrophobicContact CD1-CD2 3.84Å; I33-L1080 HydrophobicContact CD1-CG 4.14Å; I35-L1080 HydrophobicContact CD1-CD1 3.34Å; I35-L1080 HydrophobicContact CD1-CG 4.42Å; L944-L1080 CarbonylContact C-O 3.59Å; L944-L1080 VanDerWaalsContact CA-O 3.31Å; L944-L1080 WeakPolarHBondContact CA-O 3.41Å; L945-L1080 HydrophobicContact CB-CB 4.17Å; L945-L1080 HydrophobicContact CD1-CB 4.5Å; L945-L1080 PolarHBondContact N-O 3.43Å; L945-L1080 PolarHBondContact O-N 3.4Å; L1080-V1091 HydrophobicContact CB-CG1 4.05Å; L1080-V1091 HydrophobicContact CD1-CG1 4.2Å; L1080-V1091 HydrophobicContact CD2-CG1 4.35Å; L1080-V1091 HydrophobicContact CG-CG1 4.47Å; L1080-V1092 CarbonylContact C-O 3.47Å; L1080-V1092 WeakPolarHBondContact CA-O 3.06Å; L1080-A1093 HydrophobicContact CD2-CB 4.08Å; L1080-L1100 HydrophobicContact CD2-CD1 3.65Å; L1080-P1148 HydrophobicContact CD1-CB 3.63Å; L1080-P1148 HydrophobicContact CD1-CG 4.23Å
1081	L	95.3	Very high	79.4	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	118.7	171.9	178.1	71.3	0	0	0	109.7	W900 Y933 I942 L944 L1083 V1091 V1092 L1094	W900-L1081 HydrophobicContact CD2-CD1 4.15Å; W900-L1081 HydrophobicContact CE3-CD1 4.09Å; W900-L1081 HydrophobicContact CE3-CD2 4.12Å; W900-L1081 HydrophobicContact CH2-CD1 4.11Å; W900-L1081 HydrophobicContact CH2-CD2 3.53Å; W900-L1081 HydrophobicContact CH2-CG 4.38Å; W900-L1081 HydrophobicContact CZ2-CD1 4.15Å; W900-L1081 HydrophobicContact CZ2-CD2 4.35Å; W900-L1081 HydrophobicContact CZ3-CD1 4.06Å; W900-L1081 HydrophobicContact CZ3-CD2 3.37Å; W900-L1081 HydrophobicContact CZ3-CG 4.36Å; Y933-L1081 HydrophobicContact CD2-CD2 4.26Å; Y933-L1081 HydrophobicContact CE2-CD2 3.71Å; I942-L1081 HydrophobicContact CG2-CD1 3.79Å; L944-L1081 HydrophobicContact CD2-CB 4.14Å; L944-L1081 HydrophobicContact CD2-CD1 3.93Å; L944-L1081 HydrophobicContact CG-CD1 4.41Å; L1081-L1083 HydrophobicContact CD1-CD2 3.9Å; L1081-L1083 HydrophobicContact CD2-CD1 4.03Å; L1081-L1083 HydrophobicContact CD2-CD2 3.86Å; L1081-L1083 HydrophobicContact CD2-CG 4.04Å; L1081-L1083 HydrophobicContact CG-CD1 4.47Å; L1081-L1083 HydrophobicContact CG-CD2 3.69Å; L1081-L1083 HydrophobicContact CG-CG 3.94Å; L1081-V1091 CarbonylContact O-C 3.42Å; L1081-V1091 WeakPolarHBondContact O-CA 3.24Å; L1081-V1092 HydrophobicContact CB-CB 4.27Å; L1081-V1092 PolarHBondContact N-O 2.8Å; L1081-V1092 PolarHBondContact O-N 2.74Å; L1081-L1094 HydrophobicContact CB-CD1 4.04Å; L1081-L1094 HydrophobicContact CB-CD2 4.46Å; L1081-L1094 HydrophobicContact CB-CG 4.23Å
1082	V	97.7	Very high	82.5	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	120.1	175.4	-174.1	0	0	0	0	108.8	S943 L945 V1091 V1116 L1147	S943-V1082 PolarHBondContact N-O 3.14Å; S943-V1082 VanDerWaalsContact N-O 3.08Å; S943-V1082 PolarHBondContact O-N 2.96Å; L945-V1082 HydrophobicContact CD1-CG2 3.98Å; L945-V1082 HydrophobicContact CG-CG2 4.06Å; V1082-V1091 HydrophobicContact CG1-CG2 4.46Å; V1082-V1091 HydrophobicContact CG2-CG2 4.26Å; V1082-V1116 HydrophobicContact CB-CG2 4.25Å; V1082-V1116 HydrophobicContact CG1-CG2 3.98Å; V1082-L1147 HydrophobicContact CG1-CD2 3.91Å; V1082-L1147 HydrophobicContact CG2-CD1 4.34Å; V1082-L1147 HydrophobicContact CG2-CD2 3.95Å
1083	L	98.4	Very high	85.4	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	128.4	-179.4	-57.1	179.4	0	0	0	109.4	V908 Y933 L935 I942 L1081 A1089 R1090	V908-L1083 HydrophobicContact CB-CD1 4.42Å; V908-L1083 HydrophobicContact CG1-CD1 4.5Å; V908-L1083 HydrophobicContact CG1-CD2 3.93Å; V908-L1083 HydrophobicContact CG2-CD1 4.15Å; V908-L1083 HydrophobicContact CG2-CD2 4.1Å; Y933-L1083 HydrophobicContact CD2-CD1 4.15Å; Y933-L1083 HydrophobicContact CG-CD1 4.03Å; L935-L1083 HydrophobicContact CD1-CD1 4.04Å; L935-L1083 HydrophobicContact CD2-CB 4.03Å; I942-L1083 HydrophobicContact CB-CD2 4.42Å; I942-L1083 HydrophobicContact CG1-CD2 4.03Å; I942-L1083 HydrophobicContact CG2-CD2 3.97Å; L1081-L1083 HydrophobicContact CD1-CD2 3.9Å; L1081-L1083 HydrophobicContact CD2-CD1 4.03Å; L1081-L1083 HydrophobicContact CD2-CD2 3.86Å; L1081-L1083 HydrophobicContact CD2-CG 4.04Å; L1081-L1083 HydrophobicContact CG-CD1 4.47Å; L1081-L1083 HydrophobicContact CG-CD2 3.69Å; L1081-L1083 HydrophobicContact CG-CG 3.94Å; L1083-A1089 CarbonylContact O-C 3.55Å; L1083-A1089 WeakPolarHBondContact O-CA 3.31Å; L1083-A1089 WeakPolarHBondContact O-CB 3.45Å; L1083-R1090 PolarHBondContact N-O 3.19Å; L1083-R1090 PolarHBondContact O-N 2.83Å
1084	C	98.5	Very high	87.9	Confident	0 Å²	0	31.4 Å²	31.4	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	123.7	172.7	-169.9	0	0	0	0	110	I940 H941 A1114 L1133	I940-C1084 PolarHBondContact N-O 3.26Å; H941-C1084 HydrophobicContact CB-CB 4.19Å; H941-C1084 PolarHBondContact N-O 3.47Å; H941-C1084 VanDerWaalsContact N-O 3.1Å; H941-C1084 PolarHBondContact O-N 3.35Å; C1084-A1114 HydrophobicContact CB-CB 4.02Å; C1084-L1133 HydrophobicContact CB-CD1 4.27Å; C1084-L1133 HydrophobicContact CB-CD2 4.3Å
1085	S	98.3	Very high	89.8	Confident	0 Å²	0	25.9 Å²	25.9	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	177.9	168.2	77.5	0	0	0	0	111.1	R936 D938 K1087 Q1088	R936-S1085 WeakPolarHBondContact O-CB 3.38Å; R936-S1085 PolarHBondContact O-OG 2.89Å; D938-S1085 CarbonylContact O-C 3.46Å; D938-S1085 WeakPolarHBondContact O-CA 3.3Å; D938-S1085 WeakPolarHBondContact O-CB 3.32Å; S1085-K1087 PolarHBondContact O-N 2.96Å; S1085-K1087 VanDerWaalsContact O-N 3.09Å; S1085-K1087 PolarHBondContact OG-N 3.29Å; S1085-Q1088 PolarHBondContact N-O 2.92Å; S1085-Q1088 WeakPolarHBondContact OG-CG 3.34Å; S1085-Q1088 PolarHBondContact OG-N 3.36Å; S1085-Q1088 PolarHBondContact OG-O 2.98Å
1086	E	97.2	Very high	91.2	Very high	31 Å²	31	22 Å²	22	15%	0.145	11%	0.108	C	C	.	.	S	Bend	trans	-55.8	-24.6	174.5	-73.8	-179.1	157.7	0	0	114.4	D938 I940 T1106 Q1110 V1111	D938-E1086 HydrophobicContact CB-CG 3.79Å; D938-E1086 PolarHBondContact N-OE2 2.64Å; D938-E1086 PolarHBondContact O-N 3.28Å; I940-E1086 HydrophobicContact CD1-CG 3.81Å; I940-E1086 HydrophobicContact CG1-CG 4.02Å; E1086-T1106 WeakPolarHBondContact O-CG2 3.26Å; E1086-Q1110 HydrophobicContact CB-CB 4.16Å; E1086-Q1110 HydrophobicContact CG-CB 4.34Å; E1086-Q1110 WeakPolarHBondContact O-CA 3.39Å; E1086-V1111 PolarHBondContact O-N 3.49Å
1087	K	97.6	Very high	92.1	Very high	56 Å²	56	22.4 Å²	22.4	24%	0.243	10%	0.103	C	C	.	.	S	Bend	trans	-121.4	-23.7	-169.8	-56.2	-63.8	-179.6	174.6	0	113.9	R936 S1085 I1105 T1106 S1109	R936-K1087 HydrophobicContact CB-CB 4.39Å; S1085-K1087 PolarHBondContact O-N 2.96Å; S1085-K1087 VanDerWaalsContact O-N 3.09Å; S1085-K1087 PolarHBondContact OG-N 3.29Å; K1087-I1105 PolarHBondContact O-N 3.12Å; K1087-T1106 PolarHBondContact O-N 2.86Å; K1087-S1109 PolarHBondContact NZ-O 3.01Å
1088	Q	97.3	Very high	92.7	Very high	27 Å²	27	26.5 Å²	26.5	13%	0.126	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.3	159.6	-172.5	59	175.1	17	0	0	112.3	L935 S1085 V1103	L935-Q1088 HydrophobicContact CB-CG 4.34Å; L935-Q1088 HydrophobicContact CD2-CG 4.27Å; L935-Q1088 HydrophobicContact CG-CG 4.46Å; S1085-Q1088 PolarHBondContact N-O 2.92Å; S1085-Q1088 WeakPolarHBondContact OG-CG 3.34Å; S1085-Q1088 PolarHBondContact OG-N 3.36Å; S1085-Q1088 PolarHBondContact OG-O 2.98Å; Q1088-V1103 CarbonylContact C-O 3.51Å; Q1088-V1103 WeakPolarHBondContact CA-O 3.42Å; Q1088-V1103 WeakPolarHBondContact CB-O 3.19Å
1089	A	98.5	Very high	93.3	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	153.5	169.1	0	0	0	0	0	111.6	L1083 K1102 V1103 I1105 L1133 L1150	L1083-A1089 CarbonylContact O-C 3.55Å; L1083-A1089 WeakPolarHBondContact O-CA 3.31Å; L1083-A1089 WeakPolarHBondContact O-CB 3.45Å; A1089-K1102 WeakPolarHBondContact O-CA 3.12Å; A1089-V1103 HydrophobicContact CB-CG1 4.04Å; A1089-V1103 PolarHBondContact N-O 3.47Å; A1089-V1103 PolarHBondContact O-N 3.17Å; A1089-I1105 HydrophobicContact CB-CD1 4.06Å; A1089-L1133 HydrophobicContact CB-CD2 3.59Å; A1089-L1150 HydrophobicContact CB-CD1 4.25Å; A1089-L1150 HydrophobicContact CB-CD2 4.2Å
1090	R	98.1	Very high	93.4	Very high	62 Å²	62	25.9 Å²	25.9	23%	0.234	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	145.6	176.3	-65.3	-174.5	-179.4	168.6	3.6	110.7	R934 L935 L1083 Y1101 K1102	R934-R1090 PolarHBondContact O-NH1 2.81Å; R934-R1090 PolarHBondContact O-NH2 2.91Å; L935-R1090 HydrophobicContact CD2-CG 4.39Å; L1083-R1090 PolarHBondContact N-O 3.19Å; L1083-R1090 PolarHBondContact O-N 2.83Å; R1090-Y1101 CarbonylContact C-O 3.53Å; R1090-Y1101 VanDerWaalsContact CA-O 3.27Å; R1090-Y1101 WeakPolarHBondContact CA-O 3.41Å; R1090-K1102 HydrophobicContact CG-CB 4.03Å
1091	V	97.4	Very high	93.6	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	124	168.7	-179.3	0	0	0	0	108.4	L1080 L1081 V1082 C1099 L1100 Y1101 L1147 P1148 L1150	L1080-V1091 HydrophobicContact CB-CG1 4.05Å; L1080-V1091 HydrophobicContact CD1-CG1 4.2Å; L1080-V1091 HydrophobicContact CD2-CG1 4.35Å; L1080-V1091 HydrophobicContact CG-CG1 4.47Å; L1081-V1091 CarbonylContact O-C 3.42Å; L1081-V1091 WeakPolarHBondContact O-CA 3.24Å; V1082-V1091 HydrophobicContact CG1-CG2 4.46Å; V1082-V1091 HydrophobicContact CG2-CG2 4.26Å; V1091-C1099 CarbonylContact O-C 3.53Å; V1091-L1100 PolarHBondContact O-N 3.09Å; V1091-Y1101 HydrophobicContact CB-CD2 4.32Å; V1091-Y1101 PolarHBondContact N-O 3.42Å; V1091-Y1101 PolarHBondContact O-N 2.9Å; V1091-L1147 HydrophobicContact CG2-CD2 3.86Å; V1091-P1148 HydrophobicContact CG1-CB 4Å; V1091-P1148 WeakPolarHBondContact CG2-O 3.22Å; V1091-L1150 HydrophobicContact CG2-CD1 3.99Å; V1091-L1150 HydrophobicContact CG2-CD2 4Å; V1091-L1150 HydrophobicContact CG2-CG 3.84Å
1092	V	94	Very high	93.7	Very high	1 Å²	1	38.2 Å²	38.2	1%	0.006	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	130.6	-174.4	-176.2	0	0	0	0	109.3	Y933 L1080 L1081 Q1097 N1098 C1099	Y933-V1092 HydrophobicContact CD1-CG2 4.4Å; Y933-V1092 HydrophobicContact CE1-CB 4.43Å; Y933-V1092 HydrophobicContact CE1-CG1 3.79Å; Y933-V1092 HydrophobicContact CE1-CG2 4.04Å; L1080-V1092 CarbonylContact C-O 3.47Å; L1080-V1092 WeakPolarHBondContact CA-O 3.06Å; L1081-V1092 HydrophobicContact CB-CB 4.27Å; L1081-V1092 PolarHBondContact N-O 2.8Å; L1081-V1092 PolarHBondContact O-N 2.74Å; V1092-Q1097 VanDerWaalsContact CG1-C 3.43Å; V1092-Q1097 WeakPolarHBondContact CG1-O 3.26Å; V1092-N1098 CarbonylContact C-O 3.51Å; V1092-N1098 WeakPolarHBondContact CA-O 3.35Å; V1092-C1099 HydrophobicContact CG2-CB 4.37Å
1093	A	91	Very high	93.7	Very high	1 Å²	1	40 Å²	40	1%	0.008	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	140.4	175.9	0	0	0	0	0	111.3	D1077 L1080 Q1097 N1098 L1100	D1077-A1093 HydrophobicContact CB-CB 3.92Å; D1077-A1093 VanDerWaalsContact CG-CB 3.47Å; D1077-A1093 WeakPolarHBondContact OD2-CB 3.19Å; L1080-A1093 HydrophobicContact CD2-CB 4.08Å; A1093-Q1097 WeakPolarHBondContact O-CA 3.27Å; A1093-Q1097 PolarHBondContact O-N 2.85Å; A1093-N1098 PolarHBondContact N-O 3.48Å; A1093-N1098 PolarHBondContact O-N 3.25Å; A1093-L1100 HydrophobicContact CB-CD1 3.92Å; A1093-L1100 HydrophobicContact CB-CD2 4.05Å; A1093-L1100 HydrophobicContact CB-CG 3.91Å
1094	L	86.1	Confident	93.6	Very high	4 Å²	4	45 Å²	45	2%	0.021	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	139.4	177.9	-55.5	179.2	0	0	0	110.2	W886 W900 L944 D1077 R1078 Q1079 L1081 Q1097	W886-L1094 HydrophobicContact CE3-CD1 4.06Å; W886-L1094 HydrophobicContact CH2-CB 4.38Å; W886-L1094 HydrophobicContact CH2-CD1 4.35Å; W886-L1094 HydrophobicContact CH2-CD2 3.68Å; W886-L1094 HydrophobicContact CH2-CG 4.35Å; W886-L1094 HydrophobicContact CZ3-CB 4.31Å; W886-L1094 HydrophobicContact CZ3-CD1 3.54Å; W886-L1094 HydrophobicContact CZ3-CD2 3.61Å; W886-L1094 HydrophobicContact CZ3-CG 4.01Å; W900-L1094 HydrophobicContact CH2-CD1 4.37Å; W900-L1094 HydrophobicContact CZ2-CD1 4.05Å; L944-L1094 HydrophobicContact CD2-CD1 3.64Å; D1077-L1094 CarbonylContact C-O 3.6Å; D1077-L1094 VanDerWaalsContact CA-O 3.28Å; D1077-L1094 WeakPolarHBondContact CA-O 3.44Å; R1078-L1094 PolarHBondContact N-O 3.48Å; Q1079-L1094 HydrophobicContact CB-CB 4.26Å; Q1079-L1094 PolarHBondContact N-O 3.44Å; Q1079-L1094 PolarHBondContact O-N 2.95Å; L1081-L1094 HydrophobicContact CB-CD1 4.04Å; L1081-L1094 HydrophobicContact CB-CD2 4.46Å; L1081-L1094 HydrophobicContact CB-CG 4.23Å; L1094-Q1097 HydrophobicContact CD2-CG 4.5Å
1095	P	80	Confident	93.5	Very high	23 Å²	23	46.2 Å²	46.2	15%	0.149	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	cis	-88.4	-1.6	9.1	35.3	-35.4	0	0	0	115.3	W886 P889 Q1097	W886-P1095 HydrophobicContact CZ2-CB 4.13Å; P889-P1095 HydrophobicContact CG-CB 4.11Å; P1095-Q1097 WeakPolarHBondContact O-CG 3.36Å; P1095-Q1097 PolarHBondContact O-N 3.19Å
1096	S	82.5	Confident	93.4	Very high	39 Å²	39	46.9 Å²	46.9	27%	0.273	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-17.9	-174.8	72	0	0	0	0	114.7	D1077 N1098	D1077-S1096 WeakPolarHBondContact OD1-CB 3.36Å; D1077-S1096 PolarHBondContact OD1-N 2.91Å; D1077-S1096 PolarHBondContact OD1-OG 3.49Å; D1077-S1096 WeakPolarHBondContact OD2-CB 3.18Å; D1077-S1096 PolarHBondContact OD2-OG 3.45Å; S1096-N1098 WeakPolarHBondContact CB-ND2 3.47Å; S1096-N1098 PolarHBondContact O-N 3.34Å; S1096-N1098 VanDerWaalsContact O-N 3.16Å; S1096-N1098 WeakPolarHBondContact OG-CB 3.17Å; S1096-N1098 PolarHBondContact OG-N 3.04Å; S1096-N1098 PolarHBondContact OG-ND2 3.37Å; S1096-N1098 VanDerWaalsContact OG-ND2 3.14Å
1097	Q	85.4	Confident	93.1	Very high	76 Å²	76	52 Å²	52	36%	0.355	25%	0.254	S	S	.	.			trans	59	18.5	-174.2	-53.1	-174.5	9.7	0	0	113.5	A930 S931 V1092 A1093 L1094 P1095 C1099	A930-Q1097 PolarHBondContact O-NE2 3.4Å; S931-Q1097 PolarHBondContact OG-NE2 2.95Å; V1092-Q1097 VanDerWaalsContact CG1-C 3.43Å; V1092-Q1097 WeakPolarHBondContact CG1-O 3.26Å; A1093-Q1097 WeakPolarHBondContact O-CA 3.27Å; A1093-Q1097 PolarHBondContact O-N 2.85Å; L1094-Q1097 HydrophobicContact CD2-CG 4.5Å; P1095-Q1097 WeakPolarHBondContact O-CG 3.36Å; P1095-Q1097 PolarHBondContact O-N 3.19Å; Q1097-C1099 PolarHBondContact O-N 3.15Å
1098	N	89.3	Confident	92.9	Very high	95 Å²	95	56 Å²	56	51%	0.508	28%	0.283	S	S	.	.			trans	-71.1	119.2	177.9	-75.1	-34.3	0	0	0	110.6	V1092 A1093 S1096 L1100	V1092-N1098 CarbonylContact C-O 3.51Å; V1092-N1098 WeakPolarHBondContact CA-O 3.35Å; A1093-N1098 PolarHBondContact N-O 3.48Å; A1093-N1098 PolarHBondContact O-N 3.25Å; S1096-N1098 WeakPolarHBondContact CB-ND2 3.47Å; S1096-N1098 PolarHBondContact O-N 3.34Å; S1096-N1098 VanDerWaalsContact O-N 3.16Å; S1096-N1098 WeakPolarHBondContact OG-CB 3.17Å; S1096-N1098 PolarHBondContact OG-N 3.04Å; S1096-N1098 PolarHBondContact OG-ND2 3.37Å; S1096-N1098 VanDerWaalsContact OG-ND2 3.14Å; N1098-L1100 HydrophobicContact CB-CD2 4.32Å; N1098-L1100 PolarHBondContact O-N 2.87Å
1099	C	93	Very high	92.8	Very high	65 Å²	65	55.4 Å²	55.4	44%	0.439	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	101.4	171	-174.3	0	0	0	0	109.4	V1091 V1092 Q1097	V1091-C1099 CarbonylContact O-C 3.53Å; V1092-C1099 HydrophobicContact CG2-CB 4.37Å; Q1097-C1099 PolarHBondContact O-N 3.15Å
1100	L	92.9	Very high	92.7	Very high	63 Å²	63	59.1 Å²	59.1	33%	0.33	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	-45.8	-178	-58.6	-174.9	0	0	0	111.4	L1080 V1091 A1093 N1098	L1080-L1100 HydrophobicContact CD2-CD1 3.65Å; V1091-L1100 PolarHBondContact O-N 3.09Å; A1093-L1100 HydrophobicContact CB-CD1 3.92Å; A1093-L1100 HydrophobicContact CB-CD2 4.05Å; A1093-L1100 HydrophobicContact CB-CG 3.91Å; N1098-L1100 HydrophobicContact CB-CD2 4.32Å; N1098-L1100 PolarHBondContact O-N 2.87Å
1101	Y	96.5	Very high	92.6	Very high	95 Å²	95	56.2 Å²	56.2	37%	0.373	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	146.1	-174.2	-56.9	-79.8	0	0	0	111.4	R1090 V1091 P1148 S1149	R1090-Y1101 CarbonylContact C-O 3.53Å; R1090-Y1101 VanDerWaalsContact CA-O 3.27Å; R1090-Y1101 WeakPolarHBondContact CA-O 3.41Å; V1091-Y1101 HydrophobicContact CB-CD2 4.32Å; V1091-Y1101 PolarHBondContact N-O 3.42Å; V1091-Y1101 PolarHBondContact O-N 2.9Å; Y1101-P1148 HydrophobicContact CD2-CB 4.07Å; Y1101-P1148 WeakPolarHBondContact CD2-O 3.49Å; Y1101-P1148 HydrophobicContact CE2-CB 3.93Å; Y1101-P1148 HydrophobicContact CE2-CG 3.98Å; Y1101-S1149 WeakPolarHBondContact CD1-O 3.35Å
1102	K	97	Very high	92.6	Very high	165 Å²	165	57.6 Å²	57.6	72%	0.717	30%	0.297	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-145.7	138.8	175.5	66.7	-173.7	-179.1	-173.1	0	110.3	A1089 R1090	A1089-K1102 WeakPolarHBondContact O-CA 3.12Å; R1090-K1102 HydrophobicContact CG-CB 4.03Å
1103	V	97.7	Very high	92.7	Very high	36 Å²	36	61.9 Å²	61.9	22%	0.218	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	143.1	175.6	73.5	0	0	0	0	110.5	Q1088 A1089 I1105 F1145 L1150	Q1088-V1103 CarbonylContact C-O 3.51Å; Q1088-V1103 WeakPolarHBondContact CA-O 3.42Å; Q1088-V1103 WeakPolarHBondContact CB-O 3.19Å; A1089-V1103 HydrophobicContact CB-CG1 4.04Å; A1089-V1103 PolarHBondContact N-O 3.47Å; A1089-V1103 PolarHBondContact O-N 3.17Å; V1103-I1105 HydrophobicContact CG1-CG1 4.28Å; V1103-F1145 HydrophobicContact CG1-CD1 4.25Å; V1103-F1145 HydrophobicContact CG1-CE1 4.06Å; V1103-F1145 HydrophobicContact CG1-CZ 4.23Å; V1103-F1145 HydrophobicContact CG2-CE1 3.9Å; V1103-F1145 HydrophobicContact CG2-CZ 4.46Å; V1103-L1150 HydrophobicContact CB-CB 4.13Å; V1103-L1150 HydrophobicContact CB-CD1 4.43Å; V1103-L1150 HydrophobicContact CG1-CB 3.99Å; V1103-L1150 HydrophobicContact CG1-CD1 4.07Å; V1103-L1150 HydrophobicContact CG1-CG 4.46Å
1104	K	97.5	Very high	93	Very high	107 Å²	107	62.3 Å²	62.3	47%	0.465	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	115.7	168.7	-167.8	179.4	-166.5	-179.8	0	107.9	E1107	K1104-E1107 HydrophobicContact CD-CG 3.94Å; K1104-E1107 WeakPolarHBondContact CE-OE1 3.33Å; K1104-E1107 IonicContact NZ-OE1 3.68Å; K1104-E1107 PolarHBondContact NZ-OE1 3.19Å
1105	I	97	Very high	93.6	Very high	25 Å²	25	63.1 Å²	63.1	13%	0.128	32%	0.322	C	S	.	.			trans	-78	-46.1	-175.2	-59.4	173.7	0	0	0	110	K1087 A1089 V1103 V1111 L1137 F1145	K1087-I1105 PolarHBondContact O-N 3.12Å; A1089-I1105 HydrophobicContact CB-CD1 4.06Å; V1103-I1105 HydrophobicContact CG1-CG1 4.28Å; I1105-V1111 HydrophobicContact CB-CG2 4.26Å; I1105-V1111 HydrophobicContact CD1-CG2 3.87Å; I1105-V1111 HydrophobicContact CG2-CG2 3.77Å; I1105-L1137 HydrophobicContact CG2-CD1 4.3Å; I1105-L1137 HydrophobicContact CG2-CD2 4.32Å; I1105-F1145 HydrophobicContact CB-CE2 4.44Å; I1105-F1145 HydrophobicContact CB-CZ 4.45Å; I1105-F1145 HydrophobicContact CD1-CE2 4.24Å; I1105-F1145 HydrophobicContact CG1-CE2 3.78Å; I1105-F1145 HydrophobicContact CG1-CZ 4.02Å; I1105-F1145 HydrophobicContact CG2-CE2 4.11Å; I1105-F1145 HydrophobicContact CG2-CZ 4.3Å
1106	T	95.3	Very high	94.4	Very high	14 Å²	14	62.2 Å²	62.2	9%	0.086	32%	0.316	C	S	.	.			trans	-153.8	147.8	-175.5	168	0	0	0	0	111.6	E1086 K1087 T1108 S1109 L1137	E1086-T1106 WeakPolarHBondContact O-CG2 3.26Å; K1087-T1106 PolarHBondContact O-N 2.86Å; T1106-T1108 PolarHBondContact OG1-N 3.45Å; T1106-S1109 WeakPolarHBondContact CG2-O 3.3Å; T1106-S1109 WeakPolarHBondContact OG1-CA 3.44Å; T1106-S1109 PolarHBondContact OG1-N 2.84Å; T1106-S1109 PolarHBondContact OG1-O 3.32Å; T1106-S1109 VanDerWaalsContact OG1-O 3.13Å; T1106-L1137 HydrophobicContact CG2-CD2 4.11Å
1107	E	91.1	Very high	95	Very high	138 Å²	138	60.4 Å²	60.4	65%	0.645	30%	0.304	S	S	*	.	S	Bend	trans	-101	-44.1	171	-77.1	-175.6	-172.5	0	0	112.3	K1104	K1104-E1107 HydrophobicContact CD-CG 3.94Å; K1104-E1107 WeakPolarHBondContact CE-OE1 3.33Å; K1104-E1107 IonicContact NZ-OE1 3.68Å; K1104-E1107 PolarHBondContact NZ-OE1 3.19Å
1108	T	92.8	Very high	95.4	Very high	139 Å²	139	59.3 Å²	59.3	85%	0.853	30%	0.296	S	S	*	.	S	Bend	trans	-98	-18.9	-167.6	53.3	0	0	0	0	113.7	T1106	T1106-T1108 PolarHBondContact OG1-N 3.45Å
1109	S	95.2	Very high	95.5	Very high	16 Å²	16	54.9 Å²	54.9	11%	0.112	27%	0.273	C	S	.	.	S	Bend	trans	-120	-171.9	176.6	-165.5	0	0	0	0	111.2	K1087 T1106 N1139	K1087-S1109 PolarHBondContact NZ-O 3.01Å; T1106-S1109 WeakPolarHBondContact CG2-O 3.3Å; T1106-S1109 WeakPolarHBondContact OG1-CA 3.44Å; T1106-S1109 PolarHBondContact OG1-N 2.84Å; T1106-S1109 PolarHBondContact OG1-O 3.32Å; T1106-S1109 VanDerWaalsContact OG1-O 3.13Å; S1109-N1139 WeakPolarHBondContact OG-CB 3.21Å; S1109-N1139 PolarHBondContact OG-N 3.05Å; S1109-N1139 VanDerWaalsContact OG-N 3.09Å
1110	Q	95.7	Very high	94.9	Very high	78 Å²	78	57.5 Å²	57.5	36%	0.364	27%	0.273	S	S	.	.			trans	-135.7	144.5	178.9	65.5	-165.7	14	0	0	111	E1086 V1112 L1137 A1138	E1086-Q1110 HydrophobicContact CB-CB 4.16Å; E1086-Q1110 HydrophobicContact CG-CB 4.34Å; E1086-Q1110 WeakPolarHBondContact O-CA 3.39Å; Q1110-V1112 PolarHBondContact O-N 3.01Å; Q1110-L1137 CarbonylContact O-C 3.59Å; Q1110-L1137 WeakPolarHBondContact O-CA 3.32Å; Q1110-A1138 HydrophobicContact CG-CB 3.69Å; Q1110-A1138 PolarHBondContact O-N 2.83Å
1111	V	97.9	Very high	93.7	Very high	1 Å²	1	55 Å²	55	1%	0.006	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	122.8	168.5	-178.6	0	0	0	0	108.8	I940 E1086 I1105 R1113 A1114 C1135 L1137	I940-V1111 HydrophobicContact CG2-CG1 4.37Å; E1086-V1111 PolarHBondContact O-N 3.49Å; I1105-V1111 HydrophobicContact CB-CG2 4.26Å; I1105-V1111 HydrophobicContact CD1-CG2 3.87Å; I1105-V1111 HydrophobicContact CG2-CG2 3.77Å; V1111-R1113 WeakPolarHBondContact CG1-O 3.47Å; V1111-A1114 HydrophobicContact CG1-CB 4.04Å; V1111-C1135 HydrophobicContact CG1-CB 4.01Å; V1111-C1135 HydrophobicContact CG2-CB 4.42Å; V1111-L1137 HydrophobicContact CG2-CD1 4.09Å; V1111-L1137 HydrophobicContact CG2-CG 4.24Å
1112	V	95.9	Very high	92.2	Very high	29 Å²	29	54 Å²	54	18%	0.176	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	-42.6	-178.6	178.6	0	0	0	0	110.8	Q1110 Y1136 A1138 Y1161	Q1110-V1112 PolarHBondContact O-N 3.01Å; V1112-Y1136 HydrophobicContact CB-CD1 4.06Å; V1112-Y1136 HydrophobicContact CB-CE1 4.31Å; V1112-Y1136 HydrophobicContact CG1-CD1 4.32Å; V1112-Y1136 HydrophobicContact CG1-CE1 4.34Å; V1112-Y1136 PolarHBondContact N-O 2.81Å; V1112-A1138 HydrophobicContact CG2-CB 3.66Å; V1112-Y1161 HydrophobicContact CG1-CE2 4.06Å; V1112-Y1161 HydrophobicContact CG2-CD2 3.99Å; V1112-Y1161 HydrophobicContact CG2-CE2 3.83Å
1113	R	96.7	Very high	90.1	Very high	90 Å²	90	53.6 Å²	53.6	34%	0.34	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	142.5	174.8	-64.1	-67.7	-170.3	146.2	4.6	109	V1111 C1135 Y1136 S1166 R1167 F1169 F1171	V1111-R1113 WeakPolarHBondContact CG1-O 3.47Å; R1113-C1135 WeakPolarHBondContact O-CA 3.37Å; R1113-Y1136 PolarHBondContact N-O 2.95Å; R1113-Y1136 PolarHBondContact O-N 2.86Å; R1113-S1166 PolarHBondContact NE-O 2.91Å; R1113-S1166 PolarHBondContact NH2-O 3.36Å; R1113-R1167 PolarHBondContact NH2-O 2.84Å; R1113-F1169 HydrophobicContact CB-CD1 4.09Å; R1113-F1169 HydrophobicContact CB-CE1 4.48Å; R1113-F1169 HydrophobicContact CG-CB 4.5Å; R1113-F1169 HydrophobicContact CG-CD1 4Å; R1113-F1171 HydrophobicContact CB-CD2 4.43Å; R1113-F1171 HydrophobicContact CB-CE2 3.68Å; R1113-F1171 HydrophobicContact CB-CZ 4.45Å
1114	A	98	Very high	87.8	Confident	11 Å²	11	56 Å²	56	9%	0.091	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	148.3	170.2	0	0	0	0	0	110.3	I940 H941 C1084 V1111 L1133 A1134	I940-A1114 HydrophobicContact CG2-CB 3.99Å; H941-A1114 HydrophobicContact CB-CB 3.77Å; H941-A1114 PolarHBondContact CD2-O 3.27Å; C1084-A1114 HydrophobicContact CB-CB 4.02Å; V1111-A1114 HydrophobicContact CG1-CB 4.04Å; A1114-L1133 HydrophobicContact CB-CD1 4.4Å; A1114-A1134 CarbonylContact C-O 3.55Å; A1114-A1134 WeakPolarHBondContact CA-O 3.43Å
1115	S	97.4	Very high	85.4	Confident	20 Å²	20	57.6 Å²	57.6	14%	0.14	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	144.5	173.6	-175.6	0	0	0	0	109.9	Q1117 A1134 F1171	S1115-Q1117 PolarHBondContact OG-NE2 2.99Å; S1115-A1134 PolarHBondContact N-O 2.87Å; S1115-A1134 PolarHBondContact O-N 2.68Å; S1115-F1171 VanDerWaalsContact CB-CD2 3.4Å
1116	V	97.8	Very high	83.3	Confident	4 Å²	4	58.2 Å²	58.2	2%	0.024	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	132.8	162	178.4	0	0	0	0	108.8	H941 S943 L945 I951 V1082 F1132 L1133 L1147	H941-V1116 PolarHBondContact CE1-N 3.42Å; S943-V1116 WeakPolarHBondContact OG-CG2 3.48Å; L945-V1116 HydrophobicContact CD2-CG1 4.1Å; I951-V1116 HydrophobicContact CD1-CB 4.36Å; I951-V1116 HydrophobicContact CD1-CG1 3.73Å; I951-V1116 HydrophobicContact CG1-CG1 3.82Å; V1082-V1116 HydrophobicContact CB-CG2 4.25Å; V1082-V1116 HydrophobicContact CG1-CG2 3.98Å; V1116-F1132 CarbonylContact C-O 3.6Å; V1116-F1132 WeakPolarHBondContact CA-O 3.33Å; V1116-L1133 HydrophobicContact CG2-CD1 4.1Å; V1116-L1147 HydrophobicContact CB-CD1 4.37Å; V1116-L1147 HydrophobicContact CG1-CD1 3.55Å; V1116-L1147 HydrophobicContact CG2-CD1 3.88Å
1117	Q	95.1	Very high	81.6	Confident	2 Å²	2	64.2 Å²	64.2	1%	0.009	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	148.3	-168.3	-70.6	-67.9	-52.1	0	0	109.5	S1115 S1131 F1132 A1134 G1172 Q1173	S1115-Q1117 PolarHBondContact OG-NE2 2.99Å; Q1117-S1131 CarbonylContact O-C 3.53Å; Q1117-S1131 VanDerWaalsContact O-CA 3.27Å; Q1117-S1131 WeakPolarHBondContact O-CA 3.01Å; Q1117-F1132 HydrophobicContact CB-CD1 3.96Å; Q1117-F1132 HydrophobicContact CB-CD2 4.48Å; Q1117-F1132 HydrophobicContact CB-CE1 3.41Å; Q1117-F1132 VanDerWaalsContact CB-CE1 3.41Å; Q1117-F1132 HydrophobicContact CB-CE2 4.02Å; Q1117-F1132 HydrophobicContact CB-CG 4.46Å; Q1117-F1132 HydrophobicContact CB-CZ 3.46Å; Q1117-F1132 VanDerWaalsContact CB-CZ 3.46Å; Q1117-F1132 HydrophobicContact CG-CZ 4.17Å; Q1117-F1132 PolarHBondContact N-O 3.14Å; Q1117-F1132 VanDerWaalsContact O-CD1 3.26Å; Q1117-F1132 WeakPolarHBondContact O-CD1 3.15Å; Q1117-F1132 PolarHBondContact O-N 2.85Å; Q1117-A1134 HydrophobicContact CG-CB 3.86Å; Q1117-G1172 PolarHBondContact NE2-O 2.86Å; Q1117-G1172 PolarHBondContact OE1-O 3.29Å; Q1117-Q1173 VanDerWaalsContact OE1-CA 3.25Å
1118	R	92.9	Very high	80.7	Confident	53 Å²	53	61.2 Å²	61.2	20%	0.2	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	153.9	167.7	-68.4	-178.8	177.2	91.2	-4.9	110.8	D950 I951 A1130 Y1174 G1175	D950-R1118 IonicContact OD1-CZ 2.66Å; D950-R1118 IonicContact OD1-NE 3.87Å; D950-R1118 PolarHBondContact OD1-NE 3.36Å; D950-R1118 VanDerWaalsContact OD1-NE 3.09Å; D950-R1118 IonicContact OD1-NH2 3.46Å; D950-R1118 PolarHBondContact OD1-NH2 2.88Å; I951-R1118 HydrophobicContact CD1-CG 3.99Å; I951-R1118 HydrophobicContact CG1-CG 4.41Å; I951-R1118 VanDerWaalsContact N-NH2 3.14Å; I951-R1118 PolarHBondContact O-NH2 3.37Å; R1118-A1130 CarbonylContact C-O 3.52Å; R1118-A1130 WeakPolarHBondContact CA-O 3.5Å; R1118-Y1174 HydrophobicContact CB-CD1 4.38Å; R1118-Y1174 HydrophobicContact CB-CE1 4.32Å; R1118-Y1174 CarbonylContact O-C 3.54Å; R1118-Y1174 WeakPolarHBondContact O-CA 3.27Å; R1118-Y1174 PolarHBondContact O-N 2.61Å; R1118-Y1174 VanDerWaalsContact O-N 3.17Å; R1118-G1175 PolarHBondContact O-N 2.87Å
1119	L	91.3	Very high	80.3	Confident	2 Å²	2	55.9 Å²	55.9	1%	0.01	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	143.2	167.6	-162.8	71.2	0	0	0	109.5	L39 H43 F44 T1129 A1130 F1132 A1192	L39-L1119 HydrophobicContact CD2-CB 4.14Å; L39-L1119 HydrophobicContact CD2-CD2 3.89Å; L39-L1119 HydrophobicContact CD2-CG 4.5Å; H43-L1119 HydrophobicContact CB-CD2 3.94Å; F44-L1119 HydrophobicContact CE1-CD2 4.14Å; F44-L1119 HydrophobicContact CE2-CD2 4.07Å; F44-L1119 HydrophobicContact CZ-CD2 3.84Å; L1119-T1129 WeakPolarHBondContact O-CA 3.45Å; L1119-A1130 PolarHBondContact N-O 3.07Å; L1119-A1130 PolarHBondContact O-N 2.8Å; L1119-F1132 HydrophobicContact CB-CD1 4.12Å; L1119-F1132 HydrophobicContact CB-CE1 3.93Å; L1119-F1132 HydrophobicContact CD1-CE1 4.5Å; L1119-A1192 HydrophobicContact CD1-CB 3.49Å; L1119-A1192 VanDerWaalsContact CD1-CB 3.49Å
1120	R	80.8	Confident	80.1	Confident	119 Å²	119	56 Å²	56	45%	0.449	32%	0.317	S	S	.	.			trans	-98.1	115.1	172.5	-171.1	177.4	-67.5	126.6	-0.3	109	S1122	R1120-S1122 PolarHBondContact O-N 2.92Å
1121	P	68.4	Low	80	Confident	10 Å²	10	52.7 Å²	52.7	7%	0.065	30%	0.303	C	S	.	.			trans	-70.7	129.6	179.1	-16.4	30.2	0	0	0	111.7	L39 H1123 N1124	L39-P1121 HydrophobicContact CD2-CG 4.26Å; P1121-H1123 PolarHBondContact O-N 3.3Å; P1121-N1124 PolarHBondContact O-N 3.3Å
1122	S	63.9	Low	80	Confident	75 Å²	75	52.7 Å²	52.7	52%	0.524	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.5	-22	-177.9	-163.5	0	0	0	0	115.4	R1120	R1120-S1122 PolarHBondContact O-N 2.92Å
1123	H	54.2	Low	80.1	Confident	157 Å²	157	51.3 Å²	51.3	73%	0.727	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.4	3.1	-170.1	-72.9	-58	0	0	0	115.9	P1121	P1121-H1123 PolarHBondContact O-N 3.3Å
1124	N	49	Very low	80.2	Confident	86 Å²	86	47 Å²	47	46%	0.46	28%	0.278	S	S	.	.			trans	-101.4	121.1	173.3	-82	-4.2	0	0	0	110.2	P1121 G1126	P1121-N1124 PolarHBondContact O-N 3.3Å; N1124-G1126 PolarHBondContact O-N 3.45Å; N1124-G1126 VanDerWaalsContact O-N 3.09Å
1125	S	47.4	Very low	80.2	Confident	140 Å²	140	46.5 Å²	46.5	98%	0.979	27%	0.274	S	S	*	.	S	Bend	trans	-63.7	-4.6	166	56.2	0	0	0	0	113.2
1126	G	53.1	Low	80.2	Confident	39 Å²	39	45.5 Å²	45.5	40%	0.402	27%	0.267	S	S	.	.	S	Bend	trans	-87.4	147.1	176	0	0	0	0	0	112.9	N1124 S1128	N1124-G1126 PolarHBondContact O-N 3.45Å; N1124-G1126 VanDerWaalsContact O-N 3.09Å; G1126-S1128 PolarHBondContact O-N 3.16Å
1127	T	58.5	Low	80.2	Confident	139 Å²	139	45.6 Å²	45.6	85%	0.853	27%	0.268	S	S	*	.			trans	-68.7	6.8	173.7	48.4	0	0	0	0	114.3
1128	S	72.9	Confident	80.2	Confident	75 Å²	75	46.7 Å²	46.7	52%	0.524	28%	0.277	S	S	.	.			trans	-76.1	127.3	-173.2	-179.1	0	0	0	0	111.5	G1126	G1126-S1128 PolarHBondContact O-N 3.16Å
1129	T	84	Confident	80.3	Confident	27 Å²	27	47.6 Å²	47.6	17%	0.166	29%	0.286	C	S	.	.			trans	-99.5	149.2	172.4	53.5	0	0	0	0	109.7	L1119 Y1174	L1119-T1129 WeakPolarHBondContact O-CA 3.45Å; T1129-Y1174 HydrophobicContact CG2-CE1 3.87Å
1130	A	90.9	Very high	80.5	Confident	18 Å²	18	47.5 Å²	47.5	15%	0.149	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	140.2	174.7	0	0	0	0	0	110.8	L39 R1118 L1119	L39-A1130 HydrophobicContact CD1-CB 3.78Å; L39-A1130 HydrophobicContact CD2-CB 3.99Å; L39-A1130 HydrophobicContact CG-CB 3.56Å; R1118-A1130 CarbonylContact C-O 3.52Å; R1118-A1130 WeakPolarHBondContact CA-O 3.5Å; L1119-A1130 PolarHBondContact N-O 3.07Å; L1119-A1130 PolarHBondContact O-N 2.8Å
1131	S	94.1	Very high	81.3	Confident	10 Å²	10	44 Å²	44	7%	0.07	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	145.6	-179.2	-59.8	0	0	0	0	112	G949 Q1117	G949-S1131 VanDerWaalsContact O-CB 3.28Å; G949-S1131 WeakPolarHBondContact O-CB 3.5Å; G949-S1131 PolarHBondContact O-OG 2.66Å; Q1117-S1131 CarbonylContact O-C 3.53Å; Q1117-S1131 VanDerWaalsContact O-CA 3.27Å; Q1117-S1131 WeakPolarHBondContact O-CA 3.01Å
1132	F	96.9	Very high	82.7	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	156.4	174	73.3	-84.2	0	0	0	110.7	L39 F44 V1116 Q1117 L1119 A1134 A1144 F1145 L1153 W1191	L39-F1132 HydrophobicContact CD1-CB 3.87Å; L39-F1132 HydrophobicContact CD1-CD1 4.22Å; L39-F1132 HydrophobicContact CD1-CG 4.42Å; F44-F1132 HydrophobicContact CE1-CD1 4.35Å; F44-F1132 AromaticContact CE1-CD2 3.91Å; F44-F1132 HydrophobicContact CE1-CD2 3.91Å; F44-F1132 HydrophobicContact CE1-CE1 4.21Å; F44-F1132 AromaticContact CE1-CE2 3.75Å; F44-F1132 HydrophobicContact CE1-CE2 3.75Å; F44-F1132 HydrophobicContact CE1-CG 4.2Å; F44-F1132 AromaticContact CE1-CZ 3.91Å; F44-F1132 HydrophobicContact CE1-CZ 3.91Å; F44-F1132 HydrophobicContact CZ-CB 4.5Å; F44-F1132 HydrophobicContact CZ-CD1 4.22Å; F44-F1132 HydrophobicContact CZ-CD2 4.16Å; F44-F1132 HydrophobicContact CZ-CE1 4.49Å; F44-F1132 HydrophobicContact CZ-CE2 4.41Å; F44-F1132 HydrophobicContact CZ-CG 4.05Å; V1116-F1132 CarbonylContact C-O 3.6Å; V1116-F1132 WeakPolarHBondContact CA-O 3.33Å; Q1117-F1132 HydrophobicContact CB-CD1 3.96Å; Q1117-F1132 HydrophobicContact CB-CD2 4.48Å; Q1117-F1132 HydrophobicContact CB-CE1 3.41Å; Q1117-F1132 VanDerWaalsContact CB-CE1 3.41Å; Q1117-F1132 HydrophobicContact CB-CE2 4.02Å; Q1117-F1132 HydrophobicContact CB-CG 4.46Å; Q1117-F1132 HydrophobicContact CB-CZ 3.46Å; Q1117-F1132 VanDerWaalsContact CB-CZ 3.46Å; Q1117-F1132 HydrophobicContact CG-CZ 4.17Å; Q1117-F1132 PolarHBondContact N-O 3.14Å; Q1117-F1132 VanDerWaalsContact O-CD1 3.26Å; Q1117-F1132 WeakPolarHBondContact O-CD1 3.15Å; Q1117-F1132 PolarHBondContact O-N 2.85Å; L1119-F1132 HydrophobicContact CB-CD1 4.12Å; L1119-F1132 HydrophobicContact CB-CE1 3.93Å; L1119-F1132 HydrophobicContact CD1-CE1 4.5Å; F1132-A1134 HydrophobicContact CD2-CB 4.3Å; F1132-A1134 HydrophobicContact CE2-CB 3.69Å; F1132-A1134 HydrophobicContact CZ-CB 4.46Å; F1132-A1144 HydrophobicContact CD2-CB 3.84Å; F1132-A1144 HydrophobicContact CE2-CB 4.04Å; F1132-F1145 CarbonylContact C-O 3.58Å; F1132-F1145 WeakPolarHBondContact CA-O 3.41Å; F1132-F1145 VanDerWaalsContact CB-O 3.31Å; F1132-F1145 WeakPolarHBondContact CB-O 3.22Å; F1132-L1153 HydrophobicContact CB-CD1 4.34Å; F1132-W1191 HydrophobicContact CE2-CE3 4.08Å; F1132-W1191 HydrophobicContact CE2-CZ3 4.45Å
1133	L	98.4	Very high	84.3	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	116.4	172.9	175.9	65.3	0	0	0	109.4	C1084 A1089 A1114 V1116 A1144 F1145 L1147 L1150	C1084-L1133 HydrophobicContact CB-CD1 4.27Å; C1084-L1133 HydrophobicContact CB-CD2 4.3Å; A1089-L1133 HydrophobicContact CB-CD2 3.59Å; A1114-L1133 HydrophobicContact CB-CD1 4.4Å; V1116-L1133 HydrophobicContact CG2-CD1 4.1Å; L1133-A1144 CarbonylContact O-C 3.59Å; L1133-A1144 WeakPolarHBondContact O-CA 3.28Å; L1133-F1145 HydrophobicContact CB-CB 4.37Å; L1133-F1145 HydrophobicContact CD2-CD2 4.43Å; L1133-F1145 PolarHBondContact N-O 2.77Å; L1133-F1145 PolarHBondContact O-N 3.38Å; L1133-L1147 HydrophobicContact CB-CD1 4.39Å; L1133-L1147 HydrophobicContact CB-CD2 4.38Å; L1133-L1147 HydrophobicContact CB-CG 4.45Å; L1133-L1150 HydrophobicContact CD2-CD2 4.26Å
1134	A	98.3	Very high	86.4	Confident	0 Å²	0	32.8 Å²	32.8	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	135.3	173.7	0	0	0	0	0	110.5	A1114 S1115 Q1117 F1132 F1171 W1191	A1114-A1134 CarbonylContact C-O 3.55Å; A1114-A1134 WeakPolarHBondContact CA-O 3.43Å; S1115-A1134 PolarHBondContact N-O 2.87Å; S1115-A1134 PolarHBondContact O-N 2.68Å; Q1117-A1134 HydrophobicContact CG-CB 3.86Å; F1132-A1134 HydrophobicContact CD2-CB 4.3Å; F1132-A1134 HydrophobicContact CE2-CB 3.69Å; F1132-A1134 HydrophobicContact CZ-CB 4.46Å; A1134-F1171 HydrophobicContact CB-CD1 4.14Å; A1134-F1171 HydrophobicContact CB-CE1 3.62Å; A1134-F1171 HydrophobicContact CB-CZ 4.03Å; A1134-W1191 HydrophobicContact CB-CE3 4.29Å; A1134-W1191 HydrophobicContact CB-CH2 3.89Å; A1134-W1191 HydrophobicContact CB-CZ3 3.68Å
1135	C	98.3	Very high	88.8	Confident	0 Å²	0	29.2 Å²	29.2	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	133	178.7	-59.9	0	0	0	0	110.8	V1111 R1113 L1137 F1142 V1143	V1111-C1135 HydrophobicContact CG1-CB 4.01Å; V1111-C1135 HydrophobicContact CG2-CB 4.42Å; R1113-C1135 WeakPolarHBondContact O-CA 3.37Å; C1135-L1137 HydrophobicContact CB-CD1 3.85Å; C1135-F1142 WeakPolarHBondContact O-CA 3.38Å; C1135-V1143 HydrophobicContact CB-CB 4.31Å; C1135-V1143 PolarHBondContact N-O 3.46Å; C1135-V1143 PolarHBondContact O-N 2.95Å
1136	Y	97.7	Very high	91.1	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	125.3	166.8	168.3	-126.1	0	0	0	109.2	V1112 R1113 F1142 L1159 Y1161 V1165 F1169	V1112-Y1136 HydrophobicContact CB-CD1 4.06Å; V1112-Y1136 HydrophobicContact CB-CE1 4.31Å; V1112-Y1136 HydrophobicContact CG1-CD1 4.32Å; V1112-Y1136 HydrophobicContact CG1-CE1 4.34Å; V1112-Y1136 PolarHBondContact N-O 2.81Å; R1113-Y1136 PolarHBondContact N-O 2.95Å; R1113-Y1136 PolarHBondContact O-N 2.86Å; Y1136-F1142 AromaticContact CD2-CD1 3.73Å; Y1136-F1142 HydrophobicContact CD2-CD1 3.73Å; Y1136-F1142 AromaticContact CD2-CE1 3.52Å; Y1136-F1142 HydrophobicContact CD2-CE1 3.52Å; Y1136-F1142 HydrophobicContact CE2-CE1 4.13Å; Y1136-F1142 HydrophobicContact CG-CD1 4.41Å; Y1136-F1142 HydrophobicContact CG-CE1 4.15Å; Y1136-L1159 HydrophobicContact CE2-CB 4.29Å; Y1136-L1159 HydrophobicContact CE2-CG 4.42Å; Y1136-L1159 WeakPolarHBondContact CE2-O 3.39Å; Y1136-L1159 PolarHBondContact OH-O 2.82Å; Y1136-Y1161 WeakPolarHBondContact OH-CA 3.37Å; Y1136-V1165 HydrophobicContact CE1-CG1 3.84Å; Y1136-V1165 WeakPolarHBondContact OH-CG1 3.38Å; Y1136-F1169 HydrophobicContact CD1-CD2 4.33Å; Y1136-F1169 HydrophobicContact CD1-CG 4.3Å; Y1136-F1169 HydrophobicContact CG-CE2 4.47Å
1137	L	97.6	Very high	93.2	Very high	6 Å²	6	21.2 Å²	21.2	3%	0.031	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	153.4	-175.6	-77.4	64.4	0	0	0	112	I1105 T1106 Q1110 V1111 C1135 N1139 G1140 H1141 V1143	I1105-L1137 HydrophobicContact CG2-CD1 4.3Å; I1105-L1137 HydrophobicContact CG2-CD2 4.32Å; T1106-L1137 HydrophobicContact CG2-CD2 4.11Å; Q1110-L1137 CarbonylContact O-C 3.59Å; Q1110-L1137 WeakPolarHBondContact O-CA 3.32Å; V1111-L1137 HydrophobicContact CG2-CD1 4.09Å; V1111-L1137 HydrophobicContact CG2-CG 4.24Å; C1135-L1137 HydrophobicContact CB-CD1 3.85Å; L1137-N1139 WeakPolarHBondContact CB-OD1 3.23Å; L1137-N1139 PolarHBondContact O-N 3.31Å; L1137-N1139 VanDerWaalsContact O-N 3.17Å; L1137-G1140 PolarHBondContact O-N 3.34Å; L1137-H1141 HydrophobicContact CB-CB 4.4Å; L1137-H1141 PolarHBondContact N-O 3.48Å; L1137-V1143 HydrophobicContact CD1-CB 4.18Å; L1137-V1143 HydrophobicContact CD1-CG2 3.73Å; L1137-V1143 HydrophobicContact CD2-CG2 4.22Å
1138	A	95.9	Very high	94.9	Very high	25 Å²	25	14.8 Å²	14.8	21%	0.207	9%	0.091	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-15.9	179.6	0	0	0	0	0	114.1	Q1110 V1112 Y1161	Q1110-A1138 HydrophobicContact CG-CB 3.69Å; Q1110-A1138 PolarHBondContact O-N 2.83Å; V1112-A1138 HydrophobicContact CG2-CB 3.66Å; A1138-Y1161 HydrophobicContact CB-CD2 4.16Å; A1138-Y1161 HydrophobicContact CB-CG 4.44Å; A1138-Y1161 WeakPolarHBondContact O-CB 3.38Å
1139	N	95.2	Very high	95.9	Very high	72 Å²	72	12.7 Å²	12.7	39%	0.385	8%	0.076	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.3	3.3	171	66.3	-9.5	0	0	0	113.2	S1109 L1137 H1141	S1109-N1139 WeakPolarHBondContact OG-CB 3.21Å; S1109-N1139 PolarHBondContact OG-N 3.05Å; S1109-N1139 VanDerWaalsContact OG-N 3.09Å; L1137-N1139 WeakPolarHBondContact CB-OD1 3.23Å; L1137-N1139 PolarHBondContact O-N 3.31Å; L1137-N1139 VanDerWaalsContact O-N 3.17Å; N1139-H1141 PolarHBondContact ND2-CD2 2.73Å; N1139-H1141 PolarHBondContact OD1-N 2.95Å
1140	G	95.1	Very high	96.6	Very high	0 Å²	0	11.8 Å²	11.8	0%	0	7%	0.07	C	C	.	.	S	Bend	trans	93.2	3.8	176	0	0	0	0	0	116	L1137 Y1158 L1159	L1137-G1140 PolarHBondContact O-N 3.34Å; G1140-Y1158 PolarHBondContact O-N 2.84Å; G1140-Y1158 VanDerWaalsContact O-N 3.09Å; G1140-L1159 WeakPolarHBondContact CA-O 3.34Å; G1140-L1159 PolarHBondContact O-N 3.4Å
1141	H	97.3	Very high	96.8	Very high	45 Å²	45	15.7 Å²	15.7	21%	0.208	8%	0.081	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	138.9	-178.6	-77.6	-117.4	0	0	0	113.2	L1137 N1139 V1143 D1155 V1156	L1137-H1141 HydrophobicContact CB-CB 4.4Å; L1137-H1141 PolarHBondContact N-O 3.48Å; N1139-H1141 PolarHBondContact ND2-CD2 2.73Å; N1139-H1141 PolarHBondContact OD1-N 2.95Å; H1141-V1143 HydrophobicContact CB-CG2 4.2Å; H1141-D1155 IonicContact CE1-OD1 3.25Å; H1141-D1155 IonicContact CG-OD1 3.56Å; H1141-D1155 IonicContact ND1-OD1 3.75Å; H1141-D1155 PolarHBondContact ND1-OD1 3.09Å; H1141-V1156 CarbonylContact C-O 3.49Å; H1141-V1156 VanDerWaalsContact CA-O 3.29Å; H1141-V1156 WeakPolarHBondContact CA-O 3.13Å
1142	F	97.8	Very high	97	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	122.2	160.3	-69	-11.4	0	0	0	109.3	V46 C1135 Y1136 M1154 D1155 V1156 Y1158 L1159 F1169 V1189 W1191	V46-F1142 HydrophobicContact CG1-CD2 3.89Å; V46-F1142 HydrophobicContact CG1-CE2 3.95Å; V46-F1142 HydrophobicContact CG2-CD2 3.98Å; C1135-F1142 WeakPolarHBondContact O-CA 3.38Å; Y1136-F1142 AromaticContact CD2-CD1 3.73Å; Y1136-F1142 HydrophobicContact CD2-CD1 3.73Å; Y1136-F1142 AromaticContact CD2-CE1 3.52Å; Y1136-F1142 HydrophobicContact CD2-CE1 3.52Å; Y1136-F1142 HydrophobicContact CE2-CE1 4.13Å; Y1136-F1142 HydrophobicContact CG-CD1 4.41Å; Y1136-F1142 HydrophobicContact CG-CE1 4.15Å; F1142-M1154 HydrophobicContact CB-CE 3.9Å; F1142-D1155 WeakPolarHBondContact O-CA 3.46Å; F1142-V1156 PolarHBondContact N-O 2.89Å; F1142-V1156 PolarHBondContact O-N 3.14Å; F1142-Y1158 HydrophobicContact CD2-CD1 4.14Å; F1142-Y1158 HydrophobicContact CD2-CG 4.39Å; F1142-Y1158 AromaticContact CE2-CD1 3.46Å; F1142-Y1158 HydrophobicContact CE2-CD1 3.46Å; F1142-Y1158 VanDerWaalsContact CE2-CD1 3.46Å; F1142-Y1158 HydrophobicContact CE2-CE1 4.09Å; F1142-Y1158 HydrophobicContact CE2-CG 4.15Å; F1142-Y1158 AromaticContact CZ-CD1 3.87Å; F1142-Y1158 HydrophobicContact CZ-CD1 3.87Å; F1142-L1159 HydrophobicContact CE1-CB 4.05Å; F1142-L1159 HydrophobicContact CE1-CD2 4.28Å; F1142-L1159 HydrophobicContact CZ-CB 3.94Å; F1142-L1159 HydrophobicContact CZ-CD2 4.05Å; F1142-F1169 AromaticContact CE1-CE2 3.7Å; F1142-F1169 HydrophobicContact CE1-CE2 3.7Å; F1142-F1169 HydrophobicContact CE1-CZ 4.14Å; F1142-F1169 AromaticContact CZ-CE2 3.75Å; F1142-F1169 HydrophobicContact CZ-CE2 3.75Å; F1142-F1169 HydrophobicContact CZ-CZ 4.33Å; F1142-V1189 HydrophobicContact CE2-CG2 4.43Å; F1142-W1191 HydrophobicContact CB-CH2 3.62Å; F1142-W1191 HydrophobicContact CB-CZ2 3.67Å; F1142-W1191 HydrophobicContact CB-CZ3 4.16Å; F1142-W1191 HydrophobicContact CD1-CH2 4.26Å; F1142-W1191 AromaticContact CD1-CZ2 3.75Å; F1142-W1191 HydrophobicContact CD1-CZ2 3.75Å; F1142-W1191 HydrophobicContact CD2-CD2 4.49Å; F1142-W1191 AromaticContact CD2-CE2 3.66Å; F1142-W1191 HydrophobicContact CD2-CH2 4.46Å; F1142-W1191 AromaticContact CD2-CZ2 3.64Å; F1142-W1191 HydrophobicContact CD2-CZ2 3.64Å; F1142-W1191 AromaticContact CD2-NE1 3.73Å; F1142-W1191 HydrophobicContact CE1-CZ2 4.3Å; F1142-W1191 HydrophobicContact CE2-CZ2 4.2Å; F1142-W1191 AromaticContact CE2-NE1 3.82Å; F1142-W1191 AromaticContact CG-CE2 3.92Å; F1142-W1191 AromaticContact CG-CH2 3.89Å; F1142-W1191 HydrophobicContact CG-CH2 3.89Å; F1142-W1191 AromaticContact CG-CZ2 3.4Å; F1142-W1191 HydrophobicContact CG-CZ2 3.4Å; F1142-W1191 VanDerWaalsContact CG-CZ2 3.4Å
1143	V	98.1	Very high	97	Very high	7 Å²	7	20 Å²	20	4%	0.042	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	131	-177.9	-174.7	0	0	0	0	109.2	C1135 L1137 H1141 F1145 L1152 M1154	C1135-V1143 HydrophobicContact CB-CB 4.31Å; C1135-V1143 PolarHBondContact N-O 3.46Å; C1135-V1143 PolarHBondContact O-N 2.95Å; L1137-V1143 HydrophobicContact CD1-CB 4.18Å; L1137-V1143 HydrophobicContact CD1-CG2 3.73Å; L1137-V1143 HydrophobicContact CD2-CG2 4.22Å; H1141-V1143 HydrophobicContact CB-CG2 4.2Å; V1143-F1145 HydrophobicContact CB-CE2 4.42Å; V1143-F1145 HydrophobicContact CG1-CD2 4.11Å; V1143-F1145 HydrophobicContact CG1-CE1 4.42Å; V1143-F1145 HydrophobicContact CG1-CE2 3.38Å; V1143-F1145 HydrophobicContact CG1-CZ 3.57Å; V1143-L1152 HydrophobicContact CG1-CD1 3.63Å; V1143-M1154 CarbonylContact C-O 3.55Å; V1143-M1154 VanDerWaalsContact CA-O 3.28Å; V1143-M1154 WeakPolarHBondContact CA-O 3.27Å
1144	A	98.2	Very high	97	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	132	176.7	0	0	0	0	0	110.8	F44 F1132 L1133 L1153 M1154 W1191	F44-A1144 HydrophobicContact CD1-CB 4.09Å; F44-A1144 HydrophobicContact CE1-CB 3.79Å; F44-A1144 HydrophobicContact CZ-CB 4.35Å; F1132-A1144 HydrophobicContact CD2-CB 3.84Å; F1132-A1144 HydrophobicContact CE2-CB 4.04Å; L1133-A1144 CarbonylContact O-C 3.59Å; L1133-A1144 WeakPolarHBondContact O-CA 3.28Å; A1144-L1153 HydrophobicContact CB-CB 4.35Å; A1144-L1153 PolarHBondContact O-N 3.4Å; A1144-M1154 HydrophobicContact CB-CB 3.88Å; A1144-M1154 HydrophobicContact CB-CE 4.47Å; A1144-M1154 PolarHBondContact N-O 3.48Å; A1144-M1154 PolarHBondContact O-N 3.36Å; A1144-W1191 HydrophobicContact CB-CE3 4.34Å; A1144-W1191 HydrophobicContact CB-CZ3 4.2Å
1145	F	98.4	Very high	96.9	Very high	10 Å²	10	24.8 Å²	24.8	4%	0.044	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	137.5	173.6	-61.3	-84.2	0	0	0	110.5	V1103 I1105 F1132 L1133 V1143 L1150 R1151 L1152	V1103-F1145 HydrophobicContact CG1-CD1 4.25Å; V1103-F1145 HydrophobicContact CG1-CE1 4.06Å; V1103-F1145 HydrophobicContact CG1-CZ 4.23Å; V1103-F1145 HydrophobicContact CG2-CE1 3.9Å; V1103-F1145 HydrophobicContact CG2-CZ 4.46Å; I1105-F1145 HydrophobicContact CB-CE2 4.44Å; I1105-F1145 HydrophobicContact CB-CZ 4.45Å; I1105-F1145 HydrophobicContact CD1-CE2 4.24Å; I1105-F1145 HydrophobicContact CG1-CE2 3.78Å; I1105-F1145 HydrophobicContact CG1-CZ 4.02Å; I1105-F1145 HydrophobicContact CG2-CE2 4.11Å; I1105-F1145 HydrophobicContact CG2-CZ 4.3Å; F1132-F1145 CarbonylContact C-O 3.58Å; F1132-F1145 WeakPolarHBondContact CA-O 3.41Å; F1132-F1145 VanDerWaalsContact CB-O 3.31Å; F1132-F1145 WeakPolarHBondContact CB-O 3.22Å; L1133-F1145 HydrophobicContact CB-CB 4.37Å; L1133-F1145 HydrophobicContact CD2-CD2 4.43Å; L1133-F1145 PolarHBondContact N-O 2.77Å; L1133-F1145 PolarHBondContact O-N 3.38Å; V1143-F1145 HydrophobicContact CB-CE2 4.42Å; V1143-F1145 HydrophobicContact CG1-CD2 4.11Å; V1143-F1145 HydrophobicContact CG1-CE1 4.42Å; V1143-F1145 HydrophobicContact CG1-CE2 3.38Å; V1143-F1145 HydrophobicContact CG1-CZ 3.57Å; F1145-L1150 HydrophobicContact CB-CD2 4.26Å; F1145-L1150 VanDerWaalsContact CD1-O 3.27Å; F1145-L1150 WeakPolarHBondContact CD1-O 3.42Å; F1145-R1151 WeakPolarHBondContact CA-O 3.05Å; F1145-L1152 HydrophobicContact CD1-CB 4.25Å; F1145-L1152 HydrophobicContact CD1-CD1 4.16Å; F1145-L1152 HydrophobicContact CE1-CB 4.14Å; F1145-L1152 HydrophobicContact CE1-CD1 3.75Å; F1145-L1152 HydrophobicContact CZ-CD1 4.1Å
1146	S	96.6	Very high	96.8	Very high	1 Å²	1	27.2 Å²	27.2	1%	0.007	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.7	152.8	169.2	50.2	0	0	0	0	111.3	E37 S1149 L1150 R1151 L1153	E37-S1146 VanDerWaalsContact OE2-CB 3.24Å; E37-S1146 WeakPolarHBondContact OE2-CB 3.25Å; E37-S1146 PolarHBondContact OE2-OG 2.95Å; S1146-S1149 PolarHBondContact OG-OG 3.29Å; S1146-L1150 WeakPolarHBondContact O-CA 3.23Å; S1146-L1150 PolarHBondContact O-N 3.08Å; S1146-R1151 PolarHBondContact N-O 2.83Å; S1146-R1151 WeakPolarHBondContact OG-CA 3.11Å; S1146-R1151 VanDerWaalsContact OG-CB 3.27Å; S1146-R1151 WeakPolarHBondContact OG-CB 3.28Å; S1146-R1151 PolarHBondContact OG-N 3.44Å; S1146-R1151 PolarHBondContact OG-O 2.97Å; S1146-L1153 VanDerWaalsContact N-CD1 3.32Å
1147	L	96.5	Very high	96.7	Very high	10 Å²	10	32.4 Å²	32.4	5%	0.052	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-121.3	141.1	170.9	-68.5	168.7	0	0	0	109.1	E37 L945 V1082 V1091 V1116 L1133 L1150	E37-L1147 WeakPolarHBondContact CG-O 3.39Å; L945-L1147 HydrophobicContact CD1-CB 4.13Å; L945-L1147 HydrophobicContact CD1-CD1 4.2Å; V1082-L1147 HydrophobicContact CG1-CD2 3.91Å; V1082-L1147 HydrophobicContact CG2-CD1 4.34Å; V1082-L1147 HydrophobicContact CG2-CD2 3.95Å; V1091-L1147 HydrophobicContact CG2-CD2 3.86Å; V1116-L1147 HydrophobicContact CB-CD1 4.37Å; V1116-L1147 HydrophobicContact CG1-CD1 3.55Å; V1116-L1147 HydrophobicContact CG2-CD1 3.88Å; L1133-L1147 HydrophobicContact CB-CD1 4.39Å; L1133-L1147 HydrophobicContact CB-CD2 4.38Å; L1133-L1147 HydrophobicContact CB-CG 4.45Å; L1147-L1150 HydrophobicContact CD2-CD2 3.89Å
1148	P	94.3	Very high	96.5	Very high	4 Å²	4	35.4 Å²	35.4	3%	0.026	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	cis	-84.2	-12.9	2.8	34.5	-37.5	0	0	0	115.8	I35 E37 L1080 V1091 Y1101 L1150	I35-P1148 HydrophobicContact CB-CG 4.26Å; I35-P1148 HydrophobicContact CD1-CG 4.23Å; E37-P1148 VanDerWaalsContact OE1-CD 3.28Å; E37-P1148 WeakPolarHBondContact OE1-CD 3.32Å; L1080-P1148 HydrophobicContact CD1-CB 3.63Å; L1080-P1148 HydrophobicContact CD1-CG 4.23Å; V1091-P1148 HydrophobicContact CG1-CB 4Å; V1091-P1148 WeakPolarHBondContact CG2-O 3.22Å; Y1101-P1148 HydrophobicContact CD2-CB 4.07Å; Y1101-P1148 WeakPolarHBondContact CD2-O 3.49Å; Y1101-P1148 HydrophobicContact CE2-CB 3.93Å; Y1101-P1148 HydrophobicContact CE2-CG 3.98Å; P1148-L1150 PolarHBondContact O-N 3.32Å; P1148-L1150 VanDerWaalsContact O-N 3.1Å
1149	S	95.3	Very high	96.3	Very high	31 Å²	31	34.8 Å²	34.8	22%	0.217	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-12.3	-165.7	71.4	0	0	0	0	116.4	E37 Y1101 S1146 R1151	E37-S1149 WeakPolarHBondContact OE1-CA 3.42Å; E37-S1149 WeakPolarHBondContact OE1-CB 3.42Å; E37-S1149 PolarHBondContact OE1-N 2.81Å; E37-S1149 PolarHBondContact OE1-OG 3.31Å; E37-S1149 PolarHBondContact OE2-OG 2.83Å; Y1101-S1149 WeakPolarHBondContact CD1-O 3.35Å; S1146-S1149 PolarHBondContact OG-OG 3.29Å; S1149-R1151 PolarHBondContact O-N 2.81Å; S1149-R1151 PolarHBondContact OG-N 2.94Å
1150	L	97.8	Very high	96	Very high	8 Å²	8	35.6 Å²	35.6	4%	0.042	19%	0.185	C	C	.	.			trans	56.1	26.6	-174.4	-61.3	174.1	0	0	0	113.6	A1089 V1091 V1103 L1133 F1145 S1146 L1147 P1148	A1089-L1150 HydrophobicContact CB-CD1 4.25Å; A1089-L1150 HydrophobicContact CB-CD2 4.2Å; V1091-L1150 HydrophobicContact CG2-CD1 3.99Å; V1091-L1150 HydrophobicContact CG2-CD2 4Å; V1091-L1150 HydrophobicContact CG2-CG 3.84Å; V1103-L1150 HydrophobicContact CB-CB 4.13Å; V1103-L1150 HydrophobicContact CB-CD1 4.43Å; V1103-L1150 HydrophobicContact CG1-CB 3.99Å; V1103-L1150 HydrophobicContact CG1-CD1 4.07Å; V1103-L1150 HydrophobicContact CG1-CG 4.46Å; L1133-L1150 HydrophobicContact CD2-CD2 4.26Å; F1145-L1150 HydrophobicContact CB-CD2 4.26Å; F1145-L1150 VanDerWaalsContact CD1-O 3.27Å; F1145-L1150 WeakPolarHBondContact CD1-O 3.42Å; S1146-L1150 WeakPolarHBondContact O-CA 3.23Å; S1146-L1150 PolarHBondContact O-N 3.08Å; L1147-L1150 HydrophobicContact CD2-CD2 3.89Å; P1148-L1150 PolarHBondContact O-N 3.32Å; P1148-L1150 VanDerWaalsContact O-N 3.1Å
1151	R	96.2	Very high	95.7	Very high	100 Å²	100	40.7 Å²	40.7	38%	0.377	21%	0.205	S	C	.	.			trans	-71.7	131.5	171.7	166.2	-178	61.6	104.9	6.5	109.7	E37 L39 F1145 S1146 S1149 L1153	E37-R1151 IonicContact OE2-NE 2.85Å; E37-R1151 IonicContact OE2-NH2 3.58Å; E37-R1151 PolarHBondContact OE2-NH2 2.87Å; L39-R1151 PolarHBondContact O-NH2 3.14Å; F1145-R1151 WeakPolarHBondContact CA-O 3.05Å; S1146-R1151 PolarHBondContact N-O 2.83Å; S1146-R1151 WeakPolarHBondContact OG-CA 3.11Å; S1146-R1151 VanDerWaalsContact OG-CB 3.27Å; S1146-R1151 WeakPolarHBondContact OG-CB 3.28Å; S1146-R1151 PolarHBondContact OG-N 3.44Å; S1146-R1151 PolarHBondContact OG-O 2.97Å; S1149-R1151 PolarHBondContact O-N 2.81Å; S1149-R1151 PolarHBondContact OG-N 2.94Å; R1151-L1153 PolarHBondContact O-N 3.05Å
1152	L	97.8	Very high	95.3	Very high	94 Å²	94	41.5 Å²	41.5	49%	0.492	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.7	126.5	179.9	-177.3	67.6	0	0	0	111.1	V1143 F1145 M1154 D1155	V1143-L1152 HydrophobicContact CG1-CD1 3.63Å; F1145-L1152 HydrophobicContact CD1-CB 4.25Å; F1145-L1152 HydrophobicContact CD1-CD1 4.16Å; F1145-L1152 HydrophobicContact CE1-CB 4.14Å; F1145-L1152 HydrophobicContact CE1-CD1 3.75Å; F1145-L1152 HydrophobicContact CZ-CD1 4.1Å; L1152-M1154 WeakPolarHBondContact CD1-O 3.48Å; L1152-D1155 HydrophobicContact CD1-CB 4.35Å; L1152-D1155 HydrophobicContact CD2-CB 4.4Å
1153	L	96.8	Very high	94.6	Very high	8 Å²	8	47.2 Å²	47.2	4%	0.042	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	-38.6	178.8	-63.1	173.1	0	0	0	112	L39 S41 F44 F1132 A1144 S1146 R1151	L39-L1153 HydrophobicContact CB-CD1 3.85Å; L39-L1153 HydrophobicContact CB-CD2 4.42Å; L39-L1153 HydrophobicContact CD1-CD1 4.32Å; L39-L1153 WeakPolarHBondContact O-CD2 3.15Å; S41-L1153 WeakPolarHBondContact CA-O 3.41Å; S41-L1153 VanDerWaalsContact CB-O 3.25Å; S41-L1153 WeakPolarHBondContact CB-O 3.49Å; F44-L1153 HydrophobicContact CD2-CB 3.97Å; F44-L1153 HydrophobicContact CE2-CB 3.77Å; F44-L1153 HydrophobicContact CE2-CD1 3.58Å; F44-L1153 HydrophobicContact CE2-CG 4.19Å; F44-L1153 HydrophobicContact CZ-CB 4.25Å; F44-L1153 HydrophobicContact CZ-CD1 3.7Å; F1132-L1153 HydrophobicContact CB-CD1 4.34Å; A1144-L1153 HydrophobicContact CB-CB 4.35Å; A1144-L1153 PolarHBondContact O-N 3.4Å; S1146-L1153 VanDerWaalsContact N-CD1 3.32Å; R1151-L1153 PolarHBondContact O-N 3.05Å
1154	M	97.1	Very high	94	Very high	12 Å²	12	48.9 Å²	48.9	6%	0.059	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	142	-178.1	-173.8	179.4	71.3	0	0	110.6	F44 V46 F1142 V1143 A1144 L1152 V1156 W1191	F44-M1154 HydrophobicContact CB-CB 3.9Å; F44-M1154 HydrophobicContact CB-CG 4.14Å; F44-M1154 HydrophobicContact CB-SD 3.77Å; F44-M1154 HydrophobicContact CD1-CB 4.26Å; F44-M1154 HydrophobicContact CD1-SD 4.29Å; F44-M1154 HydrophobicContact CG-CB 4.1Å; F44-M1154 HydrophobicContact CG-SD 4.45Å; V46-M1154 HydrophobicContact CG2-CE 3.86Å; V46-M1154 HydrophobicContact CG2-SD 3.63Å; F1142-M1154 HydrophobicContact CB-CE 3.9Å; V1143-M1154 CarbonylContact C-O 3.55Å; V1143-M1154 VanDerWaalsContact CA-O 3.28Å; V1143-M1154 WeakPolarHBondContact CA-O 3.27Å; A1144-M1154 HydrophobicContact CB-CB 3.88Å; A1144-M1154 HydrophobicContact CB-CE 4.47Å; A1144-M1154 PolarHBondContact N-O 3.48Å; A1144-M1154 PolarHBondContact O-N 3.36Å; L1152-M1154 WeakPolarHBondContact CD1-O 3.48Å; M1154-V1156 HydrophobicContact CG-CG2 3.62Å; M1154-V1156 HydrophobicContact SD-CG2 4.05Å; M1154-W1191 HydrophobicContact CE-CB 4.38Å; M1154-W1191 HydrophobicContact CE-CD2 3.65Å; M1154-W1191 HydrophobicContact CE-CE3 3.16Å; M1154-W1191 HydrophobicContact CE-CG 4.2Å; M1154-W1191 HydrophobicContact CE-CH2 4.4Å; M1154-W1191 HydrophobicContact CE-CZ3 3.6Å
1155	D	97.2	Very high	93.6	Very high	87 Å²	87	49.1 Å²	49.1	47%	0.465	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	103.6	169.4	178.2	12.4	0	0	0	108.4	H1141 F1142 L1152	H1141-D1155 IonicContact CE1-OD1 3.25Å; H1141-D1155 IonicContact CG-OD1 3.56Å; H1141-D1155 IonicContact ND1-OD1 3.75Å; H1141-D1155 PolarHBondContact ND1-OD1 3.09Å; F1142-D1155 WeakPolarHBondContact O-CA 3.46Å; L1152-D1155 HydrophobicContact CD1-CB 4.35Å; L1152-D1155 HydrophobicContact CD2-CB 4.4Å
1156	V	96.3	Very high	93	Very high	51 Å²	51	49.5 Å²	49.5	31%	0.309	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	123.7	-171.8	179.3	0	0	0	0	110.3	V46 H1141 F1142 M1154 Y1158	V46-V1156 HydrophobicContact CG2-CB 4.26Å; V46-V1156 HydrophobicContact CG2-CG1 4.28Å; V46-V1156 HydrophobicContact CG2-CG2 4.44Å; H1141-V1156 CarbonylContact C-O 3.49Å; H1141-V1156 VanDerWaalsContact CA-O 3.29Å; H1141-V1156 WeakPolarHBondContact CA-O 3.13Å; F1142-V1156 PolarHBondContact N-O 2.89Å; F1142-V1156 PolarHBondContact O-N 3.14Å; M1154-V1156 HydrophobicContact CG-CG2 3.62Å; M1154-V1156 HydrophobicContact SD-CG2 4.05Å; V1156-Y1158 PolarHBondContact O-N 3.32Å
1157	D	95.6	Very high	92.5	Very high	110 Å²	110	54.7 Å²	54.7	59%	0.588	28%	0.276	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.9	116.3	166.7	-175.8	10.9	0	0	0	109.3
1158	Y	92.7	Very high	92.3	Very high	69 Å²	69	54.3 Å²	54.3	27%	0.271	27%	0.274	S	S	.	.			trans	-141.9	-49.2	-170.3	-173.9	-96.3	0	0	0	114.3	V46 G1140 F1142 V1156 V1189	V46-Y1158 HydrophobicContact CB-CD2 4.08Å; V46-Y1158 HydrophobicContact CB-CE2 4.27Å; V46-Y1158 HydrophobicContact CB-CG 4.48Å; V46-Y1158 HydrophobicContact CG1-CD1 3.84Å; V46-Y1158 HydrophobicContact CG1-CD2 3.54Å; V46-Y1158 HydrophobicContact CG1-CE1 3.86Å; V46-Y1158 HydrophobicContact CG1-CE2 3.54Å; V46-Y1158 HydrophobicContact CG1-CG 3.7Å; G1140-Y1158 PolarHBondContact O-N 2.84Å; G1140-Y1158 VanDerWaalsContact O-N 3.09Å; F1142-Y1158 HydrophobicContact CD2-CD1 4.14Å; F1142-Y1158 HydrophobicContact CD2-CG 4.39Å; F1142-Y1158 AromaticContact CE2-CD1 3.46Å; F1142-Y1158 HydrophobicContact CE2-CD1 3.46Å; F1142-Y1158 VanDerWaalsContact CE2-CD1 3.46Å; F1142-Y1158 HydrophobicContact CE2-CE1 4.09Å; F1142-Y1158 HydrophobicContact CE2-CG 4.15Å; F1142-Y1158 AromaticContact CZ-CD1 3.87Å; F1142-Y1158 HydrophobicContact CZ-CD1 3.87Å; V1156-Y1158 PolarHBondContact O-N 3.32Å; Y1158-V1189 HydrophobicContact CE1-CG1 4.01Å
1159	L	91.2	Very high	92.4	Very high	11 Å²	11	54.2 Å²	54.2	6%	0.058	27%	0.273	C	S	.	.	S	Bend	trans	-124.7	98.3	-169.1	179.2	57.6	0	0	0	111.4	Y1136 G1140 F1142 Y1161 V1165 F1169 Y1179	Y1136-L1159 HydrophobicContact CE2-CB 4.29Å; Y1136-L1159 HydrophobicContact CE2-CG 4.42Å; Y1136-L1159 WeakPolarHBondContact CE2-O 3.39Å; Y1136-L1159 PolarHBondContact OH-O 2.82Å; G1140-L1159 WeakPolarHBondContact CA-O 3.34Å; G1140-L1159 PolarHBondContact O-N 3.4Å; F1142-L1159 HydrophobicContact CE1-CB 4.05Å; F1142-L1159 HydrophobicContact CE1-CD2 4.28Å; F1142-L1159 HydrophobicContact CZ-CB 3.94Å; F1142-L1159 HydrophobicContact CZ-CD2 4.05Å; L1159-Y1161 PolarHBondContact O-N 3.33Å; L1159-V1165 HydrophobicContact CD1-CG2 4.13Å; L1159-V1165 HydrophobicContact CD2-CG1 3.56Å; L1159-V1165 HydrophobicContact CD2-CG2 4.46Å; L1159-V1165 HydrophobicContact CG-CG1 3.97Å; L1159-V1165 HydrophobicContact CG-CG2 4.42Å; L1159-F1169 HydrophobicContact CD2-CD2 3.99Å; L1159-F1169 HydrophobicContact CD2-CE2 4.2Å; L1159-Y1179 HydrophobicContact CD1-CD2 3.85Å; L1159-Y1179 HydrophobicContact CD1-CE1 4.49Å; L1159-Y1179 HydrophobicContact CD1-CE2 3.37Å; L1159-Y1179 HydrophobicContact CD2-CD1 3.75Å; L1159-Y1179 HydrophobicContact CD2-CD2 3.73Å; L1159-Y1179 HydrophobicContact CD2-CE1 3.91Å; L1159-Y1179 HydrophobicContact CD2-CE2 3.91Å; L1159-Y1179 HydrophobicContact CD2-CG 3.65Å; L1159-Y1179 HydrophobicContact CG-CD2 4.45Å; L1159-Y1179 HydrophobicContact CG-CE2 4.29Å
1160	P	90.4	Very high	92.4	Very high	89 Å²	89	53.1 Å²	53.1	58%	0.578	27%	0.267	S	S	*	.			trans	-51.6	140.2	177.9	-26.7	34.5	0	0	0	112.6	T1162	P1160-T1162 PolarHBondContact O-N 2.89Å
1161	Y	89.2	Confident	92.4	Very high	107 Å²	107	54.1 Å²	54.1	42%	0.42	27%	0.27	S	S	.	.			trans	-69.4	125.2	177.9	179	-89.8	0	0	0	111.3	V1112 Y1136 A1138 L1159	V1112-Y1161 HydrophobicContact CG1-CE2 4.06Å; V1112-Y1161 HydrophobicContact CG2-CD2 3.99Å; V1112-Y1161 HydrophobicContact CG2-CE2 3.83Å; Y1136-Y1161 WeakPolarHBondContact OH-CA 3.37Å; A1138-Y1161 HydrophobicContact CB-CD2 4.16Å; A1138-Y1161 HydrophobicContact CB-CG 4.44Å; A1138-Y1161 WeakPolarHBondContact O-CB 3.38Å; L1159-Y1161 PolarHBondContact O-N 3.33Å
1162	T	87.6	Confident	92.2	Very high	63 Å²	63	49.6 Å²	49.6	39%	0.387	26%	0.255	S	S	.	.			trans	-134.6	158.2	166.4	66.2	0	0	0	0	108.4	P1160 C1164 V1165 S1166	P1160-T1162 PolarHBondContact O-N 2.89Å; T1162-C1164 PolarHBondContact O-N 3.03Å; T1162-V1165 PolarHBondContact O-N 2.82Å; T1162-V1165 WeakPolarHBondContact OG1-CB 3.19Å; T1162-V1165 WeakPolarHBondContact OG1-CG2 3.4Å; T1162-V1165 PolarHBondContact OG1-N 3.46Å; T1162-V1165 VanDerWaalsContact OG1-N 3.12Å; T1162-S1166 PolarHBondContact O-N 2.8Å
1163	E	83.2	Confident	92	Very high	119 Å²	119	47.3 Å²	47.3	56%	0.556	24%	0.242	S	C	*	.	H	α-helix	trans	-62.1	-34.7	175.4	-174.5	172.8	-165.5	0	0	112.4	S1166 R1167	E1163-S1166 PolarHBondContact O-N 2.79Å; E1163-S1166 PolarHBondContact O-OG 3.45Å; E1163-R1167 WeakPolarHBondContact O-CG 3.08Å; E1163-R1167 PolarHBondContact O-N 2.7Å; E1163-R1167 IonicContact OE1-CZ 3.97Å; E1163-R1167 VanDerWaalsContact OE1-CZ 3.3Å; E1163-R1167 IonicContact OE1-NE 3.55Å; E1163-R1167 PolarHBondContact OE1-NE 3.26Å; E1163-R1167 IonicContact OE1-NH2 2.8Å; E1163-R1167 PolarHBondContact OE1-NH2 3.11Å
1164	C	85	Confident	91.8	Very high	42 Å²	42	49.3 Å²	49.3	28%	0.284	25%	0.249	S	C	.	.	H	α-helix	trans	-61.6	-47	173.9	-175	0	0	0	0	111.4	T1162 S1168 L1180	T1162-C1164 PolarHBondContact O-N 3.03Å; C1164-S1168 VanDerWaalsContact O-CB 3.31Å; C1164-S1168 WeakPolarHBondContact O-CB 3.34Å; C1164-S1168 PolarHBondContact O-N 2.77Å; C1164-S1168 PolarHBondContact O-OG 2.84Å; C1164-L1180 VanDerWaalsContact SG-CB 3.58Å
1165	V	90.1	Very high	91.6	Very high	5 Å²	5	48.8 Å²	48.8	3%	0.03	25%	0.247	C	C	.	.	H	α-helix	trans	-64.9	-44.4	178	170.3	0	0	0	0	111	Y1136 L1159 T1162 R1167 S1168 F1169 Y1179 L1180	Y1136-V1165 HydrophobicContact CE1-CG1 3.84Å; Y1136-V1165 WeakPolarHBondContact OH-CG1 3.38Å; L1159-V1165 HydrophobicContact CD1-CG2 4.13Å; L1159-V1165 HydrophobicContact CD2-CG1 3.56Å; L1159-V1165 HydrophobicContact CD2-CG2 4.46Å; L1159-V1165 HydrophobicContact CG-CG1 3.97Å; L1159-V1165 HydrophobicContact CG-CG2 4.42Å; T1162-V1165 PolarHBondContact O-N 2.82Å; T1162-V1165 WeakPolarHBondContact OG1-CB 3.19Å; T1162-V1165 WeakPolarHBondContact OG1-CG2 3.4Å; T1162-V1165 PolarHBondContact OG1-N 3.46Å; T1162-V1165 VanDerWaalsContact OG1-N 3.12Å; V1165-R1167 VanDerWaalsContact C-N 3.27Å; V1165-R1167 PolarHBondContact O-N 3.08Å; V1165-S1168 PolarHBondContact O-N 2.82Å; V1165-F1169 HydrophobicContact CG1-CB 4.38Å; V1165-F1169 HydrophobicContact CG1-CD2 4.47Å; V1165-F1169 WeakPolarHBondContact O-CB 3.28Å; V1165-F1169 PolarHBondContact O-N 3.36Å; V1165-Y1179 HydrophobicContact CG2-CD2 4.17Å; V1165-L1180 WeakPolarHBondContact CG2-O 3.48Å
1166	S	87.2	Confident	91.4	Very high	19 Å²	19	45.7 Å²	45.7	13%	0.133	23%	0.23	C	C	.	.	H	α-helix	trans	-61.8	-36	-177.1	68.7	0	0	0	0	113	R1113 T1162 E1163	R1113-S1166 PolarHBondContact NE-O 2.91Å; R1113-S1166 PolarHBondContact NH2-O 3.36Å; T1162-S1166 PolarHBondContact O-N 2.8Å; E1163-S1166 PolarHBondContact O-N 2.79Å; E1163-S1166 PolarHBondContact O-OG 3.45Å
1167	R	85.7	Confident	91.4	Very high	109 Å²	109	43.2 Å²	43.2	41%	0.411	22%	0.215	S	C	.	.	H	α-helix	trans	-76	-39.2	176.6	-67.4	178.7	-176.8	-155.1	0.5	113.1	R1113 E1163 V1165	R1113-R1167 PolarHBondContact NH2-O 2.84Å; E1163-R1167 WeakPolarHBondContact O-CG 3.08Å; E1163-R1167 PolarHBondContact O-N 2.7Å; E1163-R1167 IonicContact OE1-CZ 3.97Å; E1163-R1167 VanDerWaalsContact OE1-CZ 3.3Å; E1163-R1167 IonicContact OE1-NE 3.55Å; E1163-R1167 PolarHBondContact OE1-NE 3.26Å; E1163-R1167 IonicContact OE1-NH2 2.8Å; E1163-R1167 PolarHBondContact OE1-NH2 3.11Å; V1165-R1167 VanDerWaalsContact C-N 3.27Å; V1165-R1167 PolarHBondContact O-N 3.08Å
1168	S	91.7	Very high	91.4	Very high	2 Å²	2	38 Å²	38	1%	0.014	19%	0.187	C	C	.	.	H	α-helix	trans	-94.2	-16.1	-173.7	64	0	0	0	0	115.4	C435 C1164 V1165 A1170 L1180	C435-S1168 WeakPolarHBondContact CB-O 3.47Å; C1164-S1168 VanDerWaalsContact O-CB 3.31Å; C1164-S1168 WeakPolarHBondContact O-CB 3.34Å; C1164-S1168 PolarHBondContact O-N 2.77Å; C1164-S1168 PolarHBondContact O-OG 2.84Å; V1165-S1168 PolarHBondContact O-N 2.82Å; S1168-A1170 PolarHBondContact O-N 2.94Å; S1168-L1180 WeakPolarHBondContact OG-CB 3.31Å; S1168-L1180 PolarHBondContact OG-N 2.82Å
1169	F	96.4	Very high	91.5	Very high	2 Å²	2	35.1 Å²	35.1	1%	0.009	18%	0.176	C	C	.	.			trans	-65.4	122.8	-177.5	-172.6	-77	0	0	0	110.9	R1113 Y1136 F1142 L1159 V1165 F1171 V1178	R1113-F1169 HydrophobicContact CB-CD1 4.09Å; R1113-F1169 HydrophobicContact CB-CE1 4.48Å; R1113-F1169 HydrophobicContact CG-CB 4.5Å; R1113-F1169 HydrophobicContact CG-CD1 4Å; Y1136-F1169 HydrophobicContact CD1-CD2 4.33Å; Y1136-F1169 HydrophobicContact CD1-CG 4.3Å; Y1136-F1169 HydrophobicContact CG-CE2 4.47Å; F1142-F1169 AromaticContact CE1-CE2 3.7Å; F1142-F1169 HydrophobicContact CE1-CE2 3.7Å; F1142-F1169 HydrophobicContact CE1-CZ 4.14Å; F1142-F1169 AromaticContact CZ-CE2 3.75Å; F1142-F1169 HydrophobicContact CZ-CE2 3.75Å; F1142-F1169 HydrophobicContact CZ-CZ 4.33Å; L1159-F1169 HydrophobicContact CD2-CD2 3.99Å; L1159-F1169 HydrophobicContact CD2-CE2 4.2Å; V1165-F1169 HydrophobicContact CG1-CB 4.38Å; V1165-F1169 HydrophobicContact CG1-CD2 4.47Å; V1165-F1169 WeakPolarHBondContact O-CB 3.28Å; V1165-F1169 PolarHBondContact O-N 3.36Å; F1169-F1171 HydrophobicContact CD1-CD2 4.45Å; F1169-F1171 HydrophobicContact CD1-CE2 4.33Å; F1169-F1171 AromaticContact CE1-CD1 3.76Å; F1169-F1171 HydrophobicContact CE1-CD1 3.76Å; F1169-F1171 AromaticContact CE1-CD2 3.83Å; F1169-F1171 HydrophobicContact CE1-CD2 3.83Å; F1169-F1171 AromaticContact CE1-CE1 3.53Å; F1169-F1171 HydrophobicContact CE1-CE1 3.53Å; F1169-F1171 AromaticContact CE1-CE2 3.62Å; F1169-F1171 HydrophobicContact CE1-CE2 3.62Å; F1169-F1171 AromaticContact CE1-CG 3.9Å; F1169-F1171 HydrophobicContact CE1-CG 3.9Å; F1169-F1171 AromaticContact CE1-CZ 3.46Å; F1169-F1171 HydrophobicContact CE1-CZ 3.46Å; F1169-F1171 VanDerWaalsContact CE1-CZ 3.46Å; F1169-F1171 HydrophobicContact CZ-CD1 4.15Å; F1169-F1171 AromaticContact CZ-CE1 3.75Å; F1169-F1171 HydrophobicContact CZ-CE1 3.75Å; F1169-F1171 AromaticContact CZ-CZ 3.98Å; F1169-F1171 HydrophobicContact CZ-CZ 3.98Å; F1169-V1178 WeakPolarHBondContact CA-O 3.32Å
1170	A	96.5	Very high	91.5	Very high	9 Å²	9	34.8 Å²	34.8	7%	0.074	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	130	177.1	0	0	0	0	0	110.9	C435 S1168 S1177 V1178	C435-A1170 HydrophobicContact CB-CB 4.24Å; C435-A1170 WeakPolarHBondContact O-CB 3.24Å; S1168-A1170 PolarHBondContact O-N 2.94Å; A1170-S1177 WeakPolarHBondContact O-CA 3.35Å; A1170-V1178 HydrophobicContact CB-CG2 3.91Å; A1170-V1178 PolarHBondContact N-O 2.89Å; A1170-V1178 PolarHBondContact O-N 3.45Å
1171	F	96.7	Very high	91.4	Very high	28 Å²	28	33.6 Å²	33.6	12%	0.123	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	139.4	169	-68	-74.4	0	0	0	110.1	R1113 S1115 A1134 F1169 S1177 W1191	R1113-F1171 HydrophobicContact CB-CD2 4.43Å; R1113-F1171 HydrophobicContact CB-CE2 3.68Å; R1113-F1171 HydrophobicContact CB-CZ 4.45Å; S1115-F1171 VanDerWaalsContact CB-CD2 3.4Å; A1134-F1171 HydrophobicContact CB-CD1 4.14Å; A1134-F1171 HydrophobicContact CB-CE1 3.62Å; A1134-F1171 HydrophobicContact CB-CZ 4.03Å; F1169-F1171 HydrophobicContact CD1-CD2 4.45Å; F1169-F1171 HydrophobicContact CD1-CE2 4.33Å; F1169-F1171 AromaticContact CE1-CD1 3.76Å; F1169-F1171 HydrophobicContact CE1-CD1 3.76Å; F1169-F1171 AromaticContact CE1-CD2 3.83Å; F1169-F1171 HydrophobicContact CE1-CD2 3.83Å; F1169-F1171 AromaticContact CE1-CE1 3.53Å; F1169-F1171 HydrophobicContact CE1-CE1 3.53Å; F1169-F1171 AromaticContact CE1-CE2 3.62Å; F1169-F1171 HydrophobicContact CE1-CE2 3.62Å; F1169-F1171 AromaticContact CE1-CG 3.9Å; F1169-F1171 HydrophobicContact CE1-CG 3.9Å; F1169-F1171 AromaticContact CE1-CZ 3.46Å; F1169-F1171 HydrophobicContact CE1-CZ 3.46Å; F1169-F1171 VanDerWaalsContact CE1-CZ 3.46Å; F1169-F1171 HydrophobicContact CZ-CD1 4.15Å; F1169-F1171 AromaticContact CZ-CE1 3.75Å; F1169-F1171 HydrophobicContact CZ-CE1 3.75Å; F1169-F1171 AromaticContact CZ-CZ 3.98Å; F1169-F1171 HydrophobicContact CZ-CZ 3.98Å; F1171-S1177 WeakPolarHBondContact CD1-OG 3.36Å; F1171-W1191 AromaticContact CE1-CH2 3.96Å; F1171-W1191 HydrophobicContact CE1-CH2 3.96Å; F1171-W1191 AromaticContact CE1-CZ2 3.7Å; F1171-W1191 HydrophobicContact CE1-CZ2 3.7Å; F1171-W1191 HydrophobicContact CZ-CH2 4.47Å; F1171-W1191 HydrophobicContact CZ-CZ2 4.46Å
1172	G	93.1	Very high	91.3	Very high	5 Å²	5	29.1 Å²	29.1	5%	0.052	15%	0.15	C	C	.	.			trans	-92.7	-136.7	171.1	0	0	0	0	0	111.5	Y437 Q1117 Q1176	Y437-G1172 VanDerWaalsContact CD1-CA 3.45Å; Q1117-G1172 PolarHBondContact NE2-O 2.86Å; Q1117-G1172 PolarHBondContact OE1-O 3.29Å; G1172-Q1176 PolarHBondContact N-O 3.43Å
1173	Q	92.3	Very high	91	Very high	47 Å²	47	29.1 Å²	29.1	22%	0.22	15%	0.15	C	C	.	.	S	Bend	trans	-122.6	176	159.9	-76.1	-65	-37.2	0	0	108.7	V439 Q1117 G1175 Q1176	V439-Q1173 HydrophobicContact CB-CB 4.39Å; Q1117-Q1173 VanDerWaalsContact OE1-CA 3.25Å; Q1173-G1175 VanDerWaalsContact C-N 3.25Å; Q1173-G1175 PolarHBondContact O-N 2.99Å; Q1173-Q1176 PolarHBondContact O-N 2.82Å; Q1173-Q1176 VanDerWaalsContact O-N 3.15Å
1174	Y	92.4	Very high	91.1	Very high	49 Å²	49	23.7 Å²	23.7	19%	0.192	13%	0.125	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.9	31.7	175.9	-53.4	-69.8	0	0	0	114.2	V439 D440 R1118 T1129 Q1176	V439-Y1174 HydrophobicContact CG1-CD2 3.91Å; D440-Y1174 HydrophobicContact CB-CE2 3.76Å; D440-Y1174 PolarHBondContact OD2-OH 3.22Å; R1118-Y1174 HydrophobicContact CB-CD1 4.38Å; R1118-Y1174 HydrophobicContact CB-CE1 4.32Å; R1118-Y1174 CarbonylContact O-C 3.54Å; R1118-Y1174 WeakPolarHBondContact O-CA 3.27Å; R1118-Y1174 PolarHBondContact O-N 2.61Å; R1118-Y1174 VanDerWaalsContact O-N 3.17Å; T1129-Y1174 HydrophobicContact CG2-CE1 3.87Å; Y1174-Q1176 VanDerWaalsContact C-N 3.25Å; Y1174-Q1176 PolarHBondContact O-N 2.85Å
1175	G	92.4	Very high	91.2	Very high	2 Å²	2	22.4 Å²	22.4	2%	0.021	12%	0.115	C	C	.	.	T	Hydrogen-bonded Turn	trans	68.6	21.5	-179.1	0	0	0	0	0	113.8	R1118 Q1173 T1190 W1191	R1118-G1175 PolarHBondContact O-N 2.87Å; Q1173-G1175 VanDerWaalsContact C-N 3.25Å; Q1173-G1175 PolarHBondContact O-N 2.99Å; G1175-T1190 CarbonylContact O-C 3.55Å; G1175-T1190 WeakPolarHBondContact O-CA 3.2Å; G1175-W1191 WeakPolarHBondContact O-CB 3.5Å; G1175-W1191 VanDerWaalsContact O-CD1 3.28Å; G1175-W1191 PolarHBondContact O-N 2.83Å
1176	Q	94.3	Very high	91.3	Very high	21 Å²	21	22.2 Å²	22.2	10%	0.098	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	153.2	176.5	-54.7	-170.1	19.5	0	0	111.8	Y437 V439 G1172 Q1173 Y1174 V1189	Y437-Q1176 HydrophobicContact CE1-CB 3.75Å; Y437-Q1176 PolarHBondContact OH-OE1 2.83Å; V439-Q1176 HydrophobicContact CG2-CB 4.26Å; G1172-Q1176 PolarHBondContact N-O 3.43Å; Q1173-Q1176 PolarHBondContact O-N 2.82Å; Q1173-Q1176 VanDerWaalsContact O-N 3.15Å; Y1174-Q1176 VanDerWaalsContact C-N 3.25Å; Y1174-Q1176 PolarHBondContact O-N 2.85Å; Q1176-V1189 CarbonylContact C-O 3.49Å; Q1176-V1189 WeakPolarHBondContact CA-O 3.31Å
1177	S	96.1	Very high	91.5	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	157.9	175.8	-48.9	0	0	0	0	110.8	A1170 F1171 V1189 W1191	A1170-S1177 WeakPolarHBondContact O-CA 3.35Å; F1171-S1177 WeakPolarHBondContact CD1-OG 3.36Å; S1177-V1189 PolarHBondContact N-O 3.16Å; S1177-V1189 WeakPolarHBondContact O-CG2 3.27Å; S1177-V1189 PolarHBondContact O-N 2.76Å; S1177-W1191 PolarHBondContact OG-NE1 2.81Å
1178	V	95.8	Very high	91.9	Very high	0 Å²	0	16.9 Å²	16.9	0%	0	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	151.7	173.1	-63.5	0	0	0	0	110.6	Y437 I493 F1169 A1170 L1186 A1187 K1188	Y437-V1178 HydrophobicContact CD1-CB 4.39Å; Y437-V1178 HydrophobicContact CD1-CG1 3.73Å; Y437-V1178 HydrophobicContact CD1-CG2 4.06Å; Y437-V1178 HydrophobicContact CD2-CG1 4.04Å; Y437-V1178 HydrophobicContact CE1-CG1 3.81Å; Y437-V1178 HydrophobicContact CE2-CG1 4.09Å; Y437-V1178 HydrophobicContact CG-CB 4.46Å; Y437-V1178 HydrophobicContact CG-CG1 3.85Å; Y437-V1178 HydrophobicContact CG-CG2 3.82Å; I493-V1178 HydrophobicContact CD1-CG1 3.96Å; F1169-V1178 WeakPolarHBondContact CA-O 3.32Å; A1170-V1178 HydrophobicContact CB-CG2 3.91Å; A1170-V1178 PolarHBondContact N-O 2.89Å; A1170-V1178 PolarHBondContact O-N 3.45Å; V1178-L1186 HydrophobicContact CB-CD2 4.09Å; V1178-L1186 HydrophobicContact CG1-CD2 4.11Å; V1178-A1187 VanDerWaalsContact CA-O 3.27Å; V1178-A1187 WeakPolarHBondContact CA-O 3.42Å; V1178-K1188 HydrophobicContact CG1-CB 4.19Å; V1178-K1188 HydrophobicContact CG1-CG 4.16Å
1179	Y	94.7	Very high	92	Very high	9 Å²	9	16.8 Å²	16.8	4%	0.035	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158	159.2	173.4	64.2	-85.3	0	0	0	110.4	L1159 V1165 V1181 A1187 V1189	L1159-Y1179 HydrophobicContact CD1-CD2 3.85Å; L1159-Y1179 HydrophobicContact CD1-CE1 4.49Å; L1159-Y1179 HydrophobicContact CD1-CE2 3.37Å; L1159-Y1179 HydrophobicContact CD2-CD1 3.75Å; L1159-Y1179 HydrophobicContact CD2-CD2 3.73Å; L1159-Y1179 HydrophobicContact CD2-CE1 3.91Å; L1159-Y1179 HydrophobicContact CD2-CE2 3.91Å; L1159-Y1179 HydrophobicContact CD2-CG 3.65Å; L1159-Y1179 HydrophobicContact CG-CD2 4.45Å; L1159-Y1179 HydrophobicContact CG-CE2 4.29Å; V1165-Y1179 HydrophobicContact CG2-CD2 4.17Å; Y1179-V1181 HydrophobicContact CD2-CB 4.5Å; Y1179-V1181 HydrophobicContact CE2-CB 3.93Å; Y1179-V1181 HydrophobicContact CE2-CG2 4.34Å; Y1179-A1187 HydrophobicContact CD1-CB 4.43Å; Y1179-A1187 HydrophobicContact CE1-CB 3.92Å; Y1179-A1187 HydrophobicContact CE2-CB 4.03Å; Y1179-A1187 PolarHBondContact N-O 3.4Å; Y1179-A1187 PolarHBondContact O-N 3.38Å; Y1179-V1189 HydrophobicContact CD1-CG2 4.42Å; Y1179-V1189 HydrophobicContact CE1-CG1 3.66Å; Y1179-V1189 HydrophobicContact CE1-CG2 4.16Å
1180	L	91.8	Very high	91.9	Very high	3 Å²	3	16.7 Å²	16.7	2%	0.016	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	119.3	168.8	-73.3	177.6	0	0	0	110.6	V432 C1164 V1165 S1168 S1182 E1185 L1186	V432-L1180 HydrophobicContact CB-CD1 3.63Å; V432-L1180 HydrophobicContact CG1-CD1 4.21Å; V432-L1180 HydrophobicContact CG2-CD1 3.99Å; C1164-L1180 VanDerWaalsContact SG-CB 3.58Å; V1165-L1180 WeakPolarHBondContact CG2-O 3.48Å; S1168-L1180 WeakPolarHBondContact OG-CB 3.31Å; S1168-L1180 PolarHBondContact OG-N 2.82Å; L1180-S1182 WeakPolarHBondContact CB-O 3.44Å; L1180-E1185 CarbonylContact C-O 3.54Å; L1180-E1185 VanDerWaalsContact CA-O 3.29Å; L1180-E1185 WeakPolarHBondContact CA-O 3.37Å; L1180-E1185 WeakPolarHBondContact CD2-O 3.28Å; L1180-L1186 HydrophobicContact CD2-CB 3.91Å
1181	V	87.3	Confident	91.8	Very high	64 Å²	64	16.4 Å²	16.4	39%	0.388	9%	0.087	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81	-27.1	173.3	67.2	0	0	0	0	111.3	V51 Y1179 E1185	V51-V1181 HydrophobicContact CG1-CG1 4.44Å; Y1179-V1181 HydrophobicContact CD2-CB 4.5Å; Y1179-V1181 HydrophobicContact CE2-CB 3.93Å; Y1179-V1181 HydrophobicContact CE2-CG2 4.34Å; V1181-E1185 HydrophobicContact CG1-CB 3.6Å; V1181-E1185 PolarHBondContact N-O 3.13Å
1182	S	86.3	Confident	91.6	Very high	14 Å²	14	15.1 Å²	15.1	10%	0.098	8%	0.082	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	167.6	171.7	71.6	0	0	0	0	108.4	Y56 L1180 S1184 E1185	Y56-S1182 WeakPolarHBondContact CB-OG 3.26Å; L1180-S1182 WeakPolarHBondContact CB-O 3.44Å; S1182-S1184 PolarHBondContact O-N 3.26Å; S1182-E1185 PolarHBondContact O-N 2.91Å; S1182-E1185 VanDerWaalsContact OG-CB 3.24Å; S1182-E1185 WeakPolarHBondContact OG-CB 3.23Å; S1182-E1185 WeakPolarHBondContact OG-CG 3.39Å; S1182-E1185 PolarHBondContact OG-N 2.6Å; S1182-E1185 PolarHBondContact OG-OE2 3.19Å
1183	P	82.6	Confident	91.6	Very high	62 Å²	62	16.3 Å²	16.3	40%	0.403	9%	0.09	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.9	-20.5	177.9	-27.6	36.6	0	0	0	115	Y56	Y56-P1183 HydrophobicContact CD2-CB 4.42Å; Y56-P1183 HydrophobicContact CD2-CG 4.35Å; Y56-P1183 HydrophobicContact CE1-CG 4.48Å; Y56-P1183 HydrophobicContact CE2-CB 4.06Å; Y56-P1183 HydrophobicContact CE2-CG 3.82Å
1184	S	84.7	Confident	91.4	Very high	5 Å²	5	16 Å²	16	4%	0.035	9%	0.09	C	C	.	.	T	Hydrogen-bonded Turn	trans	-115.3	0.7	-178	59.9	0	0	0	0	114.4	G53 F54 Y56 S1182	G53-S1184 WeakPolarHBondContact CA-O 3.31Å; F54-S1184 PolarHBondContact N-O 2.87Å; F54-S1184 WeakPolarHBondContact O-CB 3.41Å; F54-S1184 PolarHBondContact O-OG 2.81Å; Y56-S1184 WeakPolarHBondContact CB-OG 3.38Å; S1182-S1184 PolarHBondContact O-N 3.26Å
1185	E	88	Confident	91.1	Very high	15 Å²	15	15.1 Å²	15.1	7%	0.07	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	126.1	-175.4	-61.7	173.2	105.4	0	0	112.7	V51 H52 F54 Y56 L1180 V1181 S1182	V51-E1185 HydrophobicContact CG1-CB 3.98Å; V51-E1185 HydrophobicContact CG1-CG 4.49Å; H52-E1185 CarbonylContact O-C 3.52Å; H52-E1185 VanDerWaalsContact O-CA 3.22Å; H52-E1185 WeakPolarHBondContact O-CA 3.37Å; F54-E1185 WeakPolarHBondContact O-CG 3.46Å; Y56-E1185 PolarHBondContact N-OE2 3.38Å; L1180-E1185 CarbonylContact C-O 3.54Å; L1180-E1185 VanDerWaalsContact CA-O 3.29Å; L1180-E1185 WeakPolarHBondContact CA-O 3.37Å; L1180-E1185 WeakPolarHBondContact CD2-O 3.28Å; V1181-E1185 HydrophobicContact CG1-CB 3.6Å; V1181-E1185 PolarHBondContact N-O 3.13Å; S1182-E1185 PolarHBondContact O-N 2.91Å; S1182-E1185 VanDerWaalsContact OG-CB 3.24Å; S1182-E1185 WeakPolarHBondContact OG-CB 3.23Å; S1182-E1185 WeakPolarHBondContact OG-CG 3.39Å; S1182-E1185 PolarHBondContact OG-N 2.6Å; S1182-E1185 PolarHBondContact OG-OE2 3.19Å
1186	L	90.9	Very high	91	Very high	2 Å²	2	15.6 Å²	15.6	1%	0.01	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	123.8	177.8	-174	147.4	0	0	0	109.9	V51 H52 L427 I493 V1178 L1180	V51-L1186 CarbonylContact C-O 3.54Å; V51-L1186 WeakPolarHBondContact CA-O 3.34Å; H52-L1186 PolarHBondContact N-O 2.89Å; H52-L1186 PolarHBondContact O-N 3.22Å; L427-L1186 HydrophobicContact CD2-CB 4.21Å; L427-L1186 HydrophobicContact CD2-CD1 4.39Å; I493-L1186 HydrophobicContact CD1-CD1 4.35Å; I493-L1186 HydrophobicContact CD1-CD2 3.77Å; I493-L1186 HydrophobicContact CG2-CD1 4.15Å; V1178-L1186 HydrophobicContact CB-CD2 4.09Å; V1178-L1186 HydrophobicContact CG1-CD2 4.11Å; L1180-L1186 HydrophobicContact CD2-CB 3.91Å
1187	A	91.9	Very high	90.5	Very high	0 Å²	0	17.7 Å²	17.7	0%	0	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	135.3	176.6	0	0	0	0	0	110.8	S50 V51 V1178 Y1179	S50-A1187 WeakPolarHBondContact O-CA 3.35Å; V51-A1187 HydrophobicContact CG2-CB 4.36Å; V1178-A1187 VanDerWaalsContact CA-O 3.27Å; V1178-A1187 WeakPolarHBondContact CA-O 3.42Å; Y1179-A1187 HydrophobicContact CD1-CB 4.43Å; Y1179-A1187 HydrophobicContact CE1-CB 3.92Å; Y1179-A1187 HydrophobicContact CE2-CB 4.03Å; Y1179-A1187 PolarHBondContact N-O 3.4Å; Y1179-A1187 PolarHBondContact O-N 3.38Å
1188	K	93	Very high	89.9	Confident	16 Å²	16	21.9 Å²	21.9	7%	0.07	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	133.1	169.9	-174.5	-176.9	160.1	170.5	0	109.1	I49 S50 Y437 E491 V1178	I49-K1188 HydrophobicContact CB-CB 4.27Å; I49-K1188 HydrophobicContact CB-CD 4.24Å; I49-K1188 HydrophobicContact CB-CG 4.11Å; I49-K1188 HydrophobicContact CD1-CD 4.18Å; I49-K1188 HydrophobicContact CD1-CG 3.96Å; I49-K1188 HydrophobicContact CG1-CG 4.45Å; I49-K1188 HydrophobicContact CG2-CD 4.13Å; I49-K1188 PolarHBondContact N-O 3.19Å; S50-K1188 PolarHBondContact N-O 3.45Å; S50-K1188 PolarHBondContact O-N 3.49Å; S50-K1188 WeakPolarHBondContact OG-CB 3.48Å; Y437-K1188 WeakPolarHBondContact OH-CE 3.14Å; E491-K1188 IonicContact OE1-NZ 2.68Å; E491-K1188 PolarHBondContact OE1-NZ 2.82Å; E491-K1188 WeakPolarHBondContact OE2-CE 3.4Å; E491-K1188 IonicContact OE2-NZ 2.91Å; E491-K1188 PolarHBondContact OE2-NZ 2.79Å; V1178-K1188 HydrophobicContact CG1-CB 4.19Å; V1178-K1188 HydrophobicContact CG1-CG 4.16Å
1189	V	94.5	Very high	89.2	Confident	0 Å²	0	23.1 Å²	23.1	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	151.7	-179.5	-65.3	0	0	0	0	111.3	G47 F1142 Y1158 Q1176 S1177 Y1179	G47-V1189 CarbonylContact O-C 3.46Å; G47-V1189 VanDerWaalsContact O-CA 3.28Å; G47-V1189 WeakPolarHBondContact O-CA 3.1Å; F1142-V1189 HydrophobicContact CE2-CG2 4.43Å; Y1158-V1189 HydrophobicContact CE1-CG1 4.01Å; Q1176-V1189 CarbonylContact C-O 3.49Å; Q1176-V1189 WeakPolarHBondContact CA-O 3.31Å; S1177-V1189 PolarHBondContact N-O 3.16Å; S1177-V1189 WeakPolarHBondContact O-CG2 3.27Å; S1177-V1189 PolarHBondContact O-N 2.76Å; Y1179-V1189 HydrophobicContact CD1-CG2 4.42Å; Y1179-V1189 HydrophobicContact CE1-CG1 3.66Å; Y1179-V1189 HydrophobicContact CE1-CG2 4.16Å
1190	T	94.1	Very high	88.1	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	149.8	171.4	-178.7	0	0	0	0	110	V46 G47 I49 G1175 A1192 V1195 C1196	V46-T1190 CarbonylContact C-O 3.43Å; V46-T1190 VanDerWaalsContact CA-O 3.29Å; V46-T1190 WeakPolarHBondContact CA-O 3.37Å; G47-T1190 PolarHBondContact N-O 3.11Å; G47-T1190 PolarHBondContact O-N 3.41Å; I49-T1190 HydrophobicContact CD1-CG2 4.17Å; I49-T1190 HydrophobicContact CG1-CG2 4Å; G1175-T1190 CarbonylContact O-C 3.55Å; G1175-T1190 WeakPolarHBondContact O-CA 3.2Å; T1190-A1192 WeakPolarHBondContact OG1-CB 3.26Å; T1190-A1192 PolarHBondContact OG1-N 3.21Å; T1190-V1195 HydrophobicContact CG2-CB 4.01Å; T1190-V1195 HydrophobicContact CG2-CG1 3.79Å; T1190-C1196 VanDerWaalsContact CG2-SG 3.58Å
1191	W	94.8	Very high	87.2	Confident	2 Å²	2	35.8 Å²	35.8	1%	0.008	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	-6.4	171.4	-60.6	35.4	0	0	0	110.2	F44 Q45 F1132 A1134 F1142 A1144 M1154 F1171 G1175 S1177	F44-W1191 CarbonylContact C-O 3.56Å; F44-W1191 VanDerWaalsContact CA-O 3.25Å; F44-W1191 WeakPolarHBondContact CA-O 3.34Å; Q45-W1191 PolarHBondContact N-O 2.87Å; Q45-W1191 CarbonylContact O-C 3.54Å; Q45-W1191 VanDerWaalsContact O-CA 3.25Å; Q45-W1191 WeakPolarHBondContact O-CA 3.45Å; Q45-W1191 VanDerWaalsContact O-O 3.1Å; F1132-W1191 HydrophobicContact CE2-CE3 4.08Å; F1132-W1191 HydrophobicContact CE2-CZ3 4.45Å; A1134-W1191 HydrophobicContact CB-CE3 4.29Å; A1134-W1191 HydrophobicContact CB-CH2 3.89Å; A1134-W1191 HydrophobicContact CB-CZ3 3.68Å; F1142-W1191 HydrophobicContact CB-CH2 3.62Å; F1142-W1191 HydrophobicContact CB-CZ2 3.67Å; F1142-W1191 HydrophobicContact CB-CZ3 4.16Å; F1142-W1191 HydrophobicContact CD1-CH2 4.26Å; F1142-W1191 AromaticContact CD1-CZ2 3.75Å; F1142-W1191 HydrophobicContact CD1-CZ2 3.75Å; F1142-W1191 HydrophobicContact CD2-CD2 4.49Å; F1142-W1191 AromaticContact CD2-CE2 3.66Å; F1142-W1191 HydrophobicContact CD2-CH2 4.46Å; F1142-W1191 AromaticContact CD2-CZ2 3.64Å; F1142-W1191 HydrophobicContact CD2-CZ2 3.64Å; F1142-W1191 AromaticContact CD2-NE1 3.73Å; F1142-W1191 HydrophobicContact CE1-CZ2 4.3Å; F1142-W1191 HydrophobicContact CE2-CZ2 4.2Å; F1142-W1191 AromaticContact CE2-NE1 3.82Å; F1142-W1191 AromaticContact CG-CE2 3.92Å; F1142-W1191 AromaticContact CG-CH2 3.89Å; F1142-W1191 HydrophobicContact CG-CH2 3.89Å; F1142-W1191 AromaticContact CG-CZ2 3.4Å; F1142-W1191 HydrophobicContact CG-CZ2 3.4Å; F1142-W1191 VanDerWaalsContact CG-CZ2 3.4Å; A1144-W1191 HydrophobicContact CB-CE3 4.34Å; A1144-W1191 HydrophobicContact CB-CZ3 4.2Å; M1154-W1191 HydrophobicContact CE-CB 4.38Å; M1154-W1191 HydrophobicContact CE-CD2 3.65Å; M1154-W1191 HydrophobicContact CE-CE3 3.16Å; M1154-W1191 HydrophobicContact CE-CG 4.2Å; M1154-W1191 HydrophobicContact CE-CH2 4.4Å; M1154-W1191 HydrophobicContact CE-CZ3 3.6Å; F1171-W1191 AromaticContact CE1-CH2 3.96Å; F1171-W1191 HydrophobicContact CE1-CH2 3.96Å; F1171-W1191 AromaticContact CE1-CZ2 3.7Å; F1171-W1191 HydrophobicContact CE1-CZ2 3.7Å; F1171-W1191 HydrophobicContact CZ-CH2 4.47Å; F1171-W1191 HydrophobicContact CZ-CZ2 4.46Å; G1175-W1191 WeakPolarHBondContact O-CB 3.5Å; G1175-W1191 VanDerWaalsContact O-CD1 3.28Å; G1175-W1191 PolarHBondContact O-N 2.83Å; S1177-W1191 PolarHBondContact OG-NE1 2.81Å
1192	A	93	Very high	86.4	Confident	1 Å²	1	35.9 Å²	35.9	1%	0.008	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	124.8	-176	0	0	0	0	0	110.9	L1119 T1190 D1194 V1195 C1196	L1119-A1192 HydrophobicContact CD1-CB 3.49Å; L1119-A1192 VanDerWaalsContact CD1-CB 3.49Å; T1190-A1192 WeakPolarHBondContact OG1-CB 3.26Å; T1190-A1192 PolarHBondContact OG1-N 3.21Å; A1192-D1194 WeakPolarHBondContact CB-OD1 3.23Å; A1192-D1194 PolarHBondContact O-N 3.43Å; A1192-V1195 HydrophobicContact CB-CB 4.16Å; A1192-V1195 HydrophobicContact CB-CG2 3.84Å; A1192-V1195 PolarHBondContact O-N 3.15Å; A1192-C1196 PolarHBondContact O-N 3.28Å; A1192-C1196 PolarHBondContact O-SG 3.25Å; A1192-C1196 VanDerWaalsContact O-SG 3.33Å
1193	S	92.6	Very high	85.9	Confident	30 Å²	30	38.7 Å²	38.7	21%	0.21	21%	0.206	C	C	.	.	H	α-helix	trans	-68.5	-31.9	-177.2	-176.3	0	0	0	0	113.6	E42 H43 Q45 C1196 A1197	E42-S1193 WeakPolarHBondContact O-CB 2.96Å; H43-S1193 WeakPolarHBondContact O-CB 3.37Å; H43-S1193 PolarHBondContact O-N 2.72Å; Q45-S1193 PolarHBondContact OE1-OG 3.46Å; S1193-C1196 WeakPolarHBondContact O-CB 3.29Å; S1193-C1196 PolarHBondContact O-N 3.36Å; S1193-A1197 PolarHBondContact O-N 2.8Å
1194	D	87.6	Confident	85.6	Confident	41 Å²	41	36.4 Å²	36.4	22%	0.219	19%	0.194	C	C	.	.	H	α-helix	trans	-65.2	-45.8	174.2	62.4	-32.4	0	0	0	112.1	A1192 C1196 A1197 N1198	A1192-D1194 WeakPolarHBondContact CB-OD1 3.23Å; A1192-D1194 PolarHBondContact O-N 3.43Å; D1194-C1196 VanDerWaalsContact C-N 3.3Å; D1194-C1196 PolarHBondContact O-N 3.37Å; D1194-A1197 WeakPolarHBondContact O-CB 3.41Å; D1194-A1197 PolarHBondContact O-N 2.92Å; D1194-N1198 PolarHBondContact O-N 3.45Å; D1194-N1198 VanDerWaalsContact O-N 3.11Å; D1194-N1198 PolarHBondContact O-ND2 2.84Å
1195	V	87.6	Confident	85.7	Confident	30 Å²	30	40.2 Å²	40.2	18%	0.182	21%	0.212	C	C	.	.	H	α-helix	trans	-62.7	-41.5	173.6	-176.6	0	0	0	0	109.7	I49 T1190 A1192 A1197 N1198 L1199 M1202	I49-V1195 HydrophobicContact CD1-CG1 4.36Å; T1190-V1195 HydrophobicContact CG2-CB 4.01Å; T1190-V1195 HydrophobicContact CG2-CG1 3.79Å; A1192-V1195 HydrophobicContact CB-CB 4.16Å; A1192-V1195 HydrophobicContact CB-CG2 3.84Å; A1192-V1195 PolarHBondContact O-N 3.15Å; V1195-A1197 VanDerWaalsContact C-N 3.33Å; V1195-A1197 PolarHBondContact O-N 3.29Å; V1195-N1198 CarbonylContact O-C 3.55Å; V1195-N1198 PolarHBondContact O-N 2.77Å; V1195-N1198 VanDerWaalsContact O-N 3.14Å; V1195-L1199 WeakPolarHBondContact O-CG 3.32Å; V1195-L1199 PolarHBondContact O-N 2.96Å; V1195-M1202 HydrophobicContact CG1-CE 3.96Å
1196	C	88.6	Confident	85.7	Confident	13 Å²	13	40.1 Å²	40.1	9%	0.088	21%	0.211	C	C	.	.	H	α-helix	trans	-57.7	-41.9	174	-75.5	0	0	0	0	113.1	Q45 T1190 A1192 S1193 D1194 N1198 L1199	Q45-C1196 HydrophobicContact CB-CB 4.13Å; Q45-C1196 HydrophobicContact CG-CB 4.08Å; Q45-C1196 PolarHBondContact O-SG 2.89Å; T1190-C1196 VanDerWaalsContact CG2-SG 3.58Å; A1192-C1196 PolarHBondContact O-N 3.28Å; A1192-C1196 PolarHBondContact O-SG 3.25Å; A1192-C1196 VanDerWaalsContact O-SG 3.33Å; S1193-C1196 WeakPolarHBondContact O-CB 3.29Å; S1193-C1196 PolarHBondContact O-N 3.36Å; D1194-C1196 VanDerWaalsContact C-N 3.3Å; D1194-C1196 PolarHBondContact O-N 3.37Å; C1196-N1198 VanDerWaalsContact C-N 3.27Å; C1196-N1198 PolarHBondContact O-N 2.86Å; C1196-L1199 HydrophobicContact CB-CD1 4.45Å; C1196-L1199 WeakPolarHBondContact O-CB 3.33Å; C1196-L1199 PolarHBondContact O-N 3.43Å
1197	A	85.7	Confident	85.7	Confident	65 Å²	65	41.1 Å²	41.1	54%	0.537	22%	0.215	S	C	.	.	H	α-helix	trans	-63.9	-35.6	177.6	0	0	0	0	0	111.7	S1193 D1194 V1195	S1193-A1197 PolarHBondContact O-N 2.8Å; D1194-A1197 WeakPolarHBondContact O-CB 3.41Å; D1194-A1197 PolarHBondContact O-N 2.92Å; V1195-A1197 VanDerWaalsContact C-N 3.33Å; V1195-A1197 PolarHBondContact O-N 3.29Å
1198	N	82.7	Confident	85.7	Confident	87 Å²	87	42.5 Å²	42.5	47%	0.465	22%	0.223	S	C	.	.	H	α-helix	trans	-88.2	-5.7	-179.4	-64.6	-20.8	0	0	0	114.3	D1194 V1195 C1196 R1200 D1201 M1202	D1194-N1198 PolarHBondContact O-N 3.45Å; D1194-N1198 VanDerWaalsContact O-N 3.11Å; D1194-N1198 PolarHBondContact O-ND2 2.84Å; V1195-N1198 CarbonylContact O-C 3.55Å; V1195-N1198 PolarHBondContact O-N 2.77Å; V1195-N1198 VanDerWaalsContact O-N 3.14Å; C1196-N1198 VanDerWaalsContact C-N 3.27Å; C1196-N1198 PolarHBondContact O-N 2.86Å; N1198-R1200 PolarHBondContact O-N 3.5Å; N1198-R1200 VanDerWaalsContact O-N 3.08Å; N1198-D1201 PolarHBondContact O-N 2.93Å; N1198-M1202 PolarHBondContact O-N 3.45Å
1199	L	80.2	Confident	85.5	Confident	26 Å²	26	48 Å²	48	14%	0.136	26%	0.26	C	S	.	.	H	α-helix	trans	-52	-35.6	177.4	-74.2	175.4	0	0	0	112.3	I49 V1195 C1196 D1201 M1202 Q1203	I49-L1199 HydrophobicContact CB-CD2 4.2Å; I49-L1199 HydrophobicContact CG1-CD2 3.9Å; I49-L1199 HydrophobicContact CG2-CD2 4.38Å; V1195-L1199 WeakPolarHBondContact O-CG 3.32Å; V1195-L1199 PolarHBondContact O-N 2.96Å; C1196-L1199 HydrophobicContact CB-CD1 4.45Å; C1196-L1199 WeakPolarHBondContact O-CB 3.33Å; C1196-L1199 PolarHBondContact O-N 3.43Å; L1199-D1201 PolarHBondContact O-N 3.02Å; L1199-M1202 HydrophobicContact CD2-CE 3.66Å; L1199-M1202 HydrophobicContact CG-CE 4.39Å; L1199-M1202 PolarHBondContact O-N 3.25Å; L1199-Q1203 WeakPolarHBondContact O-CG 3.24Å; L1199-Q1203 PolarHBondContact O-N 2.85Å; L1199-Q1203 VanDerWaalsContact O-N 3.16Å
1200	R	72.4	Confident	85.2	Confident	169 Å²	169	50.2 Å²	50.2	64%	0.638	28%	0.275	S	S	*	.	H	α-helix	trans	-64.2	-30.3	179.2	-65.9	-175.6	-179.8	-173.8	1.3	113	K128 N1198	K128-R1200 WeakPolarHBondContact CD-O 3.34Å; K128-R1200 PolarHBondContact NZ-O 2.98Å; N1198-R1200 PolarHBondContact O-N 3.5Å; N1198-R1200 VanDerWaalsContact O-N 3.08Å
1201	D	72.5	Confident	85	Confident	110 Å²	110	57.7 Å²	57.7	59%	0.588	32%	0.316	S	S	*	.	H	α-helix	trans	-84.4	-21.5	-180	-63.5	-27.3	0	0	0	111.7	N1198 L1199	N1198-D1201 PolarHBondContact O-N 2.93Å; L1199-D1201 PolarHBondContact O-N 3.02Å
1202	M	71.7	Confident	84.8	Confident	65 Å²	65	61 Å²	61	32%	0.32	33%	0.332	S	S	.	.	H	α-helix	trans	-81.7	-22	173.8	-65.4	-171.1	-77.7	0	0	113.3	V1195 N1198 L1199	V1195-M1202 HydrophobicContact CG1-CE 3.96Å; N1198-M1202 PolarHBondContact O-N 3.45Å; L1199-M1202 HydrophobicContact CD2-CE 3.66Å; L1199-M1202 HydrophobicContact CG-CE 4.39Å; L1199-M1202 PolarHBondContact O-N 3.25Å
1203	Q	74.3	Confident	84.5	Confident	73 Å²	73	63.1 Å²	63.1	34%	0.341	35%	0.346	S	S	.	.	S	Bend	trans	-76.6	130.9	175.9	-73.5	176.2	-21.6	0	0	111.9	N129 L1199	N129-Q1203 PolarHBondContact OD1-OE1 3.07Å; L1199-Q1203 WeakPolarHBondContact O-CG 3.24Å; L1199-Q1203 PolarHBondContact O-N 2.85Å; L1199-Q1203 VanDerWaalsContact O-N 3.16Å
1204	G	77.6	Confident	84	Confident	15 Å²	15	69 Å²	69	16%	0.155	37%	0.37	C	S	.	.	P	Polyproline II helix	trans	-68.8	158.5	169.5	0	0	0	0	0	113.1	E481	E481-G1204 CarbonylContact O-C 3.37Å; E481-G1204 WeakPolarHBondContact O-CA 3.23Å
1205	E	85.4	Confident	83.8	Confident	85 Å²	85	70.9 Å²	70.9	40%	0.397	38%	0.384	S	S	.	.	B	Isolated β-bridge	trans	-87.5	117.8	168.8	-67	-177.9	-173	0	0	109.1	G480 E481 L1208	G480-E1205 CarbonylContact C-O 3.49Å; G480-E1205 WeakPolarHBondContact CA-O 3.28Å; E481-E1205 PolarHBondContact N-O 3.2Å; E481-E1205 PolarHBondContact O-N 2.88Å; E1205-L1208 HydrophobicContact CB-CD2 4.13Å
1206	I	89.1	Confident	83.2	Confident	13 Å²	13	71.3 Å²	71.3	7%	0.067	39%	0.388	C	S	.	.	S	Bend	trans	-77.6	-42.3	-179.5	-70.4	171.4	0	0	0	111.3	I69 I81 V87 C89	I69-I1206 HydrophobicContact CD1-CG2 3.84Å; I69-I1206 HydrophobicContact CG2-CG2 4.23Å; I81-I1206 HydrophobicContact CB-CD1 4.43Å; I81-I1206 HydrophobicContact CG2-CG2 3.89Å; V87-I1206 HydrophobicContact CG1-CG1 3.89Å; C89-I1206 HydrophobicContact CB-CD1 3.4Å; C89-I1206 WeakPolarHBondContact SG-CD1 3.25Å
1207	F	91.5	Very high	82.3	Confident	22 Å²	22	79 Å²	79	10%	0.096	42%	0.42	C	S	.	.			trans	-102	119.6	-176.2	-175.5	-88.8	0	0	0	109.8	Q67 N107 G109 R126	Q67-F1207 VanDerWaalsContact CD-CE2 3.49Å; Q67-F1207 HydrophobicContact CG-CD2 3.84Å; Q67-F1207 HydrophobicContact CG-CE2 3.75Å; N107-F1207 WeakPolarHBondContact O-CZ 3.12Å; G109-F1207 VanDerWaalsContact CA-CD2 3.44Å; G109-F1207 VanDerWaalsContact CA-CE2 3.42Å; R126-F1207 HydrophobicContact CB-CD1 4.44Å; R126-F1207 HydrophobicContact CG-CD1 3.95Å; R126-F1207 HydrophobicContact CG-CE1 4.23Å; R126-F1207 HydrophobicContact CG-CG 4.3Å; R126-F1207 VanDerWaalsContact NH1-CE1 3.26Å
1208	L	91.1	Very high	81.1	Confident	30 Å²	30	83.1 Å²	83.1	16%	0.157	43%	0.425	C	S	.	.			trans	-111.6	152.3	177.6	-61.8	175.6	0	0	0	110.7	Q67 E481 E1205 S1210	Q67-L1208 PolarHBondContact NE2-O 2.86Å; Q67-L1208 PolarHBondContact OE1-O 3.05Å; E481-L1208 HydrophobicContact CB-CD1 4.2Å; E481-L1208 HydrophobicContact CB-CD2 4.19Å; E481-L1208 HydrophobicContact CG-CD1 3.78Å; E481-L1208 HydrophobicContact CG-CD2 4.46Å; E1205-L1208 HydrophobicContact CB-CD2 4.13Å; L1208-S1210 PolarHBondContact O-N 3.17Å
1209	P	88.6	Confident	80	Confident	131 Å²	131	84.6 Å²	84.6	85%	0.851	43%	0.433	S	S	*	.			trans	-60	112.1	168.3	-20.5	33	0	0	0	110.4
1210	S	88.6	Confident	78.7	Confident	46 Å²	46	90.2 Å²	90.2	32%	0.322	46%	0.457	S	S	.	.			trans	-127	145.5	178.1	-62.3	0	0	0	0	110.3	Q67 N107 L1208 M1212	Q67-S1210 PolarHBondContact NE2-OG 3.13Å; N107-S1210 PolarHBondContact ND2-O 3.35Å; L1208-S1210 PolarHBondContact O-N 3.17Å; S1210-M1212 PolarHBondContact O-N 2.85Å
1211	N	89	Confident	77.7	Confident	158 Å²	158	89.5 Å²	89.5	85%	0.845	46%	0.459	S	S	*	.	P	Polyproline II helix	trans	-75.2	125.8	176.1	-70.4	-34.3	0	0	0	110
1212	M	90.9	Very high	76.4	Confident	70 Å²	70	91.2 Å²	91.2	35%	0.345	46%	0.461	S	S	.	.	P	Polyproline II helix	trans	-66.8	129.1	170.9	-170.4	67.4	173	0	0	108.9	V66 V106 N107 V150 P387 Y388 S1210	V66-M1212 HydrophobicContact CG2-SD 3.96Å; V106-M1212 HydrophobicContact CG1-CE 4.14Å; V106-M1212 HydrophobicContact CG1-SD 4.33Å; N107-M1212 HydrophobicContact CB-SD 3.89Å; N107-M1212 PolarHBondContact ND2-N 2.94Å; V150-M1212 HydrophobicContact CG1-CE 3.72Å; P387-M1212 HydrophobicContact CG-CE 3.88Å; Y388-M1212 WeakPolarHBondContact OH-CE 3.49Å; S1210-M1212 PolarHBondContact O-N 2.85Å
1213	P	86.5	Confident	75.2	Confident	46 Å²	46	91.4 Å²	91.4	30%	0.299	46%	0.463	S	S	.	.	P	Polyproline II helix	trans	-55.1	145.2	170	-25.1	35.2	0	0	0	111.3	V66 Y388	V66-P1213 HydrophobicContact CG2-CG 4.25Å; Y388-P1213 HydrophobicContact CE2-CB 4.44Å; Y388-P1213 WeakPolarHBondContact CE2-O 3.28Å; Y388-P1213 PolarHBondContact OH-O 2.82Å
1214	E	83	Confident	74.1	Confident	153 Å²	153	93.9 Å²	93.9	72%	0.715	48%	0.478	S	S	*	.	P	Polyproline II helix	trans	-64.9	136.2	176.3	-69.3	-174.2	179.1	0	0	110.5
1215	P	82.2	Confident	73	Confident	81 Å²	81	100.4 Å²	100.4	53%	0.526	51%	0.509	S	S	.	.	P	Polyproline II helix	trans	-63.1	147	173.8	26.7	-33.6	0	0	0	110.6	Y388 K1217	Y388-P1215 HydrophobicContact CE1-CB 4.05Å; Y388-P1215 VanDerWaalsContact CE2-CA 3.49Å; Y388-P1215 HydrophobicContact CE2-CB 4.18Å; P1215-K1217 PolarHBondContact O-N 3.02Å
1216	P	76.4	Confident	71	Confident	40 Å²	40	100 Å²	100	26%	0.26	52%	0.515	S	S	.	.	P	Polyproline II helix	trans	-57.8	130.9	-178.5	17.6	-28	0	0	0	111	S390 E391 K1218	S390-P1216 WeakPolarHBondContact OG-CG 3.36Å; E391-P1216 HydrophobicContact CB-CB 4.47Å; P1216-K1218 PolarHBondContact O-N 3.5Å
1217	K	69.8	Low	68.8	Low	174 Å²	174	102.8 Å²	102.8	76%	0.757	55%	0.548	S	S	*	.			trans	-63.9	109.8	178.6	-67.4	-179.5	-177.6	175.1	0	108.6	P1215 N1219	P1215-K1217 PolarHBondContact O-N 3.02Å; K1217-N1219 PolarHBondContact O-N 2.71Å
1218	K	60.8	Low	66.4	Low	151 Å²	151	106.2 Å²	106.2	66%	0.657	57%	0.57	S	S	*	*			trans	-59.8	111.3	167.8	-68.7	-172.2	179.3	-175.7	0	107.4	P1216 F1220	P1216-K1218 PolarHBondContact O-N 3.5Å; K1218-F1220 PolarHBondContact O-N 2.61Å
1219	N	58.4	Low	64.1	Low	118 Å²	118	111.4 Å²	111.4	63%	0.631	60%	0.597	S	S	*	*			trans	-54	101.1	-178.3	-79	-23.2	0	0	0	110.5	K1217 F1221 K1222	K1217-N1219 PolarHBondContact O-N 2.71Å; N1219-F1221 PolarHBondContact O-N 2.79Å; N1219-F1221 VanDerWaalsContact O-N 3.08Å; N1219-K1222 HydrophobicContact CB-CB 4.33Å; N1219-K1222 PolarHBondContact O-N 2.83Å
1220	F	54.1	Low	62.3	Low	145 Å²	145	108.2 Å²	108.2	64%	0.636	58%	0.576	S	S	*	*	H	α-helix	trans	-49.6	-36.9	178.3	178.5	-98	0	0	0	111.9	K1218 K1222 N1223 L1224	K1218-F1220 PolarHBondContact O-N 2.61Å; F1220-K1222 VanDerWaalsContact C-N 3.34Å; F1220-K1222 PolarHBondContact O-N 2.8Å; F1220-N1223 PolarHBondContact O-N 3.29Å; F1220-L1224 PolarHBondContact O-N 3.35Å
1221	F	49.6	Very low	60.8	Low	153 Å²	153	108.6 Å²	108.6	67%	0.671	58%	0.578	S	S	*	*	H	α-helix	trans	-66.2	-27.3	178.8	-69.2	-75.4	0	0	0	114.8	N1219 N1223 L1225	N1219-F1221 PolarHBondContact O-N 2.79Å; N1219-F1221 VanDerWaalsContact O-N 3.08Å; F1221-N1223 VanDerWaalsContact C-N 3.33Å; F1221-L1225 PolarHBondContact O-N 2.82Å
1222	K	46.2	Very low	59.6	Low	146 Å²	146	105.7 Å²	105.7	64%	0.635	57%	0.57	S	S	*	*	H	α-helix	trans	-72.3	-33.2	176.8	-144.3	179.7	-173.5	-179.9	0	111	N1219 F1220 S1226	N1219-K1222 HydrophobicContact CB-CB 4.33Å; N1219-K1222 PolarHBondContact O-N 2.83Å; F1220-K1222 VanDerWaalsContact C-N 3.34Å; F1220-K1222 PolarHBondContact O-N 2.8Å; K1222-S1226 WeakPolarHBondContact O-CB 3.34Å; K1222-S1226 PolarHBondContact O-N 2.91Å
1223	N	45.7	Very low	58.9	Low	69 Å²	69	104.2 Å²	104.2	37%	0.369	56%	0.564	S	S	.	*	H	α-helix	trans	-73.5	-31.7	177.2	-68.4	-9.3	0	0	0	112.4	F1220 F1221	F1220-N1223 PolarHBondContact O-N 3.29Å; F1221-N1223 VanDerWaalsContact C-N 3.33Å
1224	L	52.4	Low	58.7	Low	125 Å²	125	106.2 Å²	106.2	65%	0.654	57%	0.572	S	S	*	*	H	α-helix	trans	-72.2	-36.2	176.4	-157	83.1	0	0	0	112.4	F1220	F1220-L1224 PolarHBondContact O-N 3.35Å
1225	L	53.6	Low	58.8	Low	153 Å²	153	100.8 Å²	100.8	80%	0.801	55%	0.545	S	S	*	.	H	α-helix	trans	-90.5	-23.9	-175.5	-68.1	168.9	0	0	0	114.2	F1221	F1221-L1225 PolarHBondContact O-N 2.82Å
1226	S	44.3	Very low	59	Low	75 Å²	75	100.5 Å²	100.5	52%	0.524	54%	0.539	S	S	.	.	S	Bend	trans	-92.1	-3.6	-175.7	-173.1	0	0	0	0	114.6	K1222 T1228	K1222-S1226 WeakPolarHBondContact O-CB 3.34Å; K1222-S1226 PolarHBondContact O-N 2.91Å; S1226-T1228 PolarHBondContact O-N 3.43Å; S1226-T1228 PolarHBondContact O-OG1 2.98Å
1227	G	42.3	Very low	59.4	Low	73 Å²	73	105.2 Å²	105.2	75%	0.753	56%	0.557	S	S	*	*			trans	59.9	-3.3	175.6	0	0	0	0	0	116.6
1228	T	41.2	Very low	60.3	Low	93 Å²	93	97.5 Å²	97.5	57%	0.571	52%	0.524	S	S	*	.			trans	-109.6	89.1	-177.4	-39.3	0	0	0	0	106.8	S1226 V1230	S1226-T1228 PolarHBondContact O-N 3.43Å; S1226-T1228 PolarHBondContact O-OG1 2.98Å; T1228-V1230 PolarHBondContact O-N 2.81Å
1229	L	42.5	Very low	61.6	Low	139 Å²	139	90.3 Å²	90.3	73%	0.728	49%	0.493	S	S	*	.			trans	-61	102.3	167.9	-74.5	162.6	0	0	0	107.4	S1231	L1229-S1231 PolarHBondContact O-N 3.37Å
1230	V	51.4	Low	62.9	Low	65 Å²	65	85 Å²	85	39%	0.394	47%	0.466	S	S	.	.			trans	-69.9	82.1	159.6	-173.8	0	0	0	0	105.6	T1228 S1232	T1228-V1230 PolarHBondContact O-N 2.81Å; V1230-S1232 PolarHBondContact O-N 3.26Å
1231	S	56.5	Low	64.3	Low	53 Å²	53	82 Å²	82	37%	0.371	45%	0.453	S	S	.	.			trans	-54.1	123.3	167.8	59.4	0	0	0	0	107	N207 K224 L1229 L1233	N207-S1231 PolarHBondContact ND2-O 3.32Å; K224-S1231 PolarHBondContact NZ-OG 3.29Å; L1229-S1231 PolarHBondContact O-N 3.37Å; S1231-L1233 PolarHBondContact O-N 3.25Å
1232	S	63.3	Low	65.7	Low	97 Å²	97	80.1 Å²	80.1	68%	0.678	47%	0.467	S	S	*	.			trans	-58.7	114.9	167.8	50.5	0	0	0	0	107.6	V1230 D1234	V1230-S1232 PolarHBondContact O-N 3.26Å; S1232-D1234 PolarHBondContact O-N 3.03Å
1233	L	76.7	Confident	67.4	Low	40 Å²	40	76.2 Å²	76.2	21%	0.209	46%	0.458	C	S	.	.			trans	-63.1	130.8	171.9	179	68.7	0	0	0	108.6	N207 L223 K224 S1231 R1235 L1238	N207-L1233 WeakPolarHBondContact OD1-CB 3.18Å; N207-L1233 PolarHBondContact OD1-N 3.3Å; L223-L1233 HydrophobicContact CB-CD2 3.64Å; K224-L1233 HydrophobicContact CB-CD1 4.36Å; K224-L1233 HydrophobicContact CB-CD2 4.39Å; K224-L1233 HydrophobicContact CG-CD1 4.33Å; S1231-L1233 PolarHBondContact O-N 3.25Å; L1233-R1235 PolarHBondContact O-N 3.13Å; L1233-R1235 VanDerWaalsContact O-N 3.1Å; L1233-L1238 HydrophobicContact CD2-CB 4.49Å; L1233-L1238 HydrophobicContact CD2-CD2 3.79Å
1234	D	81.7	Confident	69.1	Low	88 Å²	88	74.4 Å²	74.4	47%	0.471	45%	0.451	S	S	.	.			trans	-71.3	105.6	168.7	-171	-17.7	0	0	0	108.6	S1232 D1236 E1237 L1238	S1232-D1234 PolarHBondContact O-N 3.03Å; D1234-D1236 VanDerWaalsContact C-N 3.28Å; D1234-D1236 WeakPolarHBondContact OD1-CB 3.28Å; D1234-D1236 PolarHBondContact OD1-N 2.83Å; D1234-E1237 HydrophobicContact CB-CB 3.83Å; D1234-E1237 PolarHBondContact O-N 3.2Å; D1234-E1237 PolarHBondContact OD1-N 3.48Å; D1234-L1238 PolarHBondContact O-N 3.17Å
1235	R	85.1	Confident	70.6	Confident	39 Å²	39	69.9 Å²	69.9	15%	0.147	43%	0.434	C	S	.	.	H	α-helix	trans	-69.5	-29.2	-179.7	-70.8	179	173.3	160.1	-2.7	112	E201 S206 L1233 E1237 L1238 F1239	E201-R1235 IonicContact OE1-CZ 3.06Å; E201-R1235 IonicContact OE1-NH1 3.4Å; E201-R1235 IonicContact OE1-NH2 3.13Å; E201-R1235 PolarHBondContact OE1-NH2 3.37Å; E201-R1235 IonicContact OE2-CZ 3.64Å; E201-R1235 IonicContact OE2-NH1 2.75Å; E201-R1235 PolarHBondContact OE2-NH1 2.97Å; E201-R1235 IonicContact OE2-NH2 3.73Å; E201-R1235 PolarHBondContact OE2-NH2 3.32Å; S206-R1235 PolarHBondContact O-NH2 3.24Å; L1233-R1235 PolarHBondContact O-N 3.13Å; L1233-R1235 VanDerWaalsContact O-N 3.1Å; R1235-E1237 VanDerWaalsContact C-N 3.32Å; R1235-L1238 PolarHBondContact O-N 3.04Å; R1235-F1239 HydrophobicContact CB-CD2 3.96Å; R1235-F1239 HydrophobicContact CB-CE2 4.01Å; R1235-F1239 HydrophobicContact CG-CE2 4.07Å; R1235-F1239 WeakPolarHBondContact O-CB 3.39Å; R1235-F1239 VanDerWaalsContact O-CD2 3.3Å; R1235-F1239 WeakPolarHBondContact O-CD2 3.26Å; R1235-F1239 PolarHBondContact O-N 3.09Å
1236	D	85.8	Confident	71.8	Confident	74 Å²	74	69.8 Å²	69.8	40%	0.396	43%	0.427	S	S	.	.	H	α-helix	trans	-70.8	-34.8	175.1	-69.7	-31.5	0	0	0	110.3	W154 D1234 G1240	W154-D1236 PolarHBondContact NE1-OD1 2.63Å; D1234-D1236 VanDerWaalsContact C-N 3.28Å; D1234-D1236 WeakPolarHBondContact OD1-CB 3.28Å; D1234-D1236 PolarHBondContact OD1-N 2.83Å; D1236-G1240 WeakPolarHBondContact O-CA 3.48Å; D1236-G1240 PolarHBondContact O-N 3.34Å
1237	E	85.8	Confident	73.4	Confident	139 Å²	139	66.9 Å²	66.9	65%	0.65	41%	0.409	S	S	*	.	H	α-helix	trans	-67	-37.3	169.2	-166.7	-173.5	176.1	0	0	111.8	D1234 R1235 S1243	D1234-E1237 HydrophobicContact CB-CB 3.83Å; D1234-E1237 PolarHBondContact O-N 3.2Å; D1234-E1237 PolarHBondContact OD1-N 3.48Å; R1235-E1237 VanDerWaalsContact C-N 3.32Å; E1237-S1243 WeakPolarHBondContact O-CB 3.45Å; E1237-S1243 PolarHBondContact O-OG 3.5Å
1238	L	87.8	Confident	75.3	Confident	12 Å²	12	67.2 Å²	67.2	6%	0.063	40%	0.397	C	S	.	.	H	α-helix	trans	-74.3	-48.7	-179.3	178.1	64.9	0	0	0	113.4	Y177 L223 K226 L1233 D1234 R1235 S1243	Y177-L1238 HydrophobicContact CE2-CD1 4.4Å; L223-L1238 HydrophobicContact CB-CD2 3.77Å; L223-L1238 HydrophobicContact CD2-CD2 4.16Å; L223-L1238 HydrophobicContact CG-CD2 4.47Å; L223-L1238 WeakPolarHBondContact O-CD2 3.48Å; K226-L1238 HydrophobicContact CD-CD1 4.39Å; K226-L1238 HydrophobicContact CG-CD1 4.42Å; L1233-L1238 HydrophobicContact CD2-CB 4.49Å; L1233-L1238 HydrophobicContact CD2-CD2 3.79Å; D1234-L1238 PolarHBondContact O-N 3.17Å; R1235-L1238 PolarHBondContact O-N 3.04Å; L1238-S1243 PolarHBondContact O-OG 3.22Å
1239	F	89.9	Confident	76.9	Confident	1 Å²	1	68.3 Å²	68.3	0%	0.004	41%	0.405	C	S	.	.	H	α-helix	trans	-99.7	-11.4	-170.8	-54.4	-48.1	0	0	0	112.9	W154 Y156 F166 S175 Y177 L223 R1235 S1244	W154-F1239 HydrophobicContact CB-CD2 4.36Å; W154-F1239 AromaticContact CD1-CD2 3.96Å; W154-F1239 HydrophobicContact CD2-CB 3.79Å; W154-F1239 AromaticContact CD2-CD2 3.69Å; W154-F1239 HydrophobicContact CD2-CD2 3.69Å; W154-F1239 HydrophobicContact CD2-CG 4.16Å; W154-F1239 AromaticContact CE2-CD2 3.94Å; W154-F1239 HydrophobicContact CE3-CB 3.73Å; W154-F1239 HydrophobicContact CE3-CD2 4.19Å; W154-F1239 HydrophobicContact CE3-CG 4.27Å; W154-F1239 AromaticContact CG-CD2 3.74Å; W154-F1239 HydrophobicContact CG-CD2 3.74Å; W154-F1239 HydrophobicContact CG-CE2 4.37Å; W154-F1239 VanDerWaalsContact CH2-C 3.44Å; W154-F1239 HydrophobicContact CH2-CB 3.44Å; W154-F1239 VanDerWaalsContact CH2-CB 3.44Å; W154-F1239 WeakPolarHBondContact CH2-O 2.96Å; W154-F1239 HydrophobicContact CZ2-CB 3.5Å; W154-F1239 HydrophobicContact CZ3-CB 3.57Å; Y156-F1239 HydrophobicContact CE1-CE2 4.31Å; F166-F1239 HydrophobicContact CB-CD1 4.38Å; F166-F1239 HydrophobicContact CB-CG 4.48Å; F166-F1239 HydrophobicContact CD1-CD1 4.03Å; F166-F1239 HydrophobicContact CD1-CD2 4.29Å; F166-F1239 AromaticContact CD1-CE1 3.58Å; F166-F1239 HydrophobicContact CD1-CE1 3.58Å; F166-F1239 AromaticContact CD1-CE2 3.88Å; F166-F1239 HydrophobicContact CD1-CE2 3.88Å; F166-F1239 HydrophobicContact CD1-CG 4.36Å; F166-F1239 AromaticContact CD1-CZ 3.49Å; F166-F1239 HydrophobicContact CD1-CZ 3.49Å; F166-F1239 VanDerWaalsContact CD1-CZ 3.49Å; F166-F1239 HydrophobicContact CD2-CD1 4.41Å; F166-F1239 HydrophobicContact CD2-CE1 4.2Å; F166-F1239 HydrophobicContact CE1-CD1 4.48Å; F166-F1239 AromaticContact CE1-CE1 3.61Å; F166-F1239 HydrophobicContact CE1-CE1 3.61Å; F166-F1239 HydrophobicContact CE1-CE2 4.13Å; F166-F1239 AromaticContact CE1-CZ 3.39Å; F166-F1239 HydrophobicContact CE1-CZ 3.39Å; F166-F1239 HydrophobicContact CE2-CE1 4.21Å; F166-F1239 HydrophobicContact CG-CD1 4.02Å; F166-F1239 AromaticContact CG-CE1 3.92Å; F166-F1239 HydrophobicContact CG-CE1 3.92Å; F166-F1239 HydrophobicContact CG-CG 4.47Å; F166-F1239 HydrophobicContact CG-CZ 4.28Å; F166-F1239 AromaticContact CZ-CE1 3.94Å; F166-F1239 HydrophobicContact CZ-CE1 3.94Å; F166-F1239 HydrophobicContact CZ-CZ 4.09Å; S175-F1239 WeakPolarHBondContact CB-O 3.48Å; S175-F1239 WeakPolarHBondContact OG-CA 3.28Å; S175-F1239 PolarHBondContact OG-O 2.93Å; Y177-F1239 AromaticContact CD1-CD1 3.59Å; Y177-F1239 HydrophobicContact CD1-CD1 3.59Å; Y177-F1239 AromaticContact CD1-CE1 3.46Å; Y177-F1239 HydrophobicContact CD1-CE1 3.46Å; Y177-F1239 VanDerWaalsContact CD1-CE1 3.46Å; Y177-F1239 HydrophobicContact CE1-CD1 4.32Å; Y177-F1239 AromaticContact CE1-CE1 3.75Å; Y177-F1239 HydrophobicContact CE1-CE1 3.75Å; Y177-F1239 HydrophobicContact CG-CD1 4.01Å; Y177-F1239 HydrophobicContact CG-CE1 4.28Å; L223-F1239 HydrophobicContact CD1-CZ 4.06Å; L223-F1239 HydrophobicContact CD2-CE1 4.08Å; L223-F1239 HydrophobicContact CD2-CZ 3.82Å; R1235-F1239 HydrophobicContact CB-CD2 3.96Å; R1235-F1239 HydrophobicContact CB-CE2 4.01Å; R1235-F1239 HydrophobicContact CG-CE2 4.07Å; R1235-F1239 WeakPolarHBondContact O-CB 3.39Å; R1235-F1239 VanDerWaalsContact O-CD2 3.3Å; R1235-F1239 WeakPolarHBondContact O-CD2 3.26Å; R1235-F1239 PolarHBondContact O-N 3.09Å; F1239-S1244 PolarHBondContact O-OG 2.74Å; F1239-S1244 VanDerWaalsContact O-OG 3.07Å
1240	G	85.4	Confident	78.8	Confident	5 Å²	5	63.7 Å²	63.7	5%	0.052	39%	0.392	C	S	.	.	S	Bend	trans	-63.8	160.8	179.9	0	0	0	0	0	113.3	D1236 A1242 S1243 S1244	D1236-G1240 WeakPolarHBondContact O-CA 3.48Å; D1236-G1240 PolarHBondContact O-N 3.34Å; G1240-A1242 PolarHBondContact O-N 3.46Å; G1240-S1243 PolarHBondContact O-N 2.85Å; G1240-S1243 PolarHBondContact O-OG 2.97Å; G1240-S1244 PolarHBondContact O-N 2.82Å; G1240-S1244 VanDerWaalsContact O-N 3.1Å; G1240-S1244 PolarHBondContact O-OG 2.98Å
1241	E	82	Confident	80.3	Confident	82 Å²	82	61.7 Å²	61.7	38%	0.383	38%	0.382	S	S	.	.	H	α-helix	trans	-63.6	-28.3	-178.4	-62	-171.1	172.1	0	0	112.7	S1243 G1245 K1246	E1241-S1243 PolarHBondContact O-N 3.1Å; E1241-G1245 WeakPolarHBondContact O-CA 3.41Å; E1241-G1245 PolarHBondContact O-N 3.14Å; E1241-K1246 HydrophobicContact CG-CG 4.12Å; E1241-K1246 VanDerWaalsContact OE1-CE 3.25Å; E1241-K1246 WeakPolarHBondContact OE1-CE 3.41Å; E1241-K1246 WeakPolarHBondContact OE2-CE 3.23Å; E1241-K1246 IonicContact OE2-NZ 3.73Å
1242	A	79.7	Confident	81.9	Confident	115 Å²	115	60.6 Å²	60.6	95%	0.95	37%	0.373	S	S	*	.	H	α-helix	trans	-65.7	-35.2	-177.9	0	0	0	0	0	113.2	G1240	G1240-A1242 PolarHBondContact O-N 3.46Å
1243	S	81.3	Confident	83.1	Confident	64 Å²	64	58 Å²	58	45%	0.448	35%	0.353	S	S	.	.	H	α-helix	trans	-102.5	-39.2	-174.6	59.4	0	0	0	0	113.2	E1237 L1238 G1240 E1241	E1237-S1243 WeakPolarHBondContact O-CB 3.45Å; E1237-S1243 PolarHBondContact O-OG 3.5Å; L1238-S1243 PolarHBondContact O-OG 3.22Å; G1240-S1243 PolarHBondContact O-N 2.85Å; G1240-S1243 PolarHBondContact O-OG 2.97Å; E1241-S1243 PolarHBondContact O-N 3.1Å
1244	S	82.4	Confident	83.7	Confident	31 Å²	31	60.1 Å²	60.1	22%	0.217	36%	0.364	C	S	.	.	H	α-helix	trans	-104.8	-11	-173.2	70.4	0	0	0	0	112.9	S175 G176 F1239 G1240	S175-S1244 PolarHBondContact OG-OG 2.73Å; G176-S1244 WeakPolarHBondContact CA-O 3.43Å; F1239-S1244 PolarHBondContact O-OG 2.74Å; F1239-S1244 VanDerWaalsContact O-OG 3.07Å; G1240-S1244 PolarHBondContact O-N 2.82Å; G1240-S1244 VanDerWaalsContact O-N 3.1Å; G1240-S1244 PolarHBondContact O-OG 2.98Å
1245	G	82.8	Confident	83.9	Confident	30 Å²	30	58.5 Å²	58.5	31%	0.309	36%	0.355	S	S	.	.			trans	73.9	-175.6	-170.8	0	0	0	0	0	112.5	G176 E1241	G176-G1245 WeakPolarHBondContact CA-O 3.49Å; G176-G1245 PolarHBondContact N-O 2.74Å; E1241-G1245 WeakPolarHBondContact O-CA 3.41Å; E1241-G1245 PolarHBondContact O-N 3.14Å
1246	K	80.7	Confident	83.3	Confident	150 Å²	150	60.9 Å²	60.9	65%	0.652	38%	0.376	S	S	*	.	B	Isolated β-bridge	trans	-79.5	152.8	170.1	-69.6	-176.4	175.4	-179	0	110	E1241	E1241-K1246 HydrophobicContact CG-CG 4.12Å; E1241-K1246 VanDerWaalsContact OE1-CE 3.25Å; E1241-K1246 WeakPolarHBondContact OE1-CE 3.41Å; E1241-K1246 WeakPolarHBondContact OE2-CE 3.23Å; E1241-K1246 IonicContact OE2-NZ 3.73Å
1247	G	77.8	Confident	82.2	Confident	14 Å²	14	59.5 Å²	59.5	14%	0.144	37%	0.368	C	S	.	.	P	Polyproline II helix	trans	-50	152.8	170.6	0	0	0	0	0	112.6	T174 S175	T174-G1247 PolarHBondContact O-N 2.9Å; T174-G1247 VanDerWaalsContact O-N 3.11Å; S175-G1247 WeakPolarHBondContact O-CA 3.19Å
1248	T	80.5	Confident	80.7	Confident	81 Å²	81	57 Å²	57	50%	0.497	37%	0.371	S	S	.	.	P	Polyproline II helix	trans	-47.2	124.5	-178	-56.1	0	0	0	0	111.5	G1250 A1251	T1248-G1250 PolarHBondContact O-N 2.69Å; T1248-A1251 VanDerWaalsContact O-CB 3.25Å; T1248-A1251 WeakPolarHBondContact O-CB 3.07Å; T1248-A1251 PolarHBondContact O-N 3.36Å
1249	P	76.5	Confident	78.9	Confident	115 Å²	115	64.9 Å²	64.9	75%	0.747	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.1	126.6	-179.1	-27.9	34.3	0	0	0	112.3	R140 A1251	R140-P1249 PolarHBondContact NH2-O 2.94Å; P1249-A1251 VanDerWaalsContact C-N 3.3Å; P1249-A1251 PolarHBondContact O-N 3.09Å
1250	G	80.6	Confident	76.9	Confident	43 Å²	43	69.8 Å²	69.8	44%	0.443	43%	0.426	S	S	.	.	T	Hydrogen-bonded Turn	trans	78.3	-0.1	-179.6	0	0	0	0	0	116	T1248	T1248-G1250 PolarHBondContact O-N 2.69Å
1251	A	84.6	Confident	75	Confident	23 Å²	23	76.3 Å²	76.3	19%	0.19	46%	0.455	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-35.8	173.4	0	0	0	0	0	112.2	K139 T1248 P1249	K139-A1251 PolarHBondContact N-O 3.41Å; T1248-A1251 VanDerWaalsContact O-CB 3.25Å; T1248-A1251 WeakPolarHBondContact O-CB 3.07Å; T1248-A1251 PolarHBondContact O-N 3.36Å; P1249-A1251 VanDerWaalsContact C-N 3.3Å; P1249-A1251 PolarHBondContact O-N 3.09Å
1252	T	88.6	Confident	73.2	Confident	29 Å²	29	80.3 Å²	80.3	18%	0.178	47%	0.471	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	156.4	175.3	52	0	0	0	0	110.9	Q137 F138 T174	Q137-T1252 CarbonylContact O-C 3.54Å; Q137-T1252 WeakPolarHBondContact O-CA 3.27Å; F138-T1252 HydrophobicContact CD1-CG2 3.6Å; F138-T1252 HydrophobicContact CD2-CG2 3.93Å; F138-T1252 HydrophobicContact CE1-CG2 3.57Å; F138-T1252 HydrophobicContact CE2-CG2 3.9Å; F138-T1252 HydrophobicContact CG-CG2 3.77Å; F138-T1252 HydrophobicContact CZ-CG2 3.72Å; T174-T1252 HydrophobicContact CG2-CG2 4.35Å; T174-T1252 WeakPolarHBondContact OG1-CB 3.14Å; T174-T1252 VanDerWaalsContact OG1-CG2 3.31Å; T174-T1252 WeakPolarHBondContact OG1-CG2 3.03Å; T174-T1252 PolarHBondContact OG1-OG1 3.33Å
1253	T	89.9	Confident	71.3	Confident	43 Å²	43	79.4 Å²	79.4	26%	0.264	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	123.5	176	-60.4	0	0	0	0	109.1	Q137 K139 L1255	Q137-T1253 PolarHBondContact N-O 3.34Å; Q137-T1253 PolarHBondContact O-N 3.19Å; K139-T1253 WeakPolarHBondContact CE-OG1 3.34Å; K139-T1253 PolarHBondContact NZ-OG1 3.4Å; T1253-L1255 PolarHBondContact O-N 3.35Å
1254	L	88.3	Confident	69.5	Low	85 Å²	85	79.7 Å²	79.7	45%	0.445	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	116	168.7	-170.1	74.5	0	0	0	107.6	H134 S135 L136 F172	H134-L1254 HydrophobicContact CB-CD1 4.39Å; S135-L1254 WeakPolarHBondContact O-CD1 3.49Å; L136-L1254 HydrophobicContact CD1-CD1 4.5Å; F172-L1254 HydrophobicContact CD1-CD1 4.46Å
1255	L	86.9	Confident	67.6	Low	53 Å²	53	81.4 Å²	81.4	28%	0.277	47%	0.474	S	S	.	.	P	Polyproline II helix	trans	-74.9	137.4	178.7	-57.9	176.9	0	0	0	109	V119 S135 Q137 T1253 N1257	V119-L1255 HydrophobicContact CG1-CD1 4.14Å; V119-L1255 HydrophobicContact CG2-CD1 4.24Å; S135-L1255 PolarHBondContact O-N 3.02Å; Q137-L1255 HydrophobicContact CB-CD1 4.25Å; Q137-L1255 HydrophobicContact CB-CD2 4.15Å; Q137-L1255 HydrophobicContact CB-CG 4.15Å; T1253-L1255 PolarHBondContact O-N 3.35Å; L1255-N1257 PolarHBondContact O-N 3.43Å
1256	P	71.9	Confident	65.7	Low	90 Å²	90	85.5 Å²	85.5	58%	0.584	49%	0.485	S	S	*	.	P	Polyproline II helix	trans	-59.2	131.2	173.6	-15.4	26.6	0	0	0	109.6	A1258	P1256-A1258 PolarHBondContact O-N 2.97Å
1257	N	63.1	Low	63.7	Low	44 Å²	44	83.3 Å²	83.3	24%	0.235	49%	0.485	C	S	.	.	P	Polyproline II helix	trans	-59	128.2	165.8	-81.3	-12.3	0	0	0	107.8	V133 L1255 R1259 I1260	V133-N1257 PolarHBondContact O-ND2 3.36Å; V133-N1257 PolarHBondContact O-OD1 3.1Å; L1255-N1257 PolarHBondContact O-N 3.43Å; N1257-R1259 PolarHBondContact O-N 2.85Å; N1257-I1260 HydrophobicContact CB-CD1 4.47Å; N1257-I1260 HydrophobicContact CB-CG1 4.48Å; N1257-I1260 PolarHBondContact O-N 2.76Å
1258	A	53.3	Low	62.3	Low	86 Å²	86	86.3 Å²	86.3	71%	0.711	52%	0.515	S	S	*	.	H	α-helix	trans	-53.4	-13.9	-177.4	0	0	0	0	0	114.6	P1256	P1256-A1258 PolarHBondContact O-N 2.97Å
1259	R	49.8	Very low	60.8	Low	179 Å²	179	84.1 Å²	84.1	68%	0.675	51%	0.506	S	S	*	.	H	α-helix	trans	-81.1	-29.5	170.5	-82.9	-171.5	175.2	177.8	0.9	115.1	N1257 E1261 K1262 L1263	N1257-R1259 PolarHBondContact O-N 2.85Å; R1259-E1261 VanDerWaalsContact C-N 3.29Å; R1259-E1261 PolarHBondContact O-N 3.18Å; R1259-K1262 PolarHBondContact O-N 3.48Å; R1259-K1262 VanDerWaalsContact O-N 3.13Å; R1259-L1263 WeakPolarHBondContact O-CB 3.47Å; R1259-L1263 WeakPolarHBondContact O-CG 3.23Å; R1259-L1263 PolarHBondContact O-N 3.05Å
1260	I	47.9	Very low	59.4	Low	104 Å²	104	80.4 Å²	80.4	53%	0.533	48%	0.484	S	S	.	.	H	α-helix	trans	-66.7	-33.3	-179.2	-65.2	174.6	0	0	0	110.7	N1257 L1263 S1264	N1257-I1260 HydrophobicContact CB-CD1 4.47Å; N1257-I1260 HydrophobicContact CB-CG1 4.48Å; N1257-I1260 PolarHBondContact O-N 2.76Å; I1260-L1263 PolarHBondContact O-N 3.06Å; I1260-S1264 VanDerWaalsContact O-CB 3.3Å; I1260-S1264 WeakPolarHBondContact O-CB 3.47Å; I1260-S1264 PolarHBondContact O-N 2.97Å
1261	E	46.1	Very low	58.1	Low	142 Å²	142	82.5 Å²	82.5	66%	0.664	49%	0.492	S	S	*	.	H	α-helix	trans	-70.4	-35.9	170.4	-83.9	-170	147	0	0	113.3	R1259 L1263 S1264 G1265	R1259-E1261 VanDerWaalsContact C-N 3.29Å; R1259-E1261 PolarHBondContact O-N 3.18Å; E1261-L1263 VanDerWaalsContact C-N 3.32Å; E1261-S1264 PolarHBondContact O-N 3.31Å; E1261-S1264 PolarHBondContact O-OG 2.85Å; E1261-S1264 VanDerWaalsContact O-OG 3.13Å; E1261-G1265 PolarHBondContact O-N 2.94Å; E1261-G1265 VanDerWaalsContact O-N 3.17Å
1262	K	43.7	Very low	57.3	Low	165 Å²	165	84.7 Å²	84.7	72%	0.717	51%	0.506	S	S	*	.	H	α-helix	trans	-66.5	-34.7	172.4	-87.3	-175.5	175.6	177	0	112.2	R1259	R1259-K1262 PolarHBondContact O-N 3.48Å; R1259-K1262 VanDerWaalsContact O-N 3.13Å
1263	L	39.7	Very low	56	Low	97 Å²	97	87.8 Å²	87.8	51%	0.508	52%	0.518	S	S	.	.	H	α-helix	trans	-76.8	-35.6	175.9	-77.2	161	0	0	0	112.2	R1259 I1260 E1261 G1265 Q1266 T1267	R1259-L1263 WeakPolarHBondContact O-CB 3.47Å; R1259-L1263 WeakPolarHBondContact O-CG 3.23Å; R1259-L1263 PolarHBondContact O-N 3.05Å; I1260-L1263 PolarHBondContact O-N 3.06Å; E1261-L1263 VanDerWaalsContact C-N 3.32Å; L1263-G1265 VanDerWaalsContact C-N 3.3Å; L1263-G1265 PolarHBondContact O-N 2.88Å; L1263-Q1266 CarbonylContact O-C 3.6Å; L1263-Q1266 PolarHBondContact O-N 3.36Å; L1263-T1267 PolarHBondContact O-N 3.32Å
1264	S	44.4	Very low	55.1	Low	69 Å²	69	91.6 Å²	91.6	48%	0.483	54%	0.536	S	S	.	.	H	α-helix	trans	-66.3	-35.1	177.2	79	0	0	0	0	111.4	I1260 E1261 Q1266 T1267	I1260-S1264 VanDerWaalsContact O-CB 3.3Å; I1260-S1264 WeakPolarHBondContact O-CB 3.47Å; I1260-S1264 PolarHBondContact O-N 2.97Å; E1261-S1264 PolarHBondContact O-N 3.31Å; E1261-S1264 PolarHBondContact O-OG 2.85Å; E1261-S1264 VanDerWaalsContact O-OG 3.13Å; S1264-Q1266 PolarHBondContact O-N 3.29Å; S1264-T1267 PolarHBondContact O-N 3.46Å; S1264-T1267 PolarHBondContact O-OG1 3.26Å
1265	G	43.1	Very low	54.1	Low	68 Å²	68	89.7 Å²	89.7	70%	0.701	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68	-11.3	171.7	0	0	0	0	0	115.1	E1261 L1263	E1261-G1265 PolarHBondContact O-N 2.94Å; E1261-G1265 VanDerWaalsContact O-N 3.17Å; L1263-G1265 VanDerWaalsContact C-N 3.3Å; L1263-G1265 PolarHBondContact O-N 2.88Å
1266	Q	42.7	Very low	53.4	Low	115 Å²	115	95.8 Å²	95.8	54%	0.537	55%	0.552	S	S	.	*	T	Hydrogen-bonded Turn	trans	-116.9	22.8	178.5	-71.1	-174.2	-26.4	0	0	112.7	L1263 S1264 G1268 A1269 A1270	L1263-Q1266 CarbonylContact O-C 3.6Å; L1263-Q1266 PolarHBondContact O-N 3.36Å; S1264-Q1266 PolarHBondContact O-N 3.29Å; Q1266-G1268 PolarHBondContact O-N 3.35Å; Q1266-A1269 WeakPolarHBondContact O-CB 3.48Å; Q1266-A1269 PolarHBondContact O-N 3.05Å; Q1266-A1270 PolarHBondContact O-N 2.98Å
1267	T	39.1	Very low	53.6	Low	105 Å²	105	94.5 Å²	94.5	64%	0.644	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-13.5	-178.6	30.3	0	0	0	0	115.1	L1263 S1264	L1263-T1267 PolarHBondContact O-N 3.32Å; S1264-T1267 PolarHBondContact O-N 3.46Å; S1264-T1267 PolarHBondContact O-OG1 3.26Å
1268	G	47.6	Very low	54.3	Low	76 Å²	76	101 Å²	101	78%	0.784	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.5	-20.2	166.8	0	0	0	0	0	114.9	Q1266	Q1266-G1268 PolarHBondContact O-N 3.35Å
1269	A	49.7	Very low	55.6	Low	36 Å²	36	101.7 Å²	101.7	30%	0.298	56%	0.562	S	S	.	*	T	Hydrogen-bonded Turn	trans	-99.6	-22	-179.2	0	0	0	0	0	113.4	Q1266 S1271 S1272 E1273	Q1266-A1269 WeakPolarHBondContact O-CB 3.48Å; Q1266-A1269 PolarHBondContact O-N 3.05Å; A1269-S1271 VanDerWaalsContact C-N 3.31Å; A1269-S1271 PolarHBondContact O-N 2.97Å; A1269-S1272 WeakPolarHBondContact O-CA 3.16Å; A1269-S1272 WeakPolarHBondContact O-CB 3.38Å; A1269-S1272 PolarHBondContact O-N 3.15Å; A1269-S1272 PolarHBondContact O-OG 3.43Å; A1269-E1273 WeakPolarHBondContact O-CB 3.4Å; A1269-E1273 PolarHBondContact O-N 2.98Å
1270	A	47.1	Very low	57.1	Low	36 Å²	36	95.7 Å²	95.7	30%	0.298	55%	0.55	S	S	.	*	H	α-helix	trans	-58.2	-35.5	-173.5	0	0	0	0	0	114.1	Q1266 E1273 I1274	Q1266-A1270 PolarHBondContact O-N 2.98Å; A1270-E1273 PolarHBondContact O-N 2.85Å; A1270-I1274 WeakPolarHBondContact O-CB 3.49Å; A1270-I1274 WeakPolarHBondContact O-CD1 3.29Å; A1270-I1274 WeakPolarHBondContact O-CG1 3.49Å; A1270-I1274 PolarHBondContact O-N 3.2Å
1271	S	53.7	Low	58.6	Low	88 Å²	88	93.7 Å²	93.7	62%	0.615	55%	0.549	S	S	*	.	H	α-helix	trans	-68.4	-39.4	174.9	56.1	0	0	0	0	112.3	A1269 E1273 A1275	A1269-S1271 VanDerWaalsContact C-N 3.31Å; A1269-S1271 PolarHBondContact O-N 2.97Å; S1271-E1273 VanDerWaalsContact C-N 3.31Å; S1271-A1275 WeakPolarHBondContact O-CB 3.49Å; S1271-A1275 PolarHBondContact O-N 3.26Å
1272	S	65.8	Low	60.4	Low	68 Å²	68	90.8 Å²	90.8	48%	0.476	54%	0.537	S	S	.	.	H	α-helix	trans	-67.8	-33.9	175.3	81	0	0	0	0	111.9	A1269 A1275 R1276	A1269-S1272 WeakPolarHBondContact O-CA 3.16Å; A1269-S1272 WeakPolarHBondContact O-CB 3.38Å; A1269-S1272 PolarHBondContact O-N 3.15Å; A1269-S1272 PolarHBondContact O-OG 3.43Å; S1272-A1275 PolarHBondContact O-N 3.38Å; S1272-R1276 VanDerWaalsContact O-CB 3.29Å; S1272-R1276 WeakPolarHBondContact O-CB 3.43Å; S1272-R1276 PolarHBondContact O-N 2.95Å
1273	E	62.7	Low	62.4	Low	94 Å²	94	87 Å²	87	44%	0.439	52%	0.522	S	S	.	.	H	α-helix	trans	-79.6	-36.8	-177.1	-144.8	149.4	-148.7	0	0	111.3	A1269 A1270 S1271 R1276 A1277	A1269-E1273 WeakPolarHBondContact O-CB 3.4Å; A1269-E1273 PolarHBondContact O-N 2.98Å; A1270-E1273 PolarHBondContact O-N 2.85Å; S1271-E1273 VanDerWaalsContact C-N 3.31Å; E1273-R1276 PolarHBondContact O-N 3.46Å; E1273-A1277 VanDerWaalsContact O-CB 3.29Å; E1273-A1277 WeakPolarHBondContact O-CB 3.28Å; E1273-A1277 PolarHBondContact O-N 3.34Å
1274	I	70.1	Confident	64.6	Low	123 Å²	123	91 Å²	91	63%	0.631	53%	0.53	S	S	*	.	H	α-helix	trans	-64.1	-42.2	167.8	-68.8	164.5	0	0	0	110.7	A1270 R1276 A1277 R1278	A1270-I1274 WeakPolarHBondContact O-CB 3.49Å; A1270-I1274 WeakPolarHBondContact O-CD1 3.29Å; A1270-I1274 WeakPolarHBondContact O-CG1 3.49Å; A1270-I1274 PolarHBondContact O-N 3.2Å; I1274-R1276 VanDerWaalsContact C-N 3.34Å; I1274-A1277 PolarHBondContact O-N 3.12Å; I1274-R1278 WeakPolarHBondContact O-CB 3.39Å; I1274-R1278 PolarHBondContact O-N 3.37Å
1275	A	67.3	Low	66.6	Low	45 Å²	45	89.4 Å²	89.4	37%	0.372	53%	0.526	S	S	.	.	H	α-helix	trans	-63.3	-40.9	174.9	0	0	0	0	0	111.7	S1271 S1272 R1278 N1279	S1271-A1275 WeakPolarHBondContact O-CB 3.49Å; S1271-A1275 PolarHBondContact O-N 3.26Å; S1272-A1275 PolarHBondContact O-N 3.38Å; A1275-R1278 PolarHBondContact O-N 2.88Å; A1275-N1279 WeakPolarHBondContact O-CB 3.31Å; A1275-N1279 PolarHBondContact O-N 2.88Å; A1275-N1279 PolarHBondContact O-OD1 3.1Å
1276	R	73.7	Confident	68.7	Low	182 Å²	182	92 Å²	92	69%	0.687	52%	0.519	S	S	*	.	H	α-helix	trans	-67.1	-40.3	175.9	-167	-177.6	-91.8	160.4	-9.4	111.7	S1272 E1273 I1274 N1279 A1280	S1272-R1276 VanDerWaalsContact O-CB 3.29Å; S1272-R1276 WeakPolarHBondContact O-CB 3.43Å; S1272-R1276 PolarHBondContact O-N 2.95Å; E1273-R1276 PolarHBondContact O-N 3.46Å; I1274-R1276 VanDerWaalsContact C-N 3.34Å; R1276-N1279 PolarHBondContact O-N 3.42Å; R1276-A1280 WeakPolarHBondContact O-CB 3.25Å; R1276-A1280 PolarHBondContact O-N 3.01Å
1277	A	74.5	Confident	70.9	Confident	62 Å²	62	94 Å²	94	51%	0.512	52%	0.522	S	S	.	.	H	α-helix	trans	-65.7	-40.3	174.5	0	0	0	0	0	112.1	E1273 I1274 A1280 A1281	E1273-A1277 VanDerWaalsContact O-CB 3.29Å; E1273-A1277 WeakPolarHBondContact O-CB 3.28Å; E1273-A1277 PolarHBondContact O-N 3.34Å; I1274-A1277 PolarHBondContact O-N 3.12Å; A1277-A1280 PolarHBondContact O-N 3.03Å; A1277-A1281 WeakPolarHBondContact O-CB 3.25Å; A1277-A1281 PolarHBondContact O-N 3.17Å
1278	R	78.9	Confident	73.1	Confident	180 Å²	180	93.7 Å²	93.7	68%	0.679	52%	0.516	S	S	*	.	H	α-helix	trans	-61.7	-45.7	172.7	-178.8	-177	174.9	-172.1	-1.6	111.3	I1274 A1275 A1281 I1282	I1274-R1278 WeakPolarHBondContact O-CB 3.39Å; I1274-R1278 PolarHBondContact O-N 3.37Å; A1275-R1278 PolarHBondContact O-N 2.88Å; R1278-A1281 PolarHBondContact O-N 3.24Å; R1278-I1282 HydrophobicContact CG-CD1 4.16Å; R1278-I1282 WeakPolarHBondContact O-CG1 3.44Å; R1278-I1282 PolarHBondContact O-N 3.44Å
1279	N	80.6	Confident	75	Confident	102 Å²	102	96.5 Å²	96.5	55%	0.545	51%	0.508	S	S	.	.	H	α-helix	trans	-64.7	-40.8	177.3	-69.3	-7.7	0	0	0	111.5	A1275 R1276 A1281 I1282 E1283	A1275-N1279 WeakPolarHBondContact O-CB 3.31Å; A1275-N1279 PolarHBondContact O-N 2.88Å; A1275-N1279 PolarHBondContact O-OD1 3.1Å; R1276-N1279 PolarHBondContact O-N 3.42Å; N1279-A1281 VanDerWaalsContact C-N 3.31Å; N1279-A1281 PolarHBondContact O-N 3.13Å; N1279-I1282 PolarHBondContact O-N 3.4Å; N1279-E1283 WeakPolarHBondContact O-CB 3.36Å; N1279-E1283 PolarHBondContact O-N 3.36Å
1280	A	80.8	Confident	76.8	Confident	52 Å²	52	100.5 Å²	100.5	43%	0.43	52%	0.521	S	S	.	.	H	α-helix	trans	-65	-33.5	174.5	0	0	0	0	0	112.5	R1276 A1277 R1284	R1276-A1280 WeakPolarHBondContact O-CB 3.25Å; R1276-A1280 PolarHBondContact O-N 3.01Å; A1277-A1280 PolarHBondContact O-N 3.03Å; A1280-R1284 VanDerWaalsContact O-CB 3.23Å; A1280-R1284 WeakPolarHBondContact O-CB 3.08Å; A1280-R1284 PolarHBondContact O-N 3.43Å
1281	A	79.6	Confident	78.7	Confident	62 Å²	62	103.5 Å²	103.5	51%	0.512	53%	0.531	S	S	.	.	H	α-helix	trans	-70	-39.4	174	0	0	0	0	0	112.1	A1277 R1278 N1279 R1284 G1285	A1277-A1281 WeakPolarHBondContact O-CB 3.25Å; A1277-A1281 PolarHBondContact O-N 3.17Å; R1278-A1281 PolarHBondContact O-N 3.24Å; N1279-A1281 VanDerWaalsContact C-N 3.31Å; N1279-A1281 PolarHBondContact O-N 3.13Å; A1281-R1284 PolarHBondContact O-N 2.99Å; A1281-G1285 PolarHBondContact O-N 3.08Å
1282	I	84.5	Confident	80.5	Confident	81 Å²	81	105 Å²	105	42%	0.415	53%	0.533	S	S	.	.	H	α-helix	trans	-63.7	-48.7	173.1	-67.2	165.5	0	0	0	109.9	R1278 N1279 R1284 G1285 E1286	R1278-I1282 HydrophobicContact CG-CD1 4.16Å; R1278-I1282 WeakPolarHBondContact O-CG1 3.44Å; R1278-I1282 PolarHBondContact O-N 3.44Å; N1279-I1282 PolarHBondContact O-N 3.4Å; I1282-R1284 VanDerWaalsContact C-N 3.31Å; I1282-R1284 PolarHBondContact O-N 3.08Å; I1282-G1285 CarbonylContact O-C 3.49Å; I1282-G1285 WeakPolarHBondContact O-CA 3.37Å; I1282-G1285 PolarHBondContact O-N 2.98Å; I1282-E1286 PolarHBondContact O-N 3.26Å
1283	E	86	Confident	81.7	Confident	87 Å²	87	107.4 Å²	107.4	41%	0.407	54%	0.54	S	S	.	.	H	α-helix	trans	-60.6	-40.2	176.9	-174.1	-176.8	-179.3	0	0	111.6	N1279 G1285 E1286 R1287	N1279-E1283 WeakPolarHBondContact O-CB 3.36Å; N1279-E1283 PolarHBondContact O-N 3.36Å; E1283-G1285 VanDerWaalsContact C-N 3.33Å; E1283-G1285 PolarHBondContact O-N 3.36Å; E1283-E1286 PolarHBondContact O-N 2.99Å; E1283-R1287 WeakPolarHBondContact O-CB 3.36Å; E1283-R1287 WeakPolarHBondContact O-CG 3.23Å; E1283-R1287 PolarHBondContact O-N 3.13Å; E1283-R1287 IonicContact OE1-CZ 3.78Å; E1283-R1287 VanDerWaalsContact OE1-CZ 3.3Å; E1283-R1287 IonicContact OE1-NE 2.76Å; E1283-R1287 IonicContact OE1-NH2 2.74Å; E1283-R1287 PolarHBondContact OE1-NH2 3.44Å
1284	R	84.9	Confident	82.9	Confident	179 Å²	179	108.1 Å²	108.1	68%	0.675	54%	0.543	S	S	*	.	H	α-helix	trans	-64	-39.1	173.5	-173.3	179.3	-177.9	-176.9	1.2	111.5	A1280 A1281 I1282 R1287 L1288	A1280-R1284 VanDerWaalsContact O-CB 3.23Å; A1280-R1284 WeakPolarHBondContact O-CB 3.08Å; A1280-R1284 PolarHBondContact O-N 3.43Å; A1281-R1284 PolarHBondContact O-N 2.99Å; I1282-R1284 VanDerWaalsContact C-N 3.31Å; I1282-R1284 PolarHBondContact O-N 3.08Å; R1284-R1287 PolarHBondContact O-N 3.07Å; R1284-L1288 HydrophobicContact CG-CD1 4.12Å; R1284-L1288 HydrophobicContact CG-CG 4.47Å; R1284-L1288 VanDerWaalsContact O-CB 3.31Å; R1284-L1288 WeakPolarHBondContact O-CB 3.31Å; R1284-L1288 VanDerWaalsContact O-CG 3.28Å; R1284-L1288 WeakPolarHBondContact O-CG 3.32Å; R1284-L1288 PolarHBondContact O-N 3.04Å
1285	G	85.5	Confident	83.9	Confident	37 Å²	37	105.9 Å²	105.9	38%	0.381	54%	0.535	S	S	.	.	H	α-helix	trans	-61.2	-45.5	174	0	0	0	0	0	112.1	A1281 I1282 E1283 L1288 Q1289	A1281-G1285 PolarHBondContact O-N 3.08Å; I1282-G1285 CarbonylContact O-C 3.49Å; I1282-G1285 WeakPolarHBondContact O-CA 3.37Å; I1282-G1285 PolarHBondContact O-N 2.98Å; E1283-G1285 VanDerWaalsContact C-N 3.33Å; E1283-G1285 PolarHBondContact O-N 3.36Å; G1285-L1288 PolarHBondContact O-N 3.03Å; G1285-Q1289 WeakPolarHBondContact O-CB 3.43Å; G1285-Q1289 PolarHBondContact O-N 2.91Å
1286	E	88.5	Confident	85	Confident	121 Å²	121	108.5 Å²	108.5	57%	0.565	54%	0.54	S	S	*	.	H	α-helix	trans	-63.5	-44.3	175.6	-70	174.8	173	0	0	111.8	I1282 E1283 Q1289 Q1290	I1282-E1286 PolarHBondContact O-N 3.26Å; E1283-E1286 PolarHBondContact O-N 2.99Å; E1286-Q1289 PolarHBondContact O-N 2.52Å; E1286-Q1290 WeakPolarHBondContact O-CB 3.49Å; E1286-Q1290 PolarHBondContact O-N 3.12Å
1287	R	87.9	Confident	85.8	Confident	159 Å²	159	105.3 Å²	105.3	60%	0.6	53%	0.532	S	S	*	.	H	α-helix	trans	-66.1	-37	176.1	-73.3	-170	-171.9	175	4.4	112.7	E1283 R1284 Q1290 L1291	E1283-R1287 WeakPolarHBondContact O-CB 3.36Å; E1283-R1287 WeakPolarHBondContact O-CG 3.23Å; E1283-R1287 PolarHBondContact O-N 3.13Å; E1283-R1287 IonicContact OE1-CZ 3.78Å; E1283-R1287 VanDerWaalsContact OE1-CZ 3.3Å; E1283-R1287 IonicContact OE1-NE 2.76Å; E1283-R1287 IonicContact OE1-NH2 2.74Å; E1283-R1287 PolarHBondContact OE1-NH2 3.44Å; R1284-R1287 PolarHBondContact O-N 3.07Å; R1287-Q1290 PolarHBondContact O-N 2.81Å; R1287-L1291 VanDerWaalsContact O-CB 3.31Å; R1287-L1291 WeakPolarHBondContact O-CB 3.13Å; R1287-L1291 PolarHBondContact O-N 3.16Å
1288	L	85.6	Confident	86.5	Confident	98 Å²	98	108.7 Å²	108.7	51%	0.513	54%	0.539	S	S	.	.	H	α-helix	trans	-64.9	-43.5	173.6	-81	168.4	0	0	0	110.7	R1284 G1285 Q1290 L1291 D1292	R1284-L1288 HydrophobicContact CG-CD1 4.12Å; R1284-L1288 HydrophobicContact CG-CG 4.47Å; R1284-L1288 VanDerWaalsContact O-CB 3.31Å; R1284-L1288 WeakPolarHBondContact O-CB 3.31Å; R1284-L1288 VanDerWaalsContact O-CG 3.28Å; R1284-L1288 WeakPolarHBondContact O-CG 3.32Å; R1284-L1288 PolarHBondContact O-N 3.04Å; G1285-L1288 PolarHBondContact O-N 3.03Å; L1288-Q1290 VanDerWaalsContact C-N 3.31Å; L1288-Q1290 PolarHBondContact O-N 3.3Å; L1288-L1291 PolarHBondContact O-N 3.28Å; L1288-D1292 WeakPolarHBondContact O-CB 3.46Å; L1288-D1292 PolarHBondContact O-N 2.71Å
1289	Q	87	Confident	87	Confident	134 Å²	134	102 Å²	102	63%	0.626	52%	0.522	S	S	*	.	H	α-helix	trans	-63	-39	175.4	-168.9	175.6	14.2	0	0	111.8	G1285 E1286 D1292 L1293	G1285-Q1289 WeakPolarHBondContact O-CB 3.43Å; G1285-Q1289 PolarHBondContact O-N 2.91Å; E1286-Q1289 PolarHBondContact O-N 2.52Å; Q1289-D1292 PolarHBondContact O-N 3.43Å; Q1289-L1293 WeakPolarHBondContact O-CG 3.38Å; Q1289-L1293 PolarHBondContact O-N 3.42Å
1290	Q	88	Confident	87.5	Confident	120 Å²	120	100.8 Å²	100.8	56%	0.561	52%	0.516	S	S	*	.	H	α-helix	trans	-68.6	-38.2	175.4	-165.5	171.2	22.4	0	0	112.3	E1286 R1287 L1288 D1292 L1293 Q1294	E1286-Q1290 WeakPolarHBondContact O-CB 3.49Å; E1286-Q1290 PolarHBondContact O-N 3.12Å; R1287-Q1290 PolarHBondContact O-N 2.81Å; L1288-Q1290 VanDerWaalsContact C-N 3.31Å; L1288-Q1290 PolarHBondContact O-N 3.3Å; Q1290-D1292 VanDerWaalsContact C-N 3.35Å; Q1290-L1293 PolarHBondContact O-N 3.49Å; Q1290-Q1294 WeakPolarHBondContact O-CB 3.47Å; Q1290-Q1294 WeakPolarHBondContact O-CG 3.43Å; Q1290-Q1294 PolarHBondContact O-N 3.44Å
1291	L	87.8	Confident	88	Confident	99 Å²	99	104.1 Å²	104.1	52%	0.518	52%	0.523	S	S	.	.	H	α-helix	trans	-64.8	-39.8	173.2	-167.4	97.9	0	0	0	111.1	R1287 L1288 Q1294 T1295	R1287-L1291 VanDerWaalsContact O-CB 3.31Å; R1287-L1291 WeakPolarHBondContact O-CB 3.13Å; R1287-L1291 PolarHBondContact O-N 3.16Å; L1288-L1291 PolarHBondContact O-N 3.28Å; L1291-Q1294 PolarHBondContact O-N 3.01Å; L1291-T1295 VanDerWaalsContact O-CB 3.29Å; L1291-T1295 WeakPolarHBondContact O-CB 3.42Å; L1291-T1295 PolarHBondContact O-N 3.08Å; L1291-T1295 PolarHBondContact O-OG1 2.81Å
1292	D	90.2	Very high	88.5	Confident	121 Å²	121	104 Å²	104	65%	0.647	52%	0.522	S	S	*	.	H	α-helix	trans	-64	-42.9	176.7	-135.3	19.5	0	0	0	110.5	L1288 Q1289 Q1290 T1295 Q1296	L1288-D1292 WeakPolarHBondContact O-CB 3.46Å; L1288-D1292 PolarHBondContact O-N 2.71Å; Q1289-D1292 PolarHBondContact O-N 3.43Å; Q1290-D1292 VanDerWaalsContact C-N 3.35Å; D1292-T1295 PolarHBondContact O-N 3.11Å; D1292-Q1296 VanDerWaalsContact O-CB 3.31Å; D1292-Q1296 WeakPolarHBondContact O-CB 3.34Å; D1292-Q1296 PolarHBondContact O-N 3.03Å
1293	L	91.2	Very high	88.9	Confident	117 Å²	117	105.6 Å²	105.6	61%	0.613	53%	0.526	S	S	*	.	H	α-helix	trans	-62.3	-44.2	172.4	-72.6	169.4	0	0	0	112.5	Q1289 Q1290 Q1296 E1297	Q1289-L1293 WeakPolarHBondContact O-CG 3.38Å; Q1289-L1293 PolarHBondContact O-N 3.42Å; Q1290-L1293 PolarHBondContact O-N 3.49Å; L1293-Q1296 PolarHBondContact O-N 3.36Å; L1293-E1297 WeakPolarHBondContact O-CB 3.29Å; L1293-E1297 PolarHBondContact O-N 2.79Å
1294	Q	88.6	Confident	89.1	Confident	110 Å²	110	102.8 Å²	102.8	51%	0.514	52%	0.521	S	S	.	.	H	α-helix	trans	-66.1	-37.7	176.2	-79.7	-174.1	-13.8	0	0	112.4	Q1290 L1291 Q1296 E1297 M1298	Q1290-Q1294 WeakPolarHBondContact O-CB 3.47Å; Q1290-Q1294 WeakPolarHBondContact O-CG 3.43Å; Q1290-Q1294 PolarHBondContact O-N 3.44Å; L1291-Q1294 PolarHBondContact O-N 3.01Å; Q1294-Q1296 VanDerWaalsContact C-N 3.35Å; Q1294-E1297 PolarHBondContact O-N 3.31Å; Q1294-M1298 VanDerWaalsContact O-CB 3.32Å; Q1294-M1298 WeakPolarHBondContact O-CB 3.42Å; Q1294-M1298 PolarHBondContact O-N 2.74Å
1295	T	90.7	Very high	89.4	Confident	76 Å²	76	101.8 Å²	101.8	47%	0.466	52%	0.521	S	S	.	.	H	α-helix	trans	-67.4	-40.4	176.7	-57.5	0	0	0	0	110.1	L1291 D1292 M1298 A1299	L1291-T1295 VanDerWaalsContact O-CB 3.29Å; L1291-T1295 WeakPolarHBondContact O-CB 3.42Å; L1291-T1295 PolarHBondContact O-N 3.08Å; L1291-T1295 PolarHBondContact O-OG1 2.81Å; D1292-T1295 PolarHBondContact O-N 3.11Å; T1295-M1298 PolarHBondContact O-N 2.99Å; T1295-A1299 WeakPolarHBondContact O-CB 3.21Å; T1295-A1299 PolarHBondContact O-N 2.7Å
1296	Q	90.4	Very high	89.6	Confident	100 Å²	100	101.9 Å²	101.9	47%	0.467	52%	0.522	S	S	.	.	H	α-helix	trans	-64.4	-43.3	173.2	-174.3	61	36.9	0	0	111.6	D1292 L1293 Q1294 A1299 D1300	D1292-Q1296 VanDerWaalsContact O-CB 3.31Å; D1292-Q1296 WeakPolarHBondContact O-CB 3.34Å; D1292-Q1296 PolarHBondContact O-N 3.03Å; L1293-Q1296 PolarHBondContact O-N 3.36Å; Q1294-Q1296 VanDerWaalsContact C-N 3.35Å; Q1296-A1299 PolarHBondContact O-N 3.3Å; Q1296-D1300 PolarHBondContact NE2-OD1 3.25Å; Q1296-D1300 PolarHBondContact NE2-OD2 3.01Å; Q1296-D1300 WeakPolarHBondContact O-CB 3.2Å; Q1296-D1300 PolarHBondContact O-N 3.2Å
1297	E	91.1	Very high	89.8	Confident	114 Å²	114	104.6 Å²	104.6	53%	0.533	53%	0.527	S	S	.	.	H	α-helix	trans	-61.8	-43.5	174.5	-171.8	-179.9	178.7	0	0	111.3	L1293 Q1294 A1299 D1300 Q1301	L1293-E1297 WeakPolarHBondContact O-CB 3.29Å; L1293-E1297 PolarHBondContact O-N 2.79Å; Q1294-E1297 PolarHBondContact O-N 3.31Å; E1297-A1299 VanDerWaalsContact C-N 3.35Å; E1297-A1299 PolarHBondContact O-N 3.21Å; E1297-D1300 PolarHBondContact O-N 3.5Å; E1297-Q1301 WeakPolarHBondContact O-CB 3.41Å; E1297-Q1301 WeakPolarHBondContact O-CG 3.5Å; E1297-Q1301 PolarHBondContact O-N 3.05Å
1298	M	88.3	Confident	89.9	Confident	133 Å²	133	100.5 Å²	100.5	66%	0.655	52%	0.523	S	S	*	.	H	α-helix	trans	-63.8	-40.3	175.6	-169.4	-176.8	-62.1	0	0	111.5	Q1294 T1295 D1300 Q1301 A1302	Q1294-M1298 VanDerWaalsContact O-CB 3.32Å; Q1294-M1298 WeakPolarHBondContact O-CB 3.42Å; Q1294-M1298 PolarHBondContact O-N 2.74Å; T1295-M1298 PolarHBondContact O-N 2.99Å; M1298-D1300 VanDerWaalsContact C-N 3.33Å; M1298-D1300 PolarHBondContact O-N 3.46Å; M1298-Q1301 PolarHBondContact O-N 2.99Å; M1298-A1302 VanDerWaalsContact O-CB 3.26Å; M1298-A1302 WeakPolarHBondContact O-CB 3.4Å; M1298-A1302 PolarHBondContact O-N 3Å
1299	A	89.9	Confident	90	Very high	39 Å²	39	98 Å²	98	32%	0.322	52%	0.516	S	S	.	.	H	α-helix	trans	-63.7	-38.6	174.4	0	0	0	0	0	111.7	T1295 Q1296 E1297 A1302 K1303	T1295-A1299 WeakPolarHBondContact O-CB 3.21Å; T1295-A1299 PolarHBondContact O-N 2.7Å; Q1296-A1299 PolarHBondContact O-N 3.3Å; E1297-A1299 VanDerWaalsContact C-N 3.35Å; E1297-A1299 PolarHBondContact O-N 3.21Å; A1299-A1302 PolarHBondContact O-N 3.2Å; A1299-K1303 WeakPolarHBondContact O-CG 2.93Å; A1299-K1303 PolarHBondContact O-N 3.34Å
1300	D	91.8	Very high	89.9	Confident	78 Å²	78	94.4 Å²	94.4	42%	0.417	51%	0.51	S	S	.	.	H	α-helix	trans	-74.6	-35	177.8	-69.9	-26.6	0	0	0	112.2	Q1296 E1297 M1298 K1303 G1304	Q1296-D1300 PolarHBondContact NE2-OD1 3.25Å; Q1296-D1300 PolarHBondContact NE2-OD2 3.01Å; Q1296-D1300 WeakPolarHBondContact O-CB 3.2Å; Q1296-D1300 PolarHBondContact O-N 3.2Å; E1297-D1300 PolarHBondContact O-N 3.5Å; M1298-D1300 VanDerWaalsContact C-N 3.33Å; M1298-D1300 PolarHBondContact O-N 3.46Å; D1300-K1303 PolarHBondContact O-N 3.34Å; D1300-K1303 IonicContact OD1-NZ 3.09Å; D1300-K1303 PolarHBondContact OD1-NZ 3.47Å; D1300-K1303 VanDerWaalsContact OD1-NZ 3.09Å; D1300-G1304 PolarHBondContact O-N 2.79Å
1301	Q	90.9	Very high	90	Very high	122 Å²	122	94.4 Å²	94.4	57%	0.57	51%	0.512	S	S	*	.	H	α-helix	trans	-64.1	-43	168.3	-73.7	-177.3	11.9	0	0	111.6	E1297 M1298 K1303 G1304 F1305	E1297-Q1301 WeakPolarHBondContact O-CB 3.41Å; E1297-Q1301 WeakPolarHBondContact O-CG 3.5Å; E1297-Q1301 PolarHBondContact O-N 3.05Å; M1298-Q1301 PolarHBondContact O-N 2.99Å; Q1301-K1303 VanDerWaalsContact C-N 3.35Å; Q1301-K1303 PolarHBondContact O-N 3.19Å; Q1301-G1304 CarbonylContact O-C 3.35Å; Q1301-G1304 WeakPolarHBondContact O-CA 3.49Å; Q1301-G1304 PolarHBondContact O-N 3.24Å; Q1301-G1304 VanDerWaalsContact O-N 3.11Å; Q1301-F1305 WeakPolarHBondContact O-CB 3.28Å; Q1301-F1305 PolarHBondContact O-N 3.22Å
1302	A	90.2	Very high	89.8	Confident	60 Å²	60	94.5 Å²	94.5	50%	0.496	51%	0.513	S	S	.	.	H	α-helix	trans	-63.2	-40.1	175.9	0	0	0	0	0	111.6	M1298 A1299 F1305 G1306	M1298-A1302 VanDerWaalsContact O-CB 3.26Å; M1298-A1302 WeakPolarHBondContact O-CB 3.4Å; M1298-A1302 PolarHBondContact O-N 3Å; A1299-A1302 PolarHBondContact O-N 3.2Å; A1302-F1305 PolarHBondContact O-N 3.07Å; A1302-G1306 PolarHBondContact O-N 2.95Å
1303	K	91.5	Very high	89.5	Confident	113 Å²	113	91.6 Å²	91.6	49%	0.491	51%	0.505	S	S	.	.	H	α-helix	trans	-62.3	-42	170.1	-74.5	172.3	-165.5	156.6	0	111.7	A1299 D1300 Q1301 G1306 R1307	A1299-K1303 WeakPolarHBondContact O-CG 2.93Å; A1299-K1303 PolarHBondContact O-N 3.34Å; D1300-K1303 PolarHBondContact O-N 3.34Å; D1300-K1303 IonicContact OD1-NZ 3.09Å; D1300-K1303 PolarHBondContact OD1-NZ 3.47Å; D1300-K1303 VanDerWaalsContact OD1-NZ 3.09Å; Q1301-K1303 VanDerWaalsContact C-N 3.35Å; Q1301-K1303 PolarHBondContact O-N 3.19Å; K1303-G1306 PolarHBondContact O-N 2.89Å; K1303-R1307 WeakPolarHBondContact O-CG 2.96Å; K1303-R1307 PolarHBondContact O-N 3.07Å
1304	G	90.9	Very high	89.1	Confident	29 Å²	29	88.1 Å²	88.1	30%	0.299	49%	0.494	S	S	.	.	H	α-helix	trans	-61.6	-42.7	175.4	0	0	0	0	0	112.7	D1300 Q1301 R1307 S1308	D1300-G1304 PolarHBondContact O-N 2.79Å; Q1301-G1304 CarbonylContact O-C 3.35Å; Q1301-G1304 WeakPolarHBondContact O-CA 3.49Å; Q1301-G1304 PolarHBondContact O-N 3.24Å; Q1301-G1304 VanDerWaalsContact O-N 3.11Å; G1304-R1307 PolarHBondContact O-N 2.78Å; G1304-S1308 WeakPolarHBondContact O-CB 3.2Å; G1304-S1308 PolarHBondContact O-N 3.08Å; G1304-S1308 PolarHBondContact O-OG 2.84Å
1305	F	90.7	Very high	88.7	Confident	157 Å²	157	89.4 Å²	89.4	69%	0.689	50%	0.498	S	S	*	.	H	α-helix	trans	-65.1	-46.3	174.6	-174.2	-98.2	0	0	0	111.3	Q1301 A1302 R1307 S1308 A1309	Q1301-F1305 WeakPolarHBondContact O-CB 3.28Å; Q1301-F1305 PolarHBondContact O-N 3.22Å; A1302-F1305 PolarHBondContact O-N 3.07Å; F1305-R1307 VanDerWaalsContact C-N 3.32Å; F1305-R1307 PolarHBondContact O-N 2.88Å; F1305-S1308 PolarHBondContact O-N 3.12Å; F1305-S1308 VanDerWaalsContact O-N 3.12Å; F1305-A1309 WeakPolarHBondContact O-CB 3.21Å; F1305-A1309 PolarHBondContact O-N 2.82Å
1306	G	91.3	Very high	88	Confident	39 Å²	39	92.3 Å²	92.3	40%	0.402	50%	0.501	S	S	.	.	H	α-helix	trans	-57.5	-42.1	175.7	0	0	0	0	0	112.8	A1302 K1303 A1310	A1302-G1306 PolarHBondContact O-N 2.95Å; K1303-G1306 PolarHBondContact O-N 2.89Å; G1306-A1310 WeakPolarHBondContact O-CB 3.21Å; G1306-A1310 PolarHBondContact O-N 3.04Å
1307	R	91.4	Very high	87.3	Confident	179 Å²	179	92.7 Å²	92.7	68%	0.675	50%	0.503	S	S	*	.	H	α-helix	trans	-64.5	-44.1	173.4	-72.8	176.3	-175	162.2	2.2	112.3	K1303 G1304 F1305 A1310 I1311	K1303-R1307 WeakPolarHBondContact O-CG 2.96Å; K1303-R1307 PolarHBondContact O-N 3.07Å; G1304-R1307 PolarHBondContact O-N 2.78Å; F1305-R1307 VanDerWaalsContact C-N 3.32Å; F1305-R1307 PolarHBondContact O-N 2.88Å; R1307-A1310 PolarHBondContact O-N 2.85Å; R1307-I1311 VanDerWaalsContact O-CG1 3.29Å; R1307-I1311 WeakPolarHBondContact O-CG1 3.34Å; R1307-I1311 PolarHBondContact O-N 3.44Å
1308	S	90.6	Very high	86.3	Confident	73 Å²	73	95.1 Å²	95.1	51%	0.51	51%	0.512	S	S	.	.	H	α-helix	trans	-64.2	-42.9	179.3	-59	0	0	0	0	111.5	G1304 F1305 I1311 L1312	G1304-S1308 WeakPolarHBondContact O-CB 3.2Å; G1304-S1308 PolarHBondContact O-N 3.08Å; G1304-S1308 PolarHBondContact O-OG 2.84Å; F1305-S1308 PolarHBondContact O-N 3.12Å; F1305-S1308 VanDerWaalsContact O-N 3.12Å; S1308-I1311 PolarHBondContact O-N 2.91Å; S1308-L1312 WeakPolarHBondContact O-CB 3.41Å; S1308-L1312 PolarHBondContact O-N 3.37Å
1309	A	86.6	Confident	84.9	Confident	44 Å²	44	94.3 Å²	94.3	36%	0.364	51%	0.505	S	S	.	.	H	α-helix	trans	-61.8	-43.4	174.3	0	0	0	0	0	111.5	F1305 L1312 A1313	F1305-A1309 WeakPolarHBondContact O-CB 3.21Å; F1305-A1309 PolarHBondContact O-N 2.82Å; A1309-L1312 PolarHBondContact O-N 3.25Å; A1309-A1313 WeakPolarHBondContact O-CB 3.34Å; A1309-A1313 PolarHBondContact O-N 3.32Å
1310	A	85.8	Confident	83.1	Confident	60 Å²	60	98 Å²	98	50%	0.496	52%	0.519	S	S	.	.	H	α-helix	trans	-63.4	-41.6	176	0	0	0	0	0	112.6	G1306 R1307 A1313 A1314	G1306-A1310 WeakPolarHBondContact O-CB 3.21Å; G1306-A1310 PolarHBondContact O-N 3.04Å; R1307-A1310 PolarHBondContact O-N 2.85Å; A1310-A1313 PolarHBondContact O-N 3.06Å; A1310-A1314 WeakPolarHBondContact O-CB 3.34Å; A1310-A1314 PolarHBondContact O-N 3.49Å
1311	I	90.1	Very high	81.2	Confident	120 Å²	120	101.4 Å²	101.4	62%	0.615	53%	0.53	S	S	*	.	H	α-helix	trans	-64.1	-42.1	174.7	-68.2	165	0	0	0	110.6	R1307 S1308 A1314 K1315	R1307-I1311 VanDerWaalsContact O-CG1 3.29Å; R1307-I1311 WeakPolarHBondContact O-CG1 3.34Å; R1307-I1311 PolarHBondContact O-N 3.44Å; S1308-I1311 PolarHBondContact O-N 2.91Å; I1311-A1314 PolarHBondContact O-N 3.23Å; I1311-K1315 WeakPolarHBondContact O-CB 3.49Å; I1311-K1315 PolarHBondContact O-N 3.18Å
1312	L	83.9	Confident	79	Confident	100 Å²	100	105.9 Å²	105.9	52%	0.524	54%	0.542	S	S	.	.	H	α-helix	trans	-63.6	-46.7	178	-152.9	89.8	0	0	0	110.8	S1308 A1309 A1314 K1315 Y1316	S1308-L1312 WeakPolarHBondContact O-CB 3.41Å; S1308-L1312 PolarHBondContact O-N 3.37Å; A1309-L1312 PolarHBondContact O-N 3.25Å; L1312-A1314 PolarHBondContact O-N 2.91Å; L1312-K1315 WeakPolarHBondContact O-CB 3.21Å; L1312-K1315 PolarHBondContact O-N 3.05Å; L1312-K1315 VanDerWaalsContact O-N 3.14Å; L1312-Y1316 HydrophobicContact CD2-CD2 4.34Å; L1312-Y1316 HydrophobicContact CD2-CE2 3.91Å; L1312-Y1316 HydrophobicContact CG-CD2 4.11Å; L1312-Y1316 HydrophobicContact CG-CE2 3.87Å; L1312-Y1316 VanDerWaalsContact O-CD2 3.25Å; L1312-Y1316 WeakPolarHBondContact O-CD2 3.29Å; L1312-Y1316 PolarHBondContact O-N 2.87Å
1313	A	83.1	Confident	76.7	Confident	60 Å²	60	113.2 Å²	113.2	50%	0.496	56%	0.557	S	S	.	*	H	α-helix	trans	-57.5	-48.1	175.6	0	0	0	0	0	111.2	A1309 A1310 K1315 Y1316 E1317	A1309-A1313 WeakPolarHBondContact O-CB 3.34Å; A1309-A1313 PolarHBondContact O-N 3.32Å; A1310-A1313 PolarHBondContact O-N 3.06Å; A1313-K1315 VanDerWaalsContact C-N 3.28Å; A1313-K1315 PolarHBondContact O-N 2.92Å; A1313-Y1316 PolarHBondContact O-N 3.31Å; A1313-Y1316 VanDerWaalsContact O-N 3.16Å; A1313-E1317 WeakPolarHBondContact O-CB 3.31Å; A1313-E1317 PolarHBondContact O-N 2.94Å
1314	A	82.8	Confident	74.3	Confident	45 Å²	45	111 Å²	111	37%	0.372	57%	0.565	S	S	.	*	H	α-helix	trans	-62.9	-33.1	176.5	0	0	0	0	0	113	A1310 I1311 L1312 K1318	A1310-A1314 WeakPolarHBondContact O-CB 3.34Å; A1310-A1314 PolarHBondContact O-N 3.49Å; I1311-A1314 PolarHBondContact O-N 3.23Å; L1312-A1314 PolarHBondContact O-N 2.91Å; A1314-K1318 WeakPolarHBondContact O-CB 3.49Å; A1314-K1318 WeakPolarHBondContact O-CG 3.49Å; A1314-K1318 PolarHBondContact O-N 3.42Å; A1314-K1318 VanDerWaalsContact O-N 3.07Å
1315	K	81.4	Confident	71.9	Confident	136 Å²	136	116.9 Å²	116.9	59%	0.591	59%	0.589	S	S	*	*	H	α-helix	trans	-68.6	-38.9	174.9	-171.7	179.8	-179	179.7	0	111.7	I1311 L1312 A1313 K1319	I1311-K1315 WeakPolarHBondContact O-CB 3.49Å; I1311-K1315 PolarHBondContact O-N 3.18Å; L1312-K1315 WeakPolarHBondContact O-CB 3.21Å; L1312-K1315 PolarHBondContact O-N 3.05Å; L1312-K1315 VanDerWaalsContact O-N 3.14Å; A1313-K1315 VanDerWaalsContact C-N 3.28Å; A1313-K1315 PolarHBondContact O-N 2.92Å; K1315-K1319 PolarHBondContact O-N 3.28Å; K1315-K1319 VanDerWaalsContact O-N 3.12Å
1316	Y	75.5	Confident	69.7	Low	137 Å²	137	115 Å²	115	54%	0.537	59%	0.593	S	S	.	*	H	α-helix	trans	-72.8	-39.8	175.4	-80.4	-73.3	0	0	0	112	L1312 A1313 K1318 K1319 D1320	L1312-Y1316 HydrophobicContact CD2-CD2 4.34Å; L1312-Y1316 HydrophobicContact CD2-CE2 3.91Å; L1312-Y1316 HydrophobicContact CG-CD2 4.11Å; L1312-Y1316 HydrophobicContact CG-CE2 3.87Å; L1312-Y1316 VanDerWaalsContact O-CD2 3.25Å; L1312-Y1316 WeakPolarHBondContact O-CD2 3.29Å; L1312-Y1316 PolarHBondContact O-N 2.87Å; A1313-Y1316 PolarHBondContact O-N 3.31Å; A1313-Y1316 VanDerWaalsContact O-N 3.16Å; Y1316-K1318 VanDerWaalsContact C-N 3.28Å; Y1316-K1318 PolarHBondContact O-N 3.22Å; Y1316-K1319 CarbonylContact O-C 3.52Å; Y1316-K1319 WeakPolarHBondContact O-CA 3.31Å; Y1316-K1319 WeakPolarHBondContact O-CB 3.06Å; Y1316-K1319 PolarHBondContact O-N 3.32Å; Y1316-D1320 PolarHBondContact O-N 3.35Å
1317	E	76	Confident	67.1	Low	109 Å²	109	126.4 Å²	126.4	51%	0.509	63%	0.632	S	S	.	*	H	α-helix	trans	-60.7	-37.7	174.3	-160	-157.3	139.9	0	0	111.8	A1313 K1321	A1313-E1317 WeakPolarHBondContact O-CB 3.31Å; A1313-E1317 PolarHBondContact O-N 2.94Å; E1317-K1321 WeakPolarHBondContact O-CG 3.23Å; E1317-K1321 PolarHBondContact O-N 3.26Å; E1317-K1321 IonicContact OE1-NZ 2.86Å; E1317-K1321 PolarHBondContact OE1-NZ 3.42Å
1318	K	70.5	Confident	65.9	Low	164 Å²	164	123.8 Å²	123.8	71%	0.713	63%	0.63	S	S	*	*	H	α-helix	trans	-70.2	-29.7	172	-77	-177.6	179.6	-179.4	0	113.4	A1314 Y1316	A1314-K1318 WeakPolarHBondContact O-CB 3.49Å; A1314-K1318 WeakPolarHBondContact O-CG 3.49Å; A1314-K1318 PolarHBondContact O-N 3.42Å; A1314-K1318 VanDerWaalsContact O-N 3.07Å; Y1316-K1318 VanDerWaalsContact C-N 3.28Å; Y1316-K1318 PolarHBondContact O-N 3.22Å
1319	K	57.5	Low	64.6	Low	117 Å²	117	126.4 Å²	126.4	51%	0.509	64%	0.636	S	S	.	*	H	α-helix	trans	-74.4	-38.8	175.1	-96.9	-171.7	172.4	-172.2	0	111.7	K1315 Y1316 K1321 R1322	K1315-K1319 PolarHBondContact O-N 3.28Å; K1315-K1319 VanDerWaalsContact O-N 3.12Å; Y1316-K1319 CarbonylContact O-C 3.52Å; Y1316-K1319 WeakPolarHBondContact O-CA 3.31Å; Y1316-K1319 WeakPolarHBondContact O-CB 3.06Å; Y1316-K1319 PolarHBondContact O-N 3.32Å; K1319-K1321 VanDerWaalsContact C-N 3.26Å; K1319-K1321 PolarHBondContact O-N 3.11Å; K1319-R1322 WeakPolarHBondContact O-CB 3.2Å; K1319-R1322 PolarHBondContact O-N 3.46Å
1320	D	53.1	Low	63.4	Low	117 Å²	117	131 Å²	131	63%	0.626	65%	0.651	S	S	*	*	H	α-helix	trans	-64.1	-34.4	176.1	-76.2	-16.7	0	0	0	111.4	Y1316 R1322 W1323	Y1316-D1320 PolarHBondContact O-N 3.35Å; D1320-R1322 PolarHBondContact O-N 3.48Å; D1320-W1323 PolarHBondContact O-N 3.36Å
1321	K	51.6	Low	62.1	Low	149 Å²	149	135.2 Å²	135.2	65%	0.648	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.4	-18.7	170.8	-72.3	175.3	-172	163.9	0	114	E1317 K1319	E1317-K1321 WeakPolarHBondContact O-CG 3.23Å; E1317-K1321 PolarHBondContact O-N 3.26Å; E1317-K1321 IonicContact OE1-NZ 2.86Å; E1317-K1321 PolarHBondContact OE1-NZ 3.42Å; K1319-K1321 VanDerWaalsContact C-N 3.26Å; K1319-K1321 PolarHBondContact O-N 3.11Å
1322	R	43.6	Very low	60.3	Low	215 Å²	215	136.1 Å²	136.1	81%	0.811	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.1	-16.4	178.5	-153.8	178.7	-175	-174.9	1.3	113.4	K1319 D1320	K1319-R1322 WeakPolarHBondContact O-CB 3.2Å; K1319-R1322 PolarHBondContact O-N 3.46Å; D1320-R1322 PolarHBondContact O-N 3.48Å
1323	W	42.7	Very low	58.7	Low	215 Å²	215	138.5 Å²	138.5	81%	0.814	67%	0.672	S	S	*	*	S	Bend	trans	-103	9.5	178.4	-67.7	108	0	0	0	113.8	D1320 L1325	D1320-W1323 PolarHBondContact O-N 3.36Å; W1323-L1325 PolarHBondContact O-N 3.07Å
1324	G	41.9	Very low	57	Low	65 Å²	65	144.1 Å²	144.1	67%	0.67	69%	0.685	S	S	*	*			trans	-73.3	67.8	165.3	0	0	0	0	0	112.2
1325	L	39.8	Very low	55	Low	153 Å²	153	151.8 Å²	151.8	80%	0.801	71%	0.709	S	S	*	*			trans	-117	116.5	154.5	-88.3	165.5	0	0	0	107.1	W1323 F1327	W1323-L1325 PolarHBondContact O-N 3.07Å; L1325-F1327 PolarHBondContact O-N 3.33Å
1326	P	44.5	Very low	52.8	Low	117 Å²	117	153.1 Å²	153.1	76%	0.76	72%	0.719	S	S	*	*			trans	-80.8	106.4	-178.2	31.8	-28.4	0	0	0	108.3
1327	F	37.1	Very low	50.8	Low	279 Å²	279	154.5 Å²	154.5	100%	1.224	74%	0.735	S	S	*	*			trans	-146.4	0	156.6	-95.8	-74.6	0	0	0	109.2	L1325	L1325-F1327 PolarHBondContact O-N 3.33Å

Retrieved 1,327 of 1,327 residues in 1011.9 ms (Link to these results)

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