A0A3Q0KSN2_SCHMA Loading...

DH domain-containing protein

AlphaFold DB , UniProt , Accession A0A3Q0KSN2, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,633 aa.

						>A0A3Q0KSN2_SCHMA|A0A3Q0KSN2
MNEELNQSLEHLTTDIEEHSKNCKDNQSNVVNTLNNEPLYESPKHDPFETTIDQNNCVQLNNEIFQQNDSSNLKVFNIVLEKDLDYDEEHKTTEHIYYLPLAIGNSNTSNEVLGKEFLTLTDSTSHSVSDKILYDLGKSLIGIRDDVTNKEDNSKKEMDEPTKLITTSLEENLPSVQIVNTTVTSTNTTVTTTIITTSSVTTNITTNTTSVTTTTTTPTSSPKVDLITVNLLSSDAIPESIAQQFNQIAKLNKSSLSSRRTVRTTSAKLSPLSDSKRQASFEDAHLTEIASVSDSQKNIQKDLLKDTYHARFHSDEIATLQDYVSKPQTQTILDLEYTNLENTDIVHANSSSNTGSSKHRNSNVFRSKSALSTLPPTKRGQRYGHGHQSEPSSQGTDSVHRQSPLLAHENISHSQGQSSGFTASEEGSSSSLPSLDTGGSSSTGGGCSSGHTQTADEDHSIGEELNSANTTILHSISKISKNNNEGDKHSSQLLHSDEAKHLQSDNLSSDKTVLLLSKRRHAVKELIHVEKEYVNALTTLVNMYMIPLKQEKILDDQQVDIIFFKVQELLMYHMSFLNTLQMWELTNTVGDKLLDMFSREAVAMCYCTFVDNFSNSEKTLETCWNTKSSFQKFCEMKLRMNRNKLPLKALLVQPIQRIPRYELLIKRLLESTPKDYSDHALLVEAESAIHRLALRVNAVHTAGEDENIVDGIRLIEKLLAPATLTPTRQYVRHDIVSVEERKDPVCIFMFTDQIVFTVARRRGSQVIKKPVFLRLQSIRGVDAIENIKYKIYHRLGIEAIELESRLEVDIEPTGQHKEDLDAVVRRMYMSIQKELEDLRTARNTSTPMPGNMSIFTATSKEGVERYELMFPNSAKRKEWERTILELKRQLSSVKRMAKFNEAVQIPRTLPGIQLSCASMIESSPLVAETPCDVWICASDGYTGYVCLLTVHPKPNIYFNVPLSGCTSRITCICAIPGYIHPGLRRTSHSLIAQSMRSRYGMEKKRSATMDQPLLEVEQQVTEENNCQSKLHAAVSEKPSLMNTNEKVVDSKVVDKVELNTNSDGSKNAENTFDDDVRCRKSSIPQDTSTSSHSTTPPDTPTNTESTLKLSDGDESKGDDVSNLPKKCDISPESGEINVQQNNELITQKNCEESDSLEKNKNEPQREISLDIYAEYTDDQDDPTSNDSDSSDISETEGDLTQHIISENLSDNSLFKETEHNIQSYEYDSKTDEYTNSHGKNHCLTSSTQPLMWLGTEEGSIFMFYASDNLKTSRQRQKISLSHGINNILHFDVHIFVACANGDLIVYKRNSDGLWDVNKPIHVKLQPNSNEPVIVKRMLVVAGKIWCAAHRSIFILNPTTLTPELSFPLNGNYADPRGIQLMAYGKQTVWLATENSSRISLYHATTGEFLMEIDLKPIVLQRLQDCDEIIMRHKEACLRITCLTVCKDLLWAGTSAGVIVTVAIPKLGTGPTYENIKQPQLETLSYGHIGQVRFLVTLDNIADDENPIKSKTEKTNTSSQAIYISNSAITPFSDKVTSSDGNEANTSSHLVSSSRTSDLSQSGQLSRHHFSGSRRSSINPCTTINTKMKVISGGEGREEFSKKDLTTLGIYDNNLCCTIGDDDSDNYVLIWDVK
					

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.2	Very low	46.9	Very low	180 Å²	180	119.5 Å²	119.5	89%	0.887	60%	0.602	S	S	*	*				0	-80.8	0	-79.3	-178.5	-87.4	0	0	111.7	E3 E4 L5	M1-E3 PolarHBondContact O-N 3.41Å; M1-E4 VanDerWaalsContact CA-OE2 3.28Å; M1-E4 WeakPolarHBondContact CA-OE2 3.5Å; M1-E4 PolarHBondContact N-OE2 3.28Å; M1-E4 CarbonylContact O-C 3.56Å; M1-E4 WeakPolarHBondContact O-CA 3.21Å; M1-E4 WeakPolarHBondContact O-CB 3.47Å; M1-E4 PolarHBondContact O-N 3.38Å; M1-L5 PolarHBondContact O-N 3.13Å
2	N	31.8	Very low	47	Very low	128 Å²	128	118.2 Å²	118.2	68%	0.684	60%	0.597	S	S	*	*	H	α-helix	trans	-60.1	-37.7	-176.2	-81.3	20.1	0	0	0	114.6	E4 L5 N6	N2-E4 VanDerWaalsContact C-N 3.34Å; N2-L5 PolarHBondContact O-N 3.43Å; N2-N6 WeakPolarHBondContact O-CB 3.16Å; N2-N6 PolarHBondContact O-N 3.34Å
3	E	39.8	Very low	47.5	Very low	155 Å²	155	114.8 Å²	114.8	72%	0.724	59%	0.586	S	S	*	*	H	α-helix	trans	-67.1	-34	173.3	-70.5	177.1	121.7	0	0	112.6	M1 Q7	M1-E3 PolarHBondContact O-N 3.41Å; E3-Q7 VanDerWaalsContact O-CB 3.25Å; E3-Q7 WeakPolarHBondContact O-CB 3.33Å; E3-Q7 WeakPolarHBondContact O-CG 3.34Å; E3-Q7 PolarHBondContact O-N 2.84Å
4	E	40.9	Very low	48	Very low	122 Å²	122	111.9 Å²	111.9	57%	0.57	58%	0.577	S	S	*	*	H	α-helix	trans	-74.9	-35.2	176.7	-66.6	159.1	132.7	0	0	111.6	M1 N2 S8	M1-E4 VanDerWaalsContact CA-OE2 3.28Å; M1-E4 WeakPolarHBondContact CA-OE2 3.5Å; M1-E4 PolarHBondContact N-OE2 3.28Å; M1-E4 CarbonylContact O-C 3.56Å; M1-E4 WeakPolarHBondContact O-CA 3.21Å; M1-E4 WeakPolarHBondContact O-CB 3.47Å; M1-E4 PolarHBondContact O-N 3.38Å; N2-E4 VanDerWaalsContact C-N 3.34Å; E4-S8 VanDerWaalsContact O-CB 3.26Å; E4-S8 WeakPolarHBondContact O-CB 3.32Å; E4-S8 PolarHBondContact O-N 3.06Å; E4-S8 PolarHBondContact O-OG 3.36Å
5	L	46.4	Very low	47.8	Very low	104 Å²	104	110 Å²	110	55%	0.545	57%	0.568	S	S	.	*	H	α-helix	trans	-69.2	-42.6	174.8	-165.9	75.3	0	0	0	110.7	M1 N2 S8 L9	M1-L5 PolarHBondContact O-N 3.13Å; N2-L5 PolarHBondContact O-N 3.43Å; L5-S8 PolarHBondContact O-N 3.46Å; L5-L9 HydrophobicContact CG-CD1 4.47Å; L5-L9 WeakPolarHBondContact O-CB 3.48Å; L5-L9 PolarHBondContact O-N 3.16Å
6	N	50.5	Low	48	Very low	96 Å²	96	110.1 Å²	110.1	51%	0.513	57%	0.568	S	S	.	*	H	α-helix	trans	-66	-43.8	173.3	-76.2	9.7	0	0	0	111.4	N2 S8 L9 E10	N2-N6 WeakPolarHBondContact O-CB 3.16Å; N2-N6 PolarHBondContact O-N 3.34Å; N6-S8 VanDerWaalsContact C-N 3.27Å; N6-S8 PolarHBondContact O-N 3.13Å; N6-L9 PolarHBondContact O-N 3Å; N6-E10 WeakPolarHBondContact O-CB 3.42Å; N6-E10 WeakPolarHBondContact O-CG 3.28Å; N6-E10 PolarHBondContact O-N 3.46Å
7	Q	55	Low	47.8	Very low	113 Å²	113	109.5 Å²	109.5	53%	0.528	56%	0.562	S	S	.	*	H	α-helix	trans	-63.3	-32.6	174.1	-76.1	168.2	20.6	0	0	112.3	E3 H11	E3-Q7 VanDerWaalsContact O-CB 3.25Å; E3-Q7 WeakPolarHBondContact O-CB 3.33Å; E3-Q7 WeakPolarHBondContact O-CG 3.34Å; E3-Q7 PolarHBondContact O-N 2.84Å; Q7-H11 WeakPolarHBondContact O-CB 3.12Å; Q7-H11 PolarHBondContact O-N 2.96Å
8	S	47.2	Very low	47.7	Very low	75 Å²	75	109.7 Å²	109.7	52%	0.524	56%	0.56	S	S	.	*	H	α-helix	trans	-71.9	-37.8	174.1	-58.8	0	0	0	0	112.2	E4 L5 N6 L12	E4-S8 VanDerWaalsContact O-CB 3.26Å; E4-S8 WeakPolarHBondContact O-CB 3.32Å; E4-S8 PolarHBondContact O-N 3.06Å; E4-S8 PolarHBondContact O-OG 3.36Å; L5-S8 PolarHBondContact O-N 3.46Å; N6-S8 VanDerWaalsContact C-N 3.27Å; N6-S8 PolarHBondContact O-N 3.13Å; S8-L12 WeakPolarHBondContact O-CB 3.31Å; S8-L12 PolarHBondContact O-N 3Å
9	L	57.1	Low	47.5	Very low	95 Å²	95	111.2 Å²	111.2	50%	0.497	57%	0.565	S	S	.	*	H	α-helix	trans	-72.2	-37.7	174.1	-86.9	161.3	0	0	0	112.4	L5 N6 L12 T13	L5-L9 HydrophobicContact CG-CD1 4.47Å; L5-L9 WeakPolarHBondContact O-CB 3.48Å; L5-L9 PolarHBondContact O-N 3.16Å; N6-L9 PolarHBondContact O-N 3Å; L9-L12 PolarHBondContact O-N 2.85Å; L9-T13 VanDerWaalsContact O-CB 3.26Å; L9-T13 WeakPolarHBondContact O-CB 3.49Å; L9-T13 PolarHBondContact O-N 3.01Å; L9-T13 PolarHBondContact O-OG1 2.76Å
10	E	54.9	Low	47.2	Very low	130 Å²	130	108.5 Å²	108.5	61%	0.607	56%	0.556	S	S	*	*	H	α-helix	trans	-64.1	-42.7	170.7	-75.9	179.4	156.7	0	0	110.4	N6 T13 T14	N6-E10 WeakPolarHBondContact O-CB 3.42Å; N6-E10 WeakPolarHBondContact O-CG 3.28Å; N6-E10 PolarHBondContact O-N 3.46Å; E10-T13 PolarHBondContact O-N 2.88Å; E10-T14 VanDerWaalsContact O-CB 3.28Å; E10-T14 WeakPolarHBondContact O-CB 3.29Å; E10-T14 PolarHBondContact O-N 3.06Å; E10-T14 PolarHBondContact O-OG1 2.91Å
11	H	57.8	Low	46.9	Very low	116 Å²	116	108.6 Å²	108.6	54%	0.537	55%	0.553	S	S	.	*	H	α-helix	trans	-61.5	-50.3	171.3	-111.1	-64.1	0	0	0	111.8	Q7 T13 T14 D15	Q7-H11 WeakPolarHBondContact O-CB 3.12Å; Q7-H11 PolarHBondContact O-N 2.96Å; H11-T13 VanDerWaalsContact C-N 3.26Å; H11-T13 PolarHBondContact O-N 3.17Å; H11-T14 CarbonylContact O-C 3.57Å; H11-T14 PolarHBondContact O-N 3.15Å; H11-T14 VanDerWaalsContact O-N 3.08Å; H11-D15 IonicContact ND1-OD1 3.92Å; H11-D15 PolarHBondContact ND1-OD1 3.33Å; H11-D15 WeakPolarHBondContact O-CB 3.29Å; H11-D15 PolarHBondContact O-N 3.47Å; H11-D15 VanDerWaalsContact O-OD1 3.14Å
12	L	48.1	Very low	47.3	Very low	104 Å²	104	105.2 Å²	105.2	55%	0.545	54%	0.538	S	S	.	.	H	α-helix	trans	-61.4	-36	-179.7	-148	79.3	0	0	0	112.2	S8 L9 I16	S8-L12 WeakPolarHBondContact O-CB 3.31Å; S8-L12 PolarHBondContact O-N 3Å; L9-L12 PolarHBondContact O-N 2.85Å; L12-I16 HydrophobicContact CG-CD1 4.36Å; L12-I16 VanDerWaalsContact O-CB 3.31Å; L12-I16 WeakPolarHBondContact O-CB 3.45Å; L12-I16 WeakPolarHBondContact O-CD1 3.45Å; L12-I16 WeakPolarHBondContact O-CG1 3.39Å; L12-I16 PolarHBondContact O-N 3.49Å
13	T	53.6	Low	47.4	Very low	75 Å²	75	103.6 Å²	103.6	46%	0.46	54%	0.536	S	S	.	.	H	α-helix	trans	-71.5	-38.6	175.5	-53.2	0	0	0	0	111.3	L9 E10 H11 E17	L9-T13 VanDerWaalsContact O-CB 3.26Å; L9-T13 WeakPolarHBondContact O-CB 3.49Å; L9-T13 PolarHBondContact O-N 3.01Å; L9-T13 PolarHBondContact O-OG1 2.76Å; E10-T13 PolarHBondContact O-N 2.88Å; H11-T13 VanDerWaalsContact C-N 3.26Å; H11-T13 PolarHBondContact O-N 3.17Å; T13-E17 WeakPolarHBondContact O-CB 3.32Å; T13-E17 PolarHBondContact O-N 2.93Å
14	T	54.9	Low	47.2	Very low	74 Å²	74	103.1 Å²	103.1	45%	0.454	53%	0.531	S	S	.	.	H	α-helix	trans	-66.5	-46.7	175.6	-55.2	0	0	0	0	110.6	E10 H11 I16 E17 E18	E10-T14 VanDerWaalsContact O-CB 3.28Å; E10-T14 WeakPolarHBondContact O-CB 3.29Å; E10-T14 PolarHBondContact O-N 3.06Å; E10-T14 PolarHBondContact O-OG1 2.91Å; H11-T14 CarbonylContact O-C 3.57Å; H11-T14 PolarHBondContact O-N 3.15Å; H11-T14 VanDerWaalsContact O-N 3.08Å; T14-I16 VanDerWaalsContact C-N 3.34Å; T14-I16 PolarHBondContact O-N 2.94Å; T14-E17 CarbonylContact O-C 3.56Å; T14-E17 PolarHBondContact O-N 2.95Å; T14-E18 WeakPolarHBondContact O-CB 3.39Å; T14-E18 PolarHBondContact O-N 3.11Å
15	D	44.9	Very low	46.9	Very low	83 Å²	83	104 Å²	104	44%	0.444	54%	0.54	S	S	.	.	H	α-helix	trans	-61.9	-41.2	177.6	-63.4	0.7	0	0	0	110.6	H11 E18 H19	H11-D15 IonicContact ND1-OD1 3.92Å; H11-D15 PolarHBondContact ND1-OD1 3.33Å; H11-D15 WeakPolarHBondContact O-CB 3.29Å; H11-D15 PolarHBondContact O-N 3.47Å; H11-D15 VanDerWaalsContact O-OD1 3.14Å; D15-E18 PolarHBondContact O-N 2.76Å; D15-H19 VanDerWaalsContact O-CB 3.24Å; D15-H19 WeakPolarHBondContact O-CB 3.35Å; D15-H19 PolarHBondContact O-N 2.78Å
16	I	50.4	Low	46.3	Very low	112 Å²	112	106.3 Å²	106.3	57%	0.574	55%	0.553	S	S	*	*	H	α-helix	trans	-68.1	-40.9	174.3	-71.7	167	0	0	0	111.7	L12 T14 S20	L12-I16 HydrophobicContact CG-CD1 4.36Å; L12-I16 VanDerWaalsContact O-CB 3.31Å; L12-I16 WeakPolarHBondContact O-CB 3.45Å; L12-I16 WeakPolarHBondContact O-CD1 3.45Å; L12-I16 WeakPolarHBondContact O-CG1 3.39Å; L12-I16 PolarHBondContact O-N 3.49Å; T14-I16 VanDerWaalsContact C-N 3.34Å; T14-I16 PolarHBondContact O-N 2.94Å; I16-S20 WeakPolarHBondContact O-CB 3.41Å; I16-S20 PolarHBondContact O-N 2.85Å
17	E	44.3	Very low	45.2	Very low	99 Å²	99	110.8 Å²	110.8	46%	0.463	57%	0.571	S	S	.	*	H	α-helix	trans	-67.2	-37.6	174.5	-86.1	-158.5	-163.7	0	0	112.7	T13 T14 S20 K21	T13-E17 WeakPolarHBondContact O-CB 3.32Å; T13-E17 PolarHBondContact O-N 2.93Å; T14-E17 CarbonylContact O-C 3.56Å; T14-E17 PolarHBondContact O-N 2.95Å; E17-S20 CarbonylContact O-C 3.58Å; E17-S20 PolarHBondContact O-N 2.9Å; E17-K21 WeakPolarHBondContact O-CB 3.45Å; E17-K21 VanDerWaalsContact O-CD 3.32Å; E17-K21 WeakPolarHBondContact O-CD 3.42Å; E17-K21 WeakPolarHBondContact O-CG 3.35Å; E17-K21 PolarHBondContact O-N 2.9Å; E17-K21 WeakPolarHBondContact OE2-CE 3.43Å; E17-K21 IonicContact OE2-NZ 3.43Å; E17-K21 PolarHBondContact OE2-NZ 2.86Å
18	E	46	Very low	44.1	Very low	113 Å²	113	110.3 Å²	110.3	53%	0.528	58%	0.58	S	S	.	*	H	α-helix	trans	-74.6	-36.9	-179.6	-169.5	157.8	-112.3	0	0	110.9	T14 D15 S20 K21 N22	T14-E18 WeakPolarHBondContact O-CB 3.39Å; T14-E18 PolarHBondContact O-N 3.11Å; D15-E18 PolarHBondContact O-N 2.76Å; E18-S20 VanDerWaalsContact C-N 3.32Å; E18-K21 PolarHBondContact O-N 2.88Å; E18-N22 WeakPolarHBondContact O-CB 3.38Å; E18-N22 PolarHBondContact O-N 2.82Å; E18-N22 PolarHBondContact O-ND2 2.73Å; E18-N22 VanDerWaalsContact O-ND2 3.14Å
19	H	45.2	Very low	43.4	Very low	139 Å²	139	113.5 Å²	113.5	64%	0.644	59%	0.591	S	S	*	*	H	α-helix	trans	-68.3	-31.5	168.9	-150.9	-19.3	0	0	0	112	D15 C23	D15-H19 VanDerWaalsContact O-CB 3.24Å; D15-H19 WeakPolarHBondContact O-CB 3.35Å; D15-H19 PolarHBondContact O-N 2.78Å; H19-C23 WeakPolarHBondContact O-CB 3.42Å; H19-C23 PolarHBondContact O-N 2.94Å; H19-C23 PolarHBondContact O-SG 3.08Å
20	S	40.3	Very low	42.2	Very low	57 Å²	57	115.5 Å²	115.5	40%	0.399	61%	0.607	S	S	.	*	H	α-helix	trans	-75.4	-24.6	173.6	-176.6	0	0	0	0	113.9	I16 E17 E18 K24	I16-S20 WeakPolarHBondContact O-CB 3.41Å; I16-S20 PolarHBondContact O-N 2.85Å; E17-S20 CarbonylContact O-C 3.58Å; E17-S20 PolarHBondContact O-N 2.9Å; E18-S20 VanDerWaalsContact C-N 3.32Å; S20-K24 WeakPolarHBondContact O-CD 3.26Å
21	K	41.8	Very low	41	Very low	111 Å²	111	114.4 Å²	114.4	48%	0.483	61%	0.609	S	S	.	*	H	α-helix	trans	-82	-49.8	172.5	-72.9	158.3	-166	163.3	0	111	E17 E18 C23 K24	E17-K21 WeakPolarHBondContact O-CB 3.45Å; E17-K21 VanDerWaalsContact O-CD 3.32Å; E17-K21 WeakPolarHBondContact O-CD 3.42Å; E17-K21 WeakPolarHBondContact O-CG 3.35Å; E17-K21 PolarHBondContact O-N 2.9Å; E17-K21 WeakPolarHBondContact OE2-CE 3.43Å; E17-K21 IonicContact OE2-NZ 3.43Å; E17-K21 PolarHBondContact OE2-NZ 2.86Å; E18-K21 PolarHBondContact O-N 2.88Å; K21-C23 PolarHBondContact O-N 3.01Å; K21-C23 VanDerWaalsContact O-N 3.1Å; K21-K24 PolarHBondContact O-N 2.72Å
22	N	41.3	Very low	39.6	Very low	108 Å²	108	115.7 Å²	115.7	58%	0.578	62%	0.62	S	S	*	*	H	α-helix	trans	-61.6	-20.6	177.3	-76.7	-44.4	0	0	0	114	E18 K24	E18-N22 WeakPolarHBondContact O-CB 3.38Å; E18-N22 PolarHBondContact O-N 2.82Å; E18-N22 PolarHBondContact O-ND2 2.73Å; E18-N22 VanDerWaalsContact O-ND2 3.14Å; N22-K24 VanDerWaalsContact C-N 3.31Å; N22-K24 PolarHBondContact O-N 2.87Å
23	C	35.5	Very low	38.8	Very low	94 Å²	94	116 Å²	116	64%	0.635	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.2	6	170.9	-75.2	0	0	0	0	115	H19 K21	H19-C23 WeakPolarHBondContact O-CB 3.42Å; H19-C23 PolarHBondContact O-N 2.94Å; H19-C23 PolarHBondContact O-SG 3.08Å; K21-C23 PolarHBondContact O-N 3.01Å; K21-C23 VanDerWaalsContact O-N 3.1Å
24	K	35	Very low	37.8	Very low	145 Å²	145	119.3 Å²	119.3	63%	0.63	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.3	-20.9	-178.6	-74.4	171.5	-179.5	148.4	0	115.3	S20 K21 N22 N26	S20-K24 WeakPolarHBondContact O-CD 3.26Å; K21-K24 PolarHBondContact O-N 2.72Å; N22-K24 VanDerWaalsContact C-N 3.31Å; N22-K24 PolarHBondContact O-N 2.87Å; K24-N26 VanDerWaalsContact C-N 3.31Å; K24-N26 PolarHBondContact O-N 2.86Å
25	D	34.8	Very low	36.5	Very low	140 Å²	140	121.6 Å²	121.6	75%	0.749	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.3	27.9	-174.5	-67.4	-41.9	0	0	0	115
26	N	33.7	Very low	35.8	Very low	154 Å²	154	124 Å²	124	82%	0.824	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-128.4	27.9	179.2	-107	-45.6	0	0	0	114.4	K24	K24-N26 VanDerWaalsContact C-N 3.31Å; K24-N26 PolarHBondContact O-N 2.86Å
27	Q	28.4	Very low	34.9	Very low	189 Å²	189	126.9 Å²	126.9	88%	0.883	67%	0.674	S	S	*	*			trans	-133.8	89.5	170.6	-70.8	-167.4	0.6	0	0	112.8
28	S	30.6	Very low	34.6	Very low	104 Å²	104	126.6 Å²	126.6	73%	0.727	68%	0.681	S	S	*	*			trans	-154.5	157	159.2	67.8	0	0	0	0	113.3
29	N	32.8	Very low	33.7	Very low	141 Å²	141	127.3 Å²	127.3	75%	0.754	69%	0.687	S	S	*	*			trans	81.6	130.8	172.1	-57.2	-55.8	0	0	0	119
30	V	31.4	Very low	32.9	Very low	138 Å²	138	129.4 Å²	129.4	84%	0.836	69%	0.691	S	S	*	*			trans	78.5	78.9	-174.6	-167.9	0	0	0	0	113.8
31	V	29.2	Very low	32.3	Very low	107 Å²	107	134.3 Å²	134.3	65%	0.648	71%	0.707	S	S	*	*			cis	73	117	38.1	-178.4	0	0	0	0	114.4
32	N	29.6	Very low	31.8	Very low	142 Å²	142	133.4 Å²	133.4	76%	0.759	72%	0.715	S	S	*	*			trans	73.4	141.2	167	-68.8	-13.6	0	0	0	117.4
33	T	32	Very low	31.4	Very low	110 Å²	110	133.9 Å²	133.9	68%	0.675	72%	0.724	S	S	*	*			cis	-158.7	153.8	9.8	-5.3	0	0	0	0	113.2
34	L	31.1	Very low	31.2	Very low	146 Å²	146	137.4 Å²	137.4	76%	0.764	73%	0.729	S	S	*	*			trans	68.3	147.9	153.2	-61.9	165.6	0	0	0	119.5
35	N	27.9	Very low	31	Very low	121 Å²	121	137.7 Å²	137.7	65%	0.647	73%	0.732	S	S	*	*			cis	-175.2	159.4	-36	-122.7	52.2	0	0	0	109.8
36	N	31.1	Very low	30.8	Very low	133 Å²	133	137.7 Å²	137.7	71%	0.711	73%	0.732	S	S	*	*			trans	67.6	147.7	160.7	-58.8	10.7	0	0	0	117.9
37	E	30.5	Very low	31	Very low	173 Å²	173	135.1 Å²	135.1	81%	0.808	72%	0.724	S	S	*	*			cis	-160.4	168.9	-21.5	-103.4	-133.6	123.5	0	0	109.1
38	P	37.6	Very low	31.1	Very low	94 Å²	94	135.2 Å²	135.2	61%	0.61	72%	0.722	S	S	*	*			trans	-127.9	-139.7	-146.2	41	-23.1	0	0	0	115
39	L	28.1	Very low	31	Very low	128 Å²	128	137.8 Å²	137.8	67%	0.67	72%	0.722	S	S	*	*			trans	83.4	155.8	172	-44.3	148.2	0	0	0	114.3
40	Y	29	Very low	30.9	Very low	182 Å²	182	136.5 Å²	136.5	71%	0.714	72%	0.719	S	S	*	*			cis	-136.8	161.1	7.1	-100.3	-96.2	0	0	0	106.4
41	E	26.8	Very low	30.7	Very low	160 Å²	160	134.9 Å²	134.9	75%	0.748	71%	0.71	S	S	*	*			cis	178.2	161.8	-16.2	-119.3	-170.4	-175.8	0	0	106.7
42	S	31.9	Very low	30.6	Very low	92 Å²	92	136.7 Å²	136.7	64%	0.643	72%	0.715	S	S	*	*			trans	-124.7	154.3	171.9	64.7	0	0	0	0	111.8
43	P	33.4	Very low	30.7	Very low	118 Å²	118	135.6 Å²	135.6	77%	0.766	71%	0.709	S	S	*	*			trans	-143.8	149.4	130.4	24.7	-4.2	0	0	0	114
44	K	29.7	Very low	30.6	Very low	168 Å²	168	137.3 Å²	137.3	73%	0.73	71%	0.709	S	S	*	*			cis	106.8	152.2	29	-82.2	-172.1	176.9	-173	0	113.5
45	H	31.8	Very low	30.5	Very low	152 Å²	152	136.3 Å²	136.3	70%	0.704	71%	0.705	S	S	*	*			trans	78.9	142.9	166.1	-61.1	-69.1	0	0	0	117.9
46	D	29.8	Very low	30.6	Very low	139 Å²	139	138 Å²	138	74%	0.743	71%	0.713	S	S	*	*			cis	-156.8	171.2	-3.1	-112.1	-13.2	0	0	0	114.3
47	P	37.6	Very low	30.4	Very low	101 Å²	101	136.7 Å²	136.7	66%	0.656	71%	0.713	S	S	*	*			trans	-116.7	178.7	-170.2	44.1	-36.6	0	0	0	116.7
48	F	30.5	Very low	30.2	Very low	191 Å²	191	135.1 Å²	135.1	84%	0.838	72%	0.715	S	S	*	*			trans	-161	127.4	147.4	-92.3	-78.6	0	0	0	107
49	E	28.7	Very low	29.6	Very low	157 Å²	157	138.3 Å²	138.3	73%	0.734	72%	0.722	S	S	*	*				57.7	131.3	75.2	-90.2	-173.5	172.6	0	0	114.1
50	T	30.8	Very low	29.4	Very low	114 Å²	114	139.6 Å²	139.6	70%	0.699	73%	0.729	S	S	*	*				-160	129.9	53.6	10.7	0	0	0	0	116.5
51	T	27.4	Very low	29.2	Very low	104 Å²	104	137 Å²	137	64%	0.638	73%	0.728	S	S	*	*				58.4	129.4	127	62.8	0	0	0	0	127.5
52	I	27.5	Very low	29.1	Very low	146 Å²	146	135.4 Å²	135.4	75%	0.749	72%	0.724	S	S	*	*				78.1	147.4	122.4	-67.1	175.1	0	0	0	118.6
53	D	31.8	Very low	28.8	Very low	118 Å²	118	137.9 Å²	137.9	63%	0.631	73%	0.726	S	S	*	*			cis	-146.6	139.4	17.4	-125.4	-10.1	0	0	0	110.5
54	Q	30.6	Very low	28.4	Very low	147 Å²	147	138.6 Å²	138.6	69%	0.687	72%	0.721	S	S	*	*				83.4	134	85.1	-89.3	-169.3	73.2	0	0	121.3
55	N	27.9	Very low	28.1	Very low	125 Å²	125	139.2 Å²	139.2	67%	0.668	72%	0.724	S	S	*	*			trans	71.9	151.6	151.5	-56.7	-27.5	0	0	0	118.8
56	N	31	Very low	27.8	Very low	155 Å²	155	139.4 Å²	139.4	83%	0.829	73%	0.726	S	S	*	*			cis	-152.4	169.5	17.3	-140.9	-18.3	0	0	0	113.8
57	C	25.6	Very low	27.5	Very low	106 Å²	106	139.7 Å²	139.7	72%	0.716	72%	0.723	S	S	*	*			trans	-122.8	143.6	-177.4	173.5	0	0	0	0	113.2
58	V	26.8	Very low	27	Very low	140 Å²	140	141.9 Å²	141.9	85%	0.848	73%	0.729	S	S	*	*			trans	-146.7	146.5	165.8	178.5	0	0	0	0	111.2
59	Q	25.3	Very low	26.9	Very low	162 Å²	162	139.7 Å²	139.7	76%	0.757	73%	0.726	S	S	*	*			trans	-91.6	171.3	-178.2	-54.9	154.7	-80.7	0	0	113.7
60	L	24.5	Very low	26.8	Very low	155 Å²	155	137.9 Å²	137.9	81%	0.812	73%	0.73	S	S	*	*			trans	158.2	115	135.1	-82.6	161.9	0	0	0	107.9
61	N	23	Very low	26.6	Very low	128 Å²	128	137 Å²	137	68%	0.684	73%	0.729	S	S	*	*				81.5	137.8	67.4	-84.2	10.4	0	0	0	115.3
62	N	25.9	Very low	26.5	Very low	126 Å²	126	138.9 Å²	138.9	67%	0.674	74%	0.735	S	S	*	*			trans	74.3	144.3	165.2	-60.4	22.6	0	0	0	115.7
63	E	25.2	Very low	26.4	Very low	144 Å²	144	140.2 Å²	140.2	67%	0.673	74%	0.743	S	S	*	*			cis	-164	158	-1	-120.2	164	-147.4	0	0	111.7
64	I	25.2	Very low	26.1	Very low	132 Å²	132	143.4 Å²	143.4	68%	0.677	75%	0.751	S	S	*	*			trans	65	110.6	150.3	-67.6	160.6	0	0	0	117.1
65	F	23.6	Very low	25.7	Very low	181 Å²	181	143 Å²	143	79%	0.794	76%	0.758	S	S	*	*				53.8	145	84.1	-76	-75.5	0	0	0	114.4
66	Q	25.2	Very low	25.6	Very low	156 Å²	156	145.3 Å²	145.3	73%	0.729	76%	0.763	S	S	*	*			cis	-161.3	155	27.1	-151	158	36.7	0	0	113.3
67	Q	24.3	Very low	25.2	Very low	146 Å²	146	144.8 Å²	144.8	68%	0.682	76%	0.76	S	S	*	*			trans	-8.9	144.5	161.3	-57.7	160.9	-79.3	0	0	120.6
68	N	27	Very low	25.3	Very low	146 Å²	146	147.1 Å²	147.1	78%	0.781	76%	0.764	S	S	*	*				-174.5	156.3	103.8	-91.7	-41.3	0	0	0	115
69	D	27.4	Very low	25.1	Very low	145 Å²	145	146 Å²	146	78%	0.775	76%	0.757	S	S	*	*			trans	-72	153.3	-171	-41.7	-58.6	0	0	0	115.1
70	S	27.1	Very low	25.1	Very low	119 Å²	119	146 Å²	146	83%	0.832	76%	0.761	S	S	*	*				170.3	153.5	106.1	48.2	0	0	0	0	115.4
71	S	26.9	Very low	25.1	Very low	95 Å²	95	146.9 Å²	146.9	66%	0.664	76%	0.761	S	S	*	*			trans	-40.9	153.2	-177	55.9	0	0	0	0	120.8
72	N	25.3	Very low	25.3	Very low	145 Å²	145	150.4 Å²	150.4	78%	0.775	77%	0.77	S	S	*	*	S	Bend	trans	94.2	106.3	155.4	-56	-36.8	0	0	0	118.8
73	L	25	Very low	25.2	Very low	173 Å²	173	151.1 Å²	151.1	91%	0.906	77%	0.774	S	S	*	*			trans	46	89.7	152.2	-79.2	151.9	0	0	0	117.4
74	K	25.3	Very low	25.3	Very low	185 Å²	185	151.2 Å²	151.2	80%	0.804	78%	0.778	S	S	*	*			trans	-155.1	138	152.9	-114.9	159.6	-171.2	172.9	0	112.9	F76	K74-F76 HydrophobicContact CB-CD2 4.2Å; K74-F76 HydrophobicContact CB-CE2 4.08Å
75	V	22.4	Very low	25.4	Very low	138 Å²	138	150.9 Å²	150.9	84%	0.836	78%	0.778	S	S	*	*			trans	-67.8	138.3	163.7	176.9	0	0	0	0	108.3
76	F	25.2	Very low	25.5	Very low	175 Å²	175	152.2 Å²	152.2	77%	0.768	78%	0.779	S	S	*	*			trans	-133.4	131.9	172.5	-98.2	-85.6	0	0	0	111.1	K74	K74-F76 HydrophobicContact CB-CD2 4.2Å; K74-F76 HydrophobicContact CB-CE2 4.08Å
77	N	23.1	Very low	25.9	Very low	143 Å²	143	152.1 Å²	152.1	77%	0.765	78%	0.784	S	S	*	*			trans	-73.4	148.1	165.9	-67.1	-27.3	0	0	0	109.7
78	I	26.7	Very low	26.1	Very low	156 Å²	156	154 Å²	154	80%	0.8	79%	0.793	S	S	*	*			trans	-120.9	123	153.8	-64.1	-179.7	0	0	0	107	L80	I78-L80 HydrophobicContact CG2-CG 4.38Å
79	V	23	Very low	26.1	Very low	117 Å²	117	155 Å²	155	71%	0.709	79%	0.793	S	S	*	*			trans	-94.8	139.7	168.4	174.9	0	0	0	0	107.3	E81	V79-E81 HydrophobicContact CG1-CG 4.4Å
80	L	26.3	Very low	26.2	Very low	162 Å²	162	156.5 Å²	156.5	85%	0.848	80%	0.795	S	S	*	*			trans	-128.5	117	162.8	-73.1	175.2	0	0	0	108.6	I78	I78-L80 HydrophobicContact CG2-CG 4.38Å
81	E	23.7	Very low	26.1	Very low	172 Å²	172	160.3 Å²	160.3	80%	0.804	80%	0.796	S	S	*	*			trans	-78.7	145.9	174.2	-63.7	168	125.9	0	0	110.4	V79	V79-E81 HydrophobicContact CG1-CG 4.4Å
82	K	26.5	Very low	26	Very low	202 Å²	202	162.1 Å²	162.1	88%	0.878	80%	0.803	S	S	*	*			trans	-165.5	84.1	152.4	-114.1	170.8	-175.1	-178.2	0	112.8
83	D	25.2	Very low	26	Very low	141 Å²	141	160.8 Å²	160.8	75%	0.754	80%	0.801	S	S	*	*				19.1	103	126.4	-67.5	-16.6	0	0	0	118.1
84	L	26.2	Very low	26	Very low	146 Å²	146	157.4 Å²	157.4	76%	0.764	78%	0.78	S	S	*	*				151.9	131.7	108.2	-82.7	152.4	0	0	0	115.7
85	D	28.1	Very low	26.1	Very low	126 Å²	126	155.9 Å²	155.9	67%	0.674	78%	0.776	S	S	*	*			trans	57	111.1	145.6	-58.4	-14.4	0	0	0	124.1
86	Y	26.6	Very low	26.2	Very low	208 Å²	208	155.4 Å²	155.4	82%	0.816	77%	0.767	S	S	*	*			trans	38.2	123.1	130.5	-71.5	-87.3	0	0	0	119.9
87	D	31.7	Very low	26.1	Very low	155 Å²	155	157.7 Å²	157.7	83%	0.829	77%	0.772	S	S	*	*				-156.4	-175.5	66.1	-103.9	-27.1	0	0	0	114
88	E	28.5	Very low	26.2	Very low	184 Å²	184	160.8 Å²	160.8	86%	0.86	78%	0.775	S	S	*	*			trans	-88.9	173.5	-167.8	-66.4	-163.3	137.7	0	0	117.9
89	E	27.7	Very low	26.1	Very low	169 Å²	169	159.7 Å²	159.7	79%	0.79	77%	0.77	S	S	*	*			trans	83.8	112.2	168.4	-59.6	-159.2	140.6	0	0	120.4
90	H	28.9	Very low	26.2	Very low	176 Å²	176	159.4 Å²	159.4	82%	0.815	77%	0.77	S	S	*	*			trans	51.8	94.5	153.2	-66.3	-52	0	0	0	120.3
91	K	26.7	Very low	26.2	Very low	198 Å²	198	158.8 Å²	158.8	86%	0.861	77%	0.767	S	S	*	*			trans	-157.2	163.4	134.2	-116.4	163	-172.2	179.9	0	115.3
92	T	23.9	Very low	26.3	Very low	133 Å²	133	155.4 Å²	155.4	82%	0.816	77%	0.768	S	S	*	*			trans	-53.2	151.6	174.9	41.6	0	0	0	0	113.6
93	T	26.2	Very low	26.3	Very low	117 Å²	117	153 Å²	153	72%	0.718	76%	0.763	S	S	*	*			trans	-142.9	124.8	170.6	-10.6	0	0	0	0	109.9
94	E	23.4	Very low	26.3	Very low	102 Å²	102	149.4 Å²	149.4	48%	0.477	76%	0.76	S	S	.	*			trans	-88.9	139.1	178.7	-69.5	161.6	143.4	0	0	110.1
95	H	27.3	Very low	26.4	Very low	154 Å²	154	148.2 Å²	148.2	71%	0.713	75%	0.754	S	S	*	*			trans	-135.1	122	179.9	-76.2	-21.1	0	0	0	111.9
96	I	24.8	Very low	26.4	Very low	127 Å²	127	146.3 Å²	146.3	65%	0.651	75%	0.751	S	S	*	*			trans	-78	123.1	-170.9	-58.7	167	0	0	0	110.5	Y98	I96-Y98 HydrophobicContact CB-CE2 4.44Å; I96-Y98 HydrophobicContact CG2-CD2 3.84Å; I96-Y98 HydrophobicContact CG2-CE2 3.55Å; I96-Y98 PolarHBondContact O-N 2.92Å
97	Y	24.2	Very low	26.5	Very low	223 Å²	223	141.8 Å²	141.8	88%	0.875	74%	0.741	S	S	*	*			trans	-83.1	98.5	178.2	-72.8	-94.8	0	0	0	112
98	Y	24.2	Very low	26.5	Very low	208 Å²	208	137.6 Å²	137.6	82%	0.816	72%	0.721	S	S	*	*			trans	-91	114.4	163.9	-79.3	-82.4	0	0	0	110.6	I96	I96-Y98 HydrophobicContact CB-CE2 4.44Å; I96-Y98 HydrophobicContact CG2-CD2 3.84Å; I96-Y98 HydrophobicContact CG2-CE2 3.55Å; I96-Y98 PolarHBondContact O-N 2.92Å
99	L	24.3	Very low	26.5	Very low	134 Å²	134	132.5 Å²	132.5	70%	0.702	71%	0.706	S	S	*	*			trans	-118.9	106.1	-176.7	-161.8	148.3	0	0	0	110.9	L101	L99-L101 PolarHBondContact O-N 2.68Å
100	P	26	Very low	26.5	Very low	110 Å²	110	130.7 Å²	130.7	71%	0.714	70%	0.701	S	S	*	*			trans	-72.7	109.8	-177.8	-18.3	32.3	0	0	0	112.5	A102	P100-A102 PolarHBondContact O-N 3.44Å; P100-A102 VanDerWaalsContact O-N 3.08Å
101	L	25.7	Very low	26.4	Very low	150 Å²	150	130.1 Å²	130.1	79%	0.785	70%	0.699	S	S	*	*			trans	-76.7	89.8	173.2	-83.5	165.4	0	0	0	111.4	L99 I103	L99-L101 PolarHBondContact O-N 2.68Å; L101-I103 PolarHBondContact O-N 2.79Å
102	A	27.1	Very low	26.3	Very low	100 Å²	100	127.4 Å²	127.4	83%	0.826	70%	0.699	S	S	*	*			trans	-75.7	98.6	168.9	0	0	0	0	0	110.6	P100 G104	P100-A102 PolarHBondContact O-N 3.44Å; P100-A102 VanDerWaalsContact O-N 3.08Å; A102-G104 PolarHBondContact O-N 2.86Å; A102-G104 VanDerWaalsContact O-N 3.1Å
103	I	25.4	Very low	26.4	Very low	151 Å²	151	129.6 Å²	129.6	77%	0.774	71%	0.705	S	S	*	*			trans	-80.8	89	-179.7	-56.2	177.6	0	0	0	110.1	L101	L101-I103 PolarHBondContact O-N 2.79Å
104	G	26.2	Very low	26.3	Very low	66 Å²	66	127.4 Å²	127.4	68%	0.68	71%	0.705	S	S	*	*			trans	-91.8	133.1	171.3	0	0	0	0	0	112.6	A102	A102-G104 PolarHBondContact O-N 2.86Å; A102-G104 VanDerWaalsContact O-N 3.1Å
105	N	26.5	Very low	26.3	Very low	122 Å²	122	132 Å²	132	65%	0.652	72%	0.724	S	S	*	*			trans	-88.6	105.3	174.2	-86.7	-48.2	0	0	0	110.9
106	S	29.4	Very low	26.3	Very low	85 Å²	85	133.4 Å²	133.4	59%	0.594	73%	0.73	S	S	*	*			trans	-123	128.1	165.9	61.6	0	0	0	0	110.8
107	N	28	Very low	26.3	Very low	113 Å²	113	137.4 Å²	137.4	60%	0.604	74%	0.743	S	S	*	*			trans	-149.4	60	-168.3	-149.3	14.7	0	0	0	111.9
108	T	30.9	Very low	26.4	Very low	67 Å²	67	133.9 Å²	133.9	41%	0.411	74%	0.739	S	S	.	*			trans	-136	127.5	-174.6	47.2	0	0	0	0	112.7	I778	T108-I778 HydrophobicContact CG2-CB 4.35Å; T108-I778 HydrophobicContact CG2-CD1 4.15Å; T108-I778 HydrophobicContact CG2-CG1 3.85Å; T108-I778 HydrophobicContact CG2-CG2 3.99Å
109	S	29.8	Very low	26.3	Very low	78 Å²	78	129.2 Å²	129.2	55%	0.545	73%	0.732	S	S	.	*			trans	45.2	115.5	158.6	50.2	0	0	0	0	119.5
110	N	27.1	Very low	26.3	Very low	130 Å²	130	131.3 Å²	131.3	70%	0.695	74%	0.743	S	S	*	*				67.9	137.2	65.5	-75.5	-15.7	0	0	0	116.4
111	E	26.2	Very low	26.2	Very low	165 Å²	165	131.4 Å²	131.4	77%	0.771	74%	0.742	S	S	*	*			trans	60.4	89.7	150.2	-65.6	167.8	157.9	0	0	118.5
112	V	25.3	Very low	26.4	Very low	141 Å²	141	128.9 Å²	128.9	86%	0.855	73%	0.729	S	S	*	*				-167.5	111.3	113.1	168.7	0	0	0	0	109.5
113	L	26.1	Very low	26.3	Very low	179 Å²	179	126 Å²	126	94%	0.937	70%	0.703	S	S	*	*			trans	-177.6	78.1	141.8	-107.1	170.5	0	0	0	109.4
114	G	23.4	Very low	26.4	Very low	70 Å²	70	123.1 Å²	123.1	72%	0.722	69%	0.692	S	S	*	*			trans	-124.6	86.5	-178.2	0	0	0	0	0	112.5
115	K	25.4	Very low	26.4	Very low	200 Å²	200	124.3 Å²	124.3	87%	0.87	69%	0.69	S	S	*	*			trans	-175.3	162	156	-101.8	149.2	-170.8	178.4	0	110.1
116	E	25.4	Very low	26.4	Very low	182 Å²	182	126.5 Å²	126.5	85%	0.85	70%	0.696	S	S	*	*			trans	62.6	71.7	177	-60.7	-173.4	-165.4	0	0	116.7
117	F	26.5	Very low	26.3	Very low	211 Å²	211	127.4 Å²	127.4	93%	0.925	70%	0.703	S	S	*	*				-152.9	126.1	100.5	-123.4	-87.6	0	0	0	110.7
118	L	25.2	Very low	26.1	Very low	149 Å²	149	128.2 Å²	128.2	78%	0.78	71%	0.711	S	S	*	*			trans	-99.8	136.3	-175.5	-95	166.6	0	0	0	111.7
119	T	22.9	Very low	25.9	Very low	110 Å²	110	129.6 Å²	129.6	68%	0.675	72%	0.724	S	S	*	*			trans	34.6	108.9	149.4	55	0	0	0	0	119
120	L	24.8	Very low	25.7	Very low	179 Å²	179	133.5 Å²	133.5	94%	0.937	74%	0.739	S	S	*	*			trans	-147.2	63.7	136.6	-114.2	178.1	0	0	0	111.3
121	T	23.9	Very low	25.6	Very low	112 Å²	112	133.9 Å²	133.9	69%	0.687	73%	0.734	S	S	*	*			trans	-89.5	107.8	165.3	49.5	0	0	0	0	109.6
122	D	27.9	Very low	25.6	Very low	96 Å²	96	133.5 Å²	133.5	51%	0.513	74%	0.735	S	S	.	*			trans	-154	174.7	150.8	-137.4	-27.8	0	0	0	113.8	H1567	D122-H1567 VanDerWaalsContact CG-ND1 3.35Å; D122-H1567 IonicContact OD1-CE1 3.23Å; D122-H1567 IonicContact OD1-CG 3.3Å; D122-H1567 VanDerWaalsContact OD1-CG 3.31Å; D122-H1567 IonicContact OD1-ND1 2.7Å; D122-H1567 PolarHBondContact OD1-ND1 2.89Å; D122-H1567 IonicContact OD2-CD2 2.69Å; D122-H1567 PolarHBondContact OD2-CD2 3.26Å; D122-H1567 IonicContact OD2-CE1 2.83Å; D122-H1567 IonicContact OD2-CG 2.63Å; D122-H1567 IonicContact OD2-ND1 3.31Å; D122-H1567 IonicContact OD2-NE2 2.64Å
123	S	26.4	Very low	25.8	Very low	39 Å²	39	135.7 Å²	135.7	27%	0.273	74%	0.741	S	S	.	*			trans	-132.9	130.7	-141	54.3	0	0	0	0	115.2	H1567	S123-H1567 PolarHBondContact N-ND1 3.43Å; S123-H1567 PolarHBondContact O-ND1 3.32Å; S123-H1567 PolarHBondContact OG-ND1 3.45Å
124	T	27.2	Very low	26	Very low	91 Å²	91	133.3 Å²	133.3	56%	0.558	72%	0.721	S	S	*	*			trans	-177.5	114.9	157	33.6	0	0	0	0	107.1
125	S	26	Very low	26.1	Very low	91 Å²	91	134.7 Å²	134.7	64%	0.636	71%	0.712	S	S	*	*				83.9	137	61.5	71.2	0	0	0	0	115.1
126	H	26.9	Very low	26.1	Very low	168 Å²	168	133.4 Å²	133.4	78%	0.778	71%	0.713	S	S	*	*			trans	91.1	95.1	169.9	-61.1	-71.9	0	0	0	120.7
127	S	27.1	Very low	26.3	Very low	105 Å²	105	128 Å²	128	73%	0.734	71%	0.706	S	S	*	*				30.1	93.8	123.7	60.2	0	0	0	0	120.9
128	V	24.7	Very low	26.3	Very low	130 Å²	130	124.8 Å²	124.8	79%	0.788	69%	0.692	S	S	*	*			trans	-147.2	107.1	142.2	-168.3	0	0	0	0	104.7
129	S	25.5	Very low	26.4	Very low	95 Å²	95	123 Å²	123	66%	0.664	69%	0.692	S	S	*	*				57.7	121.9	85	-51.6	0	0	0	0	114.4	K131	S129-K131 PolarHBondContact O-N 2.85Å
130	D	26.3	Very low	26.6	Very low	161 Å²	161	126.2 Å²	126.2	86%	0.861	70%	0.704	S	S	*	*	S	Bend	trans	17.7	80.6	152.3	-48.5	-33.8	0	0	0	118.2
131	K	25.6	Very low	26.7	Very low	137 Å²	137	126.2 Å²	126.2	60%	0.596	70%	0.703	S	S	*	*			trans	-156.8	-27.7	160.8	-127.3	168.5	-178	-179.9	0	120.9	S129 Y134 D135	S129-K131 PolarHBondContact O-N 2.85Å; K131-Y134 WeakPolarHBondContact O-CB 3.04Å; K131-Y134 PolarHBondContact O-N 3.41Å; K131-D135 PolarHBondContact O-N 3.19Å
132	I	26.4	Very low	26.9	Very low	157 Å²	157	123.9 Å²	123.9	81%	0.805	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.3	-22.4	-171.5	-64	-179.7	0	0	0	113.8	Y134	I132-Y134 PolarHBondContact O-N 2.92Å
133	L	29.5	Very low	26.9	Very low	187 Å²	187	127.4 Å²	127.4	98%	0.979	72%	0.719	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.4	11.3	164.6	-104.4	156.5	0	0	0	113.1
134	Y	28.6	Very low	26.9	Very low	129 Å²	129	135.5 Å²	135.5	51%	0.506	74%	0.743	S	S	.	*	T	Hydrogen-bonded Turn	trans	-109.1	-32.4	177.6	-176	-100.1	0	0	0	112.2	K131 I132 K138	K131-Y134 WeakPolarHBondContact O-CB 3.04Å; K131-Y134 PolarHBondContact O-N 3.41Å; I132-Y134 PolarHBondContact O-N 2.92Å; Y134-K138 PolarHBondContact OH-NZ 3.11Å
135	D	26.6	Very low	27	Very low	99 Å²	99	137.2 Å²	137.2	53%	0.529	75%	0.749	S	S	.	*	T	Hydrogen-bonded Turn	trans	-93.6	4	-171.9	-71.7	-21.2	0	0	0	115.3	K131	K131-D135 PolarHBondContact O-N 3.19Å
136	L	26	Very low	26.9	Very low	173 Å²	173	139.5 Å²	139.5	91%	0.906	75%	0.754	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.2	8.6	169.4	-108.9	164	0	0	0	113.9
137	G	28.8	Very low	26.9	Very low	68 Å²	68	136.6 Å²	136.6	70%	0.701	75%	0.748	S	S	*	*	S	Bend	trans	-116.7	6.8	174.3	0	0	0	0	0	114.9
138	K	26.9	Very low	26.8	Very low	145 Å²	145	137.3 Å²	137.3	63%	0.63	75%	0.748	S	S	*	*	S	Bend	trans	-142.3	59.7	-173.3	-75.9	-171	176.6	176.7	0	114.6	Y134	Y134-K138 PolarHBondContact OH-NZ 3.11Å
139	S	27.1	Very low	26.9	Very low	112 Å²	112	139.2 Å²	139.2	78%	0.783	75%	0.754	S	S	*	*	S	Bend	trans	-157.6	84.9	158.9	-163.5	0	0	0	0	112.9
140	L	27	Very low	27	Very low	176 Å²	176	142 Å²	142	92%	0.921	75%	0.754	S	S	*	*			trans	175.6	62.4	149.7	-98.4	166.4	0	0	0	111.7
141	I	27.1	Very low	27.2	Very low	180 Å²	180	140.9 Å²	140.9	92%	0.923	74%	0.743	S	S	*	*			trans	-137.4	124.1	162.8	-64	-178.3	0	0	0	108.5
142	G	26.7	Very low	27.5	Very low	63 Å²	63	140.7 Å²	140.7	65%	0.649	75%	0.749	S	S	*	*			trans	149.3	146.3	173	0	0	0	0	0	112.7
143	I	29	Very low	27.5	Very low	170 Å²	170	139.5 Å²	139.5	87%	0.872	74%	0.744	S	S	*	*			trans	77.3	95	-169.1	-52.2	169.7	0	0	0	110
144	R	26.9	Very low	27.4	Very low	209 Å²	209	135.6 Å²	135.6	79%	0.789	73%	0.732	S	S	*	*			cis	68.3	116	36	-139.2	-151.3	167	118.6	5.6	110
145	D	27.5	Very low	27.3	Very low	127 Å²	127	139 Å²	139	68%	0.679	75%	0.75	S	S	*	*				-172.1	169.9	65.2	-85	-57.1	0	0	0	106.8
146	D	25.8	Very low	27.4	Very low	139 Å²	139	142.9 Å²	142.9	74%	0.743	76%	0.762	S	S	*	*			cis	-173.3	-174.3	-18.9	-175.8	16	0	0	0	106.7
147	V	26.4	Very low	27.4	Very low	107 Å²	107	141.2 Å²	141.2	65%	0.648	75%	0.75	S	S	*	*			trans	78.2	91.5	162.5	-170.2	0	0	0	0	118.7
148	T	25.4	Very low	27.3	Very low	120 Å²	120	145.3 Å²	145.3	74%	0.736	75%	0.752	S	S	*	*			trans	33.8	142	136.1	68.6	0	0	0	0	122.9
149	N	25.6	Very low	27.5	Very low	170 Å²	170	144.4 Å²	144.4	91%	0.909	75%	0.754	S	S	*	*				-152.1	168.8	127.4	-112.2	-38.4	0	0	0	113.2
150	K	28.7	Very low	27.7	Very low	153 Å²	153	147.4 Å²	147.4	67%	0.665	76%	0.756	S	S	*	*			trans	-120.4	140.6	-166.8	-125.4	-178.1	-178.7	-80.1	0	112.7
151	E	30	Very low	28.2	Very low	137 Å²	137	143.5 Å²	143.5	64%	0.64	74%	0.741	S	S	*	*			trans	46.1	114.7	139	-71.4	161.3	-165.8	0	0	120.8
152	D	30.5	Very low	28.5	Very low	133 Å²	133	140.7 Å²	140.7	71%	0.711	73%	0.733	S	S	*	*				111.6	130.4	112	-90.6	31.7	0	0	0	123.7
153	N	28.1	Very low	28.7	Very low	133 Å²	133	146.6 Å²	146.6	71%	0.711	74%	0.74	S	S	*	*			trans	78.3	105.9	142.5	-71.7	-47.9	0	0	0	123.2
154	S	27.5	Very low	28.5	Very low	104 Å²	104	145.6 Å²	145.6	73%	0.727	74%	0.736	S	S	*	*				118.2	102.3	106.7	69.6	0	0	0	0	121.3
155	K	26.3	Very low	28.5	Very low	202 Å²	202	142.3 Å²	142.3	88%	0.878	73%	0.733	S	S	*	*			trans	58.9	149.2	131.8	-65.7	-170.6	173.8	-173.4	0	123
156	K	28.3	Very low	28.3	Very low	179 Å²	179	141.5 Å²	141.5	78%	0.778	73%	0.733	S	S	*	*			trans	82.7	149.9	164.9	-66.4	-172	158.1	-83.3	0	117.3
157	E	26.7	Very low	28.1	Very low	139 Å²	139	140.8 Å²	140.8	65%	0.65	73%	0.733	S	S	*	*			cis	-179.6	139.2	-33.8	-120.2	170.2	164.3	0	0	108.2
158	M	26.5	Very low	27.9	Very low	153 Å²	153	140.9 Å²	140.9	75%	0.754	74%	0.739	S	S	*	*			trans	61.7	155.3	159.4	-61.4	176	77.7	0	0	119
159	D	30.5	Very low	27.9	Very low	126 Å²	126	142.9 Å²	142.9	67%	0.674	74%	0.744	S	S	*	*			cis	-164.5	164.4	-23.9	-106.1	-15.5	0	0	0	112
160	E	30.7	Very low	27.8	Very low	176 Å²	176	142.8 Å²	142.8	82%	0.822	74%	0.738	S	S	*	*			trans	61.4	168.6	151.8	-84.9	-142.1	123.1	0	0	121.4
161	P	37.1	Very low	27.6	Very low	93 Å²	93	140.8 Å²	140.8	60%	0.604	73%	0.731	S	S	*	*			cis	-134.1	-175.8	-27.1	30.3	-10.2	0	0	0	114.3
162	T	34.8	Very low	27.4	Very low	121 Å²	121	141.6 Å²	141.6	74%	0.742	74%	0.74	S	S	*	*				144.1	94.2	127.5	-55.5	0	0	0	0	117.2
163	K	29.4	Very low	27.4	Very low	187 Å²	187	142.3 Å²	142.3	81%	0.813	74%	0.743	S	S	*	*			trans	43.4	128.2	130.8	-76.6	178.6	170.7	178.5	0	125.1
164	L	25.4	Very low	27.4	Very low	149 Å²	149	141.6 Å²	141.6	78%	0.78	75%	0.746	S	S	*	*				95.4	151.6	121.6	-85.7	171.1	0	0	0	124.4
165	I	26.6	Very low	27.3	Very low	141 Å²	141	141.7 Å²	141.7	72%	0.723	75%	0.746	S	S	*	*			trans	96.3	87	157.8	-70.1	154.1	0	0	0	119.8
166	T	24.6	Very low	27.3	Very low	110 Å²	110	139.3 Å²	139.3	68%	0.675	75%	0.748	S	S	*	*				45	126.7	129.3	66.7	0	0	0	0	124.7
167	T	21.5	Very low	27.1	Very low	123 Å²	123	139.3 Å²	139.3	76%	0.755	75%	0.751	S	S	*	*			trans	60.2	155.5	130.6	61.7	0	0	0	0	122.5
168	S	21.7	Very low	27	Very low	109 Å²	109	140 Å²	140	76%	0.762	76%	0.757	S	S	*	*			trans	73.5	123.9	175.5	-42.6	0	0	0	0	113
169	L	24.3	Very low	26.9	Very low	162 Å²	162	139.1 Å²	139.1	85%	0.848	76%	0.761	S	S	*	*			cis	74.1	74.8	50	-145.1	179.6	0	0	0	111
170	E	23.6	Very low	26.6	Very low	169 Å²	169	139.6 Å²	139.6	79%	0.79	76%	0.763	S	S	*	*			trans	-159.6	167.4	160.1	-118.9	149.4	-149.2	0	0	110.6
171	E	26.1	Very low	26.3	Very low	111 Å²	111	138 Å²	138	52%	0.519	77%	0.766	S	S	.	*			trans	-74.6	163.5	-154.4	-55.2	-178.3	171.7	0	0	113.6
172	N	26	Very low	25.8	Very low	154 Å²	154	140 Å²	140	82%	0.824	78%	0.776	S	S	*	*			trans	-159.6	118.7	166.9	-112.2	-90.8	0	0	0	111.6
173	L	30.5	Very low	25.4	Very low	147 Å²	147	140.3 Å²	140.3	77%	0.77	78%	0.778	S	S	*	*			trans	-76	146	169	-82.3	64.8	0	0	0	110.8
174	P	27.6	Very low	25.2	Very low	119 Å²	119	137.7 Å²	137.7	77%	0.773	78%	0.778	S	S	*	*			trans	-114.9	112.1	141.1	31.9	-23.4	0	0	0	109.5
175	S	25.8	Very low	25.4	Very low	106 Å²	106	135.5 Å²	135.5	74%	0.741	78%	0.775	S	S	*	*				82.4	108.2	77.4	-72.4	0	0	0	0	113.1	Q177	S175-Q177 PolarHBondContact O-N 3.37Å
176	V	25	Very low	25.5	Very low	151 Å²	151	134.4 Å²	134.4	92%	0.915	78%	0.775	S	S	*	*			trans	-65.7	116.4	164.4	173.7	0	0	0	0	108.7
177	Q	24.1	Very low	25.6	Very low	179 Å²	179	136.4 Å²	136.4	84%	0.836	78%	0.781	S	S	*	*			trans	-154.9	150.8	157.8	-122.5	169.3	43.4	0	0	115.3	S175	S175-Q177 PolarHBondContact O-N 3.37Å
178	I	24.8	Very low	26	Very low	153 Å²	153	137 Å²	137	79%	0.785	79%	0.785	S	S	*	*			trans	-65.2	133.9	-180	-59.6	151.1	0	0	0	110.1
179	V	23.7	Very low	26.2	Very low	136 Å²	136	137.4 Å²	137.4	82%	0.824	78%	0.783	S	S	*	*			trans	-130.7	128.1	166.6	-177.2	0	0	0	0	110
180	N	24.6	Very low	26.2	Very low	136 Å²	136	136 Å²	136	73%	0.727	78%	0.781	S	S	*	*			trans	-84.3	150.1	177.4	-74.3	-52.2	0	0	0	112.1	T182	N180-T182 PolarHBondContact O-N 3.45Å
181	T	24.3	Very low	26.3	Very low	142 Å²	142	133 Å²	133	87%	0.871	77%	0.774	S	S	*	*			trans	-65.4	118.3	165.4	-52.1	0	0	0	0	111.3
182	T	26.7	Very low	26.3	Very low	134 Å²	134	133.7 Å²	133.7	82%	0.822	79%	0.786	S	S	*	*			trans	-146.1	152.3	159.4	-15.1	0	0	0	0	113	N180	N180-T182 PolarHBondContact O-N 3.45Å
183	V	26.6	Very low	26.3	Very low	129 Å²	129	131.1 Å²	131.1	78%	0.782	78%	0.776	S	S	*	*			trans	-88.8	154.4	-173	174.8	0	0	0	0	112
184	T	26.4	Very low	26.2	Very low	132 Å²	132	130.4 Å²	130.4	81%	0.81	77%	0.772	S	S	*	*			trans	-57.6	134.2	176	50.2	0	0	0	0	115.5
185	S	28	Very low	26.2	Very low	103 Å²	103	132 Å²	132	72%	0.72	77%	0.772	S	S	*	*			trans	-166.6	110.3	141	58.3	0	0	0	0	114.3
186	T	28.8	Very low	26.3	Very low	118 Å²	118	131.7 Å²	131.7	72%	0.724	77%	0.766	S	S	*	*			trans	40.1	122.3	141.9	59.2	0	0	0	0	122.3
187	N	27.9	Very low	26.4	Very low	151 Å²	151	130.6 Å²	130.6	81%	0.807	76%	0.76	S	S	*	*			trans	62.6	144	144	-52.2	-7.2	0	0	0	117.8
188	T	29.2	Very low	26.6	Very low	135 Å²	135	126.3 Å²	126.3	83%	0.828	75%	0.75	S	S	*	*			cis	-149.8	175.4	23.1	-31.6	0	0	0	0	111.2
189	T	25.9	Very low	26.9	Very low	119 Å²	119	123.8 Å²	123.8	73%	0.73	75%	0.745	S	S	*	*			trans	-78.6	154.6	-166.7	45.5	0	0	0	0	118.4
190	V	25.3	Very low	27.2	Very low	133 Å²	133	123 Å²	123	81%	0.806	74%	0.741	S	S	*	*			trans	79.5	143.8	136.9	156.5	0	0	0	0	119.4
191	T	25.4	Very low	27.3	Very low	104 Å²	104	121.8 Å²	121.8	64%	0.638	74%	0.738	S	S	*	*			cis	-175.5	149.9	-24.1	-80.6	0	0	0	0	107.9
192	T	26.1	Very low	27.4	Very low	126 Å²	126	120.4 Å²	120.4	77%	0.773	73%	0.73	S	S	*	*			trans	69	145.7	153.4	-84.7	0	0	0	0	118.5
193	T	26.2	Very low	27.3	Very low	100 Å²	100	120.4 Å²	120.4	61%	0.613	73%	0.725	S	S	*	*			cis	-174.4	151.1	-3.6	-98.5	0	0	0	0	110.9
194	I	28.3	Very low	27.5	Very low	133 Å²	133	122.6 Å²	122.6	68%	0.682	73%	0.73	S	S	*	*			trans	20.9	134.4	146.7	-50	166.9	0	0	0	120.5
195	I	26.1	Very low	27.4	Very low	153 Å²	153	121.6 Å²	121.6	79%	0.785	72%	0.724	S	S	*	*				-170.1	111.1	122.6	-95.6	157.3	0	0	0	108.8
196	T	29.1	Very low	27.4	Very low	98 Å²	98	122.7 Å²	122.7	60%	0.601	73%	0.727	S	S	*	*				56.9	118.8	89.1	-27.1	0	0	0	0	113.2
197	T	27.5	Very low	27.3	Very low	128 Å²	128	123 Å²	123	79%	0.785	72%	0.724	S	S	*	*				171.6	165.8	96.1	38.7	0	0	0	0	109.5
198	S	28.5	Very low	27.2	Very low	90 Å²	90	121.6 Å²	121.6	63%	0.629	72%	0.721	S	S	*	*			cis	-173.6	166.6	-21.1	55.2	0	0	0	0	110.6
199	S	29.7	Very low	27	Very low	99 Å²	99	121.7 Å²	121.7	69%	0.692	72%	0.722	S	S	*	*			trans	66.3	157.9	150.5	59.1	0	0	0	0	116.7
200	V	30.4	Very low	26.9	Very low	120 Å²	120	120.5 Å²	120.5	73%	0.727	72%	0.718	S	S	*	*			cis	-141.7	122.2	36.9	157	0	0	0	0	111.9
201	T	27	Very low	26.8	Very low	110 Å²	110	120.2 Å²	120.2	68%	0.675	72%	0.717	S	S	*	*				15.8	157.8	119.8	29.3	0	0	0	0	119.8
202	T	27.2	Very low	26.7	Very low	113 Å²	113	121 Å²	121	69%	0.693	72%	0.721	S	S	*	*			cis	-159.4	157.6	25.9	-19.3	0	0	0	0	112.4
203	N	24.6	Very low	26.6	Very low	134 Å²	134	120.9 Å²	120.9	72%	0.717	72%	0.721	S	S	*	*			trans	-21.8	154.6	161	-43	-12.9	0	0	0	119.1
204	I	29.4	Very low	26.4	Very low	176 Å²	176	121.5 Å²	121.5	90%	0.903	72%	0.724	S	S	*	*				-146.5	143.5	129.2	-104.4	156	0	0	0	110.2
205	T	24.5	Very low	26.2	Very low	110 Å²	110	120.8 Å²	120.8	68%	0.675	73%	0.726	S	S	*	*			trans	-110.7	144.9	-170.6	-43.8	0	0	0	0	111.5
206	T	29	Very low	26.1	Very low	127 Å²	127	119 Å²	119	78%	0.779	72%	0.723	S	S	*	*			trans	-161.7	110.4	144.4	22.8	0	0	0	0	113.3
207	N	26.7	Very low	26.1	Very low	123 Å²	123	120.1 Å²	120.1	66%	0.658	73%	0.73	S	S	*	*				53.4	105.7	115.9	-57.5	4.9	0	0	0	119.1
208	T	24.7	Very low	26.2	Very low	122 Å²	122	120 Å²	120	75%	0.748	73%	0.731	S	S	*	*				66.6	111.4	70.2	68.8	0	0	0	0	116.4
209	T	25.7	Very low	26	Very low	138 Å²	138	121.8 Å²	121.8	85%	0.847	74%	0.738	S	S	*	*			trans	179.7	141.3	138.4	21.9	0	0	0	0	107.3
210	S	23.3	Very low	25.8	Very low	93 Å²	93	122.2 Å²	122.2	65%	0.65	74%	0.741	S	S	*	*			cis	160.6	135.9	-26.2	49.6	0	0	0	0	105.8
211	V	23.1	Very low	25.5	Very low	128 Å²	128	121.5 Å²	121.5	78%	0.776	74%	0.742	S	S	*	*			trans	64.4	102.2	156.6	-177.7	0	0	0	0	117.6
212	T	24.1	Very low	25.7	Very low	120 Å²	120	121.7 Å²	121.7	74%	0.736	74%	0.744	S	S	*	*				31.3	120.4	121	-40.7	0	0	0	0	119.2
213	T	23.1	Very low	25.6	Very low	124 Å²	124	125.9 Å²	125.9	76%	0.761	75%	0.753	S	S	*	*				-175.2	132	121.8	21.5	0	0	0	0	115.6
214	T	22.9	Very low	25.7	Very low	112 Å²	112	125.3 Å²	125.3	69%	0.687	75%	0.754	S	S	*	*			trans	58.5	123	140.7	59.1	0	0	0	0	124.4
215	T	23.1	Very low	25.3	Very low	119 Å²	119	123.4 Å²	123.4	73%	0.73	75%	0.746	S	S	*	*				91.8	139.7	124.4	50.6	0	0	0	0	124.4
216	T	25.4	Very low	25.2	Very low	116 Å²	116	125.6 Å²	125.6	71%	0.712	75%	0.753	S	S	*	*			trans	72.1	96.8	149.3	44.2	0	0	0	0	121.1
217	T	28	Very low	25	Very low	121 Å²	121	126.8 Å²	126.8	74%	0.742	75%	0.753	S	S	*	*				36.2	133.4	112.6	57.9	0	0	0	0	118.9
218	P	29.9	Very low	24.8	Very low	125 Å²	125	126.6 Å²	126.6	81%	0.812	76%	0.756	S	S	*	*				-146.4	161.1	62.9	39	-20.3	0	0	0	119.9
219	T	23.8	Very low	24.9	Very low	128 Å²	128	126.3 Å²	126.3	79%	0.785	75%	0.754	S	S	*	*			trans	-51.6	135.5	167.6	49.3	0	0	0	0	117.7
220	S	26.5	Very low	24.9	Very low	107 Å²	107	126.7 Å²	126.7	75%	0.748	75%	0.751	S	S	*	*			trans	172.1	130.5	134.5	35	0	0	0	0	109.1
221	S	24.4	Very low	25	Very low	106 Å²	106	128.6 Å²	128.6	74%	0.741	75%	0.753	S	S	*	*			cis	71.9	125	44.2	78.6	0	0	0	0	113.2
222	P	29.8	Very low	25.1	Very low	113 Å²	113	129.7 Å²	129.7	73%	0.734	75%	0.754	S	S	*	*			cis	-119.4	175.8	47.2	19.5	1.7	0	0	0	113.8	V224	P222-V224 HydrophobicContact CB-CG2 4.19Å
223	K	26.3	Very low	25.3	Very low	202 Å²	202	129.1 Å²	129.1	88%	0.878	76%	0.755	S	S	*	*			cis	56.3	81.9	-4.5	-86.4	-161.6	173.8	-171.6	0	120.5
224	V	25.3	Very low	25.5	Very low	121 Å²	121	127.5 Å²	127.5	73%	0.733	75%	0.748	S	S	*	*			trans	-156.9	108.4	147.7	-179.2	0	0	0	0	104	P222	P222-V224 HydrophobicContact CB-CG2 4.19Å
225	D	22.3	Very low	25.9	Very low	136 Å²	136	129.4 Å²	129.4	73%	0.727	75%	0.754	S	S	*	*				72.4	118.6	73.2	-72.3	-42.7	0	0	0	115.6
226	L	21.7	Very low	26.2	Very low	157 Å²	157	126.7 Å²	126.7	82%	0.822	74%	0.744	S	S	*	*			trans	63.5	145.2	176.6	-74.7	68.8	0	0	0	114.2
227	I	25.2	Very low	26.3	Very low	151 Å²	151	128.2 Å²	128.2	77%	0.774	75%	0.746	S	S	*	*			cis	-135.5	142.5	41.5	-71.4	163.1	0	0	0	112	V229	I227-V229 HydrophobicContact CG2-CG2 4.36Å; I227-V229 PolarHBondContact O-N 3.17Å
228	T	22	Very low	26.5	Very low	119 Å²	119	125 Å²	125	73%	0.73	73%	0.727	S	S	*	*			trans	-66.1	120.5	169.1	-52	0	0	0	0	111.8
229	V	27.6	Very low	26.8	Very low	116 Å²	116	125.5 Å²	125.5	70%	0.703	72%	0.719	S	S	*	*			trans	-123.8	86.6	163.5	-173.9	0	0	0	0	109.4	I227 L231	I227-V229 HydrophobicContact CG2-CG2 4.36Å; I227-V229 PolarHBondContact O-N 3.17Å; V229-L231 HydrophobicContact CG1-CD1 4.18Å; V229-L231 PolarHBondContact O-N 3.5Å
230	N	25.6	Very low	27.3	Very low	146 Å²	146	122.5 Å²	122.5	78%	0.781	70%	0.703	S	S	*	*			trans	-73.9	107.6	160	-88.3	-14.3	0	0	0	108.7
231	L	25.6	Very low	28.1	Very low	133 Å²	133	121.5 Å²	121.5	70%	0.696	69%	0.688	S	S	*	*			trans	-152	122.6	152	-85.1	118.5	0	0	0	105.9	V229	V229-L231 HydrophobicContact CG1-CD1 4.18Å; V229-L231 PolarHBondContact O-N 3.5Å
232	L	25.3	Very low	28.7	Very low	152 Å²	152	119 Å²	119	80%	0.796	67%	0.674	S	S	*	*				57.2	109.5	74	-59.2	163.4	0	0	0	109.2
233	S	26.9	Very low	29.2	Very low	108 Å²	108	117.3 Å²	117.3	76%	0.755	66%	0.656	S	S	*	*				-152.7	160.3	62.7	-69	0	0	0	0	111
234	S	27.3	Very low	29.9	Very low	89 Å²	89	112.7 Å²	112.7	62%	0.622	64%	0.638	S	S	*	*				47.7	131.9	74.1	-142.2	0	0	0	0	112.3
235	D	32.1	Very low	30.4	Very low	152 Å²	152	114.8 Å²	114.8	81%	0.813	64%	0.638	S	S	*	*			cis	-126.8	118.4	30.2	-60.8	-47.8	0	0	0	112.7
236	A	29.7	Very low	31.2	Very low	62 Å²	62	112.4 Å²	112.4	51%	0.512	63%	0.625	S	S	.	*				72.9	99.7	73	0	0	0	0	0	114.1	P238	A236-P238 VanDerWaalsContact O-CD 3.31Å; A236-P238 WeakPolarHBondContact O-CD 3.27Å
237	I	27.6	Very low	32.2	Very low	149 Å²	149	109.7 Å²	109.7	76%	0.764	61%	0.608	S	S	*	*	S	Bend		-52	117.7	129	-64.1	173.7	0	0	0	103.8	E239	I237-E239 PolarHBondContact O-N 3.4Å
238	P	32.4	Very low	33.1	Very low	53 Å²	53	107.7 Å²	107.7	34%	0.344	60%	0.598	S	S	.	*			trans	-56.7	134	-170.9	-27.5	34.9	0	0	0	109.6	A236 S240 I241 A242	A236-P238 VanDerWaalsContact O-CD 3.31Å; A236-P238 WeakPolarHBondContact O-CD 3.27Å; P238-S240 WeakPolarHBondContact CB-OG 3.35Å; P238-S240 PolarHBondContact O-N 3.05Å; P238-S240 VanDerWaalsContact O-N 3.08Å; P238-I241 HydrophobicContact CB-CG1 4.29Å; P238-I241 HydrophobicContact CG-CD1 4.3Å; P238-I241 HydrophobicContact CG-CG1 4.37Å; P238-I241 PolarHBondContact O-N 3.06Å; P238-A242 PolarHBondContact O-N 2.93Å
239	E	34.4	Very low	33.8	Very low	136 Å²	136	104.9 Å²	104.9	64%	0.636	59%	0.586	S	S	*	*	H	α-helix	trans	-59.2	-21.4	167	-120.5	-164.1	120.5	0	0	109.4	I237 I241 A242 Q243	I237-E239 PolarHBondContact O-N 3.4Å; E239-I241 PolarHBondContact O-N 2.96Å; E239-A242 PolarHBondContact O-N 3.23Å; E239-Q243 HydrophobicContact CB-CG 4.36Å; E239-Q243 HydrophobicContact CG-CG 4.25Å; E239-Q243 VanDerWaalsContact O-CA 3.27Å; E239-Q243 WeakPolarHBondContact O-CA 3.22Å; E239-Q243 WeakPolarHBondContact O-CB 3.41Å; E239-Q243 WeakPolarHBondContact O-CG 3.33Å; E239-Q243 PolarHBondContact O-N 3.47Å; E239-Q243 PolarHBondContact OE1-NE2 3.37Å
240	S	35.6	Very low	34.3	Very low	65 Å²	65	105.8 Å²	105.8	46%	0.455	58%	0.581	S	S	.	*	H	α-helix	trans	-63.5	-15.4	167.7	70.4	0	0	0	0	115.5	P238 Q244	P238-S240 WeakPolarHBondContact CB-OG 3.35Å; P238-S240 PolarHBondContact O-N 3.05Å; P238-S240 VanDerWaalsContact O-N 3.08Å; S240-Q244 WeakPolarHBondContact O-CA 3.49Å; S240-Q244 WeakPolarHBondContact O-CB 3.33Å; S240-Q244 WeakPolarHBondContact O-CG 3.48Å; S240-Q244 PolarHBondContact O-N 3.36Å; S240-Q244 PolarHBondContact O-NE2 3.29Å
241	I	42.2	Very low	34.7	Very low	86 Å²	86	104.4 Å²	104.4	44%	0.441	57%	0.573	S	S	.	*	H	α-helix	trans	-92.3	-46.2	171.6	-63.4	-176.2	0	0	0	110.9	P238 E239 Q243 Q244 F245	P238-I241 HydrophobicContact CB-CG1 4.29Å; P238-I241 HydrophobicContact CG-CD1 4.3Å; P238-I241 HydrophobicContact CG-CG1 4.37Å; P238-I241 PolarHBondContact O-N 3.06Å; E239-I241 PolarHBondContact O-N 2.96Å; I241-Q243 VanDerWaalsContact C-N 3.32Å; I241-Q243 PolarHBondContact O-N 3.41Å; I241-Q244 PolarHBondContact O-N 2.86Å; I241-F245 PolarHBondContact O-N 2.82Å
242	A	37.7	Very low	35.2	Very low	53 Å²	53	104.3 Å²	104.3	44%	0.438	57%	0.573	S	S	.	*	H	α-helix	trans	-65.2	-37	174.5	0	0	0	0	0	112	P238 E239 N246	P238-A242 PolarHBondContact O-N 2.93Å; E239-A242 PolarHBondContact O-N 3.23Å; A242-N246 WeakPolarHBondContact O-CB 3.5Å; A242-N246 PolarHBondContact O-N 3Å; A242-N246 PolarHBondContact O-ND2 3.05Å; A242-N246 VanDerWaalsContact O-ND2 3.13Å
243	Q	39.5	Very low	35.5	Very low	78 Å²	78	105.7 Å²	105.7	36%	0.364	57%	0.573	S	S	.	*	H	α-helix	trans	-80.1	-17.6	167.3	-56.5	176.4	5.5	0	0	112.9	E239 I241 Q247	E239-Q243 HydrophobicContact CB-CG 4.36Å; E239-Q243 HydrophobicContact CG-CG 4.25Å; E239-Q243 VanDerWaalsContact O-CA 3.27Å; E239-Q243 WeakPolarHBondContact O-CA 3.22Å; E239-Q243 WeakPolarHBondContact O-CB 3.41Å; E239-Q243 WeakPolarHBondContact O-CG 3.33Å; E239-Q243 PolarHBondContact O-N 3.47Å; E239-Q243 PolarHBondContact OE1-NE2 3.37Å; I241-Q243 VanDerWaalsContact C-N 3.32Å; I241-Q243 PolarHBondContact O-N 3.41Å; Q243-Q247 WeakPolarHBondContact O-CA 3.13Å; Q243-Q247 WeakPolarHBondContact O-CB 3.08Å; Q243-Q247 WeakPolarHBondContact O-CG 3.15Å; Q243-Q247 PolarHBondContact O-N 3.45Å
244	Q	41.2	Very low	35.7	Very low	105 Å²	105	104.4 Å²	104.4	49%	0.491	56%	0.563	S	S	.	*	H	α-helix	trans	-72.4	-41.2	164.4	-91.9	161.7	30.4	0	0	110.8	S240 I241 Q247 I248	S240-Q244 WeakPolarHBondContact O-CA 3.49Å; S240-Q244 WeakPolarHBondContact O-CB 3.33Å; S240-Q244 WeakPolarHBondContact O-CG 3.48Å; S240-Q244 PolarHBondContact O-N 3.36Å; S240-Q244 PolarHBondContact O-NE2 3.29Å; I241-Q244 PolarHBondContact O-N 2.86Å; Q244-Q247 PolarHBondContact O-N 3.34Å; Q244-I248 WeakPolarHBondContact O-CB 3.46Å; Q244-I248 WeakPolarHBondContact O-CD1 3.27Å; Q244-I248 WeakPolarHBondContact O-CG1 3.48Å; Q244-I248 PolarHBondContact O-N 3.14Å
245	F	36.6	Very low	35.9	Very low	165 Å²	165	105.7 Å²	105.7	72%	0.724	57%	0.572	S	S	*	*	H	α-helix	trans	-62.5	-46	170.3	-102.8	-94.8	0	0	0	111.2	I241 Q247 I248 A249	I241-F245 PolarHBondContact O-N 2.82Å; F245-Q247 PolarHBondContact O-N 3.34Å; F245-I248 PolarHBondContact O-N 3.39Å; F245-A249 VanDerWaalsContact O-CB 3.32Å; F245-A249 WeakPolarHBondContact O-CB 3.34Å; F245-A249 PolarHBondContact O-N 3.16Å
246	N	39.8	Very low	35.7	Very low	85 Å²	85	106.2 Å²	106.2	46%	0.455	58%	0.575	S	S	.	*	H	α-helix	trans	-71.5	-25.9	176.9	-89.3	-87	0	0	0	114.6	A242 K250	A242-N246 WeakPolarHBondContact O-CB 3.5Å; A242-N246 PolarHBondContact O-N 3Å; A242-N246 PolarHBondContact O-ND2 3.05Å; A242-N246 VanDerWaalsContact O-ND2 3.13Å; N246-K250 WeakPolarHBondContact O-CB 3.22Å; N246-K250 WeakPolarHBondContact O-CD 3.3Å; N246-K250 WeakPolarHBondContact O-CG 3.18Å; N246-K250 PolarHBondContact O-N 3.16Å
247	Q	42.7	Very low	35.7	Very low	101 Å²	101	108.4 Å²	108.4	47%	0.472	59%	0.586	S	S	.	*	H	α-helix	trans	-83.8	-32.1	172.4	-74.1	178.2	-8.7	0	0	111.4	Q243 Q244 F245 A249 K250 L251	Q243-Q247 WeakPolarHBondContact O-CA 3.13Å; Q243-Q247 WeakPolarHBondContact O-CB 3.08Å; Q243-Q247 WeakPolarHBondContact O-CG 3.15Å; Q243-Q247 PolarHBondContact O-N 3.45Å; Q244-Q247 PolarHBondContact O-N 3.34Å; F245-Q247 PolarHBondContact O-N 3.34Å; Q247-A249 PolarHBondContact O-N 2.73Å; Q247-K250 PolarHBondContact O-N 3.2Å; Q247-L251 HydrophobicContact CB-CD1 4.07Å; Q247-L251 HydrophobicContact CB-CG 4.36Å; Q247-L251 WeakPolarHBondContact O-CA 3.43Å; Q247-L251 WeakPolarHBondContact O-CB 3.31Å; Q247-L251 WeakPolarHBondContact O-CD1 3.41Å; Q247-L251 WeakPolarHBondContact O-CG 3.28Å; Q247-L251 PolarHBondContact O-N 3.5Å
248	I	43.9	Very low	35.9	Very low	109 Å²	109	106.6 Å²	106.6	56%	0.559	59%	0.586	S	S	*	*	H	α-helix	trans	-65.8	-33.6	169.1	-69.2	165.2	0	0	0	109.6	Q244 F245 N252	Q244-I248 WeakPolarHBondContact O-CB 3.46Å; Q244-I248 WeakPolarHBondContact O-CD1 3.27Å; Q244-I248 WeakPolarHBondContact O-CG1 3.48Å; Q244-I248 PolarHBondContact O-N 3.14Å; F245-I248 PolarHBondContact O-N 3.39Å; I248-N252 PolarHBondContact O-ND2 2.92Å
249	A	36.2	Very low	35.8	Very low	60 Å²	60	115.7 Å²	115.7	50%	0.496	61%	0.614	S	S	.	*	H	α-helix	trans	-73.2	-30.7	170.1	0	0	0	0	0	114.7	F245 Q247	F245-A249 VanDerWaalsContact O-CB 3.32Å; F245-A249 WeakPolarHBondContact O-CB 3.34Å; F245-A249 PolarHBondContact O-N 3.16Å; Q247-A249 PolarHBondContact O-N 2.73Å
250	K	37	Very low	35.6	Very low	135 Å²	135	120.3 Å²	120.3	59%	0.587	63%	0.625	S	S	*	*	H	α-helix	trans	-97.2	-24.2	-177.6	-71.6	167.5	-177.2	169.2	0	115	N246 Q247 K253 S254	N246-K250 WeakPolarHBondContact O-CB 3.22Å; N246-K250 WeakPolarHBondContact O-CD 3.3Å; N246-K250 WeakPolarHBondContact O-CG 3.18Å; N246-K250 PolarHBondContact O-N 3.16Å; Q247-K250 PolarHBondContact O-N 3.2Å; K250-K253 CarbonylContact O-C 3.55Å; K250-K253 PolarHBondContact O-N 2.92Å; K250-S254 PolarHBondContact O-OG 2.65Å
251	L	35.9	Very low	35.4	Very low	116 Å²	116	123.2 Å²	123.2	61%	0.607	64%	0.641	S	S	*	*	H	α-helix	trans	-75.9	-26.3	172.4	-67.4	169.1	0	0	0	111.7	Q247 K253	Q247-L251 HydrophobicContact CB-CD1 4.07Å; Q247-L251 HydrophobicContact CB-CG 4.36Å; Q247-L251 WeakPolarHBondContact O-CA 3.43Å; Q247-L251 WeakPolarHBondContact O-CB 3.31Å; Q247-L251 WeakPolarHBondContact O-CD1 3.41Å; Q247-L251 WeakPolarHBondContact O-CG 3.28Å; Q247-L251 PolarHBondContact O-N 3.5Å; L251-K253 PolarHBondContact O-N 3.43Å
252	N	34.5	Very low	34.7	Very low	131 Å²	131	124.7 Å²	124.7	70%	0.701	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.7	3.7	165.8	-77	-36.3	0	0	0	113.9	I248	I248-N252 PolarHBondContact O-ND2 2.92Å
253	K	31.7	Very low	34.1	Very low	182 Å²	182	133 Å²	133	79%	0.791	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-133.3	39.3	174.2	-78.5	-171.8	174	176.5	0	112.8	K250 L251	K250-K253 CarbonylContact O-C 3.55Å; K250-K253 PolarHBondContact O-N 2.92Å; L251-K253 PolarHBondContact O-N 3.43Å
254	S	31.7	Very low	33.6	Very low	80 Å²	80	135.4 Å²	135.4	56%	0.559	69%	0.694	S	S	*	*			trans	-139	14.9	174.7	34.7	0	0	0	0	116.2	K250 L256	K250-S254 PolarHBondContact O-OG 2.65Å; S254-L256 VanDerWaalsContact C-N 3.25Å; S254-L256 PolarHBondContact O-N 3.48Å
255	S	30.9	Very low	33	Very low	116 Å²	116	136.3 Å²	136.3	81%	0.811	71%	0.707	S	S	*	*			trans	-88.6	33.6	165.7	49.9	0	0	0	0	113.4	S257	S255-S257 PolarHBondContact O-N 3.03Å
256	L	28.8	Very low	32.5	Very low	164 Å²	164	134.1 Å²	134.1	86%	0.859	71%	0.711	S	S	*	*			trans	-89.6	92.5	177.7	-93.9	166.6	0	0	0	111.5	S254	S254-L256 VanDerWaalsContact C-N 3.25Å; S254-L256 PolarHBondContact O-N 3.48Å
257	S	29.5	Very low	32	Very low	108 Å²	108	134.4 Å²	134.4	76%	0.755	73%	0.726	S	S	*	*			trans	-152.6	123.3	172.8	-170.2	0	0	0	0	112.7	S255	S255-S257 PolarHBondContact O-N 3.03Å
258	S	30.9	Very low	31.3	Very low	110 Å²	110	138.5 Å²	138.5	77%	0.769	74%	0.742	S	S	*	*			trans	76.6	93.4	-173.8	-46.1	0	0	0	0	114
259	R	30.4	Very low	30.6	Very low	244 Å²	244	140.8 Å²	140.8	92%	0.921	76%	0.755	S	S	*	*			cis	76.2	130.5	49.5	-69.1	-171.8	160.7	-172.8	-3.9	116
260	R	31.6	Very low	30.2	Very low	233 Å²	233	142.6 Å²	142.6	88%	0.879	76%	0.764	S	S	*	*			trans	82.6	117.8	173.2	-64.9	179.8	163.2	155.6	-6.4	115.1
261	T	30.2	Very low	30.1	Very low	127 Å²	127	141.7 Å²	141.7	78%	0.779	77%	0.772	S	S	*	*				56.7	132.9	83.7	19.5	0	0	0	0	113.8
262	V	28.1	Very low	29.8	Very low	116 Å²	116	143.8 Å²	143.8	70%	0.703	78%	0.783	S	S	*	*			cis	-138.4	171.5	20.2	-177.2	0	0	0	0	111.2
263	R	25.1	Very low	29.6	Very low	228 Å²	228	141.8 Å²	141.8	86%	0.86	78%	0.779	S	S	*	*			trans	-34.4	138.7	161.9	-47.1	159.8	173.9	146.3	-7.7	113.6
264	T	29.5	Very low	29.7	Very low	129 Å²	129	139.2 Å²	139.2	79%	0.791	77%	0.774	S	S	*	*			trans	-177.1	143.2	132.6	25.1	0	0	0	0	113.7
265	T	29	Very low	29.8	Very low	124 Å²	124	138.9 Å²	138.9	76%	0.761	77%	0.772	S	S	*	*			trans	37.9	120.6	146.4	60.7	0	0	0	0	122.3
266	S	25.9	Very low	29.8	Very low	118 Å²	118	141.8 Å²	141.8	83%	0.825	77%	0.77	S	S	*	*			trans	-29.9	155.4	149.2	-34.7	0	0	0	0	119
267	A	28.9	Very low	29.9	Very low	92 Å²	92	143.3 Å²	143.3	76%	0.76	76%	0.764	S	S	*	*				111.2	135.7	128.5	0	0	0	0	0	120.5
268	K	27.1	Very low	30	Very low	186 Å²	186	145.3 Å²	145.3	81%	0.809	76%	0.761	S	S	*	*			trans	89.8	143.6	139.6	-109.8	173.4	-175.4	173.9	0	120.4
269	L	30.3	Very low	30.1	Very low	157 Å²	157	143.7 Å²	143.7	82%	0.822	76%	0.755	S	S	*	*			trans	73.4	134.1	164.6	-58.3	166.2	0	0	0	116.7
270	S	27.3	Very low	30.1	Very low	99 Å²	99	136.2 Å²	136.2	69%	0.692	74%	0.74	S	S	*	*			cis	-163	153.1	-18.9	30.1	0	0	0	0	110.9
271	P	35.3	Very low	30.2	Very low	116 Å²	116	134.4 Å²	134.4	75%	0.753	74%	0.739	S	S	*	*			trans	-97.7	163.4	-176.7	39.1	-35.9	0	0	0	113.9
272	L	29.7	Very low	30.4	Very low	160 Å²	160	135.7 Å²	135.7	84%	0.838	74%	0.736	S	S	*	*			trans	-160.5	117.2	152	-91.2	130.8	0	0	0	105.9
273	S	30.7	Very low	30.8	Very low	89 Å²	89	136.8 Å²	136.8	62%	0.622	74%	0.738	S	S	*	*				79.4	143.5	93.1	96.4	0	0	0	0	112.8
274	D	32.7	Very low	31.3	Very low	127 Å²	127	129.4 Å²	129.4	68%	0.679	73%	0.726	S	S	*	*			cis	-144.6	141.9	29.1	-124	-70.8	0	0	0	115.9
275	S	33.7	Very low	31.5	Very low	74 Å²	74	130 Å²	130	52%	0.517	72%	0.719	S	S	.	*			trans	53.2	134.4	142.3	-69	0	0	0	0	121.3
276	K	31.6	Very low	31.7	Very low	176 Å²	176	130.8 Å²	130.8	77%	0.765	72%	0.718	S	S	*	*			cis	-170.7	160.5	7.8	-101.5	164.3	-174.8	82.7	0	105.2
277	R	31	Very low	31.9	Very low	196 Å²	196	130 Å²	130	74%	0.74	71%	0.708	S	S	*	*			cis	-149.3	144.9	11.5	-110.5	-172	-153	-104.5	9	106.5
278	Q	31.1	Very low	32	Very low	150 Å²	150	133.6 Å²	133.6	70%	0.701	71%	0.709	S	S	*	*				73	117.3	80.4	-158.5	-177.7	13.5	0	0	114.7
279	A	33	Very low	32.2	Very low	77 Å²	77	132.8 Å²	132.8	64%	0.636	71%	0.712	S	S	*	*			cis	-165.9	153.9	-7.5	0	0	0	0	0	114.5
280	S	30.9	Very low	32.1	Very low	86 Å²	86	129.7 Å²	129.7	60%	0.601	71%	0.709	S	S	*	*			trans	56.2	150.9	137	66.5	0	0	0	0	121.6
281	F	32.7	Very low	32.2	Very low	196 Å²	196	130.3 Å²	130.3	86%	0.86	71%	0.713	S	S	*	*			cis	-141.4	144.9	22	-128	-79.1	0	0	0	113.2
282	E	35.8	Very low	32	Very low	154 Å²	154	130.9 Å²	130.9	72%	0.72	71%	0.714	S	S	*	*			trans	-94.9	-164	171.8	-51.5	87.2	159.7	0	0	109.6
283	D	35.2	Very low	32.1	Very low	139 Å²	139	127.8 Å²	127.8	74%	0.743	71%	0.706	S	S	*	*			cis	-151.1	-176	-9.9	-162.8	20.1	0	0	0	103.7	H285	D283-H285 IonicContact OD2-CE1 3.6Å; D283-H285 IonicContact OD2-ND1 3.61Å
284	A	36	Very low	32	Very low	73 Å²	73	131.3 Å²	131.3	60%	0.603	72%	0.718	S	S	*	*			cis	-164.2	-171	11.9	0	0	0	0	0	105.5
285	H	34.1	Very low	31.8	Very low	142 Å²	142	130.6 Å²	130.6	66%	0.657	72%	0.723	S	S	*	*			cis	-166.9	162.6	-13.4	-114	30.7	0	0	0	104.6	D283	D283-H285 IonicContact OD2-CE1 3.6Å; D283-H285 IonicContact OD2-ND1 3.61Å
286	L	32.4	Very low	31.8	Very low	140 Å²	140	134.9 Å²	134.9	73%	0.733	74%	0.735	S	S	*	*			cis	76.5	139.5	33.7	-53.6	-176.9	0	0	0	114.1
287	T	30.9	Very low	31.7	Very low	100 Å²	100	135.9 Å²	135.9	61%	0.613	74%	0.739	S	S	*	*			cis	-161	164.9	12.4	-13.4	0	0	0	0	113
288	E	30.2	Very low	31.6	Very low	169 Å²	169	133.7 Å²	133.7	79%	0.79	74%	0.742	S	S	*	*			trans	48.3	138.5	143.8	-79.4	178.1	121	0	0	123.7
289	I	31.7	Very low	31.7	Very low	168 Å²	168	133.8 Å²	133.8	86%	0.862	75%	0.746	S	S	*	*				-169.4	142.3	96.3	-92.5	166.5	0	0	0	109.9
290	A	28.3	Very low	31.4	Very low	92 Å²	92	138.7 Å²	138.7	76%	0.76	76%	0.756	S	S	*	*			trans	-109.1	154.6	-177	0	0	0	0	0	114.2
291	S	29.8	Very low	31.4	Very low	112 Å²	112	143.3 Å²	143.3	78%	0.783	77%	0.765	S	S	*	*			trans	174.2	168.3	139.9	48.3	0	0	0	0	113.6
292	V	30.3	Very low	31.4	Very low	128 Å²	128	141 Å²	141	78%	0.776	76%	0.762	S	S	*	*			trans	69.8	82.6	169.7	-166.4	0	0	0	0	115
293	S	31.8	Very low	31.3	Very low	96 Å²	96	141 Å²	141	67%	0.671	77%	0.765	S	S	*	*				81.8	118.8	62.1	79.8	0	0	0	0	116.4
294	D	27.8	Very low	31.2	Very low	163 Å²	163	141.3 Å²	141.3	87%	0.872	77%	0.767	S	S	*	*			trans	54.2	77.8	149.4	-59.7	-26.2	0	0	0	119.9
295	S	30.3	Very low	31	Very low	111 Å²	111	145.5 Å²	145.5	78%	0.776	77%	0.771	S	S	*	*			trans	-152.3	162.8	140.3	73.3	0	0	0	0	112.6
296	Q	32.3	Very low	30.8	Very low	165 Å²	165	145.2 Å²	145.2	77%	0.771	77%	0.774	S	S	*	*			trans	63.6	65.8	170	-59.7	-171.3	-16.1	0	0	118
297	K	29.6	Very low	30.9	Very low	197 Å²	197	143.7 Å²	143.7	86%	0.857	77%	0.771	S	S	*	*			trans	-62.6	153.4	130.9	-67.3	-175.1	176.5	-173.8	0	108.9
298	N	30.3	Very low	30.9	Very low	150 Å²	150	145.2 Å²	145.2	80%	0.802	77%	0.767	S	S	*	*			trans	88.1	46.6	178.9	-50.5	1.4	0	0	0	117.5
299	I	32.1	Very low	31	Very low	151 Å²	151	144.1 Å²	144.1	77%	0.774	76%	0.761	S	S	*	*				-123	104.2	129.3	-66.3	88.4	0	0	0	106.4
300	Q	28	Very low	31	Very low	181 Å²	181	140 Å²	140	85%	0.846	75%	0.752	S	S	*	*			trans	-155.9	95.1	180	-172.1	-177.1	23.6	0	0	109.1
301	K	30.9	Very low	31.1	Very low	183 Å²	183	146 Å²	146	80%	0.796	76%	0.755	S	S	*	*	S	Bend	trans	174.1	-33.7	146.5	-99.5	172.3	179.9	-165	0	113.9
302	D	32.1	Very low	31.2	Very low	147 Å²	147	146.7 Å²	146.7	79%	0.786	74%	0.744	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.9	18.9	-158.5	-48.8	-37.7	0	0	0	116
303	L	33.4	Very low	31.3	Very low	153 Å²	153	145.7 Å²	145.7	80%	0.801	73%	0.731	S	S	*	*	T	Hydrogen-bonded Turn	trans	-134.4	13.5	-176.4	-138.1	80.5	0	0	0	115.3
304	L	33.6	Very low	31.3	Very low	147 Å²	147	145.2 Å²	145.2	77%	0.77	73%	0.728	S	S	*	*	S	Bend	trans	-122.3	8.2	-176.3	-146.1	76.1	0	0	0	114.6
305	K	31.2	Very low	31.6	Very low	161 Å²	161	139.9 Å²	139.9	70%	0.7	70%	0.699	S	S	*	*	S	Bend	trans	-95.6	-40.6	173.3	-76.9	-168.7	169.4	-169.1	0	112.8	T307	K305-T307 PolarHBondContact O-N 3.2Å
306	D	30.9	Very low	31.9	Very low	135 Å²	135	138 Å²	138	72%	0.722	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.2	-13	-160.7	-56.6	-11.5	0	0	0	114.5
307	T	34.8	Very low	32	Very low	109 Å²	109	134.1 Å²	134.1	67%	0.669	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.1	-21.9	-177.9	-33.6	0	0	0	0	113.5	K305	K305-T307 PolarHBondContact O-N 3.2Å
308	Y	30.9	Very low	32.1	Very low	132 Å²	132	127.1 Å²	127.1	52%	0.518	64%	0.641	S	S	.	*	T	Hydrogen-bonded Turn	trans	-88.7	-32	-176.4	-99.7	-87.3	0	0	0	114.2	A310 I1618	Y308-A310 VanDerWaalsContact C-N 3.29Å; Y308-A310 PolarHBondContact O-N 2.64Å; Y308-I1618 VanDerWaalsContact OH-CD1 3.24Å; Y308-I1618 WeakPolarHBondContact OH-CD1 3.46Å
309	H	32.2	Very low	32.4	Very low	145 Å²	145	125.5 Å²	125.5	67%	0.671	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.8	-14.6	-179.1	-87.1	-79.8	0	0	0	114.6
310	A	30.2	Very low	32.3	Very low	82 Å²	82	125 Å²	125	68%	0.678	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.3	3	-167	0	0	0	0	0	116.1	Y308	Y308-A310 VanDerWaalsContact C-N 3.29Å; Y308-A310 PolarHBondContact O-N 2.64Å
311	R	31	Very low	32.4	Very low	219 Å²	219	123.3 Å²	123.3	83%	0.826	63%	0.627	S	S	*	*	S	Bend	trans	-132	3.6	-170	-73.5	-171.5	174.5	179.8	-0.6	117.9
312	F	32.2	Very low	32.4	Very low	126 Å²	126	122.2 Å²	122.2	55%	0.553	63%	0.63	S	S	*	*	S	Bend	trans	-123.1	15	-174.9	-82.8	-74.8	0	0	0	116.6
313	H	31.7	Very low	32.3	Very low	106 Å²	106	125.8 Å²	125.8	49%	0.491	63%	0.633	S	S	.	*			trans	-107.9	8.1	-168.9	-84.8	-63.1	0	0	0	117.9	I317	H313-I317 HydrophobicContact CB-CD1 4.46Å
314	S	32.6	Very low	32	Very low	86 Å²	86	124.2 Å²	124.2	60%	0.601	63%	0.63	S	S	*	*	H	α-helix	trans	-77.7	-25.5	-175.5	51.8	0	0	0	0	116.1
315	D	34.3	Very low	31.7	Very low	51 Å²	51	122.5 Å²	122.5	27%	0.273	63%	0.63	S	S	.	*	H	α-helix	trans	-93.5	-20.1	-173.3	-95.6	17.4	0	0	0	114.5	R968 R1492	D315-R968 VanDerWaalsContact CG-NH1 3.3Å; D315-R968 IonicContact OD1-CZ 2.91Å; D315-R968 VanDerWaalsContact OD1-CZ 3.24Å; D315-R968 IonicContact OD1-NH1 2.68Å; D315-R968 PolarHBondContact OD1-NH1 2.79Å; D315-R968 IonicContact OD1-NH2 2.72Å; D315-R968 PolarHBondContact OD1-NH2 2.87Å; D315-R968 IonicContact OD2-NH1 3.72Å; D315-R968 PolarHBondContact OD2-NH1 3.45Å; D315-R1492 IonicContact OD2-CZ 3.74Å; D315-R1492 IonicContact OD2-NH1 3.83Å; D315-R1492 PolarHBondContact OD2-NH1 3.17Å; D315-R1492 IonicContact OD2-NH2 3.35Å; D315-R1492 PolarHBondContact OD2-NH2 2.93Å
316	E	36.4	Very low	31.6	Very low	73 Å²	73	125 Å²	125	34%	0.341	64%	0.641	S	S	.	*	H	α-helix	trans	-95.8	-19.2	-176.2	-67.5	-177.2	170.7	0	0	113.7	T319 R1438	E316-T319 PolarHBondContact O-OG1 2.79Å; E316-T319 VanDerWaalsContact O-OG1 3.09Å; E316-R1438 IonicContact OE1-CZ 2.75Å; E316-R1438 VanDerWaalsContact OE1-CZ 3.22Å; E316-R1438 IonicContact OE1-NH1 3.62Å; E316-R1438 PolarHBondContact OE1-NH1 3Å; E316-R1438 IonicContact OE1-NH2 2.83Å; E316-R1438 PolarHBondContact OE1-NH2 2.8Å
317	I	33.1	Very low	31.6	Very low	82 Å²	82	123.5 Å²	123.5	42%	0.421	64%	0.639	S	S	.	*	H	α-helix	trans	-78.3	-34.3	177.5	-66.1	178	0	0	0	111.4	H313 T319 L320 Q321	H313-I317 HydrophobicContact CB-CD1 4.46Å; I317-T319 VanDerWaalsContact C-N 3.27Å; I317-T319 PolarHBondContact O-N 2.87Å; I317-L320 PolarHBondContact O-N 2.93Å; I317-Q321 HydrophobicContact CG2-CG 3.83Å; I317-Q321 PolarHBondContact O-N 2.84Å; I317-Q321 VanDerWaalsContact O-N 3.12Å
318	A	33.1	Very low	31.3	Very low	50 Å²	50	126.7 Å²	126.7	41%	0.413	65%	0.646	S	S	.	*	H	α-helix	trans	-59.7	-36.3	177.9	0	0	0	0	0	112.6	L320	A318-L320 VanDerWaalsContact C-N 3.28Å; A318-L320 PolarHBondContact O-N 3.32Å
319	T	35.9	Very low	31.2	Very low	116 Å²	116	125.7 Å²	125.7	71%	0.712	65%	0.654	S	S	*	*	H	α-helix	trans	-78.7	-2.4	176.1	40.8	0	0	0	0	115	E316 I317	E316-T319 PolarHBondContact O-OG1 2.79Å; E316-T319 VanDerWaalsContact O-OG1 3.09Å; I317-T319 VanDerWaalsContact C-N 3.27Å; I317-T319 PolarHBondContact O-N 2.87Å
320	L	30.7	Very low	31	Very low	142 Å²	142	126.2 Å²	126.2	74%	0.743	66%	0.657	S	S	*	*	H	α-helix	trans	-122.6	-2.7	-178.7	-71.8	173.6	0	0	0	114.1	I317 A318	I317-L320 PolarHBondContact O-N 2.93Å; A318-L320 VanDerWaalsContact C-N 3.28Å; A318-L320 PolarHBondContact O-N 3.32Å
321	Q	29	Very low	31.1	Very low	145 Å²	145	128.2 Å²	128.2	68%	0.678	66%	0.661	S	S	*	*	H	α-helix	trans	-99.2	-9.9	178.6	-75.1	-173.4	-25.6	0	0	115	I317 Y323	I317-Q321 HydrophobicContact CG2-CG 3.83Å; I317-Q321 PolarHBondContact O-N 2.84Å; I317-Q321 VanDerWaalsContact O-N 3.12Å; Q321-Y323 PolarHBondContact O-N 3.28Å; Q321-Y323 VanDerWaalsContact O-N 3.12Å
322	D	31.6	Very low	30.9	Very low	160 Å²	160	123.6 Å²	123.6	86%	0.856	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.6	9.7	-178.6	-135.9	18.7	0	0	0	114.1
323	Y	29.2	Very low	30.6	Very low	221 Å²	221	124 Å²	124	87%	0.867	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.3	10	-175.1	-113.8	-85.4	0	0	0	115.4	Q321	Q321-Y323 PolarHBondContact O-N 3.28Å; Q321-Y323 VanDerWaalsContact O-N 3.12Å
324	V	27.1	Very low	30.7	Very low	121 Å²	121	127.2 Å²	127.2	73%	0.733	68%	0.679	S	S	*	*	S	Bend	trans	-138.9	90.7	175.9	-172	0	0	0	0	111.9
325	S	28.4	Very low	30.5	Very low	110 Å²	110	130 Å²	130	77%	0.769	69%	0.686	S	S	*	*	S	Bend	trans	161.9	77.1	139.6	-76.8	0	0	0	0	115.8
326	K	29.2	Very low	30.2	Very low	213 Å²	213	136.4 Å²	136.4	93%	0.926	72%	0.715	S	S	*	*				-174.8	154.5	129.3	-100.2	150.9	-171.8	168.6	0	112.3
327	P	31	Very low	29.9	Very low	105 Å²	105	142.8 Å²	142.8	68%	0.682	74%	0.737	S	S	*	*			trans	-122.9	-174.2	-160	38.3	-21.3	0	0	0	115.2
328	Q	27.1	Very low	29.6	Very low	176 Å²	176	144.4 Å²	144.4	82%	0.822	75%	0.751	S	S	*	*			trans	83.5	130.8	172.2	-53.5	173	-6	0	0	114.6
329	T	29.6	Very low	29.4	Very low	110 Å²	110	148.1 Å²	148.1	68%	0.675	76%	0.764	S	S	*	*			cis	-159.2	143.5	-0.2	-4.7	0	0	0	0	111.7
330	Q	27.2	Very low	29	Very low	157 Å²	157	149.1 Å²	149.1	73%	0.734	76%	0.764	S	S	*	*			trans	52.1	130.8	157.5	-71.9	155.5	-50.6	0	0	118.5	I332	Q330-I332 HydrophobicContact CG-CD1 4.4Å
331	T	32.8	Very low	28.9	Very low	124 Å²	124	149.2 Å²	149.2	76%	0.761	76%	0.761	S	S	*	*			cis	-148.7	112.2	43.2	-59.9	0	0	0	0	108.8
332	I	27.2	Very low	28.9	Very low	121 Å²	121	147.9 Å²	147.9	62%	0.621	76%	0.758	S	S	*	*				58.2	99.3	101.7	-58.6	166.1	0	0	0	111.1	Q330	Q330-I332 HydrophobicContact CG-CD1 4.4Å
333	L	26	Very low	28.8	Very low	135 Å²	135	146.6 Å²	146.6	71%	0.707	76%	0.757	S	S	*	*				76.2	126.2	63.5	-71.3	168.9	0	0	0	113.9
334	D	32.3	Very low	28.6	Very low	174 Å²	174	142.7 Å²	142.7	93%	0.93	75%	0.751	S	S	*	*			trans	-142.3	114.7	141.1	-94.7	-35.7	0	0	0	107.9
335	L	29	Very low	28.7	Very low	143 Å²	143	144.4 Å²	144.4	75%	0.749	75%	0.754	S	S	*	*			trans	-143.6	111.3	-177.3	-136.7	-179.9	0	0	0	104.4
336	E	28.7	Very low	28.6	Very low	186 Å²	186	144.6 Å²	144.6	87%	0.869	75%	0.751	S	S	*	*			trans	-122.1	119.6	177.6	-98.8	-167.1	166.2	0	0	113.7
337	Y	28.9	Very low	28.5	Very low	207 Å²	207	142.1 Å²	142.1	81%	0.812	74%	0.742	S	S	*	*			trans	-108.1	119	175.6	-142.3	-81.6	0	0	0	106.5
338	T	27.1	Very low	28.4	Very low	117 Å²	117	140.7 Å²	140.7	72%	0.718	74%	0.739	S	S	*	*			trans	-142	132.7	161.3	39.2	0	0	0	0	108.1
339	N	28.8	Very low	28.3	Very low	127 Å²	127	139 Å²	139	68%	0.679	74%	0.736	S	S	*	*				64.6	139.2	55.4	-64	-21	0	0	0	111.4
340	L	28.9	Very low	28.2	Very low	138 Å²	138	138.4 Å²	138.4	72%	0.723	74%	0.736	S	S	*	*			cis	-151.8	177.2	2.1	-140.7	67.5	0	0	0	106.2
341	E	28.5	Very low	28.2	Very low	144 Å²	144	135.4 Å²	135.4	67%	0.673	73%	0.732	S	S	*	*			cis	-160.5	176.7	14	-156.4	-170.5	-78.2	0	0	109.6
342	N	28.2	Very low	28	Very low	116 Å²	116	133.8 Å²	133.8	62%	0.62	73%	0.726	S	S	*	*			trans	11.4	142.5	147.2	-67.6	-22.3	0	0	0	120.8
343	T	29	Very low	27.9	Very low	134 Å²	134	134.3 Å²	134.3	82%	0.822	73%	0.73	S	S	*	*				-154.4	154.6	63.4	30.4	0	0	0	0	116.6
344	D	26.5	Very low	28	Very low	139 Å²	139	133.2 Å²	133.2	74%	0.743	73%	0.729	S	S	*	*			trans	-60.7	170.2	163.6	-54.6	-89.7	0	0	0	113.3
345	I	27.2	Very low	27.7	Very low	157 Å²	157	128.6 Å²	128.6	81%	0.805	72%	0.722	S	S	*	*				171.2	134.4	114.2	-92	172.2	0	0	0	113.7
346	V	26.8	Very low	27.6	Very low	114 Å²	114	126.7 Å²	126.7	69%	0.691	72%	0.721	S	S	*	*			trans	71.7	105.2	156.3	167.7	0	0	0	0	120.5
347	H	28.2	Very low	27.4	Very low	161 Å²	161	121.4 Å²	121.4	75%	0.745	71%	0.705	S	S	*	*			trans	51.6	117.5	135.5	-66	-93.8	0	0	0	120.2
348	A	27.3	Very low	27.3	Very low	75 Å²	75	118.9 Å²	118.9	62%	0.62	70%	0.698	S	S	*	*				60.8	116.9	66.2	0	0	0	0	0	114.8
349	N	26.4	Very low	27.3	Very low	141 Å²	141	119.7 Å²	119.7	75%	0.754	69%	0.693	S	S	*	*				-160.7	131	102.3	-94.4	-57.9	0	0	0	107.7
350	S	27.5	Very low	27	Very low	96 Å²	96	122.2 Å²	122.2	67%	0.671	69%	0.693	S	S	*	*				69.8	139.4	91.2	118.4	0	0	0	0	112.8
351	S	27.7	Very low	26.8	Very low	95 Å²	95	121.8 Å²	121.8	66%	0.664	69%	0.692	S	S	*	*			cis	-163.4	177.1	4.1	32.9	0	0	0	0	110.8
352	S	27.2	Very low	26.6	Very low	90 Å²	90	119.4 Å²	119.4	63%	0.629	69%	0.691	S	S	*	*			trans	1.6	151.1	140.4	81.7	0	0	0	0	117.5
353	N	25.9	Very low	26.5	Very low	131 Å²	131	119.9 Å²	119.9	70%	0.701	69%	0.694	S	S	*	*			cis	-172.1	-176.5	37.6	-143.8	-23.6	0	0	0	111.2
354	T	27.3	Very low	26.3	Very low	113 Å²	113	117.8 Å²	117.8	69%	0.693	68%	0.68	S	S	*	*			trans	30.5	98.6	150.2	56.5	0	0	0	0	116.7
355	G	27.1	Very low	26.2	Very low	76 Å²	76	118 Å²	118	78%	0.784	68%	0.675	S	S	*	*			cis	121.6	-118	17.9	0	0	0	0	0	108.6
356	S	25.7	Very low	26	Very low	103 Å²	103	118.7 Å²	118.7	72%	0.72	67%	0.667	S	S	*	*			trans	-9.6	130.4	154.3	54.8	0	0	0	0	115.9
357	S	25.7	Very low	25.9	Very low	76 Å²	76	117.6 Å²	117.6	53%	0.531	67%	0.665	S	S	.	*			cis	179.5	173.8	25.9	146.8	0	0	0	0	109.9
358	K	26.2	Very low	25.7	Very low	153 Å²	153	117.8 Å²	117.8	67%	0.665	66%	0.664	S	S	*	*			trans	-6.5	135.3	136.4	-29.3	140.7	-149.1	160.1	0	111.5
359	H	26.8	Very low	25.6	Very low	135 Å²	135	119 Å²	119	63%	0.625	67%	0.667	S	S	*	*			cis	-123.1	134.6	42.6	-84.6	-96.5	0	0	0	111.7
360	R	23.5	Very low	25.5	Very low	180 Å²	180	116.9 Å²	116.9	68%	0.679	67%	0.669	S	S	*	*				49.2	157.6	73	-71.5	-160.2	-168.8	156.9	-4.6	111.5
361	N	23.9	Very low	25.3	Very low	128 Å²	128	119.8 Å²	119.8	68%	0.684	68%	0.676	S	S	*	*			trans	57.9	107.1	149.6	-69.1	12	0	0	0	114.4
362	S	25.4	Very low	25.1	Very low	94 Å²	94	120 Å²	120	66%	0.657	68%	0.678	S	S	*	*			cis	171.2	-169.7	28.9	47	0	0	0	0	105.6
363	N	25.2	Very low	24.9	Very low	127 Å²	127	121.5 Å²	121.5	68%	0.679	68%	0.684	S	S	*	*			cis	-172	-176.8	25.2	-144.9	-12.5	0	0	0	110.7
364	V	23.9	Very low	25.1	Very low	90 Å²	90	122.6 Å²	122.6	55%	0.545	69%	0.689	S	S	.	*				18.1	115.9	124.5	160.1	0	0	0	0	113.9
365	F	24.4	Very low	25.5	Very low	144 Å²	144	121.1 Å²	121.1	63%	0.632	68%	0.681	S	S	*	*			cis	-177.7	177	20.4	-129.4	178.8	0	0	0	115.4
366	R	24.1	Very low	25.6	Very low	170 Å²	170	122.8 Å²	122.8	64%	0.642	68%	0.678	S	S	*	*				18	115.3	122.6	-179.1	-128.2	-75.1	175.6	-9.1	113.3	K368	R366-K368 HydrophobicContact CG-CD 4.32Å; R366-K368 HydrophobicContact CG-CG 4.25Å
367	S	24.2	Very low	25.5	Very low	91 Å²	91	123.1 Å²	123.1	64%	0.636	68%	0.676	S	S	*	*				-160.8	129.9	83.6	-72.1	0	0	0	0	110.7
368	K	24.7	Very low	25.5	Very low	166 Å²	166	128.8 Å²	128.8	72%	0.722	69%	0.691	S	S	*	*				55.7	145	80.2	-62.3	-178	170.3	-168.5	0	113.7	R366	R366-K368 HydrophobicContact CG-CD 4.32Å; R366-K368 HydrophobicContact CG-CG 4.25Å
369	S	24.2	Very low	25.4	Very low	99 Å²	99	133 Å²	133	69%	0.692	70%	0.703	S	S	*	*			trans	49.6	100	146.6	56.8	0	0	0	0	116.4
370	A	24.4	Very low	25.3	Very low	97 Å²	97	129.9 Å²	129.9	80%	0.802	71%	0.707	S	S	*	*				64.1	168.2	66.5	0	0	0	0	0	113.9
371	L	23.5	Very low	25.6	Very low	157 Å²	157	130.1 Å²	130.1	82%	0.822	72%	0.716	S	S	*	*			trans	71.3	123	166.5	-140.5	77.7	0	0	0	115.9
372	S	22.7	Very low	25.6	Very low	100 Å²	100	133.3 Å²	133.3	70%	0.699	72%	0.718	S	S	*	*			trans	61.1	140.1	154.4	54.9	0	0	0	0	117.5
373	T	24	Very low	25.7	Very low	121 Å²	121	138 Å²	138	74%	0.742	72%	0.723	S	S	*	*			cis	-157.5	143.2	20.1	-17	0	0	0	0	105.6
374	L	30.5	Very low	26	Very low	154 Å²	154	135 Å²	135	81%	0.806	72%	0.722	S	S	*	*				48.9	150.7	51.5	-82.7	174.8	0	0	0	114.2
375	P	34.9	Very low	26.3	Very low	82 Å²	82	139.4 Å²	139.4	53%	0.532	74%	0.737	S	S	.	*				-100.2	-177.8	-76.2	40.4	-30	0	0	0	111.2	T377	P375-T377 HydrophobicContact CB-CG2 4.02Å; P375-T377 WeakPolarHBondContact CB-OG1 3.32Å; P375-T377 HydrophobicContact CG-CG2 4.42Å; P375-T377 VanDerWaalsContact CG-OG1 3.25Å; P375-T377 WeakPolarHBondContact CG-OG1 3.35Å
376	P	29.4	Very low	26.6	Very low	112 Å²	112	135.5 Å²	135.5	73%	0.727	74%	0.736	S	S	*	*				-142.1	132	93	34	-18.6	0	0	0	112.1
377	T	23.6	Very low	27	Very low	110 Å²	110	134.8 Å²	134.8	68%	0.675	74%	0.74	S	S	*	*			cis	43.3	46.2	42.1	72.1	0	0	0	0	116	P375	P375-T377 HydrophobicContact CB-CG2 4.02Å; P375-T377 WeakPolarHBondContact CB-OG1 3.32Å; P375-T377 HydrophobicContact CG-CG2 4.42Å; P375-T377 VanDerWaalsContact CG-OG1 3.25Å; P375-T377 WeakPolarHBondContact CG-OG1 3.35Å
378	K	25.9	Very low	27.3	Very low	194 Å²	194	138 Å²	138	84%	0.843	75%	0.745	S	S	*	*			trans	-119.9	101.2	140.8	-72.6	-175.7	179.4	176.9	0	106.7
379	R	23.4	Very low	27.6	Very low	242 Å²	242	134.9 Å²	134.9	91%	0.913	74%	0.744	S	S	*	*			cis	73.3	98.9	38.8	-157.8	-171.1	-169.9	-167.2	4.7	111.8
380	G	26.3	Very low	27.8	Very low	69 Å²	69	139 Å²	139	71%	0.711	75%	0.752	S	S	*	*			trans	107.5	132.6	-174.5	0	0	0	0	0	110.8
381	Q	28.1	Very low	28.2	Very low	185 Å²	185	139.7 Å²	139.7	86%	0.864	75%	0.749	S	S	*	*			cis	-137.2	140.8	-3.5	-73.9	172.9	-9.8	0	0	107.7
382	R	24.9	Very low	28.4	Very low	196 Å²	196	137.2 Å²	137.2	74%	0.74	74%	0.744	S	S	*	*				84.1	109.3	50.3	-154.2	-166.5	-166.7	-166.2	5.6	111.2
383	Y	27.5	Very low	28.7	Very low	192 Å²	192	137.1 Å²	137.1	75%	0.753	74%	0.744	S	S	*	*			trans	71.3	150.2	-177.9	-44.3	-70.8	0	0	0	115.2
384	G	31.7	Very low	28.9	Very low	65 Å²	65	140.9 Å²	140.9	67%	0.67	75%	0.753	S	S	*	*			cis	-126.6	158.5	-6.2	0	0	0	0	0	111.4
385	H	30.2	Very low	28.9	Very low	182 Å²	182	137.4 Å²	137.4	84%	0.843	76%	0.755	S	S	*	*				66.7	126	75.9	-89.5	-66.9	0	0	0	115.3
386	G	30.9	Very low	28.5	Very low	61 Å²	61	139.5 Å²	139.5	63%	0.629	77%	0.766	S	S	*	*			trans	127.7	82.9	-172.4	0	0	0	0	0	109.6
387	H	32.4	Very low	28.5	Very low	156 Å²	156	140.8 Å²	140.8	72%	0.722	77%	0.767	S	S	*	*				62.3	131.3	77.5	-62.3	-59.9	0	0	0	112.5
388	Q	30.2	Very low	28.6	Very low	159 Å²	159	140.8 Å²	140.8	74%	0.743	77%	0.771	S	S	*	*			cis	-161.7	160.7	11.5	-132.8	159	13	0	0	111.6
389	S	31	Very low	28.8	Very low	99 Å²	99	137.5 Å²	137.5	69%	0.692	77%	0.767	S	S	*	*			trans	48.7	118.1	149.1	60.5	0	0	0	0	118.5
390	E	27.7	Very low	29.1	Very low	186 Å²	186	134.4 Å²	134.4	87%	0.869	76%	0.763	S	S	*	*			cis	53.7	155.5	42.4	-113.7	-170.3	-153.4	0	0	113.3
391	P	33.6	Very low	29.2	Very low	112 Å²	112	141 Å²	141	73%	0.727	77%	0.766	S	S	*	*			cis	-131.1	-173.9	-1.2	42.5	-25.2	0	0	0	114.9
392	S	26.5	Very low	29.3	Very low	104 Å²	104	139.9 Å²	139.9	73%	0.727	76%	0.761	S	S	*	*			trans	-89	-177.2	171.4	56.9	0	0	0	0	113.5
393	S	29.5	Very low	29.7	Very low	99 Å²	99	135.7 Å²	135.7	69%	0.692	76%	0.762	S	S	*	*			trans	102.2	128	150.9	79.3	0	0	0	0	119.9
394	Q	27.8	Very low	30.1	Very low	199 Å²	199	132 Å²	132	93%	0.93	76%	0.761	S	S	*	*			trans	46.7	122.2	135	-60.8	175.4	-7.8	0	0	120.1
395	G	30.4	Very low	30.1	Very low	82 Å²	82	136.1 Å²	136.1	85%	0.845	77%	0.767	S	S	*	*			trans	179.8	103.2	169.6	0	0	0	0	0	114.3
396	T	28.2	Very low	30.3	Very low	126 Å²	126	134.1 Å²	134.1	77%	0.773	76%	0.762	S	S	*	*			trans	-54.8	153.7	176.3	43.7	0	0	0	0	117.6
397	D	28.5	Very low	30.4	Very low	138 Å²	138	135 Å²	135	74%	0.738	76%	0.764	S	S	*	*			trans	68.1	100.9	140.8	-58.5	-18.2	0	0	0	123.4
398	S	25.6	Very low	30.5	Very low	110 Å²	110	134.5 Å²	134.5	77%	0.769	76%	0.761	S	S	*	*				86.3	175.3	119.5	82.1	0	0	0	0	121.4
399	V	31.1	Very low	30.6	Very low	125 Å²	125	133.8 Å²	133.8	76%	0.758	76%	0.758	S	S	*	*			trans	74.5	82.4	175.1	-162	0	0	0	0	119
400	H	28.4	Very low	30.6	Very low	177 Å²	177	135.4 Å²	135.4	82%	0.819	76%	0.759	S	S	*	*				46.8	151.4	110.8	-123.8	24.7	0	0	0	123
401	R	29.4	Very low	30.8	Very low	209 Å²	209	134.2 Å²	134.2	79%	0.789	76%	0.756	S	S	*	*			trans	87.7	145	172.7	-58	177.9	173.8	-150.1	4	115.8
402	Q	30.9	Very low	30.6	Very low	161 Å²	161	132.7 Å²	132.7	75%	0.752	75%	0.749	S	S	*	*			cis	-154.6	155.8	-9.2	-121.4	164.5	-45.6	0	0	111.5
403	S	32	Very low	30.9	Very low	108 Å²	108	136.6 Å²	136.6	76%	0.755	76%	0.755	S	S	*	*			trans	-86.6	175.1	177.5	-36.3	0	0	0	0	113.7
404	P	36.9	Very low	30.9	Very low	113 Å²	113	136.6 Å²	136.6	73%	0.734	76%	0.755	S	S	*	*				-117.5	134.5	121.4	-6.8	27.2	0	0	0	112.8
405	L	31.7	Very low	30.8	Very low	152 Å²	152	136.7 Å²	136.7	80%	0.796	76%	0.755	S	S	*	*				72.4	129.5	85.8	-63.5	175.7	0	0	0	113.2
406	L	33.8	Very low	30.7	Very low	140 Å²	140	136.2 Å²	136.2	73%	0.733	75%	0.751	S	S	*	*			cis	-149.5	-176.1	1.9	-97.7	160.9	0	0	0	108.2
407	A	33.8	Very low	30.7	Very low	81 Å²	81	140.2 Å²	140.2	67%	0.669	76%	0.761	S	S	*	*			cis	-141.4	171.1	6.9	0	0	0	0	0	109.4
408	H	33.6	Very low	30.4	Very low	144 Å²	144	139.2 Å²	139.2	67%	0.667	77%	0.765	S	S	*	*				62	125.9	63.4	-61.6	-111.3	0	0	0	115.7
409	E	32.8	Very low	30.6	Very low	145 Å²	145	138.9 Å²	138.9	68%	0.678	76%	0.762	S	S	*	*			cis	-158.2	157	6.1	-124.5	173.4	-150.1	0	0	116.8
410	N	29.6	Very low	30.5	Very low	133 Å²	133	136.4 Å²	136.4	71%	0.711	76%	0.762	S	S	*	*			trans	5.9	146.4	154.3	-46.4	-26.8	0	0	0	120.1
411	I	32.4	Very low	30.3	Very low	160 Å²	160	136.4 Å²	136.4	82%	0.821	76%	0.76	S	S	*	*				-175.1	157	64	-73.7	178.1	0	0	0	107.3
412	S	29.9	Very low	30.1	Very low	81 Å²	81	131.7 Å²	131.7	57%	0.566	75%	0.754	S	S	*	*			cis	-177.6	146.6	-38.6	72.1	0	0	0	0	109.6
413	H	32	Very low	30	Very low	186 Å²	186	128.6 Å²	128.6	86%	0.861	76%	0.756	S	S	*	*			trans	64.9	149.5	171.6	-60.7	-69.9	0	0	0	117.3
414	S	29.2	Very low	29.7	Very low	98 Å²	98	127.8 Å²	127.8	69%	0.685	75%	0.75	S	S	*	*			cis	-153	145.9	-0.8	49.2	0	0	0	0	113.5
415	Q	27.5	Very low	29.3	Very low	201 Å²	201	131.3 Å²	131.3	94%	0.939	76%	0.757	S	S	*	*			trans	49.8	99.8	150	-65.9	-179.6	-17	0	0	119.6
416	G	27.6	Very low	29.1	Very low	73 Å²	73	132.8 Å²	132.8	75%	0.753	76%	0.76	S	S	*	*			trans	-169.8	130.8	162.4	0	0	0	0	0	110.2	S418	G416-S418 PolarHBondContact O-N 3.11Å
417	Q	27.2	Very low	28.7	Very low	210 Å²	210	129.4 Å²	129.4	98%	0.981	76%	0.759	S	S	*	*			trans	-64.1	128.5	-170.4	-69.5	170	-19.4	0	0	112.4
418	S	24.1	Very low	28.4	Very low	117 Å²	117	131.7 Å²	131.7	82%	0.818	77%	0.77	S	S	*	*			trans	-108.4	113	-174.6	60.6	0	0	0	0	113.4	G416	G416-S418 PolarHBondContact O-N 3.11Å
419	S	28.6	Very low	28	Very low	103 Å²	103	130.4 Å²	130.4	72%	0.72	78%	0.777	S	S	*	*			trans	-119.6	137.3	155.7	52.8	0	0	0	0	108.1	F421	S419-F421 PolarHBondContact O-N 2.81Å
420	G	29.1	Very low	27.7	Very low	73 Å²	73	128.7 Å²	128.7	75%	0.753	78%	0.782	S	S	*	*			trans	-55.4	128	-176.4	0	0	0	0	0	111.9
421	F	25.1	Very low	27.5	Very low	177 Å²	177	127.1 Å²	127.1	78%	0.776	78%	0.781	S	S	*	*				57.4	88.1	63.7	-72.9	-89.4	0	0	0	110.7	S419	S419-F421 PolarHBondContact O-N 2.81Å
422	T	25.4	Very low	27.3	Very low	110 Å²	110	127.3 Å²	127.3	68%	0.675	78%	0.783	S	S	*	*				84.2	148.2	77.7	55.7	0	0	0	0	112.6
423	A	28.3	Very low	27.1	Very low	96 Å²	96	128.9 Å²	128.9	79%	0.793	79%	0.791	S	S	*	*			cis	-111.3	158.8	5.5	0	0	0	0	0	111.7
424	S	24.7	Very low	26.8	Very low	90 Å²	90	124.9 Å²	124.9	63%	0.629	78%	0.784	S	S	*	*			cis	86.6	77.8	20.7	-52.4	0	0	0	0	116.1
425	E	29	Very low	26.6	Very low	187 Å²	187	127.5 Å²	127.5	87%	0.874	79%	0.79	S	S	*	*			trans	-145.7	119.4	136.8	-102	168.7	-156.9	0	0	103.2
426	E	27.1	Very low	26.5	Very low	183 Å²	183	125.5 Å²	125.5	86%	0.855	79%	0.785	S	S	*	*				55.1	127.5	55.9	-57.3	-167.2	-162.2	0	0	111.7
427	G	25.9	Very low	26.6	Very low	70 Å²	70	127.5 Å²	127.5	72%	0.722	78%	0.783	S	S	*	*			cis	133.2	73.7	10.3	0	0	0	0	0	110.1
428	S	26.4	Very low	26.7	Very low	129 Å²	129	121.7 Å²	121.7	90%	0.902	78%	0.78	S	S	*	*			trans	-136.2	79	-176.6	-76.8	0	0	0	0	112.3
429	S	25.8	Very low	26.9	Very low	116 Å²	116	119 Å²	119	81%	0.811	77%	0.77	S	S	*	*			trans	-94.9	114.5	162.8	56.1	0	0	0	0	110.3
430	S	26.1	Very low	27.1	Very low	110 Å²	110	119.3 Å²	119.3	77%	0.769	77%	0.773	S	S	*	*			trans	-146.7	133.7	158.2	56.2	0	0	0	0	108.1
431	S	26	Very low	27.2	Very low	99 Å²	99	120.6 Å²	120.6	69%	0.692	77%	0.77	S	S	*	*			cis	71.6	84.1	11.6	94.9	0	0	0	0	116.5
432	L	27.3	Very low	27.5	Very low	164 Å²	164	117.2 Å²	117.2	86%	0.859	77%	0.768	S	S	*	*			trans	71.2	160.2	155.9	-60.6	173.6	0	0	0	115.8
433	P	26.9	Very low	27.9	Very low	114 Å²	114	118.5 Å²	118.5	74%	0.74	78%	0.776	S	S	*	*			cis	-121.4	169.4	8.6	42.5	-30.4	0	0	0	115.8
434	S	25.5	Very low	28	Very low	103 Å²	103	118 Å²	118	72%	0.72	78%	0.78	S	S	*	*			trans	-65.9	130.3	150.7	51.6	0	0	0	0	110.6
435	L	25.6	Very low	28.3	Very low	153 Å²	153	117.7 Å²	117.7	80%	0.801	79%	0.791	S	S	*	*			trans	-156.4	116.4	147.6	-144.2	74.9	0	0	0	111.8
436	D	26	Very low	28.5	Very low	159 Å²	159	112.1 Å²	112.1	85%	0.85	78%	0.784	S	S	*	*			trans	-67.5	125.2	153.8	-67.6	-71.1	0	0	0	108.8
437	T	28.6	Very low	28.5	Very low	115 Å²	115	109.5 Å²	109.5	71%	0.706	79%	0.785	S	S	*	*			trans	-174.4	114.3	138.4	13.7	0	0	0	0	111.6
438	G	28.3	Very low	28.8	Very low	88 Å²	88	110.8 Å²	110.8	91%	0.907	78%	0.782	S	S	*	*			trans	-89.2	116.1	159.1	0	0	0	0	0	109.9
439	G	30.1	Very low	29.1	Very low	60 Å²	60	110.5 Å²	110.5	62%	0.619	78%	0.781	S	S	*	*			trans	99.7	144	178.4	0	0	0	0	0	114.1
440	S	31.4	Very low	29.4	Very low	110 Å²	110	108.4 Å²	108.4	77%	0.769	78%	0.777	S	S	*	*			cis	-160	159.9	4.3	52.3	0	0	0	0	114.6
441	S	31.8	Very low	29.6	Very low	99 Å²	99	112 Å²	112	69%	0.692	78%	0.781	S	S	*	*			trans	63.9	125.2	155.6	55.4	0	0	0	0	122.4
442	S	31.9	Very low	29.9	Very low	106 Å²	106	113.5 Å²	113.5	74%	0.741	79%	0.786	S	S	*	*			trans	71.9	145.3	137.8	69.8	0	0	0	0	119.8
443	T	32.9	Very low	29.9	Very low	137 Å²	137	114.2 Å²	114.2	84%	0.84	79%	0.785	S	S	*	*			cis	-163.1	137.5	-9	12.1	0	0	0	0	111.7
444	G	31.2	Very low	30.2	Very low	86 Å²	86	115.3 Å²	115.3	89%	0.887	79%	0.79	S	S	*	*			trans	74.8	154	159.4	0	0	0	0	0	117.6
445	G	31.4	Very low	30.3	Very low	83 Å²	83	114.8 Å²	114.8	86%	0.856	79%	0.792	S	S	*	*			cis	167.1	152.4	-8	0	0	0	0	0	113.3
446	G	31.3	Very low	30.7	Very low	70 Å²	70	115.8 Å²	115.8	72%	0.722	80%	0.798	S	S	*	*			trans	97.3	112.5	178.9	0	0	0	0	0	113.1
447	C	28.8	Very low	30.9	Very low	129 Å²	129	117 Å²	117	87%	0.872	80%	0.799	S	S	*	*				83.1	137.2	59.2	-69.1	0	0	0	0	113.5
448	S	32.5	Very low	31.2	Very low	96 Å²	96	119.2 Å²	119.2	67%	0.671	81%	0.806	S	S	*	*			cis	-176.7	149.8	-7.1	45.2	0	0	0	0	112.5
449	S	31.7	Very low	31.3	Very low	124 Å²	124	122.8 Å²	122.8	87%	0.867	80%	0.799	S	S	*	*			trans	59.5	146.7	152.1	57.8	0	0	0	0	120.6
450	G	31.9	Very low	31.3	Very low	71 Å²	71	125.5 Å²	125.5	73%	0.732	81%	0.809	S	S	*	*			cis	174.9	-167.5	-1.1	0	0	0	0	0	115.3
451	H	31.4	Very low	31.3	Very low	187 Å²	187	127.8 Å²	127.8	87%	0.866	81%	0.811	S	S	*	*			trans	-38	164.2	175.2	-54.1	-73.5	0	0	0	117.2
452	T	31	Very low	31.1	Very low	130 Å²	130	125.9 Å²	125.9	80%	0.798	81%	0.807	S	S	*	*			cis	-150.3	163.8	38.9	47.1	0	0	0	0	117.3
453	Q	28.5	Very low	31.1	Very low	178 Å²	178	130.6 Å²	130.6	83%	0.832	82%	0.817	S	S	*	*			trans	-47.6	147.2	172.9	-58.5	148.2	-23	0	0	117.6
454	T	31.7	Very low	30.7	Very low	138 Å²	138	132.5 Å²	132.5	85%	0.847	82%	0.816	S	S	*	*				179.9	117.8	115.5	25.8	0	0	0	0	106.8
455	A	29.2	Very low	30.6	Very low	91 Å²	91	135.4 Å²	135.4	75%	0.752	81%	0.81	S	S	*	*				77.1	93.1	63.7	0	0	0	0	0	113.4
456	D	34	Very low	30.5	Very low	175 Å²	175	139.6 Å²	139.6	94%	0.936	81%	0.813	S	S	*	*			trans	-155.6	152.8	146.4	-99.2	-33	0	0	0	107.9
457	E	30.1	Very low	30.3	Very low	184 Å²	184	141.4 Å²	141.4	86%	0.86	82%	0.815	S	S	*	*			trans	-103.4	140.2	-171.6	-59.4	-178.7	137.1	0	0	112.1
458	D	33.8	Very low	30.3	Very low	162 Å²	162	139.1 Å²	139.1	87%	0.866	81%	0.805	S	S	*	*			trans	-152.8	150.1	150.1	-136.9	-27	0	0	0	111.7
459	H	30.5	Very low	30.2	Very low	162 Å²	162	141 Å²	141	75%	0.75	81%	0.808	S	S	*	*			trans	-92.7	127.4	-161.4	-75.9	-65.5	0	0	0	115.2
460	S	30.9	Very low	30.2	Very low	118 Å²	118	141.4 Å²	141.4	83%	0.825	81%	0.805	S	S	*	*			trans	-147	99.5	158.1	178.8	0	0	0	0	110.7
461	I	30.2	Very low	30.1	Very low	158 Å²	158	143.3 Å²	143.3	81%	0.81	80%	0.803	S	S	*	*			trans	-98.8	132.1	176.4	-52.7	171.1	0	0	0	107.8
462	G	29	Very low	30.1	Very low	59 Å²	59	139.6 Å²	139.6	61%	0.608	79%	0.788	S	S	*	*			cis	136.4	122	5.1	0	0	0	0	0	109.8	E464	G462-E464 PolarHBondContact O-N 2.87Å
463	E	30.5	Very low	30.1	Very low	205 Å²	205	141.9 Å²	141.9	96%	0.958	80%	0.795	S	S	*	*			trans	-78	100.5	-171.1	-61	160.7	118.6	0	0	111.6
464	E	26.4	Very low	30.1	Very low	176 Å²	176	140.3 Å²	140.3	82%	0.822	79%	0.787	S	S	*	*			trans	-150	65.4	178.4	-150.6	172.5	-137.5	0	0	115.1	G462	G462-E464 PolarHBondContact O-N 2.87Å
465	L	28.2	Very low	30	Very low	147 Å²	147	138.1 Å²	138.1	77%	0.77	78%	0.777	S	S	*	*			trans	-133.9	48.7	168	-79.4	-179.3	0	0	0	112.9
466	N	28.5	Very low	30.1	Very low	171 Å²	171	141.8 Å²	141.8	91%	0.914	78%	0.782	S	S	*	*	S	Bend	trans	-142.9	36.6	172.7	-126.2	-13.7	0	0	0	113.7
467	S	27.4	Very low	29.8	Very low	109 Å²	109	138.7 Å²	138.7	76%	0.762	77%	0.774	S	S	*	*			trans	-147.1	72	179.6	-178.2	0	0	0	0	112.8
468	A	29.5	Very low	29.9	Very low	80 Å²	80	137.8 Å²	137.8	66%	0.661	77%	0.768	S	S	*	*	S	Bend	trans	-142	-18.1	177.3	0	0	0	0	0	116.1
469	N	29.9	Very low	29.7	Very low	136 Å²	136	138.1 Å²	138.1	73%	0.727	77%	0.768	S	S	*	*	S	Bend	trans	-98.7	9.3	-168.7	-76.5	-32.5	0	0	0	115.6
470	T	31.7	Very low	29.6	Very low	132 Å²	132	135.4 Å²	135.4	81%	0.81	77%	0.767	S	S	*	*	S	Bend	trans	-114.6	-7.7	-169.8	-35.8	0	0	0	0	114.4
471	T	30.5	Very low	29.6	Very low	112 Å²	112	138.4 Å²	138.4	69%	0.687	77%	0.765	S	S	*	*	G	3₁₀ helix	trans	-91.3	-8.8	-160.2	-41.6	0	0	0	0	115.5
472	I	30.8	Very low	29.8	Very low	108 Å²	108	137.8 Å²	137.8	55%	0.554	76%	0.764	S	S	*	*	G	3₁₀ helix	trans	-90.1	-6.8	-167.8	-66.3	178.3	0	0	0	114.2
473	L	31.3	Very low	29.8	Very low	179 Å²	179	141.8 Å²	141.8	94%	0.937	77%	0.771	S	S	*	*	G	3₁₀ helix	trans	-106.6	16.5	-178.4	-75.1	175.3	0	0	0	115.9
474	H	28.1	Very low	29.8	Very low	145 Å²	145	137.9 Å²	137.9	67%	0.671	76%	0.757	S	S	*	*	S	Bend	trans	-118.4	14.7	-174.9	-154.2	-79.3	0	0	0	115.5
475	S	30	Very low	30.1	Very low	92 Å²	92	137.9 Å²	137.9	64%	0.643	76%	0.757	S	S	*	*	S	Bend	trans	-110.5	-7	-172.2	50	0	0	0	0	116.3
476	I	30.9	Very low	30.1	Very low	167 Å²	167	134.3 Å²	134.3	86%	0.856	76%	0.756	S	S	*	*	S	Bend	trans	-102.9	-10	-173.4	-64.3	177.6	0	0	0	113.3
477	S	28.7	Very low	30.4	Very low	110 Å²	110	132.5 Å²	132.5	77%	0.769	75%	0.746	S	S	*	*	S	Bend	trans	-94.4	-4.2	-170.8	-174.9	0	0	0	0	116.4
478	K	30.7	Very low	30.6	Very low	166 Å²	166	134 Å²	134	72%	0.722	74%	0.739	S	S	*	*			trans	-134.2	42.8	-165.6	-67.3	-170.1	178.8	-179.1	0	115.9
479	I	30	Very low	30.8	Very low	168 Å²	168	138.1 Å²	138.1	86%	0.862	74%	0.744	S	S	*	*			trans	-128.8	83	164.8	-52.5	-178.3	0	0	0	110.2
480	S	28.2	Very low	31.2	Very low	106 Å²	106	135.7 Å²	135.7	74%	0.741	74%	0.738	S	S	*	*			trans	-156.2	138.8	163.7	-167.2	0	0	0	0	109.1
481	K	31.7	Very low	31.3	Very low	180 Å²	180	133.7 Å²	133.7	78%	0.783	73%	0.729	S	S	*	*			trans	66.1	86.5	177.9	-52	174.8	-174.2	175.3	0	116
482	N	33.3	Very low	31.6	Very low	146 Å²	146	136.3 Å²	136.3	78%	0.781	73%	0.734	S	S	*	*				176.3	140	95.1	-85.7	-17.4	0	0	0	113.6
483	N	30.4	Very low	31.5	Very low	143 Å²	143	137.1 Å²	137.1	77%	0.765	74%	0.738	S	S	*	*			trans	-3.1	146.9	143.5	-48.9	-1.9	0	0	0	117.1
484	N	30.5	Very low	31.6	Very low	122 Å²	122	135.9 Å²	135.9	65%	0.652	73%	0.732	S	S	*	*			cis	-159.9	169.4	31.3	-140.8	26	0	0	0	113.7
485	E	31.4	Very low	31.8	Very low	176 Å²	176	136.3 Å²	136.3	82%	0.822	73%	0.734	S	S	*	*			trans	67	141.6	155.6	-73.8	159.9	-125.1	0	0	121.6
486	G	29.6	Very low	31.7	Very low	73 Å²	73	137 Å²	137	75%	0.753	74%	0.739	S	S	*	*			trans	127.5	65.4	153.5	0	0	0	0	0	119.4
487	D	34	Very low	31.8	Very low	132 Å²	132	135.6 Å²	135.6	71%	0.706	73%	0.733	S	S	*	*			trans	38.4	143	140	-82.3	15.7	0	0	0	122.8
488	K	31.8	Very low	31.8	Very low	142 Å²	142	139.8 Å²	139.8	62%	0.617	74%	0.74	S	S	*	*			cis	-174.6	159.8	-8.2	-124.3	-179.8	-165.6	80.1	0	108.4
489	H	34.4	Very low	31.9	Very low	165 Å²	165	136.3 Å²	136.3	76%	0.764	74%	0.743	S	S	*	*			trans	62.4	138.4	162.9	-72.1	-65.9	0	0	0	118.2
490	S	36.6	Very low	31.8	Very low	86 Å²	86	138.2 Å²	138.2	60%	0.601	75%	0.745	S	S	*	*			cis	-160.8	141	7.1	-105.3	0	0	0	0	112.1
491	S	35.6	Very low	31.9	Very low	90 Å²	90	141.4 Å²	141.4	63%	0.629	75%	0.748	S	S	*	*				62	143.5	127.2	-55.1	0	0	0	0	121.8
492	Q	36	Very low	31.8	Very low	167 Å²	167	140.8 Å²	140.8	78%	0.78	75%	0.752	S	S	*	*			cis	-160.6	149.7	-3.8	-115.9	158.5	7.9	0	0	111.1
493	L	29.2	Very low	31.7	Very low	124 Å²	124	141.2 Å²	141.2	65%	0.649	75%	0.75	S	S	*	*			trans	9	150.1	144.1	-71.9	137.7	0	0	0	120.1	H495	L493-H495 WeakPolarHBondContact CD2-CD2 3.45Å
494	L	33.4	Very low	31.7	Very low	154 Å²	154	139.3 Å²	139.3	81%	0.806	75%	0.747	S	S	*	*			cis	-140.4	151.3	43.8	-63.4	152.6	0	0	0	110.4
495	H	31.3	Very low	31.8	Very low	153 Å²	153	139.5 Å²	139.5	71%	0.708	75%	0.748	S	S	*	*				52.5	138.4	65.7	-74.8	-41.2	0	0	0	115	L493	L493-H495 WeakPolarHBondContact CD2-CD2 3.45Å
496	S	28.8	Very low	31.8	Very low	108 Å²	108	135.4 Å²	135.4	76%	0.755	73%	0.732	S	S	*	*			cis	-143.1	173.2	12.8	56.4	0	0	0	0	114.1
497	D	32.9	Very low	32.1	Very low	136 Å²	136	138.4 Å²	138.4	73%	0.727	73%	0.73	S	S	*	*			trans	-61.2	139.7	179.1	-50.1	-117.3	0	0	0	115.2
498	E	27.7	Very low	32.5	Very low	198 Å²	198	136.2 Å²	136.2	93%	0.925	73%	0.725	S	S	*	*			trans	-176.4	96.6	134.5	-108.9	-179.2	-176.1	0	0	112.6
499	A	33.5	Very low	33.2	Very low	94 Å²	94	132.1 Å²	132.1	78%	0.777	71%	0.714	S	S	*	*			trans	179.8	87.2	156.6	0	0	0	0	0	111.9	H501	A499-H501 PolarHBondContact O-N 3.02Å
500	K	27.2	Very low	34.3	Very low	207 Å²	207	129 Å²	129	90%	0.9	70%	0.704	S	S	*	*			trans	-93.3	59.8	175.7	-73.4	-175.6	177.9	172.3	0	113.2
501	H	30	Very low	35.6	Very low	174 Å²	174	132.4 Å²	132.4	81%	0.806	71%	0.707	S	S	*	*			trans	-157.7	158.9	164.9	-126.6	37.7	0	0	0	111.2	A499	A499-H501 PolarHBondContact O-N 3.02Å
502	L	29.7	Very low	37.1	Very low	167 Å²	167	131.5 Å²	131.5	87%	0.874	70%	0.698	S	S	*	*			trans	74.8	165.5	-171.5	-50.6	164.9	0	0	0	114.8
503	Q	30.7	Very low	39	Very low	155 Å²	155	128 Å²	128	72%	0.724	69%	0.688	S	S	*	*			trans	72.9	56.7	-179.9	-52.3	-170.7	33.2	0	0	117.5	N506	Q503-N506 PolarHBondContact OE1-ND2 2.97Å
504	S	31	Very low	41.3	Very low	102 Å²	102	127.8 Å²	127.8	71%	0.713	69%	0.687	S	S	*	*			trans	-81.6	-15.7	160.4	42.1	0	0	0	0	114.2
505	D	33.1	Very low	43.6	Very low	127 Å²	127	122.8 Å²	122.8	68%	0.679	66%	0.661	S	S	*	*			trans	-102.7	-1.6	-154.4	-46.8	-33.4	0	0	0	114.1	L507	D505-L507 PolarHBondContact O-N 2.54Å
506	N	31.9	Very low	45.9	Very low	90 Å²	90	118.4 Å²	118.4	48%	0.481	64%	0.642	S	S	.	*	T	Hydrogen-bonded Turn	trans	-75.4	3.3	-176.4	-77.1	-31	0	0	0	114.9	Q503 S508 S509	Q503-N506 PolarHBondContact OE1-ND2 2.97Å; N506-S508 PolarHBondContact O-N 2.87Å; N506-S509 PolarHBondContact O-OG 3Å
507	L	36.1	Very low	48.6	Very low	136 Å²	136	115 Å²	115	71%	0.712	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.6	-7.5	-172.2	-147.5	73.1	0	0	0	114.8	D505	D505-L507 PolarHBondContact O-N 2.54Å
508	S	42.1	Very low	51.3	Low	86 Å²	86	115 Å²	115	60%	0.601	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.1	-36	174.4	61.8	0	0	0	0	112.6	N506 K511 T512	N506-S508 PolarHBondContact O-N 2.87Å; S508-K511 PolarHBondContact O-N 2.98Å; S508-T512 PolarHBondContact O-OG1 2.95Å
509	S	45.2	Very low	54.3	Low	55 Å²	55	106 Å²	106	39%	0.385	57%	0.569	S	S	.	*	H	α-helix	trans	-66.8	-41.3	-176.9	55	0	0	0	0	112.5	N506 K511 T512 V513	N506-S509 PolarHBondContact O-OG 3Å; S509-K511 VanDerWaalsContact C-N 3.3Å; S509-K511 PolarHBondContact O-N 2.7Å; S509-T512 PolarHBondContact O-N 2.7Å; S509-T512 VanDerWaalsContact O-N 3.09Å; S509-V513 WeakPolarHBondContact O-CG2 3.33Å; S509-V513 PolarHBondContact O-N 3.42Å
510	D	57.3	Low	57	Low	101 Å²	101	107.4 Å²	107.4	54%	0.54	56%	0.555	S	S	.	*	H	α-helix	trans	-55	-41.6	177.6	-92.7	-17.3	0	0	0	112.9	V513 L514	D510-V513 PolarHBondContact O-N 3.29Å; D510-L514 WeakPolarHBondContact O-CB 3.38Å; D510-L514 VanDerWaalsContact O-CG 3.29Å; D510-L514 WeakPolarHBondContact O-CG 3.33Å; D510-L514 PolarHBondContact O-N 2.72Å
511	K	65.8	Low	60	Low	157 Å²	157	103 Å²	103	68%	0.683	54%	0.537	S	S	*	.	H	α-helix	trans	-64.4	-42.9	177.6	-71.8	-176.9	178.9	177.4	0	111.4	S508 S509 L514 L515	S508-K511 PolarHBondContact O-N 2.98Å; S509-K511 VanDerWaalsContact C-N 3.3Å; S509-K511 PolarHBondContact O-N 2.7Å; K511-L514 PolarHBondContact O-N 2.84Å; K511-L515 WeakPolarHBondContact O-CB 3.37Å; K511-L515 PolarHBondContact O-N 2.98Å
512	T	66.6	Low	63	Low	71 Å²	71	95.1 Å²	95.1	44%	0.436	50%	0.502	S	S	.	.	H	α-helix	trans	-67.3	-40	177.8	-55.3	0	0	0	0	111.8	S508 S509 L515 L516	S508-T512 PolarHBondContact O-OG1 2.95Å; S509-T512 PolarHBondContact O-N 2.7Å; S509-T512 VanDerWaalsContact O-N 3.09Å; T512-L515 PolarHBondContact O-N 3.21Å; T512-L516 HydrophobicContact CG2-CD1 4.03Å; T512-L516 HydrophobicContact CG2-CG 4.44Å; T512-L516 WeakPolarHBondContact O-CB 3.35Å; T512-L516 WeakPolarHBondContact O-CG 3.46Å; T512-L516 PolarHBondContact O-N 2.88Å
513	V	74.6	Confident	66	Low	94 Å²	94	87.1 Å²	87.1	57%	0.57	46%	0.46	S	S	*	.	H	α-helix	trans	-63.6	-43.6	174.6	170.1	0	0	0	0	111.3	S509 D510 S517	S509-V513 WeakPolarHBondContact O-CG2 3.33Å; S509-V513 PolarHBondContact O-N 3.42Å; D510-V513 PolarHBondContact O-N 3.29Å; V513-S517 VanDerWaalsContact O-CB 3.27Å; V513-S517 WeakPolarHBondContact O-CB 3.28Å; V513-S517 PolarHBondContact O-N 2.98Å
514	L	78.3	Confident	69	Low	118 Å²	118	85 Å²	85	62%	0.618	45%	0.449	S	S	*	.	H	α-helix	trans	-64.3	-38.9	175	-72.6	170.3	0	0	0	112.2	D510 K511 S517 K518	D510-L514 WeakPolarHBondContact O-CB 3.38Å; D510-L514 VanDerWaalsContact O-CG 3.29Å; D510-L514 WeakPolarHBondContact O-CG 3.33Å; D510-L514 PolarHBondContact O-N 2.72Å; K511-L514 PolarHBondContact O-N 2.84Å; L514-S517 WeakPolarHBondContact O-CB 3.37Å; L514-S517 PolarHBondContact O-N 3.07Å; L514-K518 PolarHBondContact O-N 2.77Å
515	L	82	Confident	72	Confident	50 Å²	50	82 Å²	82	26%	0.262	42%	0.423	S	S	.	.	H	α-helix	trans	-68.1	-48.8	178.7	-171.3	58.9	0	0	0	111.8	K511 T512 S517 K518 R519 P673	K511-L515 WeakPolarHBondContact O-CB 3.37Å; K511-L515 PolarHBondContact O-N 2.98Å; T512-L515 PolarHBondContact O-N 3.21Å; L515-S517 VanDerWaalsContact C-N 3.25Å; L515-S517 PolarHBondContact O-N 3.01Å; L515-K518 WeakPolarHBondContact O-CA 3.27Å; L515-K518 WeakPolarHBondContact O-CB 3.46Å; L515-K518 PolarHBondContact O-N 3.42Å; L515-R519 PolarHBondContact O-N 3.17Å; L515-P673 HydrophobicContact CD2-CB 4.5Å; L515-P673 HydrophobicContact CD2-CG 3.89Å
516	L	80	Confident	74.9	Confident	61 Å²	61	76.1 Å²	76.1	32%	0.319	39%	0.392	S	S	.	.	H	α-helix	trans	-63.2	-31	173.7	-68.9	172.6	0	0	0	112.4	T512 R519 R520 Y676	T512-L516 HydrophobicContact CG2-CD1 4.03Å; T512-L516 HydrophobicContact CG2-CG 4.44Å; T512-L516 WeakPolarHBondContact O-CB 3.35Å; T512-L516 WeakPolarHBondContact O-CG 3.46Å; T512-L516 PolarHBondContact O-N 2.88Å; L516-R519 WeakPolarHBondContact O-CB 3.32Å; L516-R519 PolarHBondContact O-N 3.2Å; L516-R520 PolarHBondContact O-N 2.66Å; L516-Y676 HydrophobicContact CD2-CD2 4.24Å; L516-Y676 HydrophobicContact CD2-CE2 3.85Å
517	S	84.7	Confident	78	Confident	36 Å²	36	72.6 Å²	72.6	25%	0.252	37%	0.373	S	S	.	.	H	α-helix	trans	-64	-44.3	170.2	-167.4	0	0	0	0	111.3	V513 L514 L515 R520 H521	V513-S517 VanDerWaalsContact O-CB 3.27Å; V513-S517 WeakPolarHBondContact O-CB 3.28Å; V513-S517 PolarHBondContact O-N 2.98Å; L514-S517 WeakPolarHBondContact O-CB 3.37Å; L514-S517 PolarHBondContact O-N 3.07Å; L515-S517 VanDerWaalsContact C-N 3.25Å; L515-S517 PolarHBondContact O-N 3.01Å; S517-R520 PolarHBondContact O-N 3.45Å; S517-H521 PolarHBondContact O-N 2.81Å; S517-H521 VanDerWaalsContact O-N 3.17Å; S517-H521 PolarHBondContact O-ND1 3.11Å
518	K	88.7	Confident	80.8	Confident	137 Å²	137	71.3 Å²	71.3	60%	0.596	36%	0.363	S	S	*	.	H	α-helix	trans	-59.3	-46	171.9	-70.2	179.5	177.4	-175	0	111.6	L514 L515 R520 H521 A522	L514-K518 PolarHBondContact O-N 2.77Å; L515-K518 WeakPolarHBondContact O-CA 3.27Å; L515-K518 WeakPolarHBondContact O-CB 3.46Å; L515-K518 PolarHBondContact O-N 3.42Å; K518-R520 VanDerWaalsContact C-N 3.34Å; K518-R520 PolarHBondContact O-N 3.04Å; K518-H521 WeakPolarHBondContact O-CA 3.21Å; K518-H521 WeakPolarHBondContact O-CB 3.24Å; K518-H521 PolarHBondContact O-N 2.68Å; K518-A522 PolarHBondContact O-N 3.34Å
519	R	90.8	Very high	83.3	Confident	7 Å²	7	68 Å²	68	3%	0.026	34%	0.339	C	S	.	.	H	α-helix	trans	-53.5	-50.3	177.3	-167.3	-178.3	167.2	-106.2	-12.6	111.3	L515 L516 H521 A522 V523 N587 L668 S671 T672 Y676 D678	L515-R519 PolarHBondContact O-N 3.17Å; L516-R519 WeakPolarHBondContact O-CB 3.32Å; L516-R519 PolarHBondContact O-N 3.2Å; R519-H521 VanDerWaalsContact C-N 3.27Å; R519-H521 PolarHBondContact O-N 3.06Å; R519-A522 PolarHBondContact O-N 2.97Å; R519-A522 VanDerWaalsContact O-N 3.08Å; R519-V523 WeakPolarHBondContact O-CG2 3.15Å; R519-V523 PolarHBondContact O-N 2.92Å; R519-N587 PolarHBondContact NH1-O 2.98Å; R519-N587 PolarHBondContact NH2-O 3.08Å; R519-L668 HydrophobicContact CG-CD1 3.65Å; R519-S671 WeakPolarHBondContact CB-O 3.34Å; R519-T672 WeakPolarHBondContact CD-OG1 3.47Å; R519-Y676 VanDerWaalsContact CZ-CE1 3.45Å; R519-Y676 PolarHBondContact NH1-OH 2.71Å; R519-D678 IonicContact CZ-OD2 3.62Å; R519-D678 IonicContact NE-OD2 3.59Å; R519-D678 IonicContact NH2-OD2 2.71Å; R519-D678 PolarHBondContact NH2-OD2 3.47Å
520	R	90.7	Very high	85.8	Confident	124 Å²	124	65.4 Å²	65.4	47%	0.468	32%	0.321	S	S	.	.	H	α-helix	trans	-60.8	-31.3	177.4	-178.6	173.7	64.7	-179.4	-3.2	113.3	L516 S517 K518 K524 W583	L516-R520 PolarHBondContact O-N 2.66Å; S517-R520 PolarHBondContact O-N 3.45Å; K518-R520 VanDerWaalsContact C-N 3.34Å; K518-R520 PolarHBondContact O-N 3.04Å; R520-K524 HydrophobicContact CG-CD 4.39Å; R520-K524 WeakPolarHBondContact O-CB 3.42Å; R520-K524 VanDerWaalsContact O-CG 3.25Å; R520-K524 WeakPolarHBondContact O-CG 3.47Å; R520-K524 PolarHBondContact O-N 3.49Å; R520-W583 HydrophobicContact CB-CH2 4.23Å; R520-W583 HydrophobicContact CG-CH2 3.95Å; R520-W583 HydrophobicContact CG-CZ2 4.25Å
521	H	90.8	Very high	87.6	Confident	114 Å²	114	64.3 Å²	64.3	53%	0.528	31%	0.311	S	S	.	.	H	α-helix	trans	-72.9	-41.7	172.4	-71.1	89.4	0	0	0	111.6	S517 K518 R519 K524 E525	S517-H521 PolarHBondContact O-N 2.81Å; S517-H521 VanDerWaalsContact O-N 3.17Å; S517-H521 PolarHBondContact O-ND1 3.11Å; K518-H521 WeakPolarHBondContact O-CA 3.21Å; K518-H521 WeakPolarHBondContact O-CB 3.24Å; K518-H521 PolarHBondContact O-N 2.68Å; R519-H521 VanDerWaalsContact C-N 3.27Å; R519-H521 PolarHBondContact O-N 3.06Å; H521-K524 PolarHBondContact O-N 3.1Å; H521-E525 WeakPolarHBondContact O-CB 3.33Å; H521-E525 PolarHBondContact O-N 3.24Å
522	A	92.2	Very high	89	Confident	9 Å²	9	61.7 Å²	61.7	7%	0.074	30%	0.302	C	S	.	.	H	α-helix	trans	-63.1	-42.8	176.7	0	0	0	0	0	112.5	K518 R519 E525 L526 L668	K518-A522 PolarHBondContact O-N 3.34Å; R519-A522 PolarHBondContact O-N 2.97Å; R519-A522 VanDerWaalsContact O-N 3.08Å; A522-E525 PolarHBondContact O-N 3.45Å; A522-L526 PolarHBondContact O-N 2.59Å; A522-L668 HydrophobicContact CB-CB 4.37Å; A522-L668 HydrophobicContact CB-CD1 3.84Å
523	V	93.5	Very high	90.4	Very high	0 Å²	0	58.5 Å²	58.5	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-67.5	-36.9	175.2	-175.5	0	0	0	0	111.8	R519 E525 L526 I527 W583 V589 L668	R519-V523 WeakPolarHBondContact O-CG2 3.15Å; R519-V523 PolarHBondContact O-N 2.92Å; V523-E525 VanDerWaalsContact C-N 3.34Å; V523-L526 PolarHBondContact O-N 2.75Å; V523-I527 HydrophobicContact CG1-CD1 3.94Å; V523-I527 WeakPolarHBondContact O-CG1 3.34Å; V523-I527 PolarHBondContact O-N 3.17Å; V523-W583 HydrophobicContact CB-CD2 4.3Å; V523-W583 HydrophobicContact CB-CE3 4.35Å; V523-W583 HydrophobicContact CB-CH2 4.48Å; V523-W583 HydrophobicContact CB-CZ2 4.4Å; V523-W583 HydrophobicContact CB-CZ3 4.44Å; V523-W583 HydrophobicContact CG1-CB 4.44Å; V523-W583 HydrophobicContact CG1-CD2 3.47Å; V523-W583 VanDerWaalsContact CG1-CD2 3.47Å; V523-W583 HydrophobicContact CG1-CE3 3.89Å; V523-W583 HydrophobicContact CG1-CG 3.72Å; V523-W583 HydrophobicContact CG1-CZ2 4.27Å; V523-W583 HydrophobicContact CG1-CZ3 4.44Å; V523-W583 HydrophobicContact CG2-CE3 4.38Å; V523-W583 HydrophobicContact CG2-CZ3 4.43Å; V523-V589 HydrophobicContact CG1-CG2 4.47Å; V523-V589 HydrophobicContact CG2-CG1 4.2Å; V523-L668 HydrophobicContact CG2-CD1 3.6Å; V523-L668 HydrophobicContact CG2-CD2 4.1Å
524	K	93.1	Very high	91.4	Very high	110 Å²	110	54.4 Å²	54.4	48%	0.478	26%	0.257	S	S	.	.	H	α-helix	trans	-66.8	-34.5	173.3	-76.3	-176.9	179.1	-165.1	0	112.8	R520 H521 H528	R520-K524 HydrophobicContact CG-CD 4.39Å; R520-K524 WeakPolarHBondContact O-CB 3.42Å; R520-K524 VanDerWaalsContact O-CG 3.25Å; R520-K524 WeakPolarHBondContact O-CG 3.47Å; R520-K524 PolarHBondContact O-N 3.49Å; H521-K524 PolarHBondContact O-N 3.1Å; K524-H528 VanDerWaalsContact O-CB 3.28Å; K524-H528 WeakPolarHBondContact O-CB 3.37Å; K524-H528 PolarHBondContact O-N 2.7Å
525	E	94.5	Very high	92.2	Very high	38 Å²	38	53.1 Å²	53.1	18%	0.178	25%	0.251	C	S	.	.	H	α-helix	trans	-65.1	-47.3	172	-169.5	173.5	144	0	0	110.9	H521 A522 V523 I527 H528 V529 L664 R667	H521-E525 WeakPolarHBondContact O-CB 3.33Å; H521-E525 PolarHBondContact O-N 3.24Å; A522-E525 PolarHBondContact O-N 3.45Å; V523-E525 VanDerWaalsContact C-N 3.34Å; E525-I527 PolarHBondContact O-N 2.87Å; E525-H528 PolarHBondContact O-N 3.18Å; E525-V529 HydrophobicContact CG-CG2 4.24Å; E525-V529 VanDerWaalsContact O-CB 3.26Å; E525-V529 WeakPolarHBondContact O-CB 3.16Å; E525-V529 VanDerWaalsContact O-CG2 3.23Å; E525-V529 WeakPolarHBondContact O-CG2 2.89Å; E525-V529 PolarHBondContact O-N 2.93Å; E525-L664 HydrophobicContact CG-CD2 4.09Å; E525-R667 IonicContact OE1-CZ 2.69Å; E525-R667 IonicContact OE1-NH1 2.72Å; E525-R667 PolarHBondContact OE1-NH1 2.88Å; E525-R667 IonicContact OE2-CZ 3.41Å; E525-R667 IonicContact OE2-NH1 3.6Å; E525-R667 PolarHBondContact OE2-NH1 3Å; E525-R667 IonicContact OE2-NH2 3.75Å; E525-R667 PolarHBondContact OE2-NH2 2.99Å
526	L	94.9	Very high	92.8	Very high	4 Å²	4	51 Å²	51	2%	0.021	24%	0.24	C	C	.	.	H	α-helix	trans	-54	-50.2	174.2	176	63.1	0	0	0	112	A522 V523 H528 V529 E530 L580 V589 L593 Y661 L664	A522-L526 PolarHBondContact O-N 2.59Å; V523-L526 PolarHBondContact O-N 2.75Å; L526-H528 PolarHBondContact O-N 3.21Å; L526-V529 PolarHBondContact O-N 3.45Å; L526-E530 WeakPolarHBondContact O-CB 3.23Å; L526-E530 PolarHBondContact O-N 2.75Å; L526-L580 HydrophobicContact CD2-CD1 4.49Å; L526-L580 HydrophobicContact CD2-CD2 4.14Å; L526-L580 HydrophobicContact CG-CD1 4.19Å; L526-V589 HydrophobicContact CD2-CG2 4.3Å; L526-L593 HydrophobicContact CD2-CD1 4.5Å; L526-L593 HydrophobicContact CD2-CD2 4.43Å; L526-Y661 HydrophobicContact CD1-CD1 4.02Å; L526-Y661 HydrophobicContact CD1-CE1 4.19Å; L526-L664 HydrophobicContact CD1-CD1 3.93Å
527	I	95.7	Very high	93.6	Very high	17 Å²	17	48.1 Å²	48.1	9%	0.087	23%	0.225	C	C	.	.	H	α-helix	trans	-65.8	-38.6	179.5	-68	165.7	0	0	0	112.1	V523 E525 E530 K531 L580 Q581 W583	V523-I527 HydrophobicContact CG1-CD1 3.94Å; V523-I527 WeakPolarHBondContact O-CG1 3.34Å; V523-I527 PolarHBondContact O-N 3.17Å; E525-I527 PolarHBondContact O-N 2.87Å; I527-E530 PolarHBondContact O-N 3.43Å; I527-K531 HydrophobicContact CG2-CD 4.36Å; I527-K531 WeakPolarHBondContact O-CG 3.48Å; I527-K531 PolarHBondContact O-N 3.49Å; I527-L580 HydrophobicContact CG1-CB 4.11Å; I527-Q581 HydrophobicContact CG2-CG 4.36Å; I527-W583 HydrophobicContact CD1-CG 4.24Å
528	H	95.2	Very high	94.1	Very high	109 Å²	109	48 Å²	48	51%	0.505	22%	0.222	S	C	.	.	H	α-helix	trans	-65	-48.5	176.5	177.6	9.4	0	0	0	111.1	K524 E525 L526 E530 K531 E532	K524-H528 VanDerWaalsContact O-CB 3.28Å; K524-H528 WeakPolarHBondContact O-CB 3.37Å; K524-H528 PolarHBondContact O-N 2.7Å; E525-H528 PolarHBondContact O-N 3.18Å; L526-H528 PolarHBondContact O-N 3.21Å; H528-E530 VanDerWaalsContact C-N 3.25Å; H528-E530 PolarHBondContact O-N 2.68Å; H528-K531 WeakPolarHBondContact O-CB 3.32Å; H528-K531 PolarHBondContact O-N 3.05Å; H528-K531 VanDerWaalsContact O-N 3.14Å; H528-E532 IonicContact CE1-OE1 2.66Å; H528-E532 PolarHBondContact CE1-OE1 3.22Å; H528-E532 PolarHBondContact O-N 2.98Å; H528-E532 VanDerWaalsContact O-N 3.11Å
529	V	94.9	Very high	94.4	Very high	16 Å²	16	42.4 Å²	42.4	10%	0.097	20%	0.2	C	C	.	.	H	α-helix	trans	-66.3	-28.3	-180	170.3	0	0	0	0	110.8	E525 L526 Y533 R657 R660 L664	E525-V529 HydrophobicContact CG-CG2 4.24Å; E525-V529 VanDerWaalsContact O-CB 3.26Å; E525-V529 WeakPolarHBondContact O-CB 3.16Å; E525-V529 VanDerWaalsContact O-CG2 3.23Å; E525-V529 WeakPolarHBondContact O-CG2 2.89Å; E525-V529 PolarHBondContact O-N 2.93Å; L526-V529 PolarHBondContact O-N 3.45Å; V529-Y533 PolarHBondContact O-N 2.79Å; V529-R657 VanDerWaalsContact C-NH2 3.3Å; V529-R657 VanDerWaalsContact O-CZ 3.3Å; V529-R657 PolarHBondContact O-NH1 3.45Å; V529-R657 PolarHBondContact O-NH2 3.39Å; V529-R660 HydrophobicContact CG1-CG 4.3Å; V529-L664 HydrophobicContact CG1-CD1 4.13Å
530	E	96.8	Very high	94.6	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-68.3	-46	168.7	-164.4	62	-146.3	0	0	112.9	L526 I527 H528 E532 Y533 V534 H573 F576 L577 L580 R657 Y661	L526-E530 WeakPolarHBondContact O-CB 3.23Å; L526-E530 PolarHBondContact O-N 2.75Å; I527-E530 PolarHBondContact O-N 3.43Å; H528-E530 VanDerWaalsContact C-N 3.25Å; H528-E530 PolarHBondContact O-N 2.68Å; E530-E532 VanDerWaalsContact C-N 3.26Å; E530-E532 PolarHBondContact O-N 3.34Å; E530-Y533 PolarHBondContact O-N 3.08Å; E530-Y533 VanDerWaalsContact O-N 3.12Å; E530-V534 HydrophobicContact CG-CG2 4.47Å; E530-V534 PolarHBondContact O-N 2.99Å; E530-H573 IonicContact OE1-CE1 3.69Å; E530-H573 IonicContact OE1-CG 3.87Å; E530-H573 IonicContact OE1-ND1 2.74Å; E530-H573 PolarHBondContact OE1-ND1 3.25Å; E530-F576 HydrophobicContact CG-CD1 4.15Å; E530-F576 HydrophobicContact CG-CE1 4.33Å; E530-F576 WeakPolarHBondContact OE2-CE1 3.36Å; E530-L577 HydrophobicContact CB-CD1 4.2Å; E530-L577 HydrophobicContact CG-CB 4.04Å; E530-L577 HydrophobicContact CG-CD1 4.09Å; E530-L580 HydrophobicContact CB-CD1 4.22Å; E530-L580 HydrophobicContact CG-CD1 4.15Å; E530-R657 IonicContact OE2-CZ 3.99Å; E530-R657 IonicContact OE2-NE 3.57Å; E530-R657 IonicContact OE2-NH2 2.76Å; E530-R657 PolarHBondContact OE2-NH2 2.95Å; E530-Y661 PolarHBondContact OE1-OH 3.43Å; E530-Y661 WeakPolarHBondContact OE2-CE1 3.49Å; E530-Y661 PolarHBondContact OE2-OH 3.26Å
531	K	96.2	Very high	94.8	Very high	78 Å²	78	36.4 Å²	36.4	34%	0.339	18%	0.178	S	C	.	.	H	α-helix	trans	-58.5	-38.3	177	-72.9	175.1	179.9	-170.9	0	112.3	I527 H528 N535 L577	I527-K531 HydrophobicContact CG2-CD 4.36Å; I527-K531 WeakPolarHBondContact O-CG 3.48Å; I527-K531 PolarHBondContact O-N 3.49Å; H528-K531 WeakPolarHBondContact O-CB 3.32Å; H528-K531 PolarHBondContact O-N 3.05Å; H528-K531 VanDerWaalsContact O-N 3.14Å; K531-N535 VanDerWaalsContact O-CB 3.28Å; K531-N535 WeakPolarHBondContact O-CB 3.1Å; K531-N535 PolarHBondContact O-N 3.35Å; K531-N535 PolarHBondContact O-ND2 2.98Å; K531-L577 HydrophobicContact CD-CD1 4.32Å; K531-L577 HydrophobicContact CG-CD1 3.53Å; K531-L577 HydrophobicContact CG-CD2 3.86Å; K531-L577 HydrophobicContact CG-CG 4.34Å
532	E	93.9	Very high	95	Very high	103 Å²	103	35.3 Å²	35.3	48%	0.481	18%	0.176	S	C	.	.	H	α-helix	trans	-64	-41.9	176.1	-68.3	-175.5	137.9	0	0	112.7	H528 E530 N535 A536	H528-E532 IonicContact CE1-OE1 2.66Å; H528-E532 PolarHBondContact CE1-OE1 3.22Å; H528-E532 PolarHBondContact O-N 2.98Å; H528-E532 VanDerWaalsContact O-N 3.11Å; E530-E532 VanDerWaalsContact C-N 3.26Å; E530-E532 PolarHBondContact O-N 3.34Å; E532-N535 PolarHBondContact O-N 3.06Å; E532-A536 PolarHBondContact O-N 3.37Å
533	Y	96.3	Very high	95	Very high	4 Å²	4	37.2 Å²	37.2	2%	0.016	18%	0.184	C	C	.	.	H	α-helix	trans	-71.2	-43.9	179	179.9	-125.7	0	0	0	112.7	V529 E530 N535 A536 L537 H573 Y606 Q653 P654 R657	V529-Y533 PolarHBondContact O-N 2.79Å; E530-Y533 PolarHBondContact O-N 3.08Å; E530-Y533 VanDerWaalsContact O-N 3.12Å; Y533-N535 VanDerWaalsContact C-N 3.27Å; Y533-N535 PolarHBondContact O-N 3.21Å; Y533-A536 PolarHBondContact O-N 2.83Å; Y533-A536 VanDerWaalsContact O-N 3.08Å; Y533-L537 HydrophobicContact CD1-CD1 4.11Å; Y533-L537 HydrophobicContact CD2-CD1 4.45Å; Y533-L537 HydrophobicContact CD2-CG 4.3Å; Y533-L537 HydrophobicContact CE1-CD1 3.69Å; Y533-L537 HydrophobicContact CE1-CG 4.49Å; Y533-L537 HydrophobicContact CE2-CD1 4.05Å; Y533-L537 HydrophobicContact CE2-CD2 4.17Å; Y533-L537 HydrophobicContact CE2-CG 3.98Å; Y533-L537 HydrophobicContact CG-CD1 4.48Å; Y533-L537 PolarHBondContact O-N 3.31Å; Y533-H573 HydrophobicContact CD1-CB 4.43Å; Y533-H573 AromaticContact CD1-CG 3.98Å; Y533-H573 AromaticContact CD1-ND1 3.79Å; Y533-H573 HydrophobicContact CE1-CB 4.38Å; Y533-H573 AromaticContact CE1-CD2 3.77Å; Y533-H573 AromaticContact CE1-CE1 3.78Å; Y533-H573 AromaticContact CE1-CG 3.63Å; Y533-H573 AromaticContact CE1-ND1 3.63Å; Y533-H573 AromaticContact CE1-NE2 3.86Å; Y533-Y606 WeakPolarHBondContact CE1-OH 3.42Å; Y533-Y606 PolarHBondContact OH-OH 3.02Å; Y533-Q653 HydrophobicContact CD2-CB 4.26Å; Y533-Q653 HydrophobicContact CE2-CB 4.1Å; Y533-P654 HydrophobicContact CE2-CG 4.27Å; Y533-P654 WeakPolarHBondContact OH-CA 3.42Å; Y533-P654 WeakPolarHBondContact OH-CB 3.32Å; Y533-R657 HydrophobicContact CD1-CG 3.88Å; Y533-R657 HydrophobicContact CD2-CG 4.42Å; Y533-R657 HydrophobicContact CE1-CB 4.33Å; Y533-R657 HydrophobicContact CE1-CG 3.6Å; Y533-R657 HydrophobicContact CE2-CB 4.2Å; Y533-R657 HydrophobicContact CE2-CG 4.2Å; Y533-R657 HydrophobicContact CG-CG 4.27Å
534	V	96.9	Very high	95	Very high	8 Å²	8	37.3 Å²	37.3	5%	0.048	18%	0.184	C	C	.	.	H	α-helix	trans	-58.6	-40.9	172.2	172.7	0	0	0	0	110.8	E530 A536 T538 L570 H573 M574 L577	E530-V534 HydrophobicContact CG-CG2 4.47Å; E530-V534 PolarHBondContact O-N 2.99Å; V534-A536 PolarHBondContact O-N 3.23Å; V534-T538 VanDerWaalsContact O-CB 3.23Å; V534-T538 WeakPolarHBondContact O-CB 3.46Å; V534-T538 PolarHBondContact O-N 2.93Å; V534-T538 PolarHBondContact O-OG1 3.1Å; V534-L570 HydrophobicContact CG1-CD1 4.24Å; V534-H573 HydrophobicContact CG2-CB 3.91Å; V534-H573 WeakPolarHBondContact CG2-O 3.35Å; V534-M574 HydrophobicContact CG1-CE 4.31Å; V534-M574 HydrophobicContact CG1-CG 3.71Å; V534-L577 HydrophobicContact CB-CD2 4.16Å; V534-L577 HydrophobicContact CG1-CD2 4.19Å; V534-L577 HydrophobicContact CG2-CB 4.19Å; V534-L577 HydrophobicContact CG2-CD2 4.03Å
535	N	94.6	Very high	95.1	Very high	91 Å²	91	33.3 Å²	33.3	49%	0.487	17%	0.167	S	C	.	.	H	α-helix	trans	-64.2	-37.3	174.4	-76.4	-34.8	0	0	0	112.8	K531 E532 Y533 T539	K531-N535 VanDerWaalsContact O-CB 3.28Å; K531-N535 WeakPolarHBondContact O-CB 3.1Å; K531-N535 PolarHBondContact O-N 3.35Å; K531-N535 PolarHBondContact O-ND2 2.98Å; E532-N535 PolarHBondContact O-N 3.06Å; Y533-N535 VanDerWaalsContact C-N 3.27Å; Y533-N535 PolarHBondContact O-N 3.21Å; N535-T539 WeakPolarHBondContact O-CB 3.25Å; N535-T539 PolarHBondContact O-N 2.91Å; N535-T539 PolarHBondContact O-OG1 2.97Å
536	A	94.6	Very high	95.1	Very high	4 Å²	4	34.3 Å²	34.3	3%	0.033	17%	0.173	C	C	.	.	H	α-helix	trans	-69.7	-44.6	177.2	0	0	0	0	0	112.5	E532 Y533 V534 T539 L540 L650	E532-A536 PolarHBondContact O-N 3.37Å; Y533-A536 PolarHBondContact O-N 2.83Å; Y533-A536 VanDerWaalsContact O-N 3.08Å; V534-A536 PolarHBondContact O-N 3.23Å; A536-T539 WeakPolarHBondContact O-CA 3.5Å; A536-T539 WeakPolarHBondContact O-CB 3.49Å; A536-T539 PolarHBondContact O-N 3.24Å; A536-T539 VanDerWaalsContact O-N 3.11Å; A536-L540 PolarHBondContact O-N 3.42Å; A536-L650 HydrophobicContact CB-CD2 4.06Å
537	L	96.5	Very high	95.1	Very high	2 Å²	2	34.8 Å²	34.8	1%	0.01	18%	0.177	C	C	.	.	H	α-helix	trans	-61.2	-43	171.9	-68.7	175.4	0	0	0	111.4	Y533 T539 L540 V541 V566 L569 L570 H573 P654	Y533-L537 HydrophobicContact CD1-CD1 4.11Å; Y533-L537 HydrophobicContact CD2-CD1 4.45Å; Y533-L537 HydrophobicContact CD2-CG 4.3Å; Y533-L537 HydrophobicContact CE1-CD1 3.69Å; Y533-L537 HydrophobicContact CE1-CG 4.49Å; Y533-L537 HydrophobicContact CE2-CD1 4.05Å; Y533-L537 HydrophobicContact CE2-CD2 4.17Å; Y533-L537 HydrophobicContact CE2-CG 3.98Å; Y533-L537 HydrophobicContact CG-CD1 4.48Å; Y533-L537 PolarHBondContact O-N 3.31Å; L537-T539 PolarHBondContact O-N 2.92Å; L537-L540 HydrophobicContact CD2-CD1 4.36Å; L537-L540 PolarHBondContact O-N 2.87Å; L537-V541 PolarHBondContact O-N 3.48Å; L537-V566 HydrophobicContact CD2-CG1 4.19Å; L537-L569 HydrophobicContact CD1-CB 4.31Å; L537-L569 HydrophobicContact CD2-CB 4.47Å; L537-L570 HydrophobicContact CB-CB 4.11Å; L537-L570 HydrophobicContact CB-CD1 3.74Å; L537-L570 HydrophobicContact CB-CG 4.44Å; L537-H573 HydrophobicContact CD1-CB 4.25Å; L537-P654 HydrophobicContact CD2-CG 4.31Å
538	T	95.5	Very high	95.1	Very high	32 Å²	32	34 Å²	34	20%	0.196	17%	0.173	C	C	.	.	H	α-helix	trans	-59.6	-36.2	173.2	-59	0	0	0	0	111.5	V534 N542 L570	V534-T538 VanDerWaalsContact O-CB 3.23Å; V534-T538 WeakPolarHBondContact O-CB 3.46Å; V534-T538 PolarHBondContact O-N 2.93Å; V534-T538 PolarHBondContact O-OG1 3.1Å; T538-N542 WeakPolarHBondContact CG2-ND2 3.45Å; T538-N542 WeakPolarHBondContact O-CB 3.38Å; T538-N542 PolarHBondContact O-N 2.94Å; T538-N542 PolarHBondContact O-ND2 3.49Å; T538-L570 WeakPolarHBondContact OG1-CD1 3.09Å
539	T	94.1	Very high	94.9	Very high	21 Å²	21	31.7 Å²	31.7	13%	0.129	16%	0.161	C	C	.	.	H	α-helix	trans	-69.3	-44.5	176.8	-60.8	0	0	0	0	111.3	N535 A536 L537 V541 M543 Y544 L650	N535-T539 WeakPolarHBondContact O-CB 3.25Å; N535-T539 PolarHBondContact O-N 2.91Å; N535-T539 PolarHBondContact O-OG1 2.97Å; A536-T539 WeakPolarHBondContact O-CA 3.5Å; A536-T539 WeakPolarHBondContact O-CB 3.49Å; A536-T539 PolarHBondContact O-N 3.24Å; A536-T539 VanDerWaalsContact O-N 3.11Å; L537-T539 PolarHBondContact O-N 2.92Å; T539-V541 PolarHBondContact O-N 3.43Å; T539-M543 HydrophobicContact CG2-CB 4.3Å; T539-M543 HydrophobicContact CG2-CG 4.3Å; T539-M543 HydrophobicContact CG2-SD 3.91Å; T539-M543 VanDerWaalsContact O-CB 3.31Å; T539-M543 WeakPolarHBondContact O-CB 3.18Å; T539-M543 PolarHBondContact O-N 2.71Å; T539-Y544 HydrophobicContact CG2-CE2 4.15Å; T539-L650 HydrophobicContact CG2-CD1 3.91Å
540	L	95.1	Very high	94.8	Very high	1 Å²	1	37.9 Å²	37.9	1%	0.005	19%	0.189	C	C	.	.	I	π-helix	trans	-56.2	-49.4	173.9	-73.6	170	0	0	0	111.3	A536 L537 Y544 M545 F563 V566 L647 L650 L651	A536-L540 PolarHBondContact O-N 3.42Å; L537-L540 HydrophobicContact CD2-CD1 4.36Å; L537-L540 PolarHBondContact O-N 2.87Å; L540-Y544 WeakPolarHBondContact O-CB 3.42Å; L540-Y544 PolarHBondContact O-N 3.16Å; L540-M545 PolarHBondContact O-N 2.85Å; L540-F563 HydrophobicContact CB-CD1 4.42Å; L540-F563 HydrophobicContact CB-CE1 4.39Å; L540-F563 HydrophobicContact CD2-CD1 4.43Å; L540-F563 HydrophobicContact CD2-CE1 3.93Å; L540-V566 HydrophobicContact CB-CG1 3.83Å; L540-V566 HydrophobicContact CD1-CG1 3.89Å; L540-L647 HydrophobicContact CD2-CD1 3.6Å; L540-L650 HydrophobicContact CD1-CB 4.36Å; L540-L650 HydrophobicContact CD2-CB 3.58Å; L540-L650 HydrophobicContact CD2-CD1 4.4Å; L540-L650 HydrophobicContact CG-CB 3.93Å; L540-L651 HydrophobicContact CD1-CD2 4.32Å; L540-L651 HydrophobicContact CD2-CD2 3.82Å; L540-L651 HydrophobicContact CD2-CG 3.9Å
541	V	95.9	Very high	94.5	Very high	3 Å²	3	42.2 Å²	42.2	2%	0.018	21%	0.209	C	C	.	.	I	π-helix	trans	-64.5	-58.6	179.8	169.2	0	0	0	0	111.9	L537 T539 M545 I546 V566 Q567 L570	L537-V541 PolarHBondContact O-N 3.48Å; T539-V541 PolarHBondContact O-N 3.43Å; V541-M545 HydrophobicContact CG1-CE 4.09Å; V541-M545 HydrophobicContact CG2-CE 4.24Å; V541-M545 PolarHBondContact O-N 3.46Å; V541-I546 HydrophobicContact CG1-CD1 3.68Å; V541-I546 HydrophobicContact CG1-CG1 4.27Å; V541-I546 PolarHBondContact O-N 3.08Å; V541-V566 HydrophobicContact CG2-CG1 4.15Å; V541-Q567 VanDerWaalsContact CG1-OE1 3.23Å; V541-L570 HydrophobicContact CB-CD2 4.04Å; V541-L570 HydrophobicContact CG1-CD2 4.36Å; V541-L570 HydrophobicContact CG2-CD2 3.75Å
542	N	94	Very high	94.3	Very high	92 Å²	92	45.9 Å²	45.9	49%	0.492	23%	0.225	S	C	.	.	I	π-helix	trans	-85.7	-26.7	-166.7	-69.4	-40.7	0	0	0	114.6	T538 P547	T538-N542 WeakPolarHBondContact CG2-ND2 3.45Å; T538-N542 WeakPolarHBondContact O-CB 3.38Å; T538-N542 PolarHBondContact O-N 2.94Å; T538-N542 PolarHBondContact O-ND2 3.49Å; N542-P547 WeakPolarHBondContact O-CD 3.48Å; N542-P547 WeakPolarHBondContact O-CG 3.01Å
543	M	92.8	Very high	94.2	Very high	49 Å²	49	42.3 Å²	42.3	24%	0.241	21%	0.209	C	C	.	.	I	π-helix	trans	-96.5	-25.9	178.7	-64.7	-170.4	62.3	0	0	113.6	T539 K637 M640 N641	T539-M543 HydrophobicContact CG2-CB 4.3Å; T539-M543 HydrophobicContact CG2-CG 4.3Å; T539-M543 HydrophobicContact CG2-SD 3.91Å; T539-M543 VanDerWaalsContact O-CB 3.31Å; T539-M543 WeakPolarHBondContact O-CB 3.18Å; T539-M543 PolarHBondContact O-N 2.71Å; M543-K637 HydrophobicContact CE-CB 4.41Å; M543-K637 WeakPolarHBondContact CE-O 3.35Å; M543-K637 WeakPolarHBondContact O-CD 2.99Å; M543-K637 WeakPolarHBondContact O-CE 3.23Å; M543-K637 WeakPolarHBondContact O-CG 3.11Å; M543-M640 HydrophobicContact CE-CB 3.87Å; M543-N641 HydrophobicContact CE-CB 4.4Å
544	Y	94.3	Very high	94	Very high	1 Å²	1	42.4 Å²	42.4	0%	0.004	21%	0.21	C	C	.	.	I	π-helix	trans	-116.5	-65.7	-177.1	-60.2	-90.8	0	0	0	112.9	T539 L540 P547 L548 F633 K637 L647 L650	T539-Y544 HydrophobicContact CG2-CE2 4.15Å; L540-Y544 WeakPolarHBondContact O-CB 3.42Å; L540-Y544 PolarHBondContact O-N 3.16Å; Y544-P547 WeakPolarHBondContact O-CD 3.14Å; Y544-L548 VanDerWaalsContact O-CB 3.28Å; Y544-L548 WeakPolarHBondContact O-CB 3.17Å; Y544-L548 WeakPolarHBondContact O-CD1 3.34Å; Y544-L548 WeakPolarHBondContact O-CG 3.41Å; Y544-L548 PolarHBondContact O-N 3.34Å; Y544-F633 AromaticContact CD1-CE1 3.98Å; Y544-F633 HydrophobicContact CD1-CE1 3.98Å; Y544-K637 HydrophobicContact CD1-CB 4.28Å; Y544-K637 HydrophobicContact CD1-CG 4.48Å; Y544-K637 HydrophobicContact CE1-CB 3.72Å; Y544-K637 HydrophobicContact CE1-CG 4.37Å; Y544-L647 HydrophobicContact CD1-CB 4.41Å; Y544-L647 HydrophobicContact CD1-CD1 4.02Å; Y544-L647 HydrophobicContact CD1-CD2 4.01Å; Y544-L647 HydrophobicContact CD1-CG 4.38Å; Y544-L647 HydrophobicContact CD2-CD1 4.21Å; Y544-L647 HydrophobicContact CE1-CB 4.06Å; Y544-L647 HydrophobicContact CE1-CD1 4.39Å; Y544-L647 HydrophobicContact CE1-CD2 4.42Å; Y544-L647 HydrophobicContact CG-CD1 3.93Å; Y544-L650 HydrophobicContact CE2-CD1 3.81Å
545	M	94.6	Very high	93.7	Very high	26 Å²	26	45.9 Å²	45.9	13%	0.128	23%	0.228	C	C	.	.	I	π-helix	trans	-58.3	-56.2	-170.5	-171.9	-173.1	77.5	0	0	113.2	L540 V541 L548 K549 V559 F563 Q567	L540-M545 PolarHBondContact O-N 2.85Å; V541-M545 HydrophobicContact CG1-CE 4.09Å; V541-M545 HydrophobicContact CG2-CE 4.24Å; V541-M545 PolarHBondContact O-N 3.46Å; M545-L548 PolarHBondContact O-N 3.18Å; M545-K549 PolarHBondContact O-N 2.89Å; M545-V559 HydrophobicContact CG-CG1 3.93Å; M545-F563 HydrophobicContact CB-CB 4.22Å; M545-F563 HydrophobicContact CB-CD1 3.89Å; M545-F563 HydrophobicContact CB-CD2 4.1Å; M545-F563 HydrophobicContact CB-CE1 4.28Å; M545-F563 HydrophobicContact CB-CE2 4.49Å; M545-F563 HydrophobicContact CB-CG 3.8Å; M545-F563 HydrophobicContact CG-CB 3.75Å; M545-F563 HydrophobicContact CG-CD1 4.37Å; M545-F563 HydrophobicContact CG-CD2 4.07Å; M545-F563 HydrophobicContact CG-CG 3.81Å; M545-F563 HydrophobicContact SD-CB 3.71Å; M545-F563 HydrophobicContact SD-CG 4.35Å; M545-Q567 HydrophobicContact CE-CB 4.42Å
546	I	94.5	Very high	93.6	Very high	59 Å²	59	44.3 Å²	44.3	30%	0.303	22%	0.22	S	C	.	.	H	α-helix	trans	-63.9	-48.5	-178.4	-67.7	171.3	0	0	0	111	V541 L548 K549 Q550	V541-I546 HydrophobicContact CG1-CD1 3.68Å; V541-I546 HydrophobicContact CG1-CG1 4.27Å; V541-I546 PolarHBondContact O-N 3.08Å; I546-L548 VanDerWaalsContact C-N 3.35Å; I546-L548 PolarHBondContact O-N 2.78Å; I546-K549 PolarHBondContact O-N 2.85Å; I546-Q550 HydrophobicContact CG2-CG 4.32Å; I546-Q550 WeakPolarHBondContact O-CG 3.43Å; I546-Q550 PolarHBondContact O-N 2.87Å
547	P	94.5	Very high	93.5	Very high	14 Å²	14	51 Å²	51	9%	0.091	25%	0.25	C	S	.	.	H	α-helix	trans	-65.2	-30.1	176.8	-24	35.9	0	0	0	114.4	N542 Y544 K549 Q550 E551 F633	N542-P547 WeakPolarHBondContact O-CD 3.48Å; N542-P547 WeakPolarHBondContact O-CG 3.01Å; Y544-P547 WeakPolarHBondContact O-CD 3.14Å; P547-K549 PolarHBondContact O-N 2.85Å; P547-Q550 PolarHBondContact O-N 3.28Å; P547-E551 WeakPolarHBondContact CB-OE1 3.21Å; P547-E551 WeakPolarHBondContact O-CB 3.25Å; P547-E551 VanDerWaalsContact O-CG 3.27Å; P547-E551 WeakPolarHBondContact O-CG 2.92Å; P547-E551 PolarHBondContact O-N 2.9Å; P547-F633 HydrophobicContact CB-CE2 3.98Å; P547-F633 HydrophobicContact CB-CZ 3.99Å
548	L	95	Very high	93.3	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-64.2	-40.2	176.6	-78.6	166.6	0	0	0	112.5	Y544 M545 I546 K552 I553 L554 V559 F563 F630 F633	Y544-L548 VanDerWaalsContact O-CB 3.28Å; Y544-L548 WeakPolarHBondContact O-CB 3.17Å; Y544-L548 WeakPolarHBondContact O-CD1 3.34Å; Y544-L548 WeakPolarHBondContact O-CG 3.41Å; Y544-L548 PolarHBondContact O-N 3.34Å; M545-L548 PolarHBondContact O-N 3.18Å; I546-L548 VanDerWaalsContact C-N 3.35Å; I546-L548 PolarHBondContact O-N 2.78Å; L548-K552 WeakPolarHBondContact O-CA 3.28Å; L548-K552 PolarHBondContact O-N 2.85Å; L548-K552 VanDerWaalsContact O-N 3.11Å; L548-I553 HydrophobicContact CD2-CB 4.11Å; L548-I553 HydrophobicContact CD2-CG2 4.17Å; L548-I553 PolarHBondContact O-N 2.89Å; L548-L554 HydrophobicContact CD2-CG 4.31Å; L548-V559 HydrophobicContact CB-CG1 4.36Å; L548-V559 HydrophobicContact CB-CG2 3.86Å; L548-F563 HydrophobicContact CD1-CE2 3.59Å; L548-F563 HydrophobicContact CD1-CZ 3.93Å; L548-F630 HydrophobicContact CD1-CE2 3.97Å; L548-F630 HydrophobicContact CD2-CD2 3.77Å; L548-F630 HydrophobicContact CD2-CE2 3.84Å; L548-F633 HydrophobicContact CD1-CE1 4.09Å; L548-F633 HydrophobicContact CD1-CZ 4.5Å; L548-F633 HydrophobicContact CD2-CD1 3.66Å; L548-F633 HydrophobicContact CD2-CD2 4.42Å; L548-F633 HydrophobicContact CD2-CE1 3.42Å; L548-F633 VanDerWaalsContact CD2-CE1 3.42Å; L548-F633 HydrophobicContact CD2-CE2 4.15Å; L548-F633 HydrophobicContact CD2-CG 4.17Å; L548-F633 HydrophobicContact CD2-CZ 3.68Å; L548-F633 HydrophobicContact CG-CD1 4.26Å; L548-F633 HydrophobicContact CG-CE1 3.5Å; L548-F633 HydrophobicContact CG-CE2 4.35Å; L548-F633 HydrophobicContact CG-CZ 3.55Å
549	K	92.1	Very high	93.3	Very high	62 Å²	62	51.9 Å²	51.9	27%	0.27	25%	0.252	S	S	.	.	H	α-helix	trans	-70.3	-41.7	173.4	-64.5	-158.4	168.9	-164.8	0	112.2	M545 I546 P547 K552 D556 V559 D560	M545-K549 PolarHBondContact O-N 2.89Å; I546-K549 PolarHBondContact O-N 2.85Å; P547-K549 PolarHBondContact O-N 2.85Å; K549-K552 VanDerWaalsContact O-CG 3.22Å; K549-K552 WeakPolarHBondContact O-CG 3.41Å; K549-K552 PolarHBondContact O-N 3.48Å; K549-D556 WeakPolarHBondContact CB-OD1 3.49Å; K549-D556 VanDerWaalsContact CD-OD1 3.25Å; K549-D556 WeakPolarHBondContact CD-OD1 3.29Å; K549-D556 VanDerWaalsContact CG-OD1 3.24Å; K549-D556 WeakPolarHBondContact CG-OD1 3.38Å; K549-V559 HydrophobicContact CG-CB 4.06Å; K549-V559 HydrophobicContact CG-CG1 3.9Å; K549-V559 HydrophobicContact CG-CG2 4.1Å; K549-D560 VanDerWaalsContact CE-OD1 3.23Å; K549-D560 WeakPolarHBondContact CE-OD1 3.28Å; K549-D560 IonicContact NZ-OD1 3.56Å; K549-D560 PolarHBondContact NZ-OD1 2.86Å; K549-D560 IonicContact NZ-OD2 2.71Å; K549-D560 PolarHBondContact NZ-OD2 2.61Å
550	Q	92.2	Very high	93.3	Very high	145 Å²	145	54.4 Å²	54.4	68%	0.678	27%	0.265	S	S	*	.	H	α-helix	trans	-68.6	-43	180	-71.5	176.3	-10.7	0	0	113	I546 P547 K552	I546-Q550 HydrophobicContact CG2-CG 4.32Å; I546-Q550 WeakPolarHBondContact O-CG 3.43Å; I546-Q550 PolarHBondContact O-N 2.87Å; P547-Q550 PolarHBondContact O-N 3.28Å; Q550-K552 VanDerWaalsContact C-N 3.3Å
551	E	91.9	Very high	93.3	Very high	92 Å²	92	57.4 Å²	57.4	43%	0.43	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.4	-7.9	178.8	-60.3	176.3	-138.9	0	0	112.2	P547 I553 F633 K637	P547-E551 WeakPolarHBondContact CB-OE1 3.21Å; P547-E551 WeakPolarHBondContact O-CB 3.25Å; P547-E551 VanDerWaalsContact O-CG 3.27Å; P547-E551 WeakPolarHBondContact O-CG 2.92Å; P547-E551 PolarHBondContact O-N 2.9Å; E551-I553 VanDerWaalsContact C-N 3.27Å; E551-I553 HydrophobicContact CB-CD1 3.62Å; E551-I553 HydrophobicContact CB-CG1 3.96Å; E551-I553 HydrophobicContact CG-CD1 4.5Å; E551-I553 PolarHBondContact O-N 3.27Å; E551-I553 WeakPolarHBondContact OE2-CD1 3.3Å; E551-F633 WeakPolarHBondContact OE1-CE2 3.22Å; E551-F633 WeakPolarHBondContact OE2-CD2 3.5Å; E551-K637 IonicContact OE1-NZ 2.68Å; E551-K637 PolarHBondContact OE1-NZ 3.39Å
552	K	90.6	Very high	93.3	Very high	155 Å²	155	57.3 Å²	57.3	67%	0.674	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.4	40.4	179.4	-63.6	-163.7	175.3	-127.3	0	114.9	L548 K549 Q550 L554	L548-K552 WeakPolarHBondContact O-CA 3.28Å; L548-K552 PolarHBondContact O-N 2.85Å; L548-K552 VanDerWaalsContact O-N 3.11Å; K549-K552 VanDerWaalsContact O-CG 3.22Å; K549-K552 WeakPolarHBondContact O-CG 3.41Å; K549-K552 PolarHBondContact O-N 3.48Å; Q550-K552 VanDerWaalsContact C-N 3.3Å; K552-L554 CarbonylContact C-O 3.38Å
553	I	91.7	Very high	93.4	Very high	27 Å²	27	53.2 Å²	53.2	14%	0.138	26%	0.258	C	S	.	.	S	Bend	trans	-78	-36.8	-179	-69.7	162.9	0	0	0	111	L548 E551 F630 F633	L548-I553 HydrophobicContact CD2-CB 4.11Å; L548-I553 HydrophobicContact CD2-CG2 4.17Å; L548-I553 PolarHBondContact O-N 2.89Å; E551-I553 VanDerWaalsContact C-N 3.27Å; E551-I553 HydrophobicContact CB-CD1 3.62Å; E551-I553 HydrophobicContact CB-CG1 3.96Å; E551-I553 HydrophobicContact CG-CD1 4.5Å; E551-I553 PolarHBondContact O-N 3.27Å; E551-I553 WeakPolarHBondContact OE2-CD1 3.3Å; I553-F630 HydrophobicContact CG2-CB 3.95Å; I553-F630 HydrophobicContact CG2-CD2 4.29Å; I553-F633 HydrophobicContact CD1-CB 3.85Å; I553-F633 HydrophobicContact CD1-CD2 3.21Å; I553-F633 HydrophobicContact CD1-CE2 3.87Å; I553-F633 HydrophobicContact CD1-CG 3.75Å
554	L	92.5	Very high	93.5	Very high	7 Å²	7	54.9 Å²	54.9	4%	0.037	26%	0.264	C	S	.	.	S	Bend	trans	-107.5	163.8	166.2	-61.3	-171	0	0	0	109.3	L548 K552 Q558 V559 I562 C623 K627 F630	L548-L554 HydrophobicContact CD2-CG 4.31Å; K552-L554 CarbonylContact C-O 3.38Å; L554-Q558 HydrophobicContact CB-CB 4.15Å; L554-Q558 HydrophobicContact CD1-CB 4.44Å; L554-V559 HydrophobicContact CB-CG2 3.8Å; L554-V559 HydrophobicContact CD1-CG2 4.43Å; L554-I562 HydrophobicContact CD1-CD1 3.73Å; L554-C623 HydrophobicContact CD1-CB 4.38Å; L554-C623 HydrophobicContact CD2-CB 3.88Å; L554-K627 HydrophobicContact CD2-CD 3.52Å; L554-F630 HydrophobicContact CD1-CD2 3.85Å; L554-F630 HydrophobicContact CD1-CE2 3.66Å; L554-F630 HydrophobicContact CD1-CZ 4.22Å; L554-F630 HydrophobicContact CD2-CB 4.08Å; L554-F630 HydrophobicContact CD2-CD2 3.87Å; L554-F630 HydrophobicContact CD2-CE2 4.5Å; L554-F630 HydrophobicContact CD2-CG 3.97Å; L554-F630 HydrophobicContact CG-CD2 3.82Å; L554-F630 HydrophobicContact CG-CE2 4.15Å; L554-F630 HydrophobicContact CG-CG 4.43Å
555	D	90.6	Very high	93.6	Very high	81 Å²	81	57.5 Å²	57.5	43%	0.433	28%	0.275	S	S	.	.			trans	-72.9	151.4	165.3	176.9	67.7	0	0	0	109.9	Q557 Q558 V559	D555-Q557 PolarHBondContact O-N 3.03Å; D555-Q557 VanDerWaalsContact OD2-CB 3.31Å; D555-Q557 WeakPolarHBondContact OD2-CB 3.34Å; D555-Q557 WeakPolarHBondContact OD2-CG 3.16Å; D555-Q557 PolarHBondContact OD2-N 3.03Å; D555-Q558 HydrophobicContact CB-CG 4.18Å; D555-Q558 WeakPolarHBondContact O-CA 3.48Å; D555-Q558 WeakPolarHBondContact O-CB 3.3Å; D555-Q558 PolarHBondContact O-N 2.71Å; D555-V559 PolarHBondContact O-N 3.45Å; D555-V559 VanDerWaalsContact O-N 3.09Å
556	D	92.3	Very high	93.7	Very high	58 Å²	58	56.3 Å²	56.3	31%	0.31	27%	0.269	S	S	.	.	H	α-helix	trans	-57.8	-37.2	-176.2	-75.1	-50.8	0	0	0	111.8	K549 Q558 V559 D560	K549-D556 WeakPolarHBondContact CB-OD1 3.49Å; K549-D556 VanDerWaalsContact CD-OD1 3.25Å; K549-D556 WeakPolarHBondContact CD-OD1 3.29Å; K549-D556 VanDerWaalsContact CG-OD1 3.24Å; K549-D556 WeakPolarHBondContact CG-OD1 3.38Å; D556-Q558 VanDerWaalsContact C-N 3.34Å; D556-Q558 PolarHBondContact O-N 3.47Å; D556-V559 PolarHBondContact O-N 3.36Å; D556-D560 PolarHBondContact O-N 2.95Å
557	Q	92.1	Very high	93.7	Very high	144 Å²	144	56.6 Å²	56.6	67%	0.673	27%	0.269	S	S	*	.	H	α-helix	trans	-64.2	-37.8	175.3	-57.9	-178	4.2	0	0	112.1	D555 V559 D560 I561	D555-Q557 PolarHBondContact O-N 3.03Å; D555-Q557 VanDerWaalsContact OD2-CB 3.31Å; D555-Q557 WeakPolarHBondContact OD2-CB 3.34Å; D555-Q557 WeakPolarHBondContact OD2-CG 3.16Å; D555-Q557 PolarHBondContact OD2-N 3.03Å; Q557-V559 VanDerWaalsContact C-N 3.32Å; Q557-D560 PolarHBondContact O-N 2.87Å; Q557-I561 WeakPolarHBondContact O-CD1 3.4Å; Q557-I561 VanDerWaalsContact O-CG1 3.28Å; Q557-I561 WeakPolarHBondContact O-CG1 3.45Å; Q557-I561 PolarHBondContact O-N 2.84Å
558	Q	93.4	Very high	93.8	Very high	52 Å²	52	59 Å²	59	24%	0.243	28%	0.279	C	S	.	.	H	α-helix	trans	-67.9	-34.2	177.1	-62.3	-173.6	-51.2	0	0	111.5	L554 D555 D556 I562 T619	L554-Q558 HydrophobicContact CB-CB 4.15Å; L554-Q558 HydrophobicContact CD1-CB 4.44Å; D555-Q558 HydrophobicContact CB-CG 4.18Å; D555-Q558 WeakPolarHBondContact O-CA 3.48Å; D555-Q558 WeakPolarHBondContact O-CB 3.3Å; D555-Q558 PolarHBondContact O-N 2.71Å; D556-Q558 VanDerWaalsContact C-N 3.34Å; D556-Q558 PolarHBondContact O-N 3.47Å; Q558-I562 WeakPolarHBondContact O-CD1 3.36Å; Q558-I562 VanDerWaalsContact O-CG1 3.23Å; Q558-I562 WeakPolarHBondContact O-CG1 3.44Å; Q558-I562 PolarHBondContact O-N 3.27Å; Q558-T619 HydrophobicContact CB-CG2 4.36Å
559	V	95.4	Very high	93.9	Very high	0 Å²	0	59 Å²	59	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-69.1	-44.9	173.4	-174.2	0	0	0	0	110.3	M545 L548 K549 L554 D555 D556 Q557 I561 I562 F563	M545-V559 HydrophobicContact CG-CG1 3.93Å; L548-V559 HydrophobicContact CB-CG1 4.36Å; L548-V559 HydrophobicContact CB-CG2 3.86Å; K549-V559 HydrophobicContact CG-CB 4.06Å; K549-V559 HydrophobicContact CG-CG1 3.9Å; K549-V559 HydrophobicContact CG-CG2 4.1Å; L554-V559 HydrophobicContact CB-CG2 3.8Å; L554-V559 HydrophobicContact CD1-CG2 4.43Å; D555-V559 PolarHBondContact O-N 3.45Å; D555-V559 VanDerWaalsContact O-N 3.09Å; D556-V559 PolarHBondContact O-N 3.36Å; Q557-V559 VanDerWaalsContact C-N 3.32Å; V559-I561 VanDerWaalsContact C-N 3.33Å; V559-I561 PolarHBondContact O-N 2.77Å; V559-I562 PolarHBondContact O-N 2.82Å; V559-I562 VanDerWaalsContact O-N 3.12Å; V559-F563 HydrophobicContact CG1-CD2 3.67Å; V559-F563 HydrophobicContact CG1-CE2 4.16Å; V559-F563 WeakPolarHBondContact O-CD2 3.48Å; V559-F563 PolarHBondContact O-N 3.33Å
560	D	94.2	Very high	94.2	Very high	75 Å²	75	56.3 Å²	56.3	40%	0.401	27%	0.268	S	S	.	.	H	α-helix	trans	-66	-32.2	-178.7	-70.2	-34	0	0	0	113.3	K549 D556 Q557 F564	K549-D560 VanDerWaalsContact CE-OD1 3.23Å; K549-D560 WeakPolarHBondContact CE-OD1 3.28Å; K549-D560 IonicContact NZ-OD1 3.56Å; K549-D560 PolarHBondContact NZ-OD1 2.86Å; K549-D560 IonicContact NZ-OD2 2.71Å; K549-D560 PolarHBondContact NZ-OD2 2.61Å; D556-D560 PolarHBondContact O-N 2.95Å; Q557-D560 PolarHBondContact O-N 2.87Å; D560-F564 WeakPolarHBondContact O-CA 3.49Å; D560-F564 WeakPolarHBondContact O-CB 3.44Å; D560-F564 PolarHBondContact O-N 3.15Å
561	I	93.8	Very high	94.4	Very high	63 Å²	63	55.3 Å²	55.3	32%	0.323	27%	0.265	S	S	.	.	H	α-helix	trans	-69.4	-38.7	171.4	-66.1	162.6	0	0	0	111.5	Q557 V559 N612 N615 S616 T619	Q557-I561 WeakPolarHBondContact O-CD1 3.4Å; Q557-I561 VanDerWaalsContact O-CG1 3.28Å; Q557-I561 WeakPolarHBondContact O-CG1 3.45Å; Q557-I561 PolarHBondContact O-N 2.84Å; V559-I561 VanDerWaalsContact C-N 3.33Å; V559-I561 PolarHBondContact O-N 2.77Å; I561-N612 PolarHBondContact O-ND2 2.78Å; I561-N615 HydrophobicContact CG2-CB 4.44Å; I561-S616 WeakPolarHBondContact O-CB 3.38Å; I561-T619 HydrophobicContact CG2-CG2 4.29Å; I561-T619 WeakPolarHBondContact CG2-OG1 3.42Å
562	I	95.9	Very high	94.6	Very high	2 Å²	2	54.2 Å²	54.2	1%	0.01	26%	0.257	C	S	.	.	H	α-helix	trans	-72.9	-42	-178.5	-68.5	168.2	0	0	0	111.7	L554 Q558 V559 S616 T619 L620 L651	L554-I562 HydrophobicContact CD1-CD1 3.73Å; Q558-I562 WeakPolarHBondContact O-CD1 3.36Å; Q558-I562 VanDerWaalsContact O-CG1 3.23Å; Q558-I562 WeakPolarHBondContact O-CG1 3.44Å; Q558-I562 PolarHBondContact O-N 3.27Å; V559-I562 PolarHBondContact O-N 2.82Å; V559-I562 VanDerWaalsContact O-N 3.12Å; I562-S616 WeakPolarHBondContact CA-OG 3.37Å; I562-S616 PolarHBondContact O-OG 3.14Å; I562-T619 HydrophobicContact CD1-CG2 4.1Å; I562-T619 HydrophobicContact CG1-CG2 3.92Å; I562-L620 HydrophobicContact CD1-CB 4.43Å; I562-L620 HydrophobicContact CD1-CD1 4.4Å; I562-L620 HydrophobicContact CG1-CB 4.44Å; I562-L620 HydrophobicContact CG2-CD1 4.41Å; I562-L651 HydrophobicContact CG2-CD1 3.94Å
563	F	96.6	Very high	95	Very high	5 Å²	5	46.8 Å²	46.8	2%	0.022	23%	0.225	C	C	.	.	S	Bend	trans	-106.9	18.7	-173.7	-61	-89.2	0	0	0	113.9	L540 M545 L548 V559 K565 V566 L647 L651	L540-F563 HydrophobicContact CB-CD1 4.42Å; L540-F563 HydrophobicContact CB-CE1 4.39Å; L540-F563 HydrophobicContact CD2-CD1 4.43Å; L540-F563 HydrophobicContact CD2-CE1 3.93Å; M545-F563 HydrophobicContact CB-CB 4.22Å; M545-F563 HydrophobicContact CB-CD1 3.89Å; M545-F563 HydrophobicContact CB-CD2 4.1Å; M545-F563 HydrophobicContact CB-CE1 4.28Å; M545-F563 HydrophobicContact CB-CE2 4.49Å; M545-F563 HydrophobicContact CB-CG 3.8Å; M545-F563 HydrophobicContact CG-CB 3.75Å; M545-F563 HydrophobicContact CG-CD1 4.37Å; M545-F563 HydrophobicContact CG-CD2 4.07Å; M545-F563 HydrophobicContact CG-CG 3.81Å; M545-F563 HydrophobicContact SD-CB 3.71Å; M545-F563 HydrophobicContact SD-CG 4.35Å; L548-F563 HydrophobicContact CD1-CE2 3.59Å; L548-F563 HydrophobicContact CD1-CZ 3.93Å; V559-F563 HydrophobicContact CG1-CD2 3.67Å; V559-F563 HydrophobicContact CG1-CE2 4.16Å; V559-F563 WeakPolarHBondContact O-CD2 3.48Å; V559-F563 PolarHBondContact O-N 3.33Å; F563-K565 PolarHBondContact O-N 2.9Å; F563-V566 HydrophobicContact CB-CG2 4.35Å; F563-V566 WeakPolarHBondContact O-CB 3.26Å; F563-V566 WeakPolarHBondContact O-CG2 3.44Å; F563-V566 PolarHBondContact O-N 3.49Å; F563-V566 VanDerWaalsContact O-N 3.13Å; F563-L647 HydrophobicContact CE1-CD1 3.84Å; F563-L647 HydrophobicContact CZ-CD1 3.85Å; F563-L647 HydrophobicContact CZ-CD2 4.19Å; F563-L651 HydrophobicContact CD1-CD2 4.11Å; F563-L651 HydrophobicContact CE1-CD2 4.22Å
564	F	95.6	Very high	95.2	Very high	84 Å²	84	49.4 Å²	49.4	37%	0.368	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-46.4	132.4	177.5	-166.3	-111.3	0	0	0	111.9	D560 V566 T608 F609 N612	D560-F564 WeakPolarHBondContact O-CA 3.49Å; D560-F564 WeakPolarHBondContact O-CB 3.44Å; D560-F564 PolarHBondContact O-N 3.15Å; F564-V566 PolarHBondContact O-N 3.42Å; F564-T608 WeakPolarHBondContact CE1-O 3.47Å; F564-F609 VanDerWaalsContact O-CD2 3.26Å; F564-F609 WeakPolarHBondContact O-CD2 3.47Å; F564-N612 HydrophobicContact CB-CB 4.46Å; F564-N612 WeakPolarHBondContact CB-ND2 3.35Å; F564-N612 HydrophobicContact CD1-CB 3.61Å; F564-N612 HydrophobicContact CE1-CB 4.12Å; F564-N612 HydrophobicContact CG-CB 4.24Å
565	K	95.5	Very high	95.3	Very high	57 Å²	57	51.9 Å²	51.9	25%	0.248	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	60.9	-4.3	-179.4	-63.8	-74.7	153.5	-155.1	0	117.5	F563 Q567 E568 L569 F609	F563-K565 PolarHBondContact O-N 2.9Å; K565-Q567 VanDerWaalsContact C-N 3.28Å; K565-Q567 PolarHBondContact O-N 2.96Å; K565-E568 WeakPolarHBondContact CA-OE2 3.15Å; K565-E568 WeakPolarHBondContact CD-OE1 3.25Å; K565-E568 WeakPolarHBondContact CE-OE1 3.39Å; K565-E568 IonicContact NZ-OE1 3.06Å; K565-E568 PolarHBondContact NZ-OE1 2.94Å; K565-E568 PolarHBondContact O-N 3.45Å; K565-L569 WeakPolarHBondContact O-CG 3.49Å; K565-L569 PolarHBondContact O-N 2.96Å; K565-F609 HydrophobicContact CB-CB 4.09Å; K565-F609 HydrophobicContact CB-CD2 4.27Å
566	V	96.7	Very high	95.6	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-62.8	-34.7	-178.5	177.4	0	0	0	0	112.1	L537 L540 V541 F563 F564 L570 F609	L537-V566 HydrophobicContact CD2-CG1 4.19Å; L540-V566 HydrophobicContact CB-CG1 3.83Å; L540-V566 HydrophobicContact CD1-CG1 3.89Å; V541-V566 HydrophobicContact CG2-CG1 4.15Å; F563-V566 HydrophobicContact CB-CG2 4.35Å; F563-V566 WeakPolarHBondContact O-CB 3.26Å; F563-V566 WeakPolarHBondContact O-CG2 3.44Å; F563-V566 PolarHBondContact O-N 3.49Å; F563-V566 VanDerWaalsContact O-N 3.13Å; F564-V566 PolarHBondContact O-N 3.42Å; V566-L570 WeakPolarHBondContact O-CB 3.38Å; V566-L570 PolarHBondContact O-N 3.22Å; V566-F609 HydrophobicContact CG2-CD2 4.39Å; V566-F609 HydrophobicContact CG2-CE2 3.75Å
567	Q	95.8	Very high	95.8	Very high	65 Å²	65	46.2 Å²	46.2	30%	0.304	23%	0.225	S	C	.	.	H	α-helix	trans	-70.5	-40.8	-179.3	-177.4	57.9	74.9	0	0	112.1	V541 M545 K565 L570 M571	V541-Q567 VanDerWaalsContact CG1-OE1 3.23Å; M545-Q567 HydrophobicContact CE-CB 4.42Å; K565-Q567 VanDerWaalsContact C-N 3.28Å; K565-Q567 PolarHBondContact O-N 2.96Å; Q567-L570 WeakPolarHBondContact O-CB 3.31Å; Q567-L570 PolarHBondContact O-N 2.65Å; Q567-M571 WeakPolarHBondContact O-CG 3.13Å; Q567-M571 PolarHBondContact O-N 2.97Å; Q567-M571 VanDerWaalsContact O-N 3.17Å
568	E	96.4	Very high	95.9	Very high	65 Å²	65	44.3 Å²	44.3	30%	0.304	22%	0.219	S	C	.	.	H	α-helix	trans	-71.5	-41.2	177	-58.1	97.8	118.6	0	0	111.3	K565 L570 M571 Y572	K565-E568 WeakPolarHBondContact CA-OE2 3.15Å; K565-E568 WeakPolarHBondContact CD-OE1 3.25Å; K565-E568 WeakPolarHBondContact CE-OE1 3.39Å; K565-E568 IonicContact NZ-OE1 3.06Å; K565-E568 PolarHBondContact NZ-OE1 2.94Å; K565-E568 PolarHBondContact O-N 3.45Å; E568-L570 VanDerWaalsContact C-N 3.28Å; E568-L570 PolarHBondContact O-N 3.16Å; E568-M571 PolarHBondContact O-N 3.5Å; E568-M571 VanDerWaalsContact O-N 3.12Å; E568-Y572 HydrophobicContact CB-CE2 4.28Å; E568-Y572 WeakPolarHBondContact O-CD2 3.32Å; E568-Y572 PolarHBondContact O-N 3.05Å
569	L	96.8	Very high	95.9	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-55.5	-43.4	170.4	-73.4	173.5	0	0	0	111.4	L537 K565 M571 Y572 H573 Y606 F609 P654	L537-L569 HydrophobicContact CD1-CB 4.31Å; L537-L569 HydrophobicContact CD2-CB 4.47Å; K565-L569 WeakPolarHBondContact O-CG 3.49Å; K565-L569 PolarHBondContact O-N 2.96Å; L569-M571 VanDerWaalsContact C-N 3.34Å; L569-M571 PolarHBondContact O-N 2.99Å; L569-Y572 PolarHBondContact O-N 2.76Å; L569-H573 WeakPolarHBondContact O-CB 3.4Å; L569-H573 PolarHBondContact O-CD2 3.38Å; L569-H573 VanDerWaalsContact O-CD2 3.27Å; L569-H573 PolarHBondContact O-N 2.73Å; L569-Y606 HydrophobicContact CD2-CD1 4.3Å; L569-Y606 HydrophobicContact CD2-CD2 3.74Å; L569-Y606 HydrophobicContact CD2-CE1 4.1Å; L569-Y606 HydrophobicContact CD2-CE2 3.51Å; L569-Y606 HydrophobicContact CD2-CG 4.13Å; L569-F609 HydrophobicContact CD1-CB 4.19Å; L569-F609 HydrophobicContact CD1-CD2 3.75Å; L569-F609 HydrophobicContact CD1-CE2 4.38Å; L569-F609 HydrophobicContact CD1-CG 3.91Å; L569-P654 HydrophobicContact CD1-CB 4.01Å; L569-P654 HydrophobicContact CD1-CG 4.04Å
570	L	97.7	Very high	95.8	Very high	6 Å²	6	43.7 Å²	43.7	3%	0.031	22%	0.219	C	C	.	.	H	α-helix	trans	-60	-42.4	175.7	178.2	58.5	0	0	0	112.2	V534 L537 T538 V541 V566 Q567 E568 H573 M574	V534-L570 HydrophobicContact CG1-CD1 4.24Å; L537-L570 HydrophobicContact CB-CB 4.11Å; L537-L570 HydrophobicContact CB-CD1 3.74Å; L537-L570 HydrophobicContact CB-CG 4.44Å; T538-L570 WeakPolarHBondContact OG1-CD1 3.09Å; V541-L570 HydrophobicContact CB-CD2 4.04Å; V541-L570 HydrophobicContact CG1-CD2 4.36Å; V541-L570 HydrophobicContact CG2-CD2 3.75Å; V566-L570 WeakPolarHBondContact O-CB 3.38Å; V566-L570 PolarHBondContact O-N 3.22Å; Q567-L570 WeakPolarHBondContact O-CB 3.31Å; Q567-L570 PolarHBondContact O-N 2.65Å; E568-L570 VanDerWaalsContact C-N 3.28Å; E568-L570 PolarHBondContact O-N 3.16Å; L570-H573 PolarHBondContact O-N 3.39Å; L570-M574 HydrophobicContact CD1-CE 3.98Å; L570-M574 HydrophobicContact CD1-CG 3.94Å; L570-M574 HydrophobicContact CD1-SD 4.01Å; L570-M574 HydrophobicContact CG-CE 4.43Å; L570-M574 HydrophobicContact CG-CG 4.43Å; L570-M574 HydrophobicContact CG-SD 4.08Å; L570-M574 WeakPolarHBondContact O-CB 3.45Å; L570-M574 WeakPolarHBondContact O-CG 3.45Å; L570-M574 PolarHBondContact O-N 3.36Å
571	M	96.8	Very high	95.6	Very high	124 Å²	124	44.7 Å²	44.7	61%	0.611	22%	0.222	S	C	*	.	H	α-helix	trans	-64.8	-46.9	179.7	-70.5	171.9	64.7	0	0	112.2	Q567 E568 L569 M574 S575	Q567-M571 WeakPolarHBondContact O-CG 3.13Å; Q567-M571 PolarHBondContact O-N 2.97Å; Q567-M571 VanDerWaalsContact O-N 3.17Å; E568-M571 PolarHBondContact O-N 3.5Å; E568-M571 VanDerWaalsContact O-N 3.12Å; L569-M571 VanDerWaalsContact C-N 3.34Å; L569-M571 PolarHBondContact O-N 2.99Å; M571-M574 PolarHBondContact O-N 3.48Å; M571-S575 PolarHBondContact O-N 3.41Å; M571-S575 VanDerWaalsContact O-N 3.11Å
572	Y	97	Very high	95.3	Very high	68 Å²	68	46.7 Å²	46.7	27%	0.267	23%	0.231	S	C	.	.	H	α-helix	trans	-62.5	-44.4	176.9	-64.2	-59	0	0	0	111.7	E568 L569 S575 F576 V602 C605	E568-Y572 HydrophobicContact CB-CE2 4.28Å; E568-Y572 WeakPolarHBondContact O-CD2 3.32Å; E568-Y572 PolarHBondContact O-N 3.05Å; L569-Y572 PolarHBondContact O-N 2.76Å; Y572-S575 WeakPolarHBondContact O-CB 2.95Å; Y572-S575 PolarHBondContact O-N 2.89Å; Y572-F576 WeakPolarHBondContact O-CB 3.37Å; Y572-F576 PolarHBondContact O-N 2.72Å; Y572-V602 HydrophobicContact CD1-CG2 3.85Å; Y572-V602 HydrophobicContact CD2-CG2 4.3Å; Y572-V602 HydrophobicContact CE1-CG2 4.16Å; Y572-V602 HydrophobicContact CG-CG2 3.95Å; Y572-C605 HydrophobicContact CD2-CB 4.5Å; Y572-C605 HydrophobicContact CE2-CB 4.03Å
573	H	97.6	Very high	94.9	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-74.2	-28.4	-178.4	-78	-83	0	0	0	113.8	E530 Y533 V534 L537 L569 L570 L577 M596 Y606 Y661	E530-H573 IonicContact OE1-CE1 3.69Å; E530-H573 IonicContact OE1-CG 3.87Å; E530-H573 IonicContact OE1-ND1 2.74Å; E530-H573 PolarHBondContact OE1-ND1 3.25Å; Y533-H573 HydrophobicContact CD1-CB 4.43Å; Y533-H573 AromaticContact CD1-CG 3.98Å; Y533-H573 AromaticContact CD1-ND1 3.79Å; Y533-H573 HydrophobicContact CE1-CB 4.38Å; Y533-H573 AromaticContact CE1-CD2 3.77Å; Y533-H573 AromaticContact CE1-CE1 3.78Å; Y533-H573 AromaticContact CE1-CG 3.63Å; Y533-H573 AromaticContact CE1-ND1 3.63Å; Y533-H573 AromaticContact CE1-NE2 3.86Å; V534-H573 HydrophobicContact CG2-CB 3.91Å; V534-H573 WeakPolarHBondContact CG2-O 3.35Å; L537-H573 HydrophobicContact CD1-CB 4.25Å; L569-H573 WeakPolarHBondContact O-CB 3.4Å; L569-H573 PolarHBondContact O-CD2 3.38Å; L569-H573 VanDerWaalsContact O-CD2 3.27Å; L569-H573 PolarHBondContact O-N 2.73Å; L570-H573 PolarHBondContact O-N 3.39Å; H573-L577 VanDerWaalsContact O-CB 3.25Å; H573-L577 WeakPolarHBondContact O-CB 3.1Å; H573-L577 PolarHBondContact O-N 3.31Å; H573-M596 WeakPolarHBondContact CE1-CE 3.23Å; H573-M596 VanDerWaalsContact NE2-CE 3.3Å; H573-M596 WeakPolarHBondContact NE2-CE 3.26Å; H573-Y606 PolarHBondContact CE1-OH 3.4Å; H573-Y606 AromaticContact NE2-CE2 3.5Å; H573-Y606 AromaticContact NE2-CZ 3.55Å; H573-Y606 PolarHBondContact NE2-OH 3.28Å; H573-Y661 PolarHBondContact CE1-OH 3.03Å; H573-Y661 PolarHBondContact ND1-OH 3.22Å
574	M	96.5	Very high	94.4	Very high	81 Å²	81	52.7 Å²	52.7	40%	0.399	26%	0.258	S	S	.	.	H	α-helix	trans	-63.9	-41.6	166.4	-81.3	-179	155.9	0	0	112.1	V534 L570 M571 N578	V534-M574 HydrophobicContact CG1-CE 4.31Å; V534-M574 HydrophobicContact CG1-CG 3.71Å; L570-M574 HydrophobicContact CD1-CE 3.98Å; L570-M574 HydrophobicContact CD1-CG 3.94Å; L570-M574 HydrophobicContact CD1-SD 4.01Å; L570-M574 HydrophobicContact CG-CE 4.43Å; L570-M574 HydrophobicContact CG-CG 4.43Å; L570-M574 HydrophobicContact CG-SD 4.08Å; L570-M574 WeakPolarHBondContact O-CB 3.45Å; L570-M574 WeakPolarHBondContact O-CG 3.45Å; L570-M574 PolarHBondContact O-N 3.36Å; M571-M574 PolarHBondContact O-N 3.48Å; M574-N578 VanDerWaalsContact O-CG 3.32Å; M574-N578 PolarHBondContact O-N 2.93Å; M574-N578 PolarHBondContact O-ND2 2.72Å
575	S	95.4	Very high	93.7	Very high	59 Å²	59	55.1 Å²	55.1	41%	0.413	27%	0.274	S	S	.	.	H	α-helix	trans	-63.6	-49.9	176.1	-176.6	0	0	0	0	111.5	M571 Y572 L577 N578 T579	M571-S575 PolarHBondContact O-N 3.41Å; M571-S575 VanDerWaalsContact O-N 3.11Å; Y572-S575 WeakPolarHBondContact O-CB 2.95Å; Y572-S575 PolarHBondContact O-N 2.89Å; S575-L577 PolarHBondContact O-N 2.96Å; S575-N578 WeakPolarHBondContact O-CB 3.27Å; S575-N578 PolarHBondContact O-N 3.17Å; S575-N578 VanDerWaalsContact O-N 3.11Å; S575-T579 PolarHBondContact O-N 3.34Å; S575-T579 VanDerWaalsContact O-N 3.11Å
576	F	96.4	Very high	93.1	Very high	3 Å²	3	55.6 Å²	55.6	1%	0.013	28%	0.282	C	S	.	.	H	α-helix	trans	-61.9	-38.6	178	175.8	-124.2	0	0	0	113.3	E530 Y572 N578 T579 L580 L593 M596 F597 Y661	E530-F576 HydrophobicContact CG-CD1 4.15Å; E530-F576 HydrophobicContact CG-CE1 4.33Å; E530-F576 WeakPolarHBondContact OE2-CE1 3.36Å; Y572-F576 WeakPolarHBondContact O-CB 3.37Å; Y572-F576 PolarHBondContact O-N 2.72Å; F576-N578 VanDerWaalsContact C-N 3.3Å; F576-N578 PolarHBondContact O-N 2.9Å; F576-T579 PolarHBondContact O-N 3.42Å; F576-T579 PolarHBondContact O-OG1 2.95Å; F576-T579 VanDerWaalsContact O-OG1 3.07Å; F576-L580 HydrophobicContact CD1-CD1 4.15Å; F576-L580 HydrophobicContact CD2-CD1 4.46Å; F576-L580 HydrophobicContact CD2-CG 4.03Å; F576-L580 HydrophobicContact CE1-CD1 3.62Å; F576-L580 HydrophobicContact CE1-CG 4.22Å; F576-L580 HydrophobicContact CE2-CD1 3.97Å; F576-L580 HydrophobicContact CE2-CD2 3.74Å; F576-L580 HydrophobicContact CE2-CG 3.64Å; F576-L580 HydrophobicContact CG-CG 4.47Å; F576-L580 HydrophobicContact CZ-CD1 3.51Å; F576-L580 HydrophobicContact CZ-CD2 3.88Å; F576-L580 HydrophobicContact CZ-CG 3.74Å; F576-L580 WeakPolarHBondContact O-CB 3.31Å; F576-L580 WeakPolarHBondContact O-CG 3.28Å; F576-L580 PolarHBondContact O-N 3.36Å; F576-L593 HydrophobicContact CE2-CD2 4.13Å; F576-L593 HydrophobicContact CZ-CD2 3.68Å; F576-M596 HydrophobicContact CB-CB 4.46Å; F576-M596 HydrophobicContact CB-CE 3.93Å; F576-M596 HydrophobicContact CB-CG 4Å; F576-M596 HydrophobicContact CB-SD 3.78Å; F576-M596 HydrophobicContact CD1-CE 4.34Å; F576-M596 HydrophobicContact CD1-CG 4.18Å; F576-M596 HydrophobicContact CD2-CB 3.51Å; F576-M596 HydrophobicContact CD2-CG 3.69Å; F576-M596 HydrophobicContact CE2-CB 3.89Å; F576-M596 HydrophobicContact CE2-CG 4.17Å; F576-M596 HydrophobicContact CG-CB 4.06Å; F576-M596 HydrophobicContact CG-CE 4.25Å; F576-M596 HydrophobicContact CG-CG 3.7Å; F576-M596 HydrophobicContact CG-SD 4.16Å; F576-F597 HydrophobicContact CE1-CE2 4.02Å; F576-F597 HydrophobicContact CE1-CZ 4.18Å; F576-F597 HydrophobicContact CE2-CE2 4.27Å; F576-F597 AromaticContact CZ-CE2 3.77Å; F576-F597 HydrophobicContact CZ-CE2 3.77Å; F576-F597 HydrophobicContact CZ-CZ 4.39Å; F576-Y661 HydrophobicContact CE1-CE1 4.09Å
577	L	96.7	Very high	92.4	Very high	17 Å²	17	59.7 Å²	59.7	9%	0.089	30%	0.304	C	S	.	.	H	α-helix	trans	-60.3	-41	173.4	174	59.1	0	0	0	112	E530 K531 V534 H573 S575 Q581	E530-L577 HydrophobicContact CB-CD1 4.2Å; E530-L577 HydrophobicContact CG-CB 4.04Å; E530-L577 HydrophobicContact CG-CD1 4.09Å; K531-L577 HydrophobicContact CD-CD1 4.32Å; K531-L577 HydrophobicContact CG-CD1 3.53Å; K531-L577 HydrophobicContact CG-CD2 3.86Å; K531-L577 HydrophobicContact CG-CG 4.34Å; V534-L577 HydrophobicContact CB-CD2 4.16Å; V534-L577 HydrophobicContact CG1-CD2 4.19Å; V534-L577 HydrophobicContact CG2-CB 4.19Å; V534-L577 HydrophobicContact CG2-CD2 4.03Å; H573-L577 VanDerWaalsContact O-CB 3.25Å; H573-L577 WeakPolarHBondContact O-CB 3.1Å; H573-L577 PolarHBondContact O-N 3.31Å; S575-L577 PolarHBondContact O-N 2.96Å; L577-Q581 HydrophobicContact CD1-CG 4.39Å; L577-Q581 WeakPolarHBondContact O-CG 3.29Å; L577-Q581 PolarHBondContact O-N 2.93Å; L577-Q581 VanDerWaalsContact O-N 3.08Å
578	N	94.3	Very high	92.1	Very high	104 Å²	104	57.5 Å²	57.5	56%	0.556	30%	0.295	S	S	*	.	H	α-helix	trans	-66	-42.5	178.2	-68.8	-28.8	0	0	0	111.7	M574 S575 F576 Q581	M574-N578 VanDerWaalsContact O-CG 3.32Å; M574-N578 PolarHBondContact O-N 2.93Å; M574-N578 PolarHBondContact O-ND2 2.72Å; S575-N578 WeakPolarHBondContact O-CB 3.27Å; S575-N578 PolarHBondContact O-N 3.17Å; S575-N578 VanDerWaalsContact O-N 3.11Å; F576-N578 VanDerWaalsContact C-N 3.3Å; F576-N578 PolarHBondContact O-N 2.9Å; N578-Q581 PolarHBondContact O-N 2.87Å
579	T	93.3	Very high	92	Very high	40 Å²	40	54.4 Å²	54.4	25%	0.245	28%	0.28	C	S	.	.	H	α-helix	trans	-69.4	-39.8	177.7	62.2	0	0	0	0	112.1	S575 F576 Q581 M582	S575-T579 PolarHBondContact O-N 3.34Å; S575-T579 VanDerWaalsContact O-N 3.11Å; F576-T579 PolarHBondContact O-N 3.42Å; F576-T579 PolarHBondContact O-OG1 2.95Å; F576-T579 VanDerWaalsContact O-OG1 3.07Å; T579-Q581 VanDerWaalsContact C-N 3.26Å; T579-Q581 PolarHBondContact O-N 2.68Å; T579-M582 WeakPolarHBondContact O-CB 3.3Å; T579-M582 PolarHBondContact O-N 3.47Å
580	L	92.9	Very high	91.8	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-58.8	-34.9	171.9	-77.3	-174.6	0	0	0	112.7	L526 I527 E530 F576 M582 W583 V589 K592	L526-L580 HydrophobicContact CD2-CD1 4.49Å; L526-L580 HydrophobicContact CD2-CD2 4.14Å; L526-L580 HydrophobicContact CG-CD1 4.19Å; I527-L580 HydrophobicContact CG1-CB 4.11Å; E530-L580 HydrophobicContact CB-CD1 4.22Å; E530-L580 HydrophobicContact CG-CD1 4.15Å; F576-L580 HydrophobicContact CD1-CD1 4.15Å; F576-L580 HydrophobicContact CD2-CD1 4.46Å; F576-L580 HydrophobicContact CD2-CG 4.03Å; F576-L580 HydrophobicContact CE1-CD1 3.62Å; F576-L580 HydrophobicContact CE1-CG 4.22Å; F576-L580 HydrophobicContact CE2-CD1 3.97Å; F576-L580 HydrophobicContact CE2-CD2 3.74Å; F576-L580 HydrophobicContact CE2-CG 3.64Å; F576-L580 HydrophobicContact CG-CG 4.47Å; F576-L580 HydrophobicContact CZ-CD1 3.51Å; F576-L580 HydrophobicContact CZ-CD2 3.88Å; F576-L580 HydrophobicContact CZ-CG 3.74Å; F576-L580 WeakPolarHBondContact O-CB 3.31Å; F576-L580 WeakPolarHBondContact O-CG 3.28Å; F576-L580 PolarHBondContact O-N 3.36Å; L580-M582 PolarHBondContact O-N 3.46Å; L580-W583 WeakPolarHBondContact O-CB 3.24Å; L580-W583 VanDerWaalsContact O-CD1 3.28Å; L580-W583 PolarHBondContact O-N 3.22Å; L580-V589 HydrophobicContact CD2-CG2 3.38Å; L580-K592 HydrophobicContact CD2-CB 4.26Å
581	Q	91.1	Very high	91.6	Very high	96 Å²	96	56.9 Å²	56.9	45%	0.449	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67	-15	177.5	-79.3	-174.3	-137.3	0	0	113.8	I527 L577 N578 T579	I527-Q581 HydrophobicContact CG2-CG 4.36Å; L577-Q581 HydrophobicContact CD1-CG 4.39Å; L577-Q581 WeakPolarHBondContact O-CG 3.29Å; L577-Q581 PolarHBondContact O-N 2.93Å; L577-Q581 VanDerWaalsContact O-N 3.08Å; N578-Q581 PolarHBondContact O-N 2.87Å; T579-Q581 VanDerWaalsContact C-N 3.26Å; T579-Q581 PolarHBondContact O-N 2.68Å
582	M	87.2	Confident	91.4	Very high	104 Å²	104	51.9 Å²	51.9	51%	0.512	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.8	1.6	177	-61.3	178.8	68.1	0	0	113.9	T579 L580 E584 L585	T579-M582 WeakPolarHBondContact O-CB 3.3Å; T579-M582 PolarHBondContact O-N 3.47Å; L580-M582 PolarHBondContact O-N 3.46Å; M582-E584 PolarHBondContact O-N 3.01Å; M582-E584 VanDerWaalsContact O-N 3.13Å; M582-L585 HydrophobicContact CB-CD1 4.32Å; M582-L585 HydrophobicContact CE-CD1 4.13Å; M582-L585 WeakPolarHBondContact O-CB 3.41Å; M582-L585 PolarHBondContact O-N 3.4Å
583	W	87.8	Confident	91.3	Very high	18 Å²	18	48.7 Å²	48.7	7%	0.068	26%	0.256	C	S	.	.	H	α-helix	trans	-57.2	-30.6	-175.2	83.2	-77.2	0	0	0	114.6	R520 V523 I527 L580 L585 T586 N587 V589	R520-W583 HydrophobicContact CB-CH2 4.23Å; R520-W583 HydrophobicContact CG-CH2 3.95Å; R520-W583 HydrophobicContact CG-CZ2 4.25Å; V523-W583 HydrophobicContact CB-CD2 4.3Å; V523-W583 HydrophobicContact CB-CE3 4.35Å; V523-W583 HydrophobicContact CB-CH2 4.48Å; V523-W583 HydrophobicContact CB-CZ2 4.4Å; V523-W583 HydrophobicContact CB-CZ3 4.44Å; V523-W583 HydrophobicContact CG1-CB 4.44Å; V523-W583 HydrophobicContact CG1-CD2 3.47Å; V523-W583 VanDerWaalsContact CG1-CD2 3.47Å; V523-W583 HydrophobicContact CG1-CE3 3.89Å; V523-W583 HydrophobicContact CG1-CG 3.72Å; V523-W583 HydrophobicContact CG1-CZ2 4.27Å; V523-W583 HydrophobicContact CG1-CZ3 4.44Å; V523-W583 HydrophobicContact CG2-CE3 4.38Å; V523-W583 HydrophobicContact CG2-CZ3 4.43Å; I527-W583 HydrophobicContact CD1-CG 4.24Å; L580-W583 WeakPolarHBondContact O-CB 3.24Å; L580-W583 VanDerWaalsContact O-CD1 3.28Å; L580-W583 PolarHBondContact O-N 3.22Å; W583-L585 PolarHBondContact O-N 2.77Å; W583-T586 PolarHBondContact O-N 3.21Å; W583-N587 VanDerWaalsContact O-CA 3.26Å; W583-N587 WeakPolarHBondContact O-CA 3.42Å; W583-N587 PolarHBondContact O-N 2.74Å; W583-V589 HydrophobicContact CB-CB 4.49Å
584	E	84.9	Confident	91.1	Very high	115 Å²	115	49.6 Å²	49.6	54%	0.537	26%	0.261	S	S	.	.	H	α-helix	trans	-69.5	-22.2	178.6	-60.4	-168.1	163	0	0	112.3	M582	M582-E584 PolarHBondContact O-N 3.01Å; M582-E584 VanDerWaalsContact O-N 3.13Å
585	L	81	Confident	91	Very high	136 Å²	136	49.5 Å²	49.5	71%	0.712	26%	0.262	S	S	*	.	H	α-helix	trans	-79.4	-41.8	175.7	-63.4	166.9	0	0	0	111.7	M582 W583	M582-L585 HydrophobicContact CB-CD1 4.32Å; M582-L585 HydrophobicContact CE-CD1 4.13Å; M582-L585 WeakPolarHBondContact O-CB 3.41Å; M582-L585 PolarHBondContact O-N 3.4Å; W583-L585 PolarHBondContact O-N 2.77Å
586	T	82.4	Confident	90.9	Very high	66 Å²	66	47.1 Å²	47.1	41%	0.405	24%	0.244	S	C	.	.	H	α-helix	trans	-92.2	-15.2	-176	51.1	0	0	0	0	113.9	W583 T588 K592	W583-T586 PolarHBondContact O-N 3.21Å; T586-T588 PolarHBondContact O-N 3.25Å; T586-T588 PolarHBondContact OG1-O 3.41Å; T586-K592 WeakPolarHBondContact OG1-CE 3.38Å; T586-K592 PolarHBondContact OG1-NZ 2.8Å
587	N	83.6	Confident	90.8	Very high	86 Å²	86	47.4 Å²	47.4	46%	0.46	25%	0.246	S	C	.	.	S	Bend	trans	57.3	-11.2	-167.6	-78.9	-86	0	0	0	116.4	R519 W583	R519-N587 PolarHBondContact NH1-O 2.98Å; R519-N587 PolarHBondContact NH2-O 3.08Å; W583-N587 VanDerWaalsContact O-CA 3.26Å; W583-N587 WeakPolarHBondContact O-CA 3.42Å; W583-N587 PolarHBondContact O-N 2.74Å
588	T	89.3	Confident	90.6	Very high	19 Å²	19	49.8 Å²	49.8	12%	0.117	26%	0.264	C	S	.	.			trans	-98.8	152.8	172.5	62.7	0	0	0	0	112.7	T586 D591 K592 D678 L681	T586-T588 PolarHBondContact O-N 3.25Å; T586-T588 PolarHBondContact OG1-O 3.41Å; T588-D591 WeakPolarHBondContact CB-OD1 3.2Å; T588-D591 PolarHBondContact OG1-OD1 3.16Å; T588-K592 PolarHBondContact O-NZ 2.84Å; T588-K592 PolarHBondContact OG1-NZ 3.32Å; T588-K592 VanDerWaalsContact OG1-NZ 3.09Å; T588-D678 VanDerWaalsContact CA-OD1 3.25Å; T588-D678 WeakPolarHBondContact CA-OD1 3.36Å; T588-D678 VanDerWaalsContact CB-OD1 3.29Å; T588-D678 WeakPolarHBondContact CB-OD1 3.15Å; T588-D678 HydrophobicContact CG2-CB 4.28Å; T588-L681 HydrophobicContact CG2-CD1 4.2Å
589	V	93.5	Very high	90.6	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	26%	0.259	C	S	.	.			trans	-135.2	-18.7	172	75.3	0	0	0	0	112.7	V523 L526 L580 W583 D591 K592 L593 L668 D678 L682	V523-V589 HydrophobicContact CG1-CG2 4.47Å; V523-V589 HydrophobicContact CG2-CG1 4.2Å; L526-V589 HydrophobicContact CD2-CG2 4.3Å; L580-V589 HydrophobicContact CD2-CG2 3.38Å; W583-V589 HydrophobicContact CB-CB 4.49Å; V589-D591 VanDerWaalsContact C-N 3.28Å; V589-D591 PolarHBondContact O-N 2.7Å; V589-K592 PolarHBondContact O-N 3.25Å; V589-K592 VanDerWaalsContact O-N 3.1Å; V589-L593 HydrophobicContact CG1-CD1 4.48Å; V589-L593 PolarHBondContact O-N 2.81Å; V589-L593 VanDerWaalsContact O-N 3.12Å; V589-L668 HydrophobicContact CG1-CD2 3.63Å; V589-D678 PolarHBondContact N-OD1 3.48Å; V589-D678 PolarHBondContact N-OD2 3.43Å; V589-L682 HydrophobicContact CG1-CD2 4.17Å
590	G	93	Very high	90.4	Very high	0 Å²	0	53 Å²	53	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-58	-38.3	174.7	0	0	0	0	0	112.8	K592 L593 L594 D678	G590-K592 VanDerWaalsContact C-N 3.32Å; G590-K592 PolarHBondContact O-N 3.45Å; G590-L593 WeakPolarHBondContact O-CB 3.49Å; G590-L593 PolarHBondContact O-N 3.11Å; G590-L594 WeakPolarHBondContact O-CB 3.49Å; G590-L594 WeakPolarHBondContact O-CG 3.47Å; G590-L594 PolarHBondContact O-N 2.94Å; G590-D678 PolarHBondContact N-OD1 3.01Å
591	D	92.6	Very high	90.3	Very high	59 Å²	59	55.6 Å²	55.6	32%	0.316	29%	0.289	S	S	.	.	H	α-helix	trans	-66	-29.8	175.9	60.5	-46.7	0	0	0	113.6	T588 V589 D595 L681	T588-D591 WeakPolarHBondContact CB-OD1 3.2Å; T588-D591 PolarHBondContact OG1-OD1 3.16Å; V589-D591 VanDerWaalsContact C-N 3.28Å; V589-D591 PolarHBondContact O-N 2.7Å; D591-D595 PolarHBondContact O-N 2.79Å; D591-L681 HydrophobicContact CB-CD1 4.13Å
592	K	93.8	Very high	90.4	Very high	18 Å²	18	51 Å²	51	8%	0.078	27%	0.268	C	S	.	.	H	α-helix	trans	-77.3	-33	176.4	-72	58	162.8	-176	0	110.9	L580 T586 T588 V589 G590 M596	L580-K592 HydrophobicContact CD2-CB 4.26Å; T586-K592 WeakPolarHBondContact OG1-CE 3.38Å; T586-K592 PolarHBondContact OG1-NZ 2.8Å; T588-K592 PolarHBondContact O-NZ 2.84Å; T588-K592 PolarHBondContact OG1-NZ 3.32Å; T588-K592 VanDerWaalsContact OG1-NZ 3.09Å; V589-K592 PolarHBondContact O-N 3.25Å; V589-K592 VanDerWaalsContact O-N 3.1Å; G590-K592 VanDerWaalsContact C-N 3.32Å; G590-K592 PolarHBondContact O-N 3.45Å; K592-M596 WeakPolarHBondContact O-CB 3.3Å; K592-M596 PolarHBondContact O-N 3.12Å
593	L	95.1	Very high	90.5	Very high	1 Å²	1	46.5 Å²	46.5	1%	0.005	25%	0.247	C	C	.	.	H	α-helix	trans	-69	-40.9	171.6	-68.7	159.6	0	0	0	110.7	L526 F576 V589 G590 F597 I665 L682 A685 I689	L526-L593 HydrophobicContact CD2-CD1 4.5Å; L526-L593 HydrophobicContact CD2-CD2 4.43Å; F576-L593 HydrophobicContact CE2-CD2 4.13Å; F576-L593 HydrophobicContact CZ-CD2 3.68Å; V589-L593 HydrophobicContact CG1-CD1 4.48Å; V589-L593 PolarHBondContact O-N 2.81Å; V589-L593 VanDerWaalsContact O-N 3.12Å; G590-L593 WeakPolarHBondContact O-CB 3.49Å; G590-L593 PolarHBondContact O-N 3.11Å; L593-F597 HydrophobicContact CD2-CD2 4.27Å; L593-F597 HydrophobicContact CD2-CE2 4.03Å; L593-F597 WeakPolarHBondContact O-CB 3.37Å; L593-F597 VanDerWaalsContact O-CD2 3.31Å; L593-F597 WeakPolarHBondContact O-CD2 3.39Å; L593-F597 PolarHBondContact O-N 2.71Å; L593-I665 HydrophobicContact CD1-CD1 3.92Å; L593-I665 HydrophobicContact CD1-CG1 4.06Å; L593-I665 HydrophobicContact CD2-CD1 4.27Å; L593-L682 HydrophobicContact CD1-CD2 3.94Å; L593-A685 HydrophobicContact CB-CB 3.67Å; L593-A685 HydrophobicContact CD1-CB 4.34Å; L593-I689 HydrophobicContact CD2-CD1 4.36Å
594	L	92.7	Very high	90.6	Very high	20 Å²	20	49.8 Å²	49.8	11%	0.105	26%	0.264	C	S	.	.	H	α-helix	trans	-63.5	-50.4	175.8	-76	166.6	0	0	0	112.4	G590 M596 F597 S598 L681 E684 A685 A688	G590-L594 WeakPolarHBondContact O-CB 3.49Å; G590-L594 WeakPolarHBondContact O-CG 3.47Å; G590-L594 PolarHBondContact O-N 2.94Å; L594-M596 VanDerWaalsContact C-N 3.33Å; L594-M596 PolarHBondContact O-N 3.35Å; L594-F597 PolarHBondContact O-N 2.98Å; L594-S598 WeakPolarHBondContact O-CB 3.23Å; L594-S598 PolarHBondContact O-N 3.41Å; L594-S598 PolarHBondContact O-OG 3.28Å; L594-L681 HydrophobicContact CD1-CB 4.27Å; L594-L681 HydrophobicContact CD1-CD2 3.91Å; L594-E684 HydrophobicContact CD1-CB 4.22Å; L594-E684 HydrophobicContact CD1-CG 4.46Å; L594-E684 HydrophobicContact CD2-CB 3.93Å; L594-E684 HydrophobicContact CD2-CG 3.7Å; L594-A685 HydrophobicContact CD2-CB 4.44Å; L594-A685 HydrophobicContact CG-CB 4.21Å; L594-A688 HydrophobicContact CD2-CB 4.41Å
595	D	93.1	Very high	91	Very high	79 Å²	79	44.6 Å²	44.6	42%	0.422	24%	0.24	S	C	.	.	H	α-helix	trans	-54.6	-48.8	175.7	171	61.4	0	0	0	111.2	D591 R599	D591-D595 PolarHBondContact O-N 2.79Å; D595-R599 WeakPolarHBondContact O-CD 3.46Å; D595-R599 WeakPolarHBondContact O-CG 3.44Å; D595-R599 IonicContact OD1-NH1 2.77Å; D595-R599 IonicContact OD2-NH1 3.32Å
596	M	94.2	Very high	91.7	Very high	8 Å²	8	38.1 Å²	38.1	4%	0.039	21%	0.206	C	C	.	.	H	α-helix	trans	-64.9	-52.5	-179.2	177.9	59.8	168.3	0	0	113.1	H573 F576 K592 L594 V602	H573-M596 WeakPolarHBondContact CE1-CE 3.23Å; H573-M596 VanDerWaalsContact NE2-CE 3.3Å; H573-M596 WeakPolarHBondContact NE2-CE 3.26Å; F576-M596 HydrophobicContact CB-CB 4.46Å; F576-M596 HydrophobicContact CB-CE 3.93Å; F576-M596 HydrophobicContact CB-CG 4Å; F576-M596 HydrophobicContact CB-SD 3.78Å; F576-M596 HydrophobicContact CD1-CE 4.34Å; F576-M596 HydrophobicContact CD1-CG 4.18Å; F576-M596 HydrophobicContact CD2-CB 3.51Å; F576-M596 HydrophobicContact CD2-CG 3.69Å; F576-M596 HydrophobicContact CE2-CB 3.89Å; F576-M596 HydrophobicContact CE2-CG 4.17Å; F576-M596 HydrophobicContact CG-CB 4.06Å; F576-M596 HydrophobicContact CG-CE 4.25Å; F576-M596 HydrophobicContact CG-CG 3.7Å; F576-M596 HydrophobicContact CG-SD 4.16Å; K592-M596 WeakPolarHBondContact O-CB 3.3Å; K592-M596 PolarHBondContact O-N 3.12Å; L594-M596 VanDerWaalsContact C-N 3.33Å; L594-M596 PolarHBondContact O-N 3.35Å; M596-V602 HydrophobicContact CE-CG1 4.15Å; M596-V602 HydrophobicContact SD-CG1 4.39Å; M596-V602 HydrophobicContact SD-CG2 4.14Å
597	F	95.2	Very high	92	Very high	9 Å²	9	35.3 Å²	35.3	4%	0.039	19%	0.189	C	C	.	.	H	α-helix	trans	-94.6	-6.7	-166.6	-64.6	-69.6	0	0	0	115	F576 L593 L594 I658 Y661 I689 L692	F576-F597 HydrophobicContact CE1-CE2 4.02Å; F576-F597 HydrophobicContact CE1-CZ 4.18Å; F576-F597 HydrophobicContact CE2-CE2 4.27Å; F576-F597 AromaticContact CZ-CE2 3.77Å; F576-F597 HydrophobicContact CZ-CE2 3.77Å; F576-F597 HydrophobicContact CZ-CZ 4.39Å; L593-F597 HydrophobicContact CD2-CD2 4.27Å; L593-F597 HydrophobicContact CD2-CE2 4.03Å; L593-F597 WeakPolarHBondContact O-CB 3.37Å; L593-F597 VanDerWaalsContact O-CD2 3.31Å; L593-F597 WeakPolarHBondContact O-CD2 3.39Å; L593-F597 PolarHBondContact O-N 2.71Å; L594-F597 PolarHBondContact O-N 2.98Å; F597-I658 HydrophobicContact CE1-CD1 4.22Å; F597-Y661 HydrophobicContact CE1-CD2 4.11Å; F597-Y661 AromaticContact CE1-CE2 3.85Å; F597-Y661 HydrophobicContact CE1-CE2 3.85Å; F597-Y661 HydrophobicContact CE2-CD2 4.37Å; F597-Y661 HydrophobicContact CE2-CE2 4.32Å; F597-Y661 AromaticContact CZ-CD2 3.69Å; F597-Y661 HydrophobicContact CZ-CD2 3.69Å; F597-Y661 HydrophobicContact CZ-CE1 4.29Å; F597-Y661 AromaticContact CZ-CE2 3.36Å; F597-Y661 HydrophobicContact CZ-CE2 3.36Å; F597-Y661 HydrophobicContact CZ-CG 4.3Å; F597-Y661 AromaticContact CZ-CZ 3.7Å; F597-I689 HydrophobicContact CB-CD1 4.45Å; F597-I689 HydrophobicContact CB-CG1 3.74Å; F597-I689 HydrophobicContact CD1-CD1 4.46Å; F597-I689 HydrophobicContact CD1-CG1 4.25Å; F597-I689 HydrophobicContact CD2-CD1 3.4Å; F597-I689 VanDerWaalsContact CD2-CD1 3.4Å; F597-I689 HydrophobicContact CD2-CG1 3.68Å; F597-I689 HydrophobicContact CE2-CD1 3.69Å; F597-I689 HydrophobicContact CE2-CG1 4.39Å; F597-I689 HydrophobicContact CG-CD1 3.85Å; F597-I689 HydrophobicContact CG-CG1 3.6Å; F597-I689 HydrophobicContact CZ-CD1 4.35Å; F597-L692 HydrophobicContact CD1-CD2 3.76Å; F597-L692 HydrophobicContact CE1-CD2 4.39Å
598	S	91.7	Very high	92.3	Very high	68 Å²	68	33.1 Å²	33.1	48%	0.476	18%	0.179	S	C	.	.	H	α-helix	trans	-87.8	-10.7	170	-47.5	0	0	0	0	113	L594 E600	L594-S598 WeakPolarHBondContact O-CB 3.23Å; L594-S598 PolarHBondContact O-N 3.41Å; L594-S598 PolarHBondContact O-OG 3.28Å; S598-E600 PolarHBondContact O-N 3.34Å
599	R	93.3	Very high	92.5	Very high	120 Å²	120	32.6 Å²	32.6	45%	0.453	18%	0.175	S	C	.	.			trans	-77.1	113.2	-178.7	-75.2	165.2	85.4	170	6.3	111.2	D595 A601 V602 A603	D595-R599 WeakPolarHBondContact O-CD 3.46Å; D595-R599 WeakPolarHBondContact O-CG 3.44Å; D595-R599 IonicContact OD1-NH1 2.77Å; D595-R599 IonicContact OD2-NH1 3.32Å; R599-A601 PolarHBondContact O-N 3.34Å; R599-A601 VanDerWaalsContact O-N 3.09Å; R599-V602 HydrophobicContact CB-CG2 4.09Å; R599-V602 WeakPolarHBondContact O-CA 3.18Å; R599-V602 WeakPolarHBondContact O-CB 3.43Å; R599-V602 PolarHBondContact O-N 2.88Å; R599-A603 PolarHBondContact O-N 2.97Å
600	E	89	Confident	92.4	Very high	92 Å²	92	33 Å²	33	43%	0.43	18%	0.177	S	C	.	.	H	α-helix	trans	-51.6	-34.8	179.4	-179.4	58.2	-163.2	0	0	113.5	S598 V602 A603 M604 R695	S598-E600 PolarHBondContact O-N 3.34Å; E600-V602 VanDerWaalsContact C-N 3.33Å; E600-V602 PolarHBondContact O-N 3.24Å; E600-A603 PolarHBondContact O-N 3.27Å; E600-M604 HydrophobicContact CG-CG 4.45Å; E600-M604 WeakPolarHBondContact O-CB 3.3Å; E600-M604 PolarHBondContact O-N 3.06Å; E600-M604 WeakPolarHBondContact OE1-CG 3.45Å; E600-R695 VanDerWaalsContact CD-NH1 3.25Å; E600-R695 IonicContact OE1-CZ 3.48Å; E600-R695 VanDerWaalsContact OE1-CZ 3.28Å; E600-R695 IonicContact OE1-NH1 3.45Å; E600-R695 PolarHBondContact OE1-NH1 2.82Å; E600-R695 IonicContact OE1-NH2 3.39Å; E600-R695 PolarHBondContact OE1-NH2 3.33Å; E600-R695 IonicContact OE2-CZ 3.65Å; E600-R695 IonicContact OE2-NH1 3.31Å; E600-R695 PolarHBondContact OE2-NH1 2.89Å; E600-R695 IonicContact OE2-NH2 2.73Å
601	A	91.2	Very high	92.1	Very high	53 Å²	53	37.4 Å²	37.4	44%	0.438	20%	0.201	S	C	.	.	H	α-helix	trans	-62.4	-36.5	175.3	0	0	0	0	0	113.2	R599 C605	R599-A601 PolarHBondContact O-N 3.34Å; R599-A601 VanDerWaalsContact O-N 3.09Å; A601-C605 VanDerWaalsContact O-CB 3.24Å; A601-C605 WeakPolarHBondContact O-CB 3.44Å; A601-C605 PolarHBondContact O-N 3.48Å
602	V	93	Very high	92	Very high	1 Å²	1	35.8 Å²	35.8	1%	0.006	19%	0.193	C	C	.	.	H	α-helix	trans	-70.4	-42.9	174.5	-179.6	0	0	0	0	109.7	Y572 M596 R599 E600 C605 Y606	Y572-V602 HydrophobicContact CD1-CG2 3.85Å; Y572-V602 HydrophobicContact CD2-CG2 4.3Å; Y572-V602 HydrophobicContact CE1-CG2 4.16Å; Y572-V602 HydrophobicContact CG-CG2 3.95Å; M596-V602 HydrophobicContact CE-CG1 4.15Å; M596-V602 HydrophobicContact SD-CG1 4.39Å; M596-V602 HydrophobicContact SD-CG2 4.14Å; R599-V602 HydrophobicContact CB-CG2 4.09Å; R599-V602 WeakPolarHBondContact O-CA 3.18Å; R599-V602 WeakPolarHBondContact O-CB 3.43Å; R599-V602 PolarHBondContact O-N 2.88Å; E600-V602 VanDerWaalsContact C-N 3.33Å; E600-V602 PolarHBondContact O-N 3.24Å; V602-C605 WeakPolarHBondContact O-CB 3.21Å; V602-C605 PolarHBondContact O-N 3.27Å; V602-Y606 HydrophobicContact CG1-CD2 4.03Å; V602-Y606 HydrophobicContact CG1-CE2 4.14Å; V602-Y606 PolarHBondContact O-N 2.79Å
603	A	90.7	Very high	91.9	Very high	9 Å²	9	36 Å²	36	7%	0.074	19%	0.194	C	C	.	.	H	α-helix	trans	-60.4	-48.1	177.3	0	0	0	0	0	112.3	R599 E600 C605 Y606 C607 L692	R599-A603 PolarHBondContact O-N 2.97Å; E600-A603 PolarHBondContact O-N 3.27Å; A603-C605 VanDerWaalsContact C-N 3.34Å; A603-C605 PolarHBondContact O-N 2.88Å; A603-Y606 PolarHBondContact O-N 3.45Å; A603-C607 WeakPolarHBondContact O-CB 3.46Å; A603-C607 PolarHBondContact O-N 2.8Å; A603-C607 PolarHBondContact O-SG 2.9Å; A603-L692 HydrophobicContact CB-CD1 3.79Å
604	M	89.4	Confident	91.4	Very high	86 Å²	86	38.8 Å²	38.8	42%	0.424	21%	0.213	S	C	.	.	H	α-helix	trans	-65.4	-33.9	175.8	-75.6	-64.1	-69.4	0	0	112.9	E600 C607 T608 R695	E600-M604 HydrophobicContact CG-CG 4.45Å; E600-M604 WeakPolarHBondContact O-CB 3.3Å; E600-M604 PolarHBondContact O-N 3.06Å; E600-M604 WeakPolarHBondContact OE1-CG 3.45Å; M604-C607 PolarHBondContact O-N 2.91Å; M604-T608 WeakPolarHBondContact O-CB 3.25Å; M604-T608 WeakPolarHBondContact O-CG2 3.17Å; M604-T608 PolarHBondContact O-N 2.9Å; M604-T608 PolarHBondContact O-OG1 2.88Å; M604-R695 PolarHBondContact SD-NH2 3.29Å
605	C	93.5	Very high	91.2	Very high	7 Å²	7	41.3 Å²	41.3	5%	0.047	23%	0.226	C	C	.	.	H	α-helix	trans	-63.4	-46.8	174.4	-167.2	0	0	0	0	111.6	Y572 A601 V602 A603 T608 F609	Y572-C605 HydrophobicContact CD2-CB 4.5Å; Y572-C605 HydrophobicContact CE2-CB 4.03Å; A601-C605 VanDerWaalsContact O-CB 3.24Å; A601-C605 WeakPolarHBondContact O-CB 3.44Å; A601-C605 PolarHBondContact O-N 3.48Å; V602-C605 WeakPolarHBondContact O-CB 3.21Å; V602-C605 PolarHBondContact O-N 3.27Å; A603-C605 VanDerWaalsContact C-N 3.34Å; A603-C605 PolarHBondContact O-N 2.88Å; C605-T608 PolarHBondContact O-OG1 3.08Å; C605-F609 WeakPolarHBondContact O-CB 3.21Å; C605-F609 PolarHBondContact O-N 3.4Å
606	Y	94.5	Very high	91.2	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-64.2	-43.6	173.9	-89.7	-82.3	0	0	0	112.6	Y533 L569 H573 V602 A603 F609 V610 P654 I658	Y533-Y606 WeakPolarHBondContact CE1-OH 3.42Å; Y533-Y606 PolarHBondContact OH-OH 3.02Å; L569-Y606 HydrophobicContact CD2-CD1 4.3Å; L569-Y606 HydrophobicContact CD2-CD2 3.74Å; L569-Y606 HydrophobicContact CD2-CE1 4.1Å; L569-Y606 HydrophobicContact CD2-CE2 3.51Å; L569-Y606 HydrophobicContact CD2-CG 4.13Å; H573-Y606 PolarHBondContact CE1-OH 3.4Å; H573-Y606 AromaticContact NE2-CE2 3.5Å; H573-Y606 AromaticContact NE2-CZ 3.55Å; H573-Y606 PolarHBondContact NE2-OH 3.28Å; V602-Y606 HydrophobicContact CG1-CD2 4.03Å; V602-Y606 HydrophobicContact CG1-CE2 4.14Å; V602-Y606 PolarHBondContact O-N 2.79Å; A603-Y606 PolarHBondContact O-N 3.45Å; Y606-F609 PolarHBondContact O-N 2.62Å; Y606-V610 WeakPolarHBondContact O-CG2 3.33Å; Y606-V610 PolarHBondContact O-N 3.21Å; Y606-V610 VanDerWaalsContact O-N 3.1Å; Y606-P654 HydrophobicContact CE1-CB 3.99Å; Y606-P654 WeakPolarHBondContact CE1-O 3.4Å; Y606-I658 HydrophobicContact CD1-CD1 4.04Å; Y606-I658 HydrophobicContact CD1-CG1 3.86Å; Y606-I658 HydrophobicContact CD2-CD1 4.23Å; Y606-I658 HydrophobicContact CE1-CD1 3.75Å; Y606-I658 HydrophobicContact CE1-CG1 3.84Å; Y606-I658 HydrophobicContact CE2-CD1 3.96Å; Y606-I658 HydrophobicContact CG-CD1 4.28Å; Y606-I658 HydrophobicContact CG-CG1 4.37Å
607	C	89.8	Confident	91	Very high	7 Å²	7	40.1 Å²	40.1	5%	0.047	22%	0.219	C	C	.	.	H	α-helix	trans	-59.3	-50.2	177.9	-67.8	0	0	0	0	111.8	A603 M604 F609 V610 D611 V699	A603-C607 WeakPolarHBondContact O-CB 3.46Å; A603-C607 PolarHBondContact O-N 2.8Å; A603-C607 PolarHBondContact O-SG 2.9Å; M604-C607 PolarHBondContact O-N 2.91Å; C607-F609 VanDerWaalsContact C-N 3.33Å; C607-F609 PolarHBondContact O-N 3.16Å; C607-V610 PolarHBondContact O-N 2.87Å; C607-D611 WeakPolarHBondContact O-CB 3.36Å; C607-D611 PolarHBondContact O-N 2.88Å; C607-V699 HydrophobicContact CB-CG2 4.07Å
608	T	89.9	Confident	90.7	Very high	40 Å²	40	44.7 Å²	44.7	25%	0.245	24%	0.238	C	C	.	.	H	α-helix	trans	-71	-25.4	-179.2	53.6	0	0	0	0	113.4	F564 M604 C605 N612	F564-T608 WeakPolarHBondContact CE1-O 3.47Å; M604-T608 WeakPolarHBondContact O-CB 3.25Å; M604-T608 WeakPolarHBondContact O-CG2 3.17Å; M604-T608 PolarHBondContact O-N 2.9Å; M604-T608 PolarHBondContact O-OG1 2.88Å; C605-T608 PolarHBondContact O-OG1 3.08Å; T608-N612 PolarHBondContact O-N 3.33Å
609	F	94	Very high	90.8	Very high	8 Å²	8	42.7 Å²	42.7	4%	0.035	22%	0.223	C	C	.	.	H	α-helix	trans	-64	-49.1	167.8	178.8	-89.2	0	0	0	111.8	F564 K565 V566 L569 C605 Y606 C607 F613 L651 P654 I655	F564-F609 VanDerWaalsContact O-CD2 3.26Å; F564-F609 WeakPolarHBondContact O-CD2 3.47Å; K565-F609 HydrophobicContact CB-CB 4.09Å; K565-F609 HydrophobicContact CB-CD2 4.27Å; V566-F609 HydrophobicContact CG2-CD2 4.39Å; V566-F609 HydrophobicContact CG2-CE2 3.75Å; L569-F609 HydrophobicContact CD1-CB 4.19Å; L569-F609 HydrophobicContact CD1-CD2 3.75Å; L569-F609 HydrophobicContact CD1-CE2 4.38Å; L569-F609 HydrophobicContact CD1-CG 3.91Å; C605-F609 WeakPolarHBondContact O-CB 3.21Å; C605-F609 PolarHBondContact O-N 3.4Å; Y606-F609 PolarHBondContact O-N 2.62Å; C607-F609 VanDerWaalsContact C-N 3.33Å; C607-F609 PolarHBondContact O-N 3.16Å; F609-F613 AromaticContact CE1-CD2 3.84Å; F609-F613 HydrophobicContact CE1-CD2 3.84Å; F609-F613 AromaticContact CZ-CD2 3.96Å; F609-F613 HydrophobicContact CZ-CD2 3.96Å; F609-F613 HydrophobicContact CZ-CE2 4.46Å; F609-F613 PolarHBondContact O-N 3.4Å; F609-L651 WeakPolarHBondContact CZ-O 3.39Å; F609-P654 HydrophobicContact CD1-CB 3.92Å; F609-P654 HydrophobicContact CD1-CG 4.38Å; F609-P654 HydrophobicContact CE1-CB 3.72Å; F609-P654 HydrophobicContact CE1-CG 3.82Å; F609-P654 HydrophobicContact CE2-CG 4.25Å; F609-P654 HydrophobicContact CZ-CB 4.19Å; F609-P654 HydrophobicContact CZ-CG 3.76Å; F609-I655 HydrophobicContact CE1-CD1 4.5Å; F609-I655 HydrophobicContact CE1-CG1 4.33Å
610	V	90.7	Very high	90.8	Very high	7 Å²	7	37.8 Å²	37.8	4%	0.042	21%	0.206	C	C	.	.	H	α-helix	trans	-70.9	-39.7	-174.8	175.1	0	0	0	0	112.2	Y606 C607 N612 F613 I655 V696 H700	Y606-V610 WeakPolarHBondContact O-CG2 3.33Å; Y606-V610 PolarHBondContact O-N 3.21Å; Y606-V610 VanDerWaalsContact O-N 3.1Å; C607-V610 PolarHBondContact O-N 2.87Å; V610-N612 PolarHBondContact O-N 3.47Å; V610-F613 VanDerWaalsContact O-CB 3.27Å; V610-F613 WeakPolarHBondContact O-CB 3.33Å; V610-F613 PolarHBondContact O-N 2.94Å; V610-F613 VanDerWaalsContact O-N 3.09Å; V610-I655 HydrophobicContact CG2-CG1 3.73Å; V610-V696 HydrophobicContact CB-CG1 4.25Å; V610-V696 HydrophobicContact CG1-CG1 4.33Å; V610-V696 HydrophobicContact CG2-CG1 3.71Å; V610-H700 HydrophobicContact CG1-CB 4.2Å
611	D	86.6	Confident	90.9	Very high	94 Å²	94	39.5 Å²	39.5	50%	0.503	21%	0.214	S	C	.	.	H	α-helix	trans	-52.9	-52.3	172.4	-177.8	42.1	0	0	0	111.9	C607 F613 V699	C607-D611 WeakPolarHBondContact O-CB 3.36Å; C607-D611 PolarHBondContact O-N 2.88Å; D611-F613 VanDerWaalsContact C-N 3.31Å; D611-F613 PolarHBondContact O-N 3.25Å; D611-V699 HydrophobicContact CB-CG1 3.91Å
612	N	90.4	Very high	90.9	Very high	25 Å²	25	40.7 Å²	40.7	13%	0.134	22%	0.216	C	C	.	.	H	α-helix	trans	-73.4	-15	177.4	-179.4	73.3	0	0	0	114.2	I561 F564 T608 V610 S614 N615 S616	I561-N612 PolarHBondContact O-ND2 2.78Å; F564-N612 HydrophobicContact CB-CB 4.46Å; F564-N612 WeakPolarHBondContact CB-ND2 3.35Å; F564-N612 HydrophobicContact CD1-CB 3.61Å; F564-N612 HydrophobicContact CE1-CB 4.12Å; F564-N612 HydrophobicContact CG-CB 4.24Å; T608-N612 PolarHBondContact O-N 3.33Å; V610-N612 PolarHBondContact O-N 3.47Å; N612-S614 VanDerWaalsContact C-N 3.26Å; N612-S614 PolarHBondContact O-N 3.43Å; N612-S614 VanDerWaalsContact O-N 3.17Å; N612-N615 CarbonylContact O-C 3.52Å; N612-N615 WeakPolarHBondContact O-CA 3.15Å; N612-N615 PolarHBondContact O-N 2.98Å; N612-S616 PolarHBondContact O-N 2.91Å
613	F	91.6	Very high	90.9	Very high	23 Å²	23	40.6 Å²	40.6	10%	0.101	22%	0.216	C	C	.	.	H	α-helix	trans	-56.4	-39.5	-173.2	-172.7	-99	0	0	0	112.7	F609 V610 D611 N615 S616 E617 L651 V652 I655	F609-F613 AromaticContact CE1-CD2 3.84Å; F609-F613 HydrophobicContact CE1-CD2 3.84Å; F609-F613 AromaticContact CZ-CD2 3.96Å; F609-F613 HydrophobicContact CZ-CD2 3.96Å; F609-F613 HydrophobicContact CZ-CE2 4.46Å; F609-F613 PolarHBondContact O-N 3.4Å; V610-F613 VanDerWaalsContact O-CB 3.27Å; V610-F613 WeakPolarHBondContact O-CB 3.33Å; V610-F613 PolarHBondContact O-N 2.94Å; V610-F613 VanDerWaalsContact O-N 3.09Å; D611-F613 VanDerWaalsContact C-N 3.31Å; D611-F613 PolarHBondContact O-N 3.25Å; F613-N615 PolarHBondContact O-N 2.94Å; F613-S616 WeakPolarHBondContact O-CB 3.29Å; F613-S616 PolarHBondContact O-N 2.93Å; F613-E617 HydrophobicContact CD1-CG 3.93Å; F613-E617 HydrophobicContact CE1-CG 3.54Å; F613-E617 HydrophobicContact CZ-CG 3.92Å; F613-E617 WeakPolarHBondContact O-CG 3.45Å; F613-E617 PolarHBondContact O-N 3.06Å; F613-L651 HydrophobicContact CE2-CB 4.33Å; F613-L651 WeakPolarHBondContact CE2-O 3.44Å; F613-V652 HydrophobicContact CZ-CB 4.04Å; F613-V652 HydrophobicContact CZ-CG2 4.08Å; F613-I655 HydrophobicContact CB-CD1 4.2Å; F613-I655 HydrophobicContact CD1-CD1 3.57Å; F613-I655 HydrophobicContact CD2-CD1 3.77Å; F613-I655 HydrophobicContact CE1-CD1 3.81Å; F613-I655 HydrophobicContact CE2-CD1 4Å; F613-I655 HydrophobicContact CG-CD1 3.56Å; F613-I655 HydrophobicContact CZ-CD1 4.01Å
614	S	85.7	Confident	91	Very high	58 Å²	58	45.3 Å²	45.3	41%	0.406	23%	0.232	S	C	.	.	H	α-helix	trans	-58.7	-30.6	173.8	-77.4	0	0	0	0	113.7	N612 K618	N612-S614 VanDerWaalsContact C-N 3.26Å; N612-S614 PolarHBondContact O-N 3.43Å; N612-S614 VanDerWaalsContact O-N 3.17Å; S614-K618 VanDerWaalsContact O-CD 3.23Å; S614-K618 WeakPolarHBondContact O-CD 3.1Å; S614-K618 VanDerWaalsContact O-CE 3.25Å; S614-K618 WeakPolarHBondContact O-CE 3.49Å; S614-K618 WeakPolarHBondContact O-CG 3.4Å; S614-K618 PolarHBondContact O-N 3.32Å
615	N	88.6	Confident	91	Very high	73 Å²	73	46.2 Å²	46.2	39%	0.39	24%	0.238	S	C	.	.	H	α-helix	trans	-89.2	-30.9	178.4	-63.6	-28.7	0	0	0	111.8	I561 N612 F613 K618 T619	I561-N615 HydrophobicContact CG2-CB 4.44Å; N612-N615 CarbonylContact O-C 3.52Å; N612-N615 WeakPolarHBondContact O-CA 3.15Å; N612-N615 PolarHBondContact O-N 2.98Å; F613-N615 PolarHBondContact O-N 2.94Å; N615-K618 PolarHBondContact OD1-NZ 3.16Å; N615-K618 VanDerWaalsContact OD1-NZ 3.12Å; N615-T619 VanDerWaalsContact O-CB 3.26Å; N615-T619 WeakPolarHBondContact O-CB 3.02Å; N615-T619 PolarHBondContact O-N 3.39Å; N615-T619 PolarHBondContact O-OG1 3.26Å
616	S	92.6	Very high	90.9	Very high	4 Å²	4	50.6 Å²	50.6	3%	0.028	27%	0.265	C	S	.	.	H	α-helix	trans	-57.3	-50	166.1	177	0	0	0	0	110.9	I561 I562 N612 F613 T619 L620	I561-S616 WeakPolarHBondContact O-CB 3.38Å; I562-S616 WeakPolarHBondContact CA-OG 3.37Å; I562-S616 PolarHBondContact O-OG 3.14Å; N612-S616 PolarHBondContact O-N 2.91Å; F613-S616 WeakPolarHBondContact O-CB 3.29Å; F613-S616 PolarHBondContact O-N 2.93Å; S616-T619 PolarHBondContact O-N 2.91Å; S616-L620 WeakPolarHBondContact O-CB 3.43Å; S616-L620 PolarHBondContact O-N 3.45Å
617	E	89.9	Confident	90.7	Very high	58 Å²	58	53.3 Å²	53.3	27%	0.271	28%	0.277	S	S	.	.	H	α-helix	trans	-58.6	-51.5	177.8	-69.4	-119.7	84.3	0	0	112.6	F613 T619 L620 E621 K648	F613-E617 HydrophobicContact CD1-CG 3.93Å; F613-E617 HydrophobicContact CE1-CG 3.54Å; F613-E617 HydrophobicContact CZ-CG 3.92Å; F613-E617 WeakPolarHBondContact O-CG 3.45Å; F613-E617 PolarHBondContact O-N 3.06Å; E617-T619 VanDerWaalsContact C-N 3.29Å; E617-T619 PolarHBondContact O-N 2.95Å; E617-L620 PolarHBondContact O-N 3.44Å; E617-E621 WeakPolarHBondContact O-CB 3.28Å; E617-E621 PolarHBondContact O-N 3Å; E617-K648 WeakPolarHBondContact OE1-CD 3.28Å; E617-K648 WeakPolarHBondContact OE1-CE 3.27Å; E617-K648 IonicContact OE1-NZ 3.89Å; E617-K648 PolarHBondContact OE1-NZ 3.07Å; E617-K648 IonicContact OE2-NZ 3.54Å; E617-K648 PolarHBondContact OE2-NZ 3.25Å
618	K	89.5	Confident	90.8	Very high	105 Å²	105	56.3 Å²	56.3	46%	0.457	30%	0.298	S	S	.	.	H	α-helix	trans	-58.4	-40.3	177.8	-68.2	163.5	-160.5	164.4	0	111.9	S614 N615 T622	S614-K618 VanDerWaalsContact O-CD 3.23Å; S614-K618 WeakPolarHBondContact O-CD 3.1Å; S614-K618 VanDerWaalsContact O-CE 3.25Å; S614-K618 WeakPolarHBondContact O-CE 3.49Å; S614-K618 WeakPolarHBondContact O-CG 3.4Å; S614-K618 PolarHBondContact O-N 3.32Å; N615-K618 PolarHBondContact OD1-NZ 3.16Å; N615-K618 VanDerWaalsContact OD1-NZ 3.12Å; K618-T622 VanDerWaalsContact O-CB 3.28Å; K618-T622 WeakPolarHBondContact O-CB 3.4Å; K618-T622 PolarHBondContact O-N 2.84Å; K618-T622 PolarHBondContact O-OG1 3.38Å
619	T	93.1	Very high	91	Very high	26 Å²	26	57.3 Å²	57.3	16%	0.16	31%	0.306	C	S	.	.	H	α-helix	trans	-72.9	-40.4	-179.9	-55.6	0	0	0	0	111.2	Q558 I561 I562 N615 S616 E617 T622 C623	Q558-T619 HydrophobicContact CB-CG2 4.36Å; I561-T619 HydrophobicContact CG2-CG2 4.29Å; I561-T619 WeakPolarHBondContact CG2-OG1 3.42Å; I562-T619 HydrophobicContact CD1-CG2 4.1Å; I562-T619 HydrophobicContact CG1-CG2 3.92Å; N615-T619 VanDerWaalsContact O-CB 3.26Å; N615-T619 WeakPolarHBondContact O-CB 3.02Å; N615-T619 PolarHBondContact O-N 3.39Å; N615-T619 PolarHBondContact O-OG1 3.26Å; S616-T619 PolarHBondContact O-N 2.91Å; E617-T619 VanDerWaalsContact C-N 3.29Å; E617-T619 PolarHBondContact O-N 2.95Å; T619-T622 PolarHBondContact O-N 3.27Å; T619-C623 VanDerWaalsContact O-CB 3.3Å; T619-C623 WeakPolarHBondContact O-CB 3.5Å; T619-C623 PolarHBondContact O-N 2.9Å; T619-C623 PolarHBondContact O-SG 2.88Å
620	L	93.4	Very high	91	Very high	17 Å²	17	56.9 Å²	56.9	9%	0.089	30%	0.304	C	S	.	.	H	α-helix	trans	-61.2	-48.3	175.2	-179.6	67.8	0	0	0	111.3	I562 S616 E617 C623 W624 F630 L647 K648 L651	I562-L620 HydrophobicContact CD1-CB 4.43Å; I562-L620 HydrophobicContact CD1-CD1 4.4Å; I562-L620 HydrophobicContact CG1-CB 4.44Å; I562-L620 HydrophobicContact CG2-CD1 4.41Å; S616-L620 WeakPolarHBondContact O-CB 3.43Å; S616-L620 PolarHBondContact O-N 3.45Å; E617-L620 PolarHBondContact O-N 3.44Å; L620-C623 PolarHBondContact O-N 2.99Å; L620-W624 VanDerWaalsContact O-CB 3.3Å; L620-W624 WeakPolarHBondContact O-CB 3.41Å; L620-W624 PolarHBondContact O-N 2.79Å; L620-F630 HydrophobicContact CD1-CE1 3.82Å; L620-F630 HydrophobicContact CD1-CZ 3.62Å; L620-L647 HydrophobicContact CD1-CD2 3.76Å; L620-L647 HydrophobicContact CD1-CG 4.3Å; L620-K648 HydrophobicContact CD2-CB 4.12Å; L620-L651 HydrophobicContact CD2-CD1 3.87Å
621	E	91.5	Very high	91.1	Very high	128 Å²	128	59.3 Å²	59.3	60%	0.598	32%	0.315	S	S	*	.	H	α-helix	trans	-64.8	-42.5	176.5	-179.3	172.9	-167.7	0	0	111.7	E617 C623 W624 N625	E617-E621 WeakPolarHBondContact O-CB 3.28Å; E617-E621 PolarHBondContact O-N 3Å; E621-C623 PolarHBondContact O-N 3.2Å; E621-W624 PolarHBondContact O-N 3.39Å; E621-N625 VanDerWaalsContact CG-ND2 3.33Å; E621-N625 WeakPolarHBondContact CG-ND2 3.47Å; E621-N625 WeakPolarHBondContact O-CB 3.35Å; E621-N625 PolarHBondContact O-N 3.42Å; E621-N625 PolarHBondContact O-ND2 2.72Å
622	T	91.4	Very high	91.3	Very high	78 Å²	78	61.6 Å²	61.6	48%	0.479	32%	0.32	S	S	.	.	H	α-helix	trans	-60.6	-46.3	175.7	-61	0	0	0	0	111.2	K618 T619 N625 T626	K618-T622 VanDerWaalsContact O-CB 3.28Å; K618-T622 WeakPolarHBondContact O-CB 3.4Å; K618-T622 PolarHBondContact O-N 2.84Å; K618-T622 PolarHBondContact O-OG1 3.38Å; T619-T622 PolarHBondContact O-N 3.27Å; T622-N625 PolarHBondContact O-N 2.93Å; T622-T626 HydrophobicContact CG2-CG2 4.45Å; T622-T626 WeakPolarHBondContact O-CB 3.43Å; T622-T626 VanDerWaalsContact O-CG2 3.32Å; T622-T626 WeakPolarHBondContact O-CG2 3.42Å; T622-T626 PolarHBondContact O-N 2.74Å; T622-T626 PolarHBondContact O-OG1 3.36Å
623	C	93.2	Very high	91.5	Very high	0 Å²	0	60.6 Å²	60.6	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-64.1	-41	176	-74.7	0	0	0	0	112.1	L554 T619 L620 E621 T626 K627 F630	L554-C623 HydrophobicContact CD1-CB 4.38Å; L554-C623 HydrophobicContact CD2-CB 3.88Å; T619-C623 VanDerWaalsContact O-CB 3.3Å; T619-C623 WeakPolarHBondContact O-CB 3.5Å; T619-C623 PolarHBondContact O-N 2.9Å; T619-C623 PolarHBondContact O-SG 2.88Å; L620-C623 PolarHBondContact O-N 2.99Å; E621-C623 PolarHBondContact O-N 3.2Å; C623-T626 PolarHBondContact O-N 3.13Å; C623-K627 WeakPolarHBondContact O-CB 3.49Å; C623-K627 PolarHBondContact O-N 3.49Å; C623-F630 HydrophobicContact CB-CD1 3.83Å; C623-F630 HydrophobicContact CB-CE1 3.96Å; C623-F630 HydrophobicContact CB-CG 4.41Å
624	W	91.2	Very high	91.5	Very high	108 Å²	108	59.9 Å²	59.9	41%	0.409	31%	0.313	S	S	.	.	H	α-helix	trans	-61.3	-44.5	175.6	-175.9	-91.4	0	0	0	112.3	L620 E621 Q631 C634	L620-W624 VanDerWaalsContact O-CB 3.3Å; L620-W624 WeakPolarHBondContact O-CB 3.41Å; L620-W624 PolarHBondContact O-N 2.79Å; E621-W624 PolarHBondContact O-N 3.39Å; W624-Q631 HydrophobicContact CD2-CG 4.16Å; W624-Q631 HydrophobicContact CE3-CG 4.33Å; W624-Q631 WeakPolarHBondContact O-CG 3.32Å; W624-Q631 PolarHBondContact O-NE2 3.12Å; W624-C634 HydrophobicContact CZ3-CB 3.83Å
625	N	91.1	Very high	91.7	Very high	105 Å²	105	60.8 Å²	60.8	56%	0.561	31%	0.311	S	S	*	.	H	α-helix	trans	-79.4	-18.2	-177.4	-70.9	-29.9	0	0	0	113.9	E621 T622	E621-N625 VanDerWaalsContact CG-ND2 3.33Å; E621-N625 WeakPolarHBondContact CG-ND2 3.47Å; E621-N625 WeakPolarHBondContact O-CB 3.35Å; E621-N625 PolarHBondContact O-N 3.42Å; E621-N625 PolarHBondContact O-ND2 2.72Å; T622-N625 PolarHBondContact O-N 2.93Å
626	T	90.4	Very high	91.8	Very high	98 Å²	98	61.6 Å²	61.6	60%	0.601	31%	0.313	S	S	*	.	H	α-helix	trans	-109.8	-26.7	-177	59.4	0	0	0	0	115.2	T622 C623	T622-T626 HydrophobicContact CG2-CG2 4.45Å; T622-T626 WeakPolarHBondContact O-CB 3.43Å; T622-T626 VanDerWaalsContact O-CG2 3.32Å; T622-T626 WeakPolarHBondContact O-CG2 3.42Å; T622-T626 PolarHBondContact O-N 2.74Å; T622-T626 PolarHBondContact O-OG1 3.36Å; C623-T626 PolarHBondContact O-N 3.13Å
627	K	90.5	Very high	91.6	Very high	58 Å²	58	62.7 Å²	62.7	25%	0.252	32%	0.317	S	S	.	.			trans	-118.5	98.4	-172.5	-67.9	179.5	170.9	-172.7	0	112.1	L554 C623 S629 F630 Q631	L554-K627 HydrophobicContact CD2-CD 3.52Å; C623-K627 WeakPolarHBondContact O-CB 3.49Å; C623-K627 PolarHBondContact O-N 3.49Å; K627-S629 PolarHBondContact O-N 2.99Å; K627-F630 HydrophobicContact CB-CB 3.88Å; K627-F630 WeakPolarHBondContact O-CA 3.49Å; K627-F630 WeakPolarHBondContact O-CB 3.31Å; K627-F630 PolarHBondContact O-N 3.36Å; K627-Q631 PolarHBondContact O-N 2.77Å; K627-Q631 VanDerWaalsContact O-N 3.16Å
628	S	92.3	Very high	91.5	Very high	70 Å²	70	62.6 Å²	62.6	49%	0.49	32%	0.318	S	S	.	.	H	α-helix	trans	-66.1	-17	175	62.6	0	0	0	0	114.3	K632	S628-K632 WeakPolarHBondContact O-CD 3.46Å; S628-K632 VanDerWaalsContact O-CG 3.28Å; S628-K632 WeakPolarHBondContact O-CG 3.24Å; S628-K632 PolarHBondContact O-N 3.01Å
629	S	93.1	Very high	91.3	Very high	60 Å²	60	67.1 Å²	67.1	42%	0.42	33%	0.333	S	S	.	.	H	α-helix	trans	-66.1	-41.4	166	48.7	0	0	0	0	111.9	K627 F633	K627-S629 PolarHBondContact O-N 2.99Å; S629-F633 WeakPolarHBondContact O-CB 3.4Å; S629-F633 PolarHBondContact O-N 2.93Å
630	F	94.4	Very high	90.8	Very high	0 Å²	0	72.6 Å²	72.6	0%	0	36%	0.358	C	S	.	.	H	α-helix	trans	-69.7	-43.7	178.4	-178.7	-113.1	0	0	0	111.8	L548 I553 L554 L620 C623 K627 K632 F633 C634 L647	L548-F630 HydrophobicContact CD1-CE2 3.97Å; L548-F630 HydrophobicContact CD2-CD2 3.77Å; L548-F630 HydrophobicContact CD2-CE2 3.84Å; I553-F630 HydrophobicContact CG2-CB 3.95Å; I553-F630 HydrophobicContact CG2-CD2 4.29Å; L554-F630 HydrophobicContact CD1-CD2 3.85Å; L554-F630 HydrophobicContact CD1-CE2 3.66Å; L554-F630 HydrophobicContact CD1-CZ 4.22Å; L554-F630 HydrophobicContact CD2-CB 4.08Å; L554-F630 HydrophobicContact CD2-CD2 3.87Å; L554-F630 HydrophobicContact CD2-CE2 4.5Å; L554-F630 HydrophobicContact CD2-CG 3.97Å; L554-F630 HydrophobicContact CG-CD2 3.82Å; L554-F630 HydrophobicContact CG-CE2 4.15Å; L554-F630 HydrophobicContact CG-CG 4.43Å; L620-F630 HydrophobicContact CD1-CE1 3.82Å; L620-F630 HydrophobicContact CD1-CZ 3.62Å; C623-F630 HydrophobicContact CB-CD1 3.83Å; C623-F630 HydrophobicContact CB-CE1 3.96Å; C623-F630 HydrophobicContact CB-CG 4.41Å; K627-F630 HydrophobicContact CB-CB 3.88Å; K627-F630 WeakPolarHBondContact O-CA 3.49Å; K627-F630 WeakPolarHBondContact O-CB 3.31Å; K627-F630 PolarHBondContact O-N 3.36Å; F630-K632 PolarHBondContact O-N 3.44Å; F630-F633 PolarHBondContact O-N 2.97Å; F630-C634 WeakPolarHBondContact O-CB 3.49Å; F630-C634 PolarHBondContact O-N 3.24Å; F630-C634 PolarHBondContact O-SG 2.95Å; F630-L647 HydrophobicContact CZ-CD2 4.05Å
631	Q	92	Very high	90.1	Very high	58 Å²	58	72.1 Å²	72.1	27%	0.271	36%	0.356	S	S	.	.	H	α-helix	trans	-51.3	-56.1	171.8	-66.1	174.2	-21.9	0	0	111.5	W624 K627 F633 C634 E635	W624-Q631 HydrophobicContact CD2-CG 4.16Å; W624-Q631 HydrophobicContact CE3-CG 4.33Å; W624-Q631 WeakPolarHBondContact O-CG 3.32Å; W624-Q631 PolarHBondContact O-NE2 3.12Å; K627-Q631 PolarHBondContact O-N 2.77Å; K627-Q631 VanDerWaalsContact O-N 3.16Å; Q631-F633 VanDerWaalsContact C-N 3.33Å; Q631-F633 PolarHBondContact O-N 2.97Å; Q631-C634 PolarHBondContact O-N 2.87Å; Q631-C634 VanDerWaalsContact O-N 3.16Å; Q631-E635 PolarHBondContact O-N 3.22Å
632	K	92.4	Very high	89.2	Confident	141 Å²	141	77.5 Å²	77.5	61%	0.613	37%	0.37	S	S	*	.	H	α-helix	trans	-61.5	-37.8	-179.4	-71.8	171.6	-177.7	176.7	0	113.2	S628 F630 M636	S628-K632 WeakPolarHBondContact O-CD 3.46Å; S628-K632 VanDerWaalsContact O-CG 3.28Å; S628-K632 WeakPolarHBondContact O-CG 3.24Å; S628-K632 PolarHBondContact O-N 3.01Å; F630-K632 PolarHBondContact O-N 3.44Å; K632-M636 VanDerWaalsContact O-CB 3.28Å; K632-M636 WeakPolarHBondContact O-CB 3.28Å; K632-M636 PolarHBondContact O-N 3.09Å
633	F	93.9	Very high	88.2	Confident	4 Å²	4	78.2 Å²	78.2	2%	0.018	37%	0.372	C	S	.	.	H	α-helix	trans	-63.4	-49.1	173.7	170.9	-83.1	0	0	0	111.3	Y544 P547 L548 E551 I553 S629 F630 Q631 E635 M636 K637	Y544-F633 AromaticContact CD1-CE1 3.98Å; Y544-F633 HydrophobicContact CD1-CE1 3.98Å; P547-F633 HydrophobicContact CB-CE2 3.98Å; P547-F633 HydrophobicContact CB-CZ 3.99Å; L548-F633 HydrophobicContact CD1-CE1 4.09Å; L548-F633 HydrophobicContact CD1-CZ 4.5Å; L548-F633 HydrophobicContact CD2-CD1 3.66Å; L548-F633 HydrophobicContact CD2-CD2 4.42Å; L548-F633 HydrophobicContact CD2-CE1 3.42Å; L548-F633 VanDerWaalsContact CD2-CE1 3.42Å; L548-F633 HydrophobicContact CD2-CE2 4.15Å; L548-F633 HydrophobicContact CD2-CG 4.17Å; L548-F633 HydrophobicContact CD2-CZ 3.68Å; L548-F633 HydrophobicContact CG-CD1 4.26Å; L548-F633 HydrophobicContact CG-CE1 3.5Å; L548-F633 HydrophobicContact CG-CE2 4.35Å; L548-F633 HydrophobicContact CG-CZ 3.55Å; E551-F633 WeakPolarHBondContact OE1-CE2 3.22Å; E551-F633 WeakPolarHBondContact OE2-CD2 3.5Å; I553-F633 HydrophobicContact CD1-CB 3.85Å; I553-F633 HydrophobicContact CD1-CD2 3.21Å; I553-F633 HydrophobicContact CD1-CE2 3.87Å; I553-F633 HydrophobicContact CD1-CG 3.75Å; S629-F633 WeakPolarHBondContact O-CB 3.4Å; S629-F633 PolarHBondContact O-N 2.93Å; F630-F633 PolarHBondContact O-N 2.97Å; Q631-F633 VanDerWaalsContact C-N 3.33Å; Q631-F633 PolarHBondContact O-N 2.97Å; F633-E635 PolarHBondContact O-N 3.12Å; F633-M636 HydrophobicContact CD2-CE 4.37Å; F633-M636 WeakPolarHBondContact O-CB 3.25Å; F633-M636 PolarHBondContact O-N 3.35Å; F633-M636 VanDerWaalsContact O-N 3.15Å; F633-K637 HydrophobicContact CD1-CG 4.13Å; F633-K637 HydrophobicContact CD2-CG 4.47Å; F633-K637 HydrophobicContact CE1-CG 3.81Å; F633-K637 HydrophobicContact CE2-CD 4.3Å; F633-K637 HydrophobicContact CE2-CG 4.25Å; F633-K637 HydrophobicContact CG-CG 4.44Å; F633-K637 HydrophobicContact CZ-CD 4.23Å; F633-K637 HydrophobicContact CZ-CG 3.88Å; F633-K637 WeakPolarHBondContact O-CG 3.43Å; F633-K637 PolarHBondContact O-N 2.79Å
634	C	91.3	Very high	87.4	Confident	8 Å²	8	86.4 Å²	86.4	5%	0.054	41%	0.407	C	S	.	.	H	α-helix	trans	-61.6	-43	178.5	-74.7	0	0	0	0	111.7	W624 F630 Q631 M636 L638	W624-C634 HydrophobicContact CZ3-CB 3.83Å; F630-C634 WeakPolarHBondContact O-CB 3.49Å; F630-C634 PolarHBondContact O-N 3.24Å; F630-C634 PolarHBondContact O-SG 2.95Å; Q631-C634 PolarHBondContact O-N 2.87Å; Q631-C634 VanDerWaalsContact O-N 3.16Å; C634-M636 PolarHBondContact O-N 3.37Å; C634-L638 WeakPolarHBondContact O-CB 3.29Å; C634-L638 PolarHBondContact O-N 2.87Å
635	E	89.7	Confident	87.2	Confident	78 Å²	78	84.1 Å²	84.1	36%	0.364	40%	0.403	S	S	.	.	H	α-helix	trans	-58.5	-44.7	171.6	-74.4	180	-133.9	0	0	112.6	Q631 F633 L638 R639	Q631-E635 PolarHBondContact O-N 3.22Å; F633-E635 PolarHBondContact O-N 3.12Å; E635-L638 PolarHBondContact O-N 3.25Å; E635-R639 VanDerWaalsContact O-CG 3.26Å; E635-R639 WeakPolarHBondContact O-CG 3.39Å; E635-R639 PolarHBondContact O-N 3.39Å; E635-R639 IonicContact OE2-NH2 3.73Å; E635-R639 PolarHBondContact OE2-NH2 2.92Å
636	M	90.3	Very high	87.1	Confident	89 Å²	89	82.2 Å²	82.2	44%	0.438	40%	0.396	S	S	.	.	H	α-helix	trans	-63.2	-50.1	179.5	177.6	178.3	63.5	0	0	111.5	K632 F633 C634 L638 R639 M640	K632-M636 VanDerWaalsContact O-CB 3.28Å; K632-M636 WeakPolarHBondContact O-CB 3.28Å; K632-M636 PolarHBondContact O-N 3.09Å; F633-M636 HydrophobicContact CD2-CE 4.37Å; F633-M636 WeakPolarHBondContact O-CB 3.25Å; F633-M636 PolarHBondContact O-N 3.35Å; F633-M636 VanDerWaalsContact O-N 3.15Å; C634-M636 PolarHBondContact O-N 3.37Å; M636-L638 VanDerWaalsContact C-N 3.32Å; M636-L638 PolarHBondContact O-N 2.68Å; M636-R639 PolarHBondContact O-N 3.49Å; M636-M640 PolarHBondContact O-N 3.36Å
637	K	88.5	Confident	87.2	Confident	28 Å²	28	78.1 Å²	78.1	12%	0.122	37%	0.37	C	S	.	.	H	α-helix	trans	-66.6	-34.3	178	-54.9	-61	-174.6	-173.3	0	111.2	M543 Y544 E551 F633 M640 N641	M543-K637 HydrophobicContact CE-CB 4.41Å; M543-K637 WeakPolarHBondContact CE-O 3.35Å; M543-K637 WeakPolarHBondContact O-CD 2.99Å; M543-K637 WeakPolarHBondContact O-CE 3.23Å; M543-K637 WeakPolarHBondContact O-CG 3.11Å; Y544-K637 HydrophobicContact CD1-CB 4.28Å; Y544-K637 HydrophobicContact CD1-CG 4.48Å; Y544-K637 HydrophobicContact CE1-CB 3.72Å; Y544-K637 HydrophobicContact CE1-CG 4.37Å; E551-K637 IonicContact OE1-NZ 2.68Å; E551-K637 PolarHBondContact OE1-NZ 3.39Å; F633-K637 HydrophobicContact CD1-CG 4.13Å; F633-K637 HydrophobicContact CD2-CG 4.47Å; F633-K637 HydrophobicContact CE1-CG 3.81Å; F633-K637 HydrophobicContact CE2-CD 4.3Å; F633-K637 HydrophobicContact CE2-CG 4.25Å; F633-K637 HydrophobicContact CG-CG 4.44Å; F633-K637 HydrophobicContact CZ-CD 4.23Å; F633-K637 HydrophobicContact CZ-CG 3.88Å; F633-K637 WeakPolarHBondContact O-CG 3.43Å; F633-K637 PolarHBondContact O-N 2.79Å; K637-M640 CarbonylContact O-C 3.6Å; K637-M640 PolarHBondContact O-N 3.37Å; K637-M640 VanDerWaalsContact O-N 3.16Å; K637-N641 PolarHBondContact O-N 3.05Å
638	L	87.2	Confident	87.2	Confident	56 Å²	56	81 Å²	81	29%	0.293	38%	0.383	S	S	.	.	H	α-helix	trans	-62.5	-42.8	173.8	177.8	57.6	0	0	0	112.4	C634 E635 M636 M640 N641 K644 L645 P646	C634-L638 WeakPolarHBondContact O-CB 3.29Å; C634-L638 PolarHBondContact O-N 2.87Å; E635-L638 PolarHBondContact O-N 3.25Å; M636-L638 VanDerWaalsContact C-N 3.32Å; M636-L638 PolarHBondContact O-N 2.68Å; L638-M640 PolarHBondContact O-N 3.3Å; L638-N641 PolarHBondContact O-N 3.37Å; L638-K644 WeakPolarHBondContact CD1-O 3.49Å; L638-L645 WeakPolarHBondContact CD1-O 3.39Å; L638-P646 HydrophobicContact CD2-CB 4.49Å
639	R	85.4	Confident	87.2	Confident	200 Å²	200	78.7 Å²	78.7	76%	0.755	37%	0.368	S	S	*	.	H	α-helix	trans	-65	-23.9	174.4	-68.7	170.7	-159.1	-152.2	9.2	112.9	E635 M636	E635-R639 VanDerWaalsContact O-CG 3.26Å; E635-R639 WeakPolarHBondContact O-CG 3.39Å; E635-R639 PolarHBondContact O-N 3.39Å; E635-R639 IonicContact OE2-NH2 3.73Å; E635-R639 PolarHBondContact OE2-NH2 2.92Å; M636-R639 PolarHBondContact O-N 3.49Å
640	M	84.1	Confident	87.3	Confident	140 Å²	140	75.9 Å²	75.9	69%	0.69	35%	0.348	S	S	*	.	H	α-helix	trans	-91.8	-20.5	175	-65.8	-169.8	126.9	0	0	113.9	M543 M636 K637 L638 R642	M543-M640 HydrophobicContact CE-CB 3.87Å; M636-M640 PolarHBondContact O-N 3.36Å; K637-M640 CarbonylContact O-C 3.6Å; K637-M640 PolarHBondContact O-N 3.37Å; K637-M640 VanDerWaalsContact O-N 3.16Å; L638-M640 PolarHBondContact O-N 3.3Å; M640-R642 PolarHBondContact O-N 3.14Å
641	N	77.4	Confident	87.3	Confident	8 Å²	8	76 Å²	76	4%	0.043	35%	0.349	C	S	.	.			trans	-68.9	112	177.9	-179.7	6.1	0	0	0	110.1	M543 K637 L638 N643 K644 L645	M543-N641 HydrophobicContact CE-CB 4.4Å; K637-N641 PolarHBondContact O-N 3.05Å; L638-N641 PolarHBondContact O-N 3.37Å; N641-N643 PolarHBondContact O-N 3.19Å; N641-N643 VanDerWaalsContact O-N 3.12Å; N641-N643 PolarHBondContact OD1-N 2.81Å; N641-K644 PolarHBondContact O-N 3.28Å; N641-L645 PolarHBondContact ND2-O 3.34Å
642	R	73.2	Confident	87.3	Confident	240 Å²	240	74.7 Å²	74.7	91%	0.906	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.5	-32.4	178	-71.5	-175.4	174	-175.3	-1.5	113.1	M640 K644	M640-R642 PolarHBondContact O-N 3.14Å; R642-K644 VanDerWaalsContact C-N 3.31Å
643	N	70.9	Confident	87.4	Confident	94 Å²	94	69.8 Å²	69.8	50%	0.503	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.6	-6.3	-176.8	-61.1	8	0	0	0	112.5	N641 L645	N641-N643 PolarHBondContact O-N 3.19Å; N641-N643 VanDerWaalsContact O-N 3.12Å; N641-N643 PolarHBondContact OD1-N 2.81Å; N643-L645 PolarHBondContact O-N 2.99Å
644	K	76.9	Confident	87.4	Confident	171 Å²	171	69.6 Å²	69.6	74%	0.743	32%	0.323	S	S	*	.			trans	52.7	12.2	-179	-60.4	-173.8	178.9	-177.5	0	116.5	L638 N641 R642	L638-K644 WeakPolarHBondContact CD1-O 3.49Å; N641-K644 PolarHBondContact O-N 3.28Å; R642-K644 VanDerWaalsContact C-N 3.31Å
645	L	85.3	Confident	87.4	Confident	61 Å²	61	71.5 Å²	71.5	32%	0.319	33%	0.332	S	S	.	.			trans	-73.8	129.9	175.4	-67.5	176	0	0	0	110.4	L638 N641 N643 A649 L650	L638-L645 WeakPolarHBondContact CD1-O 3.39Å; N641-L645 PolarHBondContact ND2-O 3.34Å; N643-L645 PolarHBondContact O-N 2.99Å; L645-A649 HydrophobicContact CD2-CB 4.4Å; L645-L650 HydrophobicContact CB-CD2 3.92Å; L645-L650 HydrophobicContact CB-CG 4.03Å; L645-L650 HydrophobicContact CD1-CD2 3.91Å
646	P	90.3	Very high	87.5	Confident	65 Å²	65	72.7 Å²	72.7	42%	0.422	34%	0.338	S	S	.	.			trans	-69.3	158.8	173	29.8	-35.2	0	0	0	111.3	L638 K648 A649 L650	L638-P646 HydrophobicContact CD2-CB 4.49Å; P646-K648 VanDerWaalsContact C-N 3.32Å; P646-K648 PolarHBondContact O-N 2.83Å; P646-A649 HydrophobicContact CG-CB 3.83Å; P646-A649 WeakPolarHBondContact O-CA 3.14Å; P646-A649 WeakPolarHBondContact O-CB 3.42Å; P646-A649 PolarHBondContact O-N 3.09Å; P646-L650 PolarHBondContact O-N 3.21Å; P646-L650 VanDerWaalsContact O-N 3.14Å
647	L	92.6	Very high	87.7	Confident	11 Å²	11	69.4 Å²	69.4	6%	0.058	32%	0.32	C	S	.	.	H	α-helix	trans	-52.1	-44.4	-175.1	176.3	55.7	0	0	0	113.4	L540 Y544 F563 L620 F630 A649 L650 L651	L540-L647 HydrophobicContact CD2-CD1 3.6Å; Y544-L647 HydrophobicContact CD1-CB 4.41Å; Y544-L647 HydrophobicContact CD1-CD1 4.02Å; Y544-L647 HydrophobicContact CD1-CD2 4.01Å; Y544-L647 HydrophobicContact CD1-CG 4.38Å; Y544-L647 HydrophobicContact CD2-CD1 4.21Å; Y544-L647 HydrophobicContact CE1-CB 4.06Å; Y544-L647 HydrophobicContact CE1-CD1 4.39Å; Y544-L647 HydrophobicContact CE1-CD2 4.42Å; Y544-L647 HydrophobicContact CG-CD1 3.93Å; F563-L647 HydrophobicContact CE1-CD1 3.84Å; F563-L647 HydrophobicContact CZ-CD1 3.85Å; F563-L647 HydrophobicContact CZ-CD2 4.19Å; L620-L647 HydrophobicContact CD1-CD2 3.76Å; L620-L647 HydrophobicContact CD1-CG 4.3Å; F630-L647 HydrophobicContact CZ-CD2 4.05Å; L647-A649 VanDerWaalsContact C-N 3.33Å; L647-A649 PolarHBondContact O-N 2.92Å; L647-L650 PolarHBondContact O-N 3.23Å; L647-L650 VanDerWaalsContact O-N 3.13Å; L647-L651 HydrophobicContact CD1-CD1 3.92Å; L647-L651 HydrophobicContact CD1-CG 4Å; L647-L651 HydrophobicContact CG-CD1 3.92Å; L647-L651 HydrophobicContact CG-CG 4.46Å; L647-L651 WeakPolarHBondContact O-CG 3.44Å; L647-L651 PolarHBondContact O-N 2.77Å
648	K	91	Very high	87.9	Confident	119 Å²	119	68.2 Å²	68.2	52%	0.517	32%	0.316	S	S	.	.	H	α-helix	trans	-60.4	-37.5	175.8	176.5	161.7	169.2	144.8	0	113.2	E617 L620 P646 L650 L651 V652	E617-K648 WeakPolarHBondContact OE1-CD 3.28Å; E617-K648 WeakPolarHBondContact OE1-CE 3.27Å; E617-K648 IonicContact OE1-NZ 3.89Å; E617-K648 PolarHBondContact OE1-NZ 3.07Å; E617-K648 IonicContact OE2-NZ 3.54Å; E617-K648 PolarHBondContact OE2-NZ 3.25Å; L620-K648 HydrophobicContact CD2-CB 4.12Å; P646-K648 VanDerWaalsContact C-N 3.32Å; P646-K648 PolarHBondContact O-N 2.83Å; K648-L650 VanDerWaalsContact C-N 3.31Å; K648-L650 PolarHBondContact O-N 3.17Å; K648-L651 PolarHBondContact O-N 3.44Å; K648-V652 PolarHBondContact O-N 3.35Å
649	A	91.8	Very high	88.1	Confident	21 Å²	21	68.4 Å²	68.4	17%	0.174	32%	0.32	C	S	.	.	H	α-helix	trans	-76.6	-16.1	177.8	0	0	0	0	0	113.7	L645 P646 L647 Q653	L645-A649 HydrophobicContact CD2-CB 4.4Å; P646-A649 HydrophobicContact CG-CB 3.83Å; P646-A649 WeakPolarHBondContact O-CA 3.14Å; P646-A649 WeakPolarHBondContact O-CB 3.42Å; P646-A649 PolarHBondContact O-N 3.09Å; L647-A649 VanDerWaalsContact C-N 3.33Å; L647-A649 PolarHBondContact O-N 2.92Å; A649-Q653 WeakPolarHBondContact O-CG 3.43Å
650	L	93.8	Very high	88.5	Confident	1 Å²	1	62.4 Å²	62.4	1%	0.005	30%	0.297	C	S	.	.	H	α-helix	trans	-83.3	-43.6	167.6	-67.2	171.3	0	0	0	110.9	A536 T539 L540 Y544 L645 P646 L647 K648 V652 Q653	A536-L650 HydrophobicContact CB-CD2 4.06Å; T539-L650 HydrophobicContact CG2-CD1 3.91Å; L540-L650 HydrophobicContact CD1-CB 4.36Å; L540-L650 HydrophobicContact CD2-CB 3.58Å; L540-L650 HydrophobicContact CD2-CD1 4.4Å; L540-L650 HydrophobicContact CG-CB 3.93Å; Y544-L650 HydrophobicContact CE2-CD1 3.81Å; L645-L650 HydrophobicContact CB-CD2 3.92Å; L645-L650 HydrophobicContact CB-CG 4.03Å; L645-L650 HydrophobicContact CD1-CD2 3.91Å; P646-L650 PolarHBondContact O-N 3.21Å; P646-L650 VanDerWaalsContact O-N 3.14Å; L647-L650 PolarHBondContact O-N 3.23Å; L647-L650 VanDerWaalsContact O-N 3.13Å; K648-L650 VanDerWaalsContact C-N 3.31Å; K648-L650 PolarHBondContact O-N 3.17Å; L650-V652 VanDerWaalsContact C-N 3.32Å; L650-V652 PolarHBondContact O-N 2.77Å; L650-Q653 WeakPolarHBondContact O-CB 3.43Å; L650-Q653 WeakPolarHBondContact O-CG 3.37Å; L650-Q653 PolarHBondContact O-N 3.26Å
651	L	94.6	Very high	89	Confident	3 Å²	3	55.8 Å²	55.8	2%	0.016	27%	0.265	C	S	.	.	H	α-helix	trans	-63	-32.5	-178.2	-74.8	167.6	0	0	0	113.5	L540 I562 F563 F609 F613 L620 L647 K648 Q653 P654	L540-L651 HydrophobicContact CD1-CD2 4.32Å; L540-L651 HydrophobicContact CD2-CD2 3.82Å; L540-L651 HydrophobicContact CD2-CG 3.9Å; I562-L651 HydrophobicContact CG2-CD1 3.94Å; F563-L651 HydrophobicContact CD1-CD2 4.11Å; F563-L651 HydrophobicContact CE1-CD2 4.22Å; F609-L651 WeakPolarHBondContact CZ-O 3.39Å; F613-L651 HydrophobicContact CE2-CB 4.33Å; F613-L651 WeakPolarHBondContact CE2-O 3.44Å; L620-L651 HydrophobicContact CD2-CD1 3.87Å; L647-L651 HydrophobicContact CD1-CD1 3.92Å; L647-L651 HydrophobicContact CD1-CG 4Å; L647-L651 HydrophobicContact CG-CD1 3.92Å; L647-L651 HydrophobicContact CG-CG 4.46Å; L647-L651 WeakPolarHBondContact O-CG 3.44Å; L647-L651 PolarHBondContact O-N 2.77Å; K648-L651 PolarHBondContact O-N 3.44Å; L651-Q653 VanDerWaalsContact C-N 3.28Å; L651-Q653 PolarHBondContact O-N 2.85Å; L651-P654 VanDerWaalsContact O-CD 3.26Å; L651-P654 WeakPolarHBondContact O-CD 3.38Å
652	V	93.4	Very high	89.7	Confident	31 Å²	31	56.7 Å²	56.7	19%	0.188	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-11.5	179.3	73.4	0	0	0	0	114.1	F613 K648 L650 I655 Q656	F613-V652 HydrophobicContact CZ-CB 4.04Å; F613-V652 HydrophobicContact CZ-CG2 4.08Å; K648-V652 PolarHBondContact O-N 3.35Å; L650-V652 VanDerWaalsContact C-N 3.32Å; L650-V652 PolarHBondContact O-N 2.77Å; V652-I655 PolarHBondContact O-N 3.09Å; V652-Q656 HydrophobicContact CG2-CG 4.5Å; V652-Q656 PolarHBondContact O-N 3.28Å
653	Q	93.6	Very high	90.6	Very high	37 Å²	37	50.2 Å²	50.2	17%	0.173	25%	0.251	C	S	.	.	H	α-helix	trans	-61.3	-36.9	-172.4	-67.1	-165.3	4.2	0	0	115.7	Y533 A649 L650 L651 I655 Q656 R657	Y533-Q653 HydrophobicContact CD2-CB 4.26Å; Y533-Q653 HydrophobicContact CE2-CB 4.1Å; A649-Q653 WeakPolarHBondContact O-CG 3.43Å; L650-Q653 WeakPolarHBondContact O-CB 3.43Å; L650-Q653 WeakPolarHBondContact O-CG 3.37Å; L650-Q653 PolarHBondContact O-N 3.26Å; L651-Q653 VanDerWaalsContact C-N 3.28Å; L651-Q653 PolarHBondContact O-N 2.85Å; Q653-I655 VanDerWaalsContact C-N 3.31Å; Q653-I655 PolarHBondContact O-N 3.37Å; Q653-Q656 CarbonylContact O-C 3.58Å; Q653-Q656 PolarHBondContact O-N 2.85Å; Q653-Q656 VanDerWaalsContact O-N 3.16Å; Q653-R657 WeakPolarHBondContact O-CB 3.47Å; Q653-R657 PolarHBondContact O-N 2.81Å
654	P	94.1	Very high	91.7	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-60.7	-37.6	177.6	-25.4	36.6	0	0	0	113.6	Y533 L537 L569 Y606 F609 L651 R657	Y533-P654 HydrophobicContact CE2-CG 4.27Å; Y533-P654 WeakPolarHBondContact OH-CA 3.42Å; Y533-P654 WeakPolarHBondContact OH-CB 3.32Å; L537-P654 HydrophobicContact CD2-CG 4.31Å; L569-P654 HydrophobicContact CD1-CB 4.01Å; L569-P654 HydrophobicContact CD1-CG 4.04Å; Y606-P654 HydrophobicContact CE1-CB 3.99Å; Y606-P654 WeakPolarHBondContact CE1-O 3.4Å; F609-P654 HydrophobicContact CD1-CB 3.92Å; F609-P654 HydrophobicContact CD1-CG 4.38Å; F609-P654 HydrophobicContact CE1-CB 3.72Å; F609-P654 HydrophobicContact CE1-CG 3.82Å; F609-P654 HydrophobicContact CE2-CG 4.25Å; F609-P654 HydrophobicContact CZ-CB 4.19Å; F609-P654 HydrophobicContact CZ-CG 3.76Å; L651-P654 VanDerWaalsContact O-CD 3.26Å; L651-P654 WeakPolarHBondContact O-CD 3.38Å; P654-R657 VanDerWaalsContact O-CB 3.32Å; P654-R657 WeakPolarHBondContact O-CB 3.45Å; P654-R657 PolarHBondContact O-N 3.24Å; P654-R657 VanDerWaalsContact O-N 3.16Å
655	I	91.6	Very high	92.6	Very high	49 Å²	49	38.2 Å²	38.2	25%	0.251	20%	0.196	S	C	.	.	H	α-helix	trans	-63.3	-44.4	175	-65.9	160.4	0	0	0	110.2	F609 V610 F613 V652 Q653 R657 P659	F609-I655 HydrophobicContact CE1-CD1 4.5Å; F609-I655 HydrophobicContact CE1-CG1 4.33Å; V610-I655 HydrophobicContact CG2-CG1 3.73Å; F613-I655 HydrophobicContact CB-CD1 4.2Å; F613-I655 HydrophobicContact CD1-CD1 3.57Å; F613-I655 HydrophobicContact CD2-CD1 3.77Å; F613-I655 HydrophobicContact CE1-CD1 3.81Å; F613-I655 HydrophobicContact CE2-CD1 4Å; F613-I655 HydrophobicContact CG-CD1 3.56Å; F613-I655 HydrophobicContact CZ-CD1 4.01Å; V652-I655 PolarHBondContact O-N 3.09Å; Q653-I655 VanDerWaalsContact C-N 3.31Å; Q653-I655 PolarHBondContact O-N 3.37Å; I655-R657 PolarHBondContact O-N 3.39Å; I655-P659 WeakPolarHBondContact O-CD 3.32Å
656	Q	92.3	Very high	92.9	Very high	103 Å²	103	39.4 Å²	39.4	48%	0.481	20%	0.198	S	C	.	.	H	α-helix	trans	-70.4	-15.5	177.8	-62.6	177.4	-10.6	0	0	113.2	V652 Q653	V652-Q656 HydrophobicContact CG2-CG 4.5Å; V652-Q656 PolarHBondContact O-N 3.28Å; Q653-Q656 CarbonylContact O-C 3.58Å; Q653-Q656 PolarHBondContact O-N 2.85Å; Q653-Q656 VanDerWaalsContact O-N 3.16Å
657	R	94.5	Very high	93	Very high	19 Å²	19	40.9 Å²	40.9	7%	0.072	20%	0.195	C	C	.	.	H	α-helix	trans	-75.6	-46.8	-170.8	-169.5	70.1	-171.3	170.5	5.3	113.2	V529 E530 Y533 Q653 P654 I655 R660 Y661	V529-R657 VanDerWaalsContact C-NH2 3.3Å; V529-R657 VanDerWaalsContact O-CZ 3.3Å; V529-R657 PolarHBondContact O-NH1 3.45Å; V529-R657 PolarHBondContact O-NH2 3.39Å; E530-R657 IonicContact OE2-CZ 3.99Å; E530-R657 IonicContact OE2-NE 3.57Å; E530-R657 IonicContact OE2-NH2 2.76Å; E530-R657 PolarHBondContact OE2-NH2 2.95Å; Y533-R657 HydrophobicContact CD1-CG 3.88Å; Y533-R657 HydrophobicContact CD2-CG 4.42Å; Y533-R657 HydrophobicContact CE1-CB 4.33Å; Y533-R657 HydrophobicContact CE1-CG 3.6Å; Y533-R657 HydrophobicContact CE2-CB 4.2Å; Y533-R657 HydrophobicContact CE2-CG 4.2Å; Y533-R657 HydrophobicContact CG-CG 4.27Å; Q653-R657 WeakPolarHBondContact O-CB 3.47Å; Q653-R657 PolarHBondContact O-N 2.81Å; P654-R657 VanDerWaalsContact O-CB 3.32Å; P654-R657 WeakPolarHBondContact O-CB 3.45Å; P654-R657 PolarHBondContact O-N 3.24Å; P654-R657 VanDerWaalsContact O-N 3.16Å; I655-R657 PolarHBondContact O-N 3.39Å; R657-R660 WeakPolarHBondContact O-CB 3.26Å; R657-R660 PolarHBondContact O-N 3.38Å; R657-R660 VanDerWaalsContact O-N 3.09Å; R657-Y661 HydrophobicContact CG-CD2 4.33Å; R657-Y661 HydrophobicContact CG-CE2 3.53Å; R657-Y661 PolarHBondContact NE-OH 3.32Å; R657-Y661 PolarHBondContact NH2-OH 3.42Å; R657-Y661 WeakPolarHBondContact O-CD2 3.42Å; R657-Y661 PolarHBondContact O-N 3.15Å
658	I	92.4	Very high	93	Very high	4 Å²	4	40.5 Å²	40.5	2%	0.021	19%	0.193	C	C	.	.	H	α-helix	trans	-61.5	-48.2	-174.2	-59.3	-54.2	0	0	0	112.1	F597 Y606 R660 Y661 I689 L692 A693	F597-I658 HydrophobicContact CE1-CD1 4.22Å; Y606-I658 HydrophobicContact CD1-CD1 4.04Å; Y606-I658 HydrophobicContact CD1-CG1 3.86Å; Y606-I658 HydrophobicContact CD2-CD1 4.23Å; Y606-I658 HydrophobicContact CE1-CD1 3.75Å; Y606-I658 HydrophobicContact CE1-CG1 3.84Å; Y606-I658 HydrophobicContact CE2-CD1 3.96Å; Y606-I658 HydrophobicContact CG-CD1 4.28Å; Y606-I658 HydrophobicContact CG-CG1 4.37Å; I658-R660 PolarHBondContact O-N 3.12Å; I658-Y661 HydrophobicContact CD1-CD2 4.24Å; I658-Y661 HydrophobicContact CD1-CE2 4.29Å; I658-Y661 PolarHBondContact O-N 2.73Å; I658-Y661 VanDerWaalsContact O-N 3.12Å; I658-I689 HydrophobicContact CG2-CG2 4.25Å; I658-L692 HydrophobicContact CD1-CD2 3.73Å; I658-L692 HydrophobicContact CD1-CG 4.42Å; I658-L692 HydrophobicContact CG1-CD2 4.38Å; I658-L692 HydrophobicContact CG2-CG 4.29Å; I658-A693 HydrophobicContact CG2-CB 3.84Å
659	P	90.9	Very high	93.1	Very high	59 Å²	59	36 Å²	36	38%	0.383	17%	0.174	S	C	.	.	H	α-helix	trans	-61.7	-26.3	174.8	-23.8	35.2	0	0	0	113.9	I655 Y661 E662 L663	I655-P659 WeakPolarHBondContact O-CD 3.32Å; P659-Y661 VanDerWaalsContact C-N 3.33Å; P659-Y661 PolarHBondContact O-N 3.19Å; P659-E662 PolarHBondContact O-N 3.13Å; P659-L663 PolarHBondContact O-N 3.48Å
660	R	93.3	Very high	93.1	Very high	74 Å²	74	42.3 Å²	42.3	28%	0.279	20%	0.2	S	C	.	.	H	α-helix	trans	-68.5	-32.5	177.5	-170.3	66.5	-173.8	-161.6	4.9	111.9	V529 R657 I658 L664	V529-R660 HydrophobicContact CG1-CG 4.3Å; R657-R660 WeakPolarHBondContact O-CB 3.26Å; R657-R660 PolarHBondContact O-N 3.38Å; R657-R660 VanDerWaalsContact O-N 3.09Å; I658-R660 PolarHBondContact O-N 3.12Å; R660-L664 HydrophobicContact CG-CD1 4.24Å; R660-L664 WeakPolarHBondContact O-CG 3.33Å; R660-L664 PolarHBondContact O-N 2.86Å
661	Y	95.4	Very high	92.8	Very high	1 Å²	1	42.5 Å²	42.5	0%	0.004	20%	0.202	C	C	.	.	H	α-helix	trans	-69.9	-40.2	176.3	-65.3	-59.9	0	0	0	112.5	L526 E530 H573 F576 F597 R657 I658 P659 L663 L664 I665 I689	L526-Y661 HydrophobicContact CD1-CD1 4.02Å; L526-Y661 HydrophobicContact CD1-CE1 4.19Å; E530-Y661 PolarHBondContact OE1-OH 3.43Å; E530-Y661 WeakPolarHBondContact OE2-CE1 3.49Å; E530-Y661 PolarHBondContact OE2-OH 3.26Å; H573-Y661 PolarHBondContact CE1-OH 3.03Å; H573-Y661 PolarHBondContact ND1-OH 3.22Å; F576-Y661 HydrophobicContact CE1-CE1 4.09Å; F597-Y661 HydrophobicContact CE1-CD2 4.11Å; F597-Y661 AromaticContact CE1-CE2 3.85Å; F597-Y661 HydrophobicContact CE1-CE2 3.85Å; F597-Y661 HydrophobicContact CE2-CD2 4.37Å; F597-Y661 HydrophobicContact CE2-CE2 4.32Å; F597-Y661 AromaticContact CZ-CD2 3.69Å; F597-Y661 HydrophobicContact CZ-CD2 3.69Å; F597-Y661 HydrophobicContact CZ-CE1 4.29Å; F597-Y661 AromaticContact CZ-CE2 3.36Å; F597-Y661 HydrophobicContact CZ-CE2 3.36Å; F597-Y661 HydrophobicContact CZ-CG 4.3Å; F597-Y661 AromaticContact CZ-CZ 3.7Å; R657-Y661 HydrophobicContact CG-CD2 4.33Å; R657-Y661 HydrophobicContact CG-CE2 3.53Å; R657-Y661 PolarHBondContact NE-OH 3.32Å; R657-Y661 PolarHBondContact NH2-OH 3.42Å; R657-Y661 WeakPolarHBondContact O-CD2 3.42Å; R657-Y661 PolarHBondContact O-N 3.15Å; I658-Y661 HydrophobicContact CD1-CD2 4.24Å; I658-Y661 HydrophobicContact CD1-CE2 4.29Å; I658-Y661 PolarHBondContact O-N 2.73Å; I658-Y661 VanDerWaalsContact O-N 3.12Å; P659-Y661 VanDerWaalsContact C-N 3.33Å; P659-Y661 PolarHBondContact O-N 3.19Å; Y661-L663 VanDerWaalsContact C-N 3.28Å; Y661-L663 PolarHBondContact O-N 3.03Å; Y661-L664 PolarHBondContact O-N 3.21Å; Y661-L664 VanDerWaalsContact O-N 3.08Å; Y661-I665 PolarHBondContact O-N 3.29Å; Y661-I689 HydrophobicContact CD2-CD1 4.48Å; Y661-I689 HydrophobicContact CG-CD1 4.13Å
662	E	91.3	Very high	92.5	Very high	27 Å²	27	42.7 Å²	42.7	13%	0.126	20%	0.203	C	C	.	.	H	α-helix	trans	-55.8	-44.4	176.1	-65.3	-174.2	93.1	0	0	111.5	P659 L664 I665 K666 I689 H690	P659-E662 PolarHBondContact O-N 3.13Å; E662-L664 PolarHBondContact O-N 2.89Å; E662-I665 PolarHBondContact O-N 3.22Å; E662-K666 WeakPolarHBondContact O-CB 3.49Å; E662-K666 WeakPolarHBondContact O-CD 3.43Å; E662-K666 VanDerWaalsContact O-CG 3.29Å; E662-K666 WeakPolarHBondContact O-CG 3.42Å; E662-K666 PolarHBondContact O-N 3.36Å; E662-K666 VanDerWaalsContact O-N 3.07Å; E662-I689 HydrophobicContact CG-CG2 3.85Å; E662-H690 IonicContact OE1-CE1 3.32Å; E662-H690 IonicContact OE1-CG 3.16Å; E662-H690 IonicContact OE1-ND1 2.7Å; E662-H690 PolarHBondContact OE1-ND1 3.35Å
663	L	92.7	Very high	92.2	Very high	104 Å²	104	42.6 Å²	42.6	55%	0.545	20%	0.203	S	C	.	.	H	α-helix	trans	-65.7	-35.7	177.5	-63.5	174.6	0	0	0	112.7	P659 Y661 R667	P659-L663 PolarHBondContact O-N 3.48Å; Y661-L663 VanDerWaalsContact C-N 3.28Å; Y661-L663 PolarHBondContact O-N 3.03Å; L663-R667 PolarHBondContact O-N 2.98Å
664	L	94.6	Very high	91.8	Very high	12 Å²	12	49 Å²	49	6%	0.063	23%	0.231	C	C	.	.	H	α-helix	trans	-72.7	-40.6	177.8	-73.2	167.7	0	0	0	112	E525 L526 V529 R660 Y661 E662 L668	E525-L664 HydrophobicContact CG-CD2 4.09Å; L526-L664 HydrophobicContact CD1-CD1 3.93Å; V529-L664 HydrophobicContact CG1-CD1 4.13Å; R660-L664 HydrophobicContact CG-CD1 4.24Å; R660-L664 WeakPolarHBondContact O-CG 3.33Å; R660-L664 PolarHBondContact O-N 2.86Å; Y661-L664 PolarHBondContact O-N 3.21Å; Y661-L664 VanDerWaalsContact O-N 3.08Å; E662-L664 PolarHBondContact O-N 2.89Å; L664-L668 WeakPolarHBondContact O-CB 3.26Å; L664-L668 PolarHBondContact O-N 2.95Å
665	I	94.3	Very high	91.2	Very high	2 Å²	2	56.8 Å²	56.8	1%	0.01	27%	0.272	C	S	.	.	H	α-helix	trans	-67.8	-43.9	177.6	-65.7	-179.9	0	0	0	111	L593 Y661 E662 R667 L668 L669 L682 A685 E686 I689	L593-I665 HydrophobicContact CD1-CD1 3.92Å; L593-I665 HydrophobicContact CD1-CG1 4.06Å; L593-I665 HydrophobicContact CD2-CD1 4.27Å; Y661-I665 PolarHBondContact O-N 3.29Å; E662-I665 PolarHBondContact O-N 3.22Å; I665-R667 VanDerWaalsContact C-N 3.32Å; I665-R667 PolarHBondContact O-N 3.12Å; I665-L668 CarbonylContact O-C 3.55Å; I665-L668 WeakPolarHBondContact O-CA 3.31Å; I665-L668 WeakPolarHBondContact O-CB 3.34Å; I665-L668 PolarHBondContact O-N 3.37Å; I665-L669 HydrophobicContact CG2-CD1 4.02Å; I665-L669 HydrophobicContact CG2-CG 4.33Å; I665-L669 PolarHBondContact O-N 3.07Å; I665-L682 HydrophobicContact CG2-CD2 4.49Å; I665-A685 HydrophobicContact CD1-CB 4.08Å; I665-E686 HydrophobicContact CG2-CB 3.87Å; I665-E686 HydrophobicContact CG2-CG 4.46Å; I665-I689 HydrophobicContact CD1-CD1 3.57Å; I665-I689 HydrophobicContact CD1-CG1 4.34Å
666	K	92.3	Very high	91	Very high	85 Å²	85	56.9 Å²	56.9	37%	0.37	27%	0.27	S	S	.	.	H	α-helix	trans	-54.8	-46.6	177.1	-75.2	165	-177.2	167.3	0	111.9	E662 L668 L669 E670 E686	E662-K666 WeakPolarHBondContact O-CB 3.49Å; E662-K666 WeakPolarHBondContact O-CD 3.43Å; E662-K666 VanDerWaalsContact O-CG 3.29Å; E662-K666 WeakPolarHBondContact O-CG 3.42Å; E662-K666 PolarHBondContact O-N 3.36Å; E662-K666 VanDerWaalsContact O-N 3.07Å; K666-L668 VanDerWaalsContact C-N 3.31Å; K666-L668 PolarHBondContact O-N 3.29Å; K666-L669 PolarHBondContact O-N 2.8Å; K666-E670 WeakPolarHBondContact O-CG 3.45Å; K666-E670 PolarHBondContact O-N 2.74Å; K666-E686 WeakPolarHBondContact CE-OE1 3.4Å; K666-E686 VanDerWaalsContact CG-OE1 3.27Å; K666-E686 WeakPolarHBondContact CG-OE1 3.38Å; K666-E686 IonicContact NZ-OE1 3.71Å
667	R	92	Very high	90.7	Very high	96 Å²	96	56.1 Å²	56.1	36%	0.362	28%	0.276	S	S	.	.	H	α-helix	trans	-70.2	-23.2	175.7	-176.1	167.1	158.7	-137	-13.9	114	E525 L663 I665 S671	E525-R667 IonicContact OE1-CZ 2.69Å; E525-R667 IonicContact OE1-NH1 2.72Å; E525-R667 PolarHBondContact OE1-NH1 2.88Å; E525-R667 IonicContact OE2-CZ 3.41Å; E525-R667 IonicContact OE2-NH1 3.6Å; E525-R667 PolarHBondContact OE2-NH1 3Å; E525-R667 IonicContact OE2-NH2 3.75Å; E525-R667 PolarHBondContact OE2-NH2 2.99Å; L663-R667 PolarHBondContact O-N 2.98Å; I665-R667 VanDerWaalsContact C-N 3.32Å; I665-R667 PolarHBondContact O-N 3.12Å; R667-S671 PolarHBondContact O-N 2.69Å; R667-S671 PolarHBondContact O-OG 3.07Å
668	L	93.2	Very high	90.5	Very high	3 Å²	3	55.2 Å²	55.2	2%	0.016	27%	0.272	C	S	.	.	H	α-helix	trans	-78.7	-36.4	173.3	-175.9	57.9	0	0	0	111.8	R519 A522 V523 V589 L664 I665 K666 S671 T672 L682	R519-L668 HydrophobicContact CG-CD1 3.65Å; A522-L668 HydrophobicContact CB-CB 4.37Å; A522-L668 HydrophobicContact CB-CD1 3.84Å; V523-L668 HydrophobicContact CG2-CD1 3.6Å; V523-L668 HydrophobicContact CG2-CD2 4.1Å; V589-L668 HydrophobicContact CG1-CD2 3.63Å; L664-L668 WeakPolarHBondContact O-CB 3.26Å; L664-L668 PolarHBondContact O-N 2.95Å; I665-L668 CarbonylContact O-C 3.55Å; I665-L668 WeakPolarHBondContact O-CA 3.31Å; I665-L668 WeakPolarHBondContact O-CB 3.34Å; I665-L668 PolarHBondContact O-N 3.37Å; K666-L668 VanDerWaalsContact C-N 3.31Å; K666-L668 PolarHBondContact O-N 3.29Å; L668-S671 WeakPolarHBondContact CA-OG 3.22Å; L668-S671 CarbonylContact O-C 3.57Å; L668-S671 PolarHBondContact O-N 2.91Å; L668-S671 PolarHBondContact O-OG 3.37Å; L668-T672 WeakPolarHBondContact O-CB 3.46Å; L668-T672 PolarHBondContact O-N 3.08Å; L668-T672 VanDerWaalsContact O-N 3.09Å; L668-T672 PolarHBondContact O-OG1 3.42Å; L668-L682 HydrophobicContact CD2-CD1 4.13Å; L668-L682 HydrophobicContact CD2-CD2 3.54Å; L668-L682 HydrophobicContact CG-CD1 3.86Å; L668-L682 HydrophobicContact CG-CD2 4.1Å
669	L	92.8	Very high	90.5	Very high	24 Å²	24	56.9 Å²	56.9	13%	0.126	28%	0.28	C	S	.	.	H	α-helix	trans	-63.3	-47.5	169.2	-75.7	166.6	0	0	0	111.2	I665 K666 S671 T672 L682 V683 E686	I665-L669 HydrophobicContact CG2-CD1 4.02Å; I665-L669 HydrophobicContact CG2-CG 4.33Å; I665-L669 PolarHBondContact O-N 3.07Å; K666-L669 PolarHBondContact O-N 2.8Å; L669-S671 PolarHBondContact O-N 2.83Å; L669-T672 PolarHBondContact O-N 2.74Å; L669-L682 HydrophobicContact CD2-CB 3.49Å; L669-L682 VanDerWaalsContact CD2-CB 3.49Å; L669-L682 HydrophobicContact CD2-CD1 4.42Å; L669-L682 HydrophobicContact CG-CB 4.01Å; L669-V683 HydrophobicContact CD1-CG2 4.33Å; L669-V683 HydrophobicContact CD2-CG2 3.75Å; L669-E686 HydrophobicContact CD1-CB 4.49Å; L669-E686 VanDerWaalsContact CD1-OE2 3.26Å; L669-E686 WeakPolarHBondContact CD1-OE2 3.43Å
670	E	91	Very high	90.5	Very high	154 Å²	154	57.4 Å²	57.4	72%	0.72	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.1	-22.7	172.1	-75.3	176.4	-175.2	0	0	114.3	K666	K666-E670 WeakPolarHBondContact O-CG 3.45Å; K666-E670 PolarHBondContact O-N 2.74Å
671	S	88.3	Confident	90.6	Very high	5 Å²	5	56.2 Å²	56.2	4%	0.035	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.3	5.1	179.9	53.5	0	0	0	0	114.7	R519 R667 L668 L669	R519-S671 WeakPolarHBondContact CB-O 3.34Å; R667-S671 PolarHBondContact O-N 2.69Å; R667-S671 PolarHBondContact O-OG 3.07Å; L668-S671 WeakPolarHBondContact CA-OG 3.22Å; L668-S671 CarbonylContact O-C 3.57Å; L668-S671 PolarHBondContact O-N 2.91Å; L668-S671 PolarHBondContact O-OG 3.37Å; L669-S671 PolarHBondContact O-N 2.83Å
672	T	89	Confident	90.5	Very high	7 Å²	7	56.1 Å²	56.1	4%	0.043	29%	0.288	C	S	.	.	S	Bend	trans	-115.4	125.4	179.3	-58.3	0	0	0	0	109.9	R519 L668 L669 Y676 H679 L682	R519-T672 WeakPolarHBondContact CD-OG1 3.47Å; L668-T672 WeakPolarHBondContact O-CB 3.46Å; L668-T672 PolarHBondContact O-N 3.08Å; L668-T672 VanDerWaalsContact O-N 3.09Å; L668-T672 PolarHBondContact O-OG1 3.42Å; L669-T672 PolarHBondContact O-N 2.74Å; T672-Y676 HydrophobicContact CG2-CD1 3.69Å; T672-Y676 HydrophobicContact CG2-CG 4.07Å; T672-H679 HydrophobicContact CG2-CB 4.06Å; T672-L682 HydrophobicContact CG2-CD1 4.27Å
673	P	86.3	Confident	90.6	Very high	30 Å²	30	58.2 Å²	58.2	20%	0.195	30%	0.302	C	S	.	.			trans	-59.9	147.8	175.7	-15.4	24.2	0	0	0	112	L515 D675 Y676 H679	L515-P673 HydrophobicContact CD2-CB 4.5Å; L515-P673 HydrophobicContact CD2-CG 3.89Å; P673-D675 PolarHBondContact O-N 2.91Å; P673-Y676 WeakPolarHBondContact O-CB 3.49Å; P673-Y676 PolarHBondContact O-N 2.64Å; P673-H679 WeakPolarHBondContact O-CB 3.23Å
674	K	85.9	Confident	90.6	Very high	172 Å²	172	58.2 Å²	58.2	75%	0.748	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	-33.5	176.5	-68.7	-167.5	173.6	-169.1	0	113.2	Y676	K674-Y676 PolarHBondContact O-N 2.91Å
675	D	81.8	Confident	90.6	Very high	162 Å²	162	57.7 Å²	57.7	87%	0.866	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.4	3.3	-179	-35.3	-71.4	0	0	0	112.8	P673	P673-D675 PolarHBondContact O-N 2.91Å
676	Y	86.6	Confident	90.6	Very high	51 Å²	51	60 Å²	60	20%	0.2	31%	0.307	C	S	.	.	S	Bend	trans	-88.7	132.8	178	-165.2	-92.9	0	0	0	109.9	L516 R519 T672 P673 K674 D678 H679	L516-Y676 HydrophobicContact CD2-CD2 4.24Å; L516-Y676 HydrophobicContact CD2-CE2 3.85Å; R519-Y676 VanDerWaalsContact CZ-CE1 3.45Å; R519-Y676 PolarHBondContact NH1-OH 2.71Å; T672-Y676 HydrophobicContact CG2-CD1 3.69Å; T672-Y676 HydrophobicContact CG2-CG 4.07Å; P673-Y676 WeakPolarHBondContact O-CB 3.49Å; P673-Y676 PolarHBondContact O-N 2.64Å; K674-Y676 PolarHBondContact O-N 2.91Å; Y676-D678 HydrophobicContact CD1-CB 3.66Å; Y676-D678 HydrophobicContact CE1-CB 3.72Å; Y676-D678 PolarHBondContact O-N 3.21Å; Y676-H679 VanDerWaalsContact O-CB 3.25Å; Y676-H679 WeakPolarHBondContact O-CB 3.4Å; Y676-H679 PolarHBondContact O-N 3.1Å
677	S	85.2	Confident	90.5	Very high	87 Å²	87	58.4 Å²	58.4	61%	0.608	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.4	-35.1	-171.7	51.8	0	0	0	0	114.8	H679	S677-H679 VanDerWaalsContact C-N 3.28Å; S677-H679 PolarHBondContact O-N 3.27Å
678	D	91.2	Very high	90.6	Very high	0 Å²	0	54 Å²	54	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-70.2	-18.4	178.5	-159.5	48.3	0	0	0	113.7	R519 T588 V589 G590 Y676 A680 L681 L682	R519-D678 IonicContact CZ-OD2 3.62Å; R519-D678 IonicContact NE-OD2 3.59Å; R519-D678 IonicContact NH2-OD2 2.71Å; R519-D678 PolarHBondContact NH2-OD2 3.47Å; T588-D678 VanDerWaalsContact CA-OD1 3.25Å; T588-D678 WeakPolarHBondContact CA-OD1 3.36Å; T588-D678 VanDerWaalsContact CB-OD1 3.29Å; T588-D678 WeakPolarHBondContact CB-OD1 3.15Å; T588-D678 HydrophobicContact CG2-CB 4.28Å; V589-D678 PolarHBondContact N-OD1 3.48Å; V589-D678 PolarHBondContact N-OD2 3.43Å; G590-D678 PolarHBondContact N-OD1 3.01Å; Y676-D678 HydrophobicContact CD1-CB 3.66Å; Y676-D678 HydrophobicContact CE1-CB 3.72Å; Y676-D678 PolarHBondContact O-N 3.21Å; D678-A680 PolarHBondContact O-N 2.92Å; D678-L681 PolarHBondContact O-N 3.43Å; D678-L682 HydrophobicContact CB-CD1 4.43Å; D678-L682 WeakPolarHBondContact O-CB 3.34Å; D678-L682 WeakPolarHBondContact O-CG 3.35Å; D678-L682 PolarHBondContact O-N 3.13Å; D678-L682 WeakPolarHBondContact OD2-CD1 3.5Å
679	H	92.6	Very high	90.6	Very high	40 Å²	40	53.9 Å²	53.9	19%	0.185	29%	0.291	C	S	.	.	H	α-helix	trans	-63.9	-43.3	-175.5	-176.6	-73.9	0	0	0	112.5	T672 P673 Y676 S677 L682 V683	T672-H679 HydrophobicContact CG2-CB 4.06Å; P673-H679 WeakPolarHBondContact O-CB 3.23Å; Y676-H679 VanDerWaalsContact O-CB 3.25Å; Y676-H679 WeakPolarHBondContact O-CB 3.4Å; Y676-H679 PolarHBondContact O-N 3.1Å; S677-H679 VanDerWaalsContact C-N 3.28Å; S677-H679 PolarHBondContact O-N 3.27Å; H679-L682 PolarHBondContact O-N 3.24Å; H679-V683 WeakPolarHBondContact O-CG2 3.26Å; H679-V683 PolarHBondContact O-N 3.38Å; H679-V683 VanDerWaalsContact O-N 3.1Å
680	A	91.3	Very high	90.6	Very high	70 Å²	70	56.8 Å²	56.8	58%	0.579	30%	0.303	S	S	*	.	H	α-helix	trans	-62.7	-46.9	177.3	0	0	0	0	0	111.3	D678 L682 V683 E684	D678-A680 PolarHBondContact O-N 2.92Å; A680-L682 VanDerWaalsContact C-N 3.28Å; A680-L682 PolarHBondContact O-N 2.96Å; A680-V683 PolarHBondContact O-N 2.96Å; A680-E684 PolarHBondContact O-N 2.91Å; A680-E684 VanDerWaalsContact O-N 3.09Å
681	L	94	Very high	90.4	Very high	48 Å²	48	55.9 Å²	55.9	25%	0.251	29%	0.293	S	S	.	.	H	α-helix	trans	-61.4	-34.9	177.4	-59.7	169.6	0	0	0	112.1	T588 D591 L594 D678 A685	T588-L681 HydrophobicContact CG2-CD1 4.2Å; D591-L681 HydrophobicContact CB-CD1 4.13Å; L594-L681 HydrophobicContact CD1-CB 4.27Å; L594-L681 HydrophobicContact CD1-CD2 3.91Å; D678-L681 PolarHBondContact O-N 3.43Å; L681-A685 WeakPolarHBondContact O-CB 3.37Å; L681-A685 PolarHBondContact O-N 2.92Å
682	L	94.9	Very high	90.5	Very high	0 Å²	0	56 Å²	56	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-72.3	-35.5	177.2	-74.9	169.1	0	0	0	113.4	V589 L593 I665 L668 L669 T672 D678 H679 A680 A685 E686	V589-L682 HydrophobicContact CG1-CD2 4.17Å; L593-L682 HydrophobicContact CD1-CD2 3.94Å; I665-L682 HydrophobicContact CG2-CD2 4.49Å; L668-L682 HydrophobicContact CD2-CD1 4.13Å; L668-L682 HydrophobicContact CD2-CD2 3.54Å; L668-L682 HydrophobicContact CG-CD1 3.86Å; L668-L682 HydrophobicContact CG-CD2 4.1Å; L669-L682 HydrophobicContact CD2-CB 3.49Å; L669-L682 VanDerWaalsContact CD2-CB 3.49Å; L669-L682 HydrophobicContact CD2-CD1 4.42Å; L669-L682 HydrophobicContact CG-CB 4.01Å; T672-L682 HydrophobicContact CG2-CD1 4.27Å; D678-L682 HydrophobicContact CB-CD1 4.43Å; D678-L682 WeakPolarHBondContact O-CB 3.34Å; D678-L682 WeakPolarHBondContact O-CG 3.35Å; D678-L682 PolarHBondContact O-N 3.13Å; D678-L682 WeakPolarHBondContact OD2-CD1 3.5Å; H679-L682 PolarHBondContact O-N 3.24Å; A680-L682 VanDerWaalsContact C-N 3.28Å; A680-L682 PolarHBondContact O-N 2.96Å; L682-A685 PolarHBondContact O-N 2.67Å; L682-E686 WeakPolarHBondContact O-CB 3.34Å; L682-E686 PolarHBondContact O-N 2.79Å
683	V	93.5	Very high	90.5	Very high	70 Å²	70	56 Å²	56	42%	0.424	29%	0.294	S	S	.	.	H	α-helix	trans	-67.1	-41.2	173.2	171.7	0	0	0	0	110.6	L669 H679 A680 E686 S687	L669-V683 HydrophobicContact CD1-CG2 4.33Å; L669-V683 HydrophobicContact CD2-CG2 3.75Å; H679-V683 WeakPolarHBondContact O-CG2 3.26Å; H679-V683 PolarHBondContact O-N 3.38Å; H679-V683 VanDerWaalsContact O-N 3.1Å; A680-V683 PolarHBondContact O-N 2.96Å; V683-E686 WeakPolarHBondContact O-CB 3.16Å; V683-E686 PolarHBondContact O-N 3.31Å; V683-S687 PolarHBondContact O-N 2.92Å; V683-S687 VanDerWaalsContact O-N 3.09Å
684	E	92.3	Very high	90.4	Very high	105 Å²	105	59.1 Å²	59.1	49%	0.491	31%	0.309	S	S	.	.	H	α-helix	trans	-67.6	-39.8	176	-161.2	-173.6	175	0	0	111.6	L594 A680 S687 A688	L594-E684 HydrophobicContact CD1-CB 4.22Å; L594-E684 HydrophobicContact CD1-CG 4.46Å; L594-E684 HydrophobicContact CD2-CB 3.93Å; L594-E684 HydrophobicContact CD2-CG 3.7Å; A680-E684 PolarHBondContact O-N 2.91Å; A680-E684 VanDerWaalsContact O-N 3.09Å; E684-S687 WeakPolarHBondContact O-CB 3.27Å; E684-S687 PolarHBondContact O-N 3.14Å; E684-A688 PolarHBondContact O-N 2.71Å
685	A	94.5	Very high	90.2	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-63.1	-39.1	173.4	0	0	0	0	0	112.8	L593 L594 I665 L681 L682 S687 A688 I689	L593-A685 HydrophobicContact CB-CB 3.67Å; L593-A685 HydrophobicContact CD1-CB 4.34Å; L594-A685 HydrophobicContact CD2-CB 4.44Å; L594-A685 HydrophobicContact CG-CB 4.21Å; I665-A685 HydrophobicContact CD1-CB 4.08Å; L681-A685 WeakPolarHBondContact O-CB 3.37Å; L681-A685 PolarHBondContact O-N 2.92Å; L682-A685 PolarHBondContact O-N 2.67Å; A685-S687 VanDerWaalsContact C-N 3.32Å; A685-A688 PolarHBondContact O-N 2.94Å; A685-I689 WeakPolarHBondContact O-CG1 3.38Å; A685-I689 PolarHBondContact O-N 3.24Å
686	E	93.9	Very high	90.2	Very high	50 Å²	50	47.9 Å²	47.9	23%	0.234	25%	0.251	C	S	.	.	H	α-helix	trans	-58	-46.8	171.2	-171.8	-179	-170.3	0	0	110.4	I665 K666 L669 L682 V683 A688 I689 H690	I665-E686 HydrophobicContact CG2-CB 3.87Å; I665-E686 HydrophobicContact CG2-CG 4.46Å; K666-E686 WeakPolarHBondContact CE-OE1 3.4Å; K666-E686 VanDerWaalsContact CG-OE1 3.27Å; K666-E686 WeakPolarHBondContact CG-OE1 3.38Å; K666-E686 IonicContact NZ-OE1 3.71Å; L669-E686 HydrophobicContact CD1-CB 4.49Å; L669-E686 VanDerWaalsContact CD1-OE2 3.26Å; L669-E686 WeakPolarHBondContact CD1-OE2 3.43Å; L682-E686 WeakPolarHBondContact O-CB 3.34Å; L682-E686 PolarHBondContact O-N 2.79Å; V683-E686 WeakPolarHBondContact O-CB 3.16Å; V683-E686 PolarHBondContact O-N 3.31Å; E686-A688 PolarHBondContact O-N 2.86Å; E686-I689 PolarHBondContact O-N 3.44Å; E686-H690 VanDerWaalsContact O-CB 3.26Å; E686-H690 WeakPolarHBondContact O-CB 3.26Å; E686-H690 PolarHBondContact O-N 2.92Å
687	S	91.1	Very high	89.6	Confident	53 Å²	53	50.2 Å²	50.2	37%	0.371	27%	0.266	S	S	.	.	H	α-helix	trans	-61.8	-42.6	177.1	-163.2	0	0	0	0	112.5	V683 E684 A685 H690 R691	V683-S687 PolarHBondContact O-N 2.92Å; V683-S687 VanDerWaalsContact O-N 3.09Å; E684-S687 WeakPolarHBondContact O-CB 3.27Å; E684-S687 PolarHBondContact O-N 3.14Å; A685-S687 VanDerWaalsContact C-N 3.32Å; S687-H690 PolarHBondContact O-N 3.2Å; S687-R691 WeakPolarHBondContact O-CB 3.33Å; S687-R691 VanDerWaalsContact O-CG 3.3Å; S687-R691 WeakPolarHBondContact O-CG 3.33Å; S687-R691 PolarHBondContact O-N 3.47Å; S687-R691 PolarHBondContact OG-NH1 3.23Å
688	A	92.3	Very high	88.8	Confident	3 Å²	3	48.5 Å²	48.5	3%	0.025	26%	0.257	C	S	.	.	H	α-helix	trans	-62.3	-47.3	177.4	0	0	0	0	0	112.4	L594 E684 A685 E686 R691 L692	L594-A688 HydrophobicContact CD2-CB 4.41Å; E684-A688 PolarHBondContact O-N 2.71Å; A685-A688 PolarHBondContact O-N 2.94Å; E686-A688 PolarHBondContact O-N 2.86Å; A688-R691 PolarHBondContact O-N 3.03Å; A688-L692 PolarHBondContact O-N 2.93Å
689	I	94	Very high	87.4	Confident	1 Å²	1	50.2 Å²	50.2	1%	0.005	27%	0.268	C	S	.	.	H	α-helix	trans	-69	-36.7	177.9	-63.8	-170.4	0	0	0	111.4	L593 F597 I658 Y661 E662 I665 A685 E686 L692 A693	L593-I689 HydrophobicContact CD2-CD1 4.36Å; F597-I689 HydrophobicContact CB-CD1 4.45Å; F597-I689 HydrophobicContact CB-CG1 3.74Å; F597-I689 HydrophobicContact CD1-CD1 4.46Å; F597-I689 HydrophobicContact CD1-CG1 4.25Å; F597-I689 HydrophobicContact CD2-CD1 3.4Å; F597-I689 VanDerWaalsContact CD2-CD1 3.4Å; F597-I689 HydrophobicContact CD2-CG1 3.68Å; F597-I689 HydrophobicContact CE2-CD1 3.69Å; F597-I689 HydrophobicContact CE2-CG1 4.39Å; F597-I689 HydrophobicContact CG-CD1 3.85Å; F597-I689 HydrophobicContact CG-CG1 3.6Å; F597-I689 HydrophobicContact CZ-CD1 4.35Å; I658-I689 HydrophobicContact CG2-CG2 4.25Å; Y661-I689 HydrophobicContact CD2-CD1 4.48Å; Y661-I689 HydrophobicContact CG-CD1 4.13Å; E662-I689 HydrophobicContact CG-CG2 3.85Å; I665-I689 HydrophobicContact CD1-CD1 3.57Å; I665-I689 HydrophobicContact CD1-CG1 4.34Å; A685-I689 WeakPolarHBondContact O-CG1 3.38Å; A685-I689 PolarHBondContact O-N 3.24Å; E686-I689 PolarHBondContact O-N 3.44Å; I689-L692 WeakPolarHBondContact O-CB 3.48Å; I689-L692 PolarHBondContact O-N 2.95Å; I689-A693 WeakPolarHBondContact O-CB 3.45Å; I689-A693 PolarHBondContact O-N 3.32Å
690	H	91.9	Very high	85.8	Confident	85 Å²	85	52.4 Å²	52.4	39%	0.394	28%	0.278	S	S	.	.	H	α-helix	trans	-64.4	-41.8	175.5	-168.8	64.6	0	0	0	111.8	E662 E686 S687 L692 A693 L694	E662-H690 IonicContact OE1-CE1 3.32Å; E662-H690 IonicContact OE1-CG 3.16Å; E662-H690 IonicContact OE1-ND1 2.7Å; E662-H690 PolarHBondContact OE1-ND1 3.35Å; E686-H690 VanDerWaalsContact O-CB 3.26Å; E686-H690 WeakPolarHBondContact O-CB 3.26Å; E686-H690 PolarHBondContact O-N 2.92Å; S687-H690 PolarHBondContact O-N 3.2Å; H690-L692 VanDerWaalsContact C-N 3.31Å; H690-L692 PolarHBondContact O-N 2.98Å; H690-A693 PolarHBondContact O-N 3.43Å; H690-L694 WeakPolarHBondContact O-CG 3.5Å; H690-L694 PolarHBondContact O-N 3.11Å
691	R	88.6	Confident	83.9	Confident	135 Å²	135	52 Å²	52	51%	0.509	27%	0.269	S	S	.	.	H	α-helix	trans	-58.9	-41	171.5	-72.8	-175.4	-58.9	-111.1	11.7	111.8	S687 A688 R695	S687-R691 WeakPolarHBondContact O-CB 3.33Å; S687-R691 VanDerWaalsContact O-CG 3.3Å; S687-R691 WeakPolarHBondContact O-CG 3.33Å; S687-R691 PolarHBondContact O-N 3.47Å; S687-R691 PolarHBondContact OG-NH1 3.23Å; A688-R691 PolarHBondContact O-N 3.03Å; R691-R695 WeakPolarHBondContact O-CB 3.36Å; R691-R695 PolarHBondContact O-N 2.91Å
692	L	89.7	Confident	81.6	Confident	7 Å²	7	52.2 Å²	52.2	4%	0.037	28%	0.277	C	S	.	.	H	α-helix	trans	-65.7	-43.6	174.9	179.4	57.7	0	0	0	112.2	F597 A603 I658 A688 I689 H690 R695 V696	F597-L692 HydrophobicContact CD1-CD2 3.76Å; F597-L692 HydrophobicContact CE1-CD2 4.39Å; A603-L692 HydrophobicContact CB-CD1 3.79Å; I658-L692 HydrophobicContact CD1-CD2 3.73Å; I658-L692 HydrophobicContact CD1-CG 4.42Å; I658-L692 HydrophobicContact CG1-CD2 4.38Å; I658-L692 HydrophobicContact CG2-CG 4.29Å; A688-L692 PolarHBondContact O-N 2.93Å; I689-L692 WeakPolarHBondContact O-CB 3.48Å; I689-L692 PolarHBondContact O-N 2.95Å; H690-L692 VanDerWaalsContact C-N 3.31Å; H690-L692 PolarHBondContact O-N 2.98Å; L692-R695 PolarHBondContact O-N 3.5Å; L692-V696 HydrophobicContact CD1-CG2 3.89Å; L692-V696 HydrophobicContact CG-CG2 4.39Å; L692-V696 WeakPolarHBondContact O-CB 3.42Å; L692-V696 WeakPolarHBondContact O-CG2 3.42Å; L692-V696 PolarHBondContact O-N 3.16Å
693	A	88.1	Confident	79.5	Confident	6 Å²	6	53.3 Å²	53.3	5%	0.05	29%	0.289	C	S	.	.	H	α-helix	trans	-59.4	-47.4	176.5	0	0	0	0	0	111.4	I658 I689 H690 R695 V696 N697	I658-A693 HydrophobicContact CG2-CB 3.84Å; I689-A693 WeakPolarHBondContact O-CB 3.45Å; I689-A693 PolarHBondContact O-N 3.32Å; H690-A693 PolarHBondContact O-N 3.43Å; A693-R695 VanDerWaalsContact C-N 3.35Å; A693-R695 PolarHBondContact O-N 3.07Å; A693-V696 PolarHBondContact O-N 2.94Å; A693-N697 WeakPolarHBondContact O-CB 3.36Å; A693-N697 PolarHBondContact O-N 3.39Å; A693-N697 PolarHBondContact O-ND2 3.28Å
694	L	84.6	Confident	77.3	Confident	97 Å²	97	53.4 Å²	53.4	51%	0.508	28%	0.284	S	S	.	.	H	α-helix	trans	-60.2	-41.7	174.9	-70	175.5	0	0	0	112.2	H690 A698	H690-L694 WeakPolarHBondContact O-CG 3.5Å; H690-L694 PolarHBondContact O-N 3.11Å; L694-A698 VanDerWaalsContact O-CB 3.31Å; L694-A698 WeakPolarHBondContact O-CB 3.49Å; L694-A698 PolarHBondContact O-N 3.23Å
695	R	82.9	Confident	75	Confident	87 Å²	87	51 Å²	51	33%	0.328	28%	0.275	S	S	.	.	H	α-helix	trans	-69.3	-41.7	179.8	-169.9	179.7	178.2	174.5	-3.2	112.8	E600 M604 R691 L692 A693 A698 V699	E600-R695 VanDerWaalsContact CD-NH1 3.25Å; E600-R695 IonicContact OE1-CZ 3.48Å; E600-R695 VanDerWaalsContact OE1-CZ 3.28Å; E600-R695 IonicContact OE1-NH1 3.45Å; E600-R695 PolarHBondContact OE1-NH1 2.82Å; E600-R695 IonicContact OE1-NH2 3.39Å; E600-R695 PolarHBondContact OE1-NH2 3.33Å; E600-R695 IonicContact OE2-CZ 3.65Å; E600-R695 IonicContact OE2-NH1 3.31Å; E600-R695 PolarHBondContact OE2-NH1 2.89Å; E600-R695 IonicContact OE2-NH2 2.73Å; M604-R695 PolarHBondContact SD-NH2 3.29Å; R691-R695 WeakPolarHBondContact O-CB 3.36Å; R691-R695 PolarHBondContact O-N 2.91Å; L692-R695 PolarHBondContact O-N 3.5Å; A693-R695 VanDerWaalsContact C-N 3.35Å; A693-R695 PolarHBondContact O-N 3.07Å; R695-A698 PolarHBondContact O-N 2.9Å; R695-V699 WeakPolarHBondContact O-CG2 3.33Å; R695-V699 PolarHBondContact O-N 2.72Å
696	V	80.5	Confident	72.8	Confident	11 Å²	11	58.3 Å²	58.3	7%	0.067	31%	0.309	C	S	.	.	H	α-helix	trans	-65.5	-41.5	175.2	171.4	0	0	0	0	110.8	V610 L692 A693 V699 H700	V610-V696 HydrophobicContact CB-CG1 4.25Å; V610-V696 HydrophobicContact CG1-CG1 4.33Å; V610-V696 HydrophobicContact CG2-CG1 3.71Å; L692-V696 HydrophobicContact CD1-CG2 3.89Å; L692-V696 HydrophobicContact CG-CG2 4.39Å; L692-V696 WeakPolarHBondContact O-CB 3.42Å; L692-V696 WeakPolarHBondContact O-CG2 3.42Å; L692-V696 PolarHBondContact O-N 3.16Å; A693-V696 PolarHBondContact O-N 2.94Å; V696-V699 PolarHBondContact O-N 3.16Å; V696-H700 PolarHBondContact O-N 2.98Å
697	N	74.6	Confident	70.6	Confident	99 Å²	99	60.1 Å²	60.1	53%	0.529	32%	0.32	S	S	.	.	H	α-helix	trans	-63.5	-40.7	173.3	-69.9	-14.8	0	0	0	111.8	A693 V699 H700 T701	A693-N697 WeakPolarHBondContact O-CB 3.36Å; A693-N697 PolarHBondContact O-N 3.39Å; A693-N697 PolarHBondContact O-ND2 3.28Å; N697-V699 VanDerWaalsContact C-N 3.32Å; N697-V699 PolarHBondContact O-N 3.37Å; N697-H700 WeakPolarHBondContact O-CB 3.33Å; N697-H700 PolarHBondContact O-N 3.08Å; N697-T701 PolarHBondContact O-N 3.35Å; N697-T701 PolarHBondContact O-OG1 2.65Å
698	A	67.9	Low	68.6	Low	51 Å²	51	59.3 Å²	59.3	42%	0.421	31%	0.312	S	S	.	.	H	α-helix	trans	-62.3	-38.2	176.9	0	0	0	0	0	112.4	L694 R695 T701 A702	L694-A698 VanDerWaalsContact O-CB 3.31Å; L694-A698 WeakPolarHBondContact O-CB 3.49Å; L694-A698 PolarHBondContact O-N 3.23Å; R695-A698 PolarHBondContact O-N 2.9Å; A698-T701 WeakPolarHBondContact CA-OG1 3.33Å; A698-T701 PolarHBondContact O-N 3.2Å; A698-T701 PolarHBondContact O-OG1 2.57Å; A698-A702 WeakPolarHBondContact O-CB 3.41Å; A698-A702 PolarHBondContact O-N 3.26Å
699	V	62.9	Low	66.6	Low	37 Å²	37	62.1 Å²	62.1	22%	0.224	33%	0.328	C	S	.	.	H	α-helix	trans	-69.2	-38.9	173.7	172.2	0	0	0	0	111.5	C607 D611 R695 V696 N697 T701 A702 G703	C607-V699 HydrophobicContact CB-CG2 4.07Å; D611-V699 HydrophobicContact CB-CG1 3.91Å; R695-V699 WeakPolarHBondContact O-CG2 3.33Å; R695-V699 PolarHBondContact O-N 2.72Å; V696-V699 PolarHBondContact O-N 3.16Å; N697-V699 VanDerWaalsContact C-N 3.32Å; N697-V699 PolarHBondContact O-N 3.37Å; V699-T701 PolarHBondContact O-N 3.5Å; V699-A702 PolarHBondContact O-N 2.73Å; V699-G703 PolarHBondContact O-N 3.47Å
700	H	59	Low	64.7	Low	86 Å²	86	66.6 Å²	66.6	40%	0.398	35%	0.352	S	S	.	.	H	α-helix	trans	-58.8	-46.7	171.7	-170.6	-73	0	0	0	111.4	V610 V696 N697 A702 G703 E704	V610-H700 HydrophobicContact CG1-CB 4.2Å; V696-H700 PolarHBondContact O-N 2.98Å; N697-H700 WeakPolarHBondContact O-CB 3.33Å; N697-H700 PolarHBondContact O-N 3.08Å; H700-A702 VanDerWaalsContact C-N 3.32Å; H700-A702 PolarHBondContact O-N 3.48Å; H700-G703 PolarHBondContact O-N 2.74Å; H700-E704 IonicContact CE1-OE1 3.17Å; H700-E704 PolarHBondContact CE1-OE1 3.39Å; H700-E704 IonicContact CE1-OE2 3.73Å; H700-E704 IonicContact ND1-OE1 2.77Å; H700-E704 IonicContact ND1-OE2 2.66Å; H700-E704 PolarHBondContact ND1-OE2 2.77Å; H700-E704 WeakPolarHBondContact O-CG 3.45Å; H700-E704 PolarHBondContact O-N 3.29Å
701	T	51.4	Low	62.9	Low	62 Å²	62	63.2 Å²	63.2	38%	0.38	34%	0.341	S	S	.	.	H	α-helix	trans	-66.6	-30.9	176.4	51.8	0	0	0	0	113	N697 A698 V699 E704 D705	N697-T701 PolarHBondContact O-N 3.35Å; N697-T701 PolarHBondContact O-OG1 2.65Å; A698-T701 WeakPolarHBondContact CA-OG1 3.33Å; A698-T701 PolarHBondContact O-N 3.2Å; A698-T701 PolarHBondContact O-OG1 2.57Å; V699-T701 PolarHBondContact O-N 3.5Å; T701-E704 CarbonylContact O-C 3.54Å; T701-E704 WeakPolarHBondContact O-CB 3.39Å; T701-E704 PolarHBondContact O-N 3.12Å; T701-D705 PolarHBondContact O-N 3.25Å
702	A	46.1	Very low	61.3	Low	51 Å²	51	57.9 Å²	57.9	42%	0.421	32%	0.322	S	S	.	.	H	α-helix	trans	-72	-33.6	174.5	0	0	0	0	0	112.7	A698 V699 H700 E704 D705 E706	A698-A702 WeakPolarHBondContact O-CB 3.41Å; A698-A702 PolarHBondContact O-N 3.26Å; V699-A702 PolarHBondContact O-N 2.73Å; H700-A702 VanDerWaalsContact C-N 3.32Å; H700-A702 PolarHBondContact O-N 3.48Å; A702-E704 VanDerWaalsContact C-N 3.32Å; A702-D705 WeakPolarHBondContact O-CB 3.45Å; A702-D705 PolarHBondContact O-N 2.84Å; A702-E706 PolarHBondContact O-N 3.35Å; A702-E706 VanDerWaalsContact O-N 3.14Å
703	G	48.9	Very low	59.9	Low	24 Å²	24	64.4 Å²	64.4	25%	0.247	35%	0.346	C	S	.	.	H	α-helix	trans	-67.7	-32.3	168.8	0	0	0	0	0	112.4	V699 H700 N707	V699-G703 PolarHBondContact O-N 3.47Å; H700-G703 PolarHBondContact O-N 2.74Å; G703-N707 PolarHBondContact O-ND2 2.68Å
704	E	48.5	Very low	58.6	Low	71 Å²	71	67.1 Å²	67.1	33%	0.332	36%	0.36	S	S	.	.	H	α-helix	trans	-68.2	-37.5	167.1	-68.5	172.8	136.4	0	0	111.4	H700 T701 A702 E706 N707 I708	H700-E704 IonicContact CE1-OE1 3.17Å; H700-E704 PolarHBondContact CE1-OE1 3.39Å; H700-E704 IonicContact CE1-OE2 3.73Å; H700-E704 IonicContact ND1-OE1 2.77Å; H700-E704 IonicContact ND1-OE2 2.66Å; H700-E704 PolarHBondContact ND1-OE2 2.77Å; H700-E704 WeakPolarHBondContact O-CG 3.45Å; H700-E704 PolarHBondContact O-N 3.29Å; T701-E704 CarbonylContact O-C 3.54Å; T701-E704 WeakPolarHBondContact O-CB 3.39Å; T701-E704 PolarHBondContact O-N 3.12Å; A702-E704 VanDerWaalsContact C-N 3.32Å; E704-E706 VanDerWaalsContact C-N 3.34Å; E704-E706 PolarHBondContact O-N 2.81Å; E704-N707 CarbonylContact O-C 3.57Å; E704-N707 WeakPolarHBondContact O-CA 3.33Å; E704-N707 WeakPolarHBondContact O-CB 3.38Å; E704-N707 PolarHBondContact O-N 2.89Å; E704-I708 WeakPolarHBondContact O-CG1 3.24Å; E704-I708 PolarHBondContact O-N 2.88Å
705	D	43.3	Very low	57.7	Low	55 Å²	55	62.8 Å²	62.8	29%	0.294	34%	0.337	S	S	.	.	H	α-helix	trans	-61.2	-34	175.1	-79.1	-44.1	0	0	0	113.1	T701 A702 N707 I708 V709	T701-D705 PolarHBondContact O-N 3.25Å; A702-D705 WeakPolarHBondContact O-CB 3.45Å; A702-D705 PolarHBondContact O-N 2.84Å; D705-N707 VanDerWaalsContact C-N 3.32Å; D705-N707 PolarHBondContact O-N 3.28Å; D705-I708 PolarHBondContact O-N 3.4Å; D705-V709 WeakPolarHBondContact O-CB 3.03Å; D705-V709 VanDerWaalsContact O-CG2 3.29Å; D705-V709 WeakPolarHBondContact O-CG2 3.14Å; D705-V709 PolarHBondContact O-N 2.89Å
706	E	47.9	Very low	56.6	Low	153 Å²	153	59.9 Å²	59.9	72%	0.715	33%	0.327	S	S	*	.	H	α-helix	trans	-62.4	-39.1	170.7	-76.2	-142.9	137	0	0	112.2	A702 E704 V709 D710	A702-E706 PolarHBondContact O-N 3.35Å; A702-E706 VanDerWaalsContact O-N 3.14Å; E704-E706 VanDerWaalsContact C-N 3.34Å; E704-E706 PolarHBondContact O-N 2.81Å; E706-V709 PolarHBondContact O-N 2.84Å; E706-D710 PolarHBondContact O-N 3.37Å
707	N	48.4	Very low	55.7	Low	88 Å²	88	68 Å²	68	47%	0.471	36%	0.362	S	S	.	.	H	α-helix	trans	-70.5	-33.8	176.2	-67.7	-92	0	0	0	111.4	G703 E704 D705 G711	G703-N707 PolarHBondContact O-ND2 2.68Å; E704-N707 CarbonylContact O-C 3.57Å; E704-N707 WeakPolarHBondContact O-CA 3.33Å; E704-N707 WeakPolarHBondContact O-CB 3.38Å; E704-N707 PolarHBondContact O-N 2.89Å; D705-N707 VanDerWaalsContact C-N 3.32Å; D705-N707 PolarHBondContact O-N 3.28Å; N707-G711 PolarHBondContact O-N 3.1Å
708	I	49.7	Very low	55	Low	37 Å²	37	64.8 Å²	64.8	19%	0.19	34%	0.344	C	S	.	.	H	α-helix	trans	-65.2	-44.5	171	-67.2	165	0	0	0	110.4	E704 D705 G711 I712 Q776	E704-I708 WeakPolarHBondContact O-CG1 3.24Å; E704-I708 PolarHBondContact O-N 2.88Å; D705-I708 PolarHBondContact O-N 3.4Å; I708-G711 CarbonylContact O-C 3.53Å; I708-G711 WeakPolarHBondContact O-CA 3.41Å; I708-G711 PolarHBondContact O-N 3.44Å; I708-I712 HydrophobicContact CG2-CD1 3.77Å; I708-I712 HydrophobicContact CG2-CG1 4.45Å; I708-I712 VanDerWaalsContact O-CG1 3.3Å; I708-I712 WeakPolarHBondContact O-CG1 3.46Å; I708-I712 PolarHBondContact O-N 2.99Å; I708-Q776 HydrophobicContact CD1-CB 4.46Å; I708-Q776 HydrophobicContact CG1-CB 3.87Å; I708-Q776 HydrophobicContact CG1-CG 4.5Å
709	V	49.7	Very low	54.9	Low	62 Å²	62	62.9 Å²	62.9	38%	0.376	33%	0.327	S	S	.	.	H	α-helix	trans	-63.7	-43.5	178.1	164.8	0	0	0	0	111.5	D705 E706 I712 R713	D705-V709 WeakPolarHBondContact O-CB 3.03Å; D705-V709 VanDerWaalsContact O-CG2 3.29Å; D705-V709 WeakPolarHBondContact O-CG2 3.14Å; D705-V709 PolarHBondContact O-N 2.89Å; E706-V709 PolarHBondContact O-N 2.84Å; V709-I712 PolarHBondContact O-N 3.36Å; V709-R713 HydrophobicContact CG1-CG 4.47Å; V709-R713 WeakPolarHBondContact O-CB 3.45Å; V709-R713 VanDerWaalsContact O-CG 3.24Å; V709-R713 WeakPolarHBondContact O-CG 3.31Å; V709-R713 PolarHBondContact O-N 3.34Å
710	D	53.8	Low	54.6	Low	94 Å²	94	64 Å²	64	50%	0.503	34%	0.339	S	S	.	.	H	α-helix	trans	-69.9	-32	174.4	-96.5	10.4	0	0	0	112.6	E706 R713 L714	E706-D710 PolarHBondContact O-N 3.37Å; D710-R713 WeakPolarHBondContact OD1-CD 3.5Å; D710-R713 IonicContact OD1-CZ 2.72Å; D710-R713 IonicContact OD1-NE 2.84Å; D710-R713 IonicContact OD1-NH1 3.7Å; D710-R713 PolarHBondContact OD1-NH1 2.74Å; D710-L714 VanDerWaalsContact O-CB 3.25Å; D710-L714 WeakPolarHBondContact O-CB 3.42Å; D710-L714 PolarHBondContact O-N 2.94Å
711	G	54.7	Low	54.2	Low	15 Å²	15	65.6 Å²	65.6	16%	0.155	36%	0.357	C	S	.	.	H	α-helix	trans	-60.1	-46.6	167.5	0	0	0	0	0	112.7	N707 I708 L714 I715	N707-G711 PolarHBondContact O-N 3.1Å; I708-G711 CarbonylContact O-C 3.53Å; I708-G711 WeakPolarHBondContact O-CA 3.41Å; I708-G711 PolarHBondContact O-N 3.44Å; G711-L714 PolarHBondContact O-N 3.46Å; G711-I715 WeakPolarHBondContact O-CG1 3.42Å; G711-I715 PolarHBondContact O-N 3.36Å
712	I	54.2	Low	53.9	Low	23 Å²	23	63.3 Å²	63.3	12%	0.118	35%	0.345	C	S	.	.	H	α-helix	trans	-64.5	-49	176.5	-70.6	164.5	0	0	0	110.6	I708 V709 L714 I715 E716	I708-I712 HydrophobicContact CG2-CD1 3.77Å; I708-I712 HydrophobicContact CG2-CG1 4.45Å; I708-I712 VanDerWaalsContact O-CG1 3.3Å; I708-I712 WeakPolarHBondContact O-CG1 3.46Å; I708-I712 PolarHBondContact O-N 2.99Å; V709-I712 PolarHBondContact O-N 3.36Å; I712-L714 PolarHBondContact O-N 2.94Å; I712-I715 CarbonylContact O-C 3.49Å; I712-I715 WeakPolarHBondContact O-CB 3.43Å; I712-I715 PolarHBondContact O-N 3.32Å; I712-I715 VanDerWaalsContact O-N 3.1Å; I712-E716 HydrophobicContact CG2-CG 4.44Å; I712-E716 WeakPolarHBondContact O-CG 3.35Å; I712-E716 PolarHBondContact O-N 3.03Å
713	R	60.8	Low	54.2	Low	143 Å²	143	66.6 Å²	66.6	54%	0.54	36%	0.36	S	S	.	.	H	α-helix	trans	-55.2	-38.2	174.5	-74.2	163.9	170.9	169.8	2.4	111.7	V709 D710 K717	V709-R713 HydrophobicContact CG1-CG 4.47Å; V709-R713 WeakPolarHBondContact O-CB 3.45Å; V709-R713 VanDerWaalsContact O-CG 3.24Å; V709-R713 WeakPolarHBondContact O-CG 3.31Å; V709-R713 PolarHBondContact O-N 3.34Å; D710-R713 WeakPolarHBondContact OD1-CD 3.5Å; D710-R713 IonicContact OD1-CZ 2.72Å; D710-R713 IonicContact OD1-NE 2.84Å; D710-R713 IonicContact OD1-NH1 3.7Å; D710-R713 PolarHBondContact OD1-NH1 2.74Å; R713-K717 VanDerWaalsContact O-CB 3.27Å; R713-K717 WeakPolarHBondContact O-CB 3.23Å; R713-K717 PolarHBondContact O-N 3.34Å
714	L	61	Low	54.2	Low	64 Å²	64	71 Å²	71	34%	0.335	38%	0.378	S	S	.	.	H	α-helix	trans	-72.6	-39.9	177.7	-172.7	56.8	0	0	0	112.2	D710 G711 I712 K717 L718 L773	D710-L714 VanDerWaalsContact O-CB 3.25Å; D710-L714 WeakPolarHBondContact O-CB 3.42Å; D710-L714 PolarHBondContact O-N 2.94Å; G711-L714 PolarHBondContact O-N 3.46Å; I712-L714 PolarHBondContact O-N 2.94Å; L714-K717 PolarHBondContact O-N 3.01Å; L714-L718 WeakPolarHBondContact O-CG 3.43Å; L714-L718 PolarHBondContact O-N 3.15Å; L714-L773 HydrophobicContact CD2-CD1 3.74Å; L714-L773 HydrophobicContact CD2-CD2 3.84Å; L714-L773 HydrophobicContact CD2-CG 4.27Å; L714-L773 HydrophobicContact CG-CD1 4.1Å
715	I	64.6	Low	54.4	Low	5 Å²	5	70.1 Å²	70.1	3%	0.026	38%	0.377	C	S	.	.	H	α-helix	trans	-57.8	-48.4	169.5	-71.4	168.7	0	0	0	110.2	G711 I712 K717 L718 L719 Y730 F750 L775	G711-I715 WeakPolarHBondContact O-CG1 3.42Å; G711-I715 PolarHBondContact O-N 3.36Å; I712-I715 CarbonylContact O-C 3.49Å; I712-I715 WeakPolarHBondContact O-CB 3.43Å; I712-I715 PolarHBondContact O-N 3.32Å; I712-I715 VanDerWaalsContact O-N 3.1Å; I715-K717 VanDerWaalsContact C-N 3.3Å; I715-K717 PolarHBondContact O-N 3.41Å; I715-L718 CarbonylContact O-C 3.57Å; I715-L718 WeakPolarHBondContact O-CA 3.4Å; I715-L718 WeakPolarHBondContact O-CB 3.19Å; I715-L718 PolarHBondContact O-N 3.47Å; I715-L719 HydrophobicContact CG2-CD1 3.5Å; I715-L719 HydrophobicContact CG2-CG 4Å; I715-L719 VanDerWaalsContact O-CB 3.28Å; I715-L719 WeakPolarHBondContact O-CB 3.24Å; I715-L719 VanDerWaalsContact O-CG 3.31Å; I715-L719 WeakPolarHBondContact O-CG 3.45Å; I715-L719 PolarHBondContact O-N 3.35Å; I715-Y730 HydrophobicContact CD1-CD2 3.76Å; I715-Y730 HydrophobicContact CD1-CE2 4.43Å; I715-Y730 HydrophobicContact CD1-CG 3.99Å; I715-F750 HydrophobicContact CG2-CE1 4.14Å; I715-F750 HydrophobicContact CG2-CZ 3.83Å; I715-L775 HydrophobicContact CD1-CD1 3.85Å; I715-L775 HydrophobicContact CD1-CD2 3.84Å; I715-L775 HydrophobicContact CD1-CG 4.4Å; I715-L775 HydrophobicContact CG1-CD1 4.07Å; I715-L775 HydrophobicContact CG1-CD2 3.87Å
716	E	61.1	Low	54.7	Low	27 Å²	27	74.1 Å²	74.1	13%	0.126	41%	0.406	C	S	.	.	H	α-helix	trans	-63.3	-36.5	179.5	-70.4	-180	153.4	0	0	112.4	I712 L718 L719 A720 A722 L724	I712-E716 HydrophobicContact CG2-CG 4.44Å; I712-E716 WeakPolarHBondContact O-CG 3.35Å; I712-E716 PolarHBondContact O-N 3.03Å; E716-L718 VanDerWaalsContact C-N 3.3Å; E716-L718 PolarHBondContact O-N 3.19Å; E716-L719 PolarHBondContact O-N 3.34Å; E716-A720 WeakPolarHBondContact O-CA 3.26Å; E716-A720 PolarHBondContact O-N 2.81Å; E716-A722 HydrophobicContact CG-CB 4.47Å; E716-L724 VanDerWaalsContact OE1-CD2 3.3Å; E716-L724 WeakPolarHBondContact OE1-CD2 3.49Å; E716-L724 WeakPolarHBondContact OE1-CG 3.19Å; E716-L724 VanDerWaalsContact OE2-CD2 3.28Å; E716-L724 WeakPolarHBondContact OE2-CD2 3.37Å; E716-L724 VanDerWaalsContact OE2-CG 3.29Å; E716-L724 WeakPolarHBondContact OE2-CG 3.45Å
717	K	61.5	Low	55.4	Low	182 Å²	182	71.6 Å²	71.6	79%	0.791	40%	0.401	S	S	*	.	H	α-helix	trans	-67.8	-27.1	173.6	-161.3	170.8	-170.2	170.9	0	113	R713 L714 I715	R713-K717 VanDerWaalsContact O-CB 3.27Å; R713-K717 WeakPolarHBondContact O-CB 3.23Å; R713-K717 PolarHBondContact O-N 3.34Å; L714-K717 PolarHBondContact O-N 3.01Å; I715-K717 VanDerWaalsContact C-N 3.3Å; I715-K717 PolarHBondContact O-N 3.41Å
718	L	60	Low	56.6	Low	30 Å²	30	68.6 Å²	68.6	16%	0.157	38%	0.383	C	S	.	.	H	α-helix	trans	-81.5	-33.9	171	-71.2	167.7	0	0	0	112.8	L714 I715 E716 L773	L714-L718 WeakPolarHBondContact O-CG 3.43Å; L714-L718 PolarHBondContact O-N 3.15Å; I715-L718 CarbonylContact O-C 3.57Å; I715-L718 WeakPolarHBondContact O-CA 3.4Å; I715-L718 WeakPolarHBondContact O-CB 3.19Å; I715-L718 PolarHBondContact O-N 3.47Å; E716-L718 VanDerWaalsContact C-N 3.3Å; E716-L718 PolarHBondContact O-N 3.19Å; L718-L773 HydrophobicContact CD1-CD1 3.77Å
719	L	65.2	Low	57.7	Low	12 Å²	12	68.9 Å²	68.9	6%	0.063	38%	0.384	C	S	.	.	H	α-helix	trans	-88.9	-19.7	-173.9	-74.5	-171.8	0	0	0	114.4	I715 E716 F748 F750 V755 T757 I791	I715-L719 HydrophobicContact CG2-CD1 3.5Å; I715-L719 HydrophobicContact CG2-CG 4Å; I715-L719 VanDerWaalsContact O-CB 3.28Å; I715-L719 WeakPolarHBondContact O-CB 3.24Å; I715-L719 VanDerWaalsContact O-CG 3.31Å; I715-L719 WeakPolarHBondContact O-CG 3.45Å; I715-L719 PolarHBondContact O-N 3.35Å; E716-L719 PolarHBondContact O-N 3.34Å; L719-F748 HydrophobicContact CD2-CD2 4.31Å; L719-F748 HydrophobicContact CD2-CE2 4.12Å; L719-F748 HydrophobicContact CD2-CZ 4.5Å; L719-F750 HydrophobicContact CD1-CE2 4.38Å; L719-F750 HydrophobicContact CD1-CZ 3.99Å; L719-V755 HydrophobicContact CD1-CG1 4.35Å; L719-V755 HydrophobicContact CD2-CG1 4.43Å; L719-T757 HydrophobicContact CD2-CG2 3.64Å; L719-I791 HydrophobicContact CB-CD1 4.08Å; L719-I791 HydrophobicContact CD2-CD1 4.38Å; L719-I791 HydrophobicContact CD2-CG1 4.13Å; L719-I791 WeakPolarHBondContact O-CD1 3.27Å
720	A	56.8	Low	59	Low	59 Å²	59	66.3 Å²	66.3	49%	0.488	37%	0.367	S	S	.	.			trans	65.9	150.1	-169.3	0	0	0	0	0	112.5	E716 A722 R794	E716-A720 WeakPolarHBondContact O-CA 3.26Å; E716-A720 PolarHBondContact O-N 2.81Å; A720-A722 PolarHBondContact O-N 2.78Å; A720-R794 PolarHBondContact O-NH2 2.8Å
721	P	50.9	Low	60.4	Low	120 Å²	120	62.1 Å²	62.1	78%	0.779	35%	0.345	S	S	*	.			trans	-51.5	113	-142.8	15.1	-29.8	0	0	0	113.2	R794	P721-R794 PolarHBondContact O-NH1 3Å; P721-R794 PolarHBondContact O-NH2 3.31Å
722	A	45.2	Very low	61.9	Low	15 Å²	15	62.8 Å²	62.8	12%	0.124	34%	0.343	C	S	.	.			trans	-83.8	145.8	154.3	0	0	0	0	0	106.9	E716 A720 L724	E716-A722 HydrophobicContact CG-CB 4.47Å; A720-A722 PolarHBondContact O-N 2.78Å; A722-L724 PolarHBondContact O-N 2.86Å
723	T	51.2	Low	63.4	Low	119 Å²	119	63.4 Å²	63.4	73%	0.73	35%	0.345	S	S	*	.			trans	-66.8	116.1	170	1.7	0	0	0	0	108	T725 R728	T723-T725 PolarHBondContact O-N 3.04Å; T723-R728 PolarHBondContact O-NH1 3.31Å
724	L	48.8	Very low	64.7	Low	118 Å²	118	56.8 Å²	56.8	62%	0.618	32%	0.32	S	S	*	.			trans	-62.3	99.9	175.9	-92.7	162.3	0	0	0	109.9	E716 A722	E716-L724 VanDerWaalsContact OE1-CD2 3.3Å; E716-L724 WeakPolarHBondContact OE1-CD2 3.49Å; E716-L724 WeakPolarHBondContact OE1-CG 3.19Å; E716-L724 VanDerWaalsContact OE2-CD2 3.28Å; E716-L724 WeakPolarHBondContact OE2-CD2 3.37Å; E716-L724 VanDerWaalsContact OE2-CG 3.29Å; E716-L724 WeakPolarHBondContact OE2-CG 3.45Å; A722-L724 PolarHBondContact O-N 2.86Å
725	T	54.5	Low	65.9	Low	52 Å²	52	58.5 Å²	58.5	32%	0.319	33%	0.329	S	S	.	.			trans	-90.5	120	162.5	37.4	0	0	0	0	107.7	T723 T727 R728	T723-T725 PolarHBondContact O-N 3.04Å; T725-T727 PolarHBondContact O-N 3Å; T725-R728 WeakPolarHBondContact O-CB 3.35Å; T725-R728 PolarHBondContact O-N 2.94Å; T725-R728 WeakPolarHBondContact OG1-CB 3.48Å; T725-R728 VanDerWaalsContact OG1-CZ 3.25Å; T725-R728 PolarHBondContact OG1-NH2 3.23Å
726	P	49.5	Very low	67	Low	138 Å²	138	58.4 Å²	58.4	90%	0.896	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-14.2	-176	-27.9	35.8	0	0	0	115.4
727	T	61.4	Low	68.2	Low	100 Å²	100	59.7 Å²	59.7	61%	0.613	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.1	-0.6	179	51.1	0	0	0	0	114.2	T725 Q729 T751	T725-T727 PolarHBondContact O-N 3Å; T727-Q729 PolarHBondContact O-N 2.88Å; T727-T751 PolarHBondContact O-OG1 3.37Å
728	R	74.6	Confident	69.3	Low	25 Å²	25	51.8 Å²	51.8	9%	0.094	31%	0.308	C	S	.	.			trans	-82.2	115.6	178.1	-178.6	179.2	-67.1	128.1	8.1	110.8	T723 T725 F750 D752 Q753	T723-R728 PolarHBondContact O-NH1 3.31Å; T725-R728 WeakPolarHBondContact O-CB 3.35Å; T725-R728 PolarHBondContact O-N 2.94Å; T725-R728 WeakPolarHBondContact OG1-CB 3.48Å; T725-R728 VanDerWaalsContact OG1-CZ 3.25Å; T725-R728 PolarHBondContact OG1-NH2 3.23Å; R728-F750 HydrophobicContact CG-CB 3.8Å; R728-F750 HydrophobicContact CG-CD1 3.85Å; R728-F750 HydrophobicContact CG-CG 4.1Å; R728-D752 WeakPolarHBondContact CG-OD1 3.32Å; R728-D752 IonicContact CZ-OD1 3.76Å; R728-D752 IonicContact CZ-OD2 2.7Å; R728-D752 VanDerWaalsContact CZ-OD2 3.32Å; R728-D752 IonicContact NE-OD1 2.77Å; R728-D752 PolarHBondContact NE-OD1 3.45Å; R728-D752 IonicContact NE-OD2 2.73Å; R728-D752 PolarHBondContact NE-OD2 3.19Å; R728-D752 VanDerWaalsContact NE-OD2 3.16Å; R728-D752 IonicContact NH2-OD1 3.94Å; R728-D752 IonicContact NH2-OD2 3.45Å; R728-D752 PolarHBondContact NH2-OD2 3.09Å; R728-Q753 VanDerWaalsContact CZ-NE2 3.33Å
729	Q	72.4	Confident	69.7	Low	44 Å²	44	56.8 Å²	56.8	21%	0.206	33%	0.33	C	S	.	.			trans	-107	152.3	169.3	-67.5	178.7	-31.5	0	0	110.5	T727 F750 T751	T727-Q729 PolarHBondContact O-N 2.88Å; Q729-F750 CarbonylContact O-C 3.55Å; Q729-F750 WeakPolarHBondContact O-CA 3.49Å; Q729-F750 WeakPolarHBondContact O-CB 3.48Å; Q729-T751 HydrophobicContact CB-CG2 3.9Å; Q729-T751 PolarHBondContact N-OG1 3.47Å; Q729-T751 PolarHBondContact O-N 3.12Å
730	Y	76.9	Confident	69.8	Low	7 Å²	7	65.5 Å²	65.5	3%	0.027	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	134.6	171.7	164.6	-90.9	0	0	0	110.1	I715 R732 H733 F748 F750 L775 Q776 D782	I715-Y730 HydrophobicContact CD1-CD2 3.76Å; I715-Y730 HydrophobicContact CD1-CE2 4.43Å; I715-Y730 HydrophobicContact CD1-CG 3.99Å; Y730-R732 VanDerWaalsContact CZ-C 3.46Å; Y730-R732 WeakPolarHBondContact OH-CA 3.44Å; Y730-H733 HydrophobicContact CE2-CB 4.29Å; Y730-H733 PolarHBondContact OH-N 3.02Å; Y730-H733 PolarHBondContact OH-ND1 3.37Å; Y730-F748 HydrophobicContact CE2-CD1 4.21Å; Y730-F750 HydrophobicContact CD2-CE1 4.46Å; Y730-L775 HydrophobicContact CD1-CB 4.3Å; Y730-L775 HydrophobicContact CE1-CB 3.95Å; Y730-L775 HydrophobicContact CE1-CD1 4.47Å; Y730-L775 HydrophobicContact CE2-CD1 4.25Å; Y730-Q776 WeakPolarHBondContact CD1-O 3.39Å; Y730-D782 HydrophobicContact CE1-CB 4.33Å; Y730-D782 VanDerWaalsContact CE1-OD2 3.32Å; Y730-D782 WeakPolarHBondContact CE1-OD2 3.28Å; Y730-D782 PolarHBondContact OH-OD2 2.73Å
731	V	82.5	Confident	70.6	Confident	6 Å²	6	68.2 Å²	68.2	4%	0.036	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	-49	-174.1	-177.5	0	0	0	0	111.9	M749 F750 T751 S777 I778 T882 L886	V731-M749 HydrophobicContact CB-CB 4.43Å; V731-M749 HydrophobicContact CB-CG 4.09Å; V731-M749 WeakPolarHBondContact CB-O 3.36Å; V731-M749 HydrophobicContact CB-SD 4.42Å; V731-M749 HydrophobicContact CG1-CG 4.44Å; V731-M749 HydrophobicContact CG1-SD 4.12Å; V731-M749 PolarHBondContact N-O 3.42Å; V731-F750 VanDerWaalsContact CG2-C 3.4Å; V731-T751 HydrophobicContact CG2-CG2 3.97Å; V731-S777 WeakPolarHBondContact O-CB 3.26Å; V731-S777 PolarHBondContact O-OG 3.12Å; V731-I778 HydrophobicContact CB-CD1 4.48Å; V731-I778 HydrophobicContact CG1-CD1 4.27Å; V731-I778 HydrophobicContact CG2-CD1 3.85Å; V731-T882 HydrophobicContact CG1-CG2 3.65Å; V731-L886 HydrophobicContact CG1-CD1 4.27Å; V731-L886 HydrophobicContact CG2-CD1 4.05Å; V731-L886 HydrophobicContact CG2-CD2 4.38Å
732	R	86.4	Confident	71.7	Confident	30 Å²	30	72.7 Å²	72.7	11%	0.113	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-170.4	166.6	179.3	61	-173.5	-63.8	152.5	1	110.9	Y730 D734 M749	Y730-R732 VanDerWaalsContact CZ-C 3.46Å; Y730-R732 WeakPolarHBondContact OH-CA 3.44Å; R732-D734 IonicContact CZ-OD2 3.28Å; R732-D734 VanDerWaalsContact CZ-OD2 3.23Å; R732-D734 IonicContact NE-OD2 2.68Å; R732-D734 PolarHBondContact NE-OD2 2.66Å; R732-D734 IonicContact NH2-OD1 3.31Å; R732-D734 IonicContact NH2-OD2 3.88Å; R732-D734 PolarHBondContact NH2-OD2 2.87Å; R732-M749 HydrophobicContact CG-CB 3.83Å; R732-M749 HydrophobicContact CG-CG 4.45Å; R732-M749 HydrophobicContact CG-SD 3.97Å; R732-M749 PolarHBondContact N-O 3Å; R732-M749 PolarHBondContact O-N 3.36Å
733	H	86.4	Confident	73.2	Confident	35 Å²	35	76.9 Å²	76.9	16%	0.162	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	152.9	161	77.1	-77	0	0	0	111.2	Y730 I747 F748	Y730-H733 HydrophobicContact CE2-CB 4.29Å; Y730-H733 PolarHBondContact OH-N 3.02Å; Y730-H733 PolarHBondContact OH-ND1 3.37Å; H733-I747 WeakPolarHBondContact CA-O 3.39Å; H733-I747 WeakPolarHBondContact CB-O 3.23Å; H733-F748 HydrophobicContact CB-CD1 4.04Å; H733-F748 HydrophobicContact CB-CE1 4.4Å; H733-F748 HydrophobicContact CB-CG 4.35Å
734	D	87.3	Confident	74.6	Confident	4 Å²	4	75.2 Å²	75.2	2%	0.021	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	155.3	175.3	-85.9	-72.1	0	0	0	110.4	R732 C746 I747 K875	R732-D734 IonicContact CZ-OD2 3.28Å; R732-D734 VanDerWaalsContact CZ-OD2 3.23Å; R732-D734 IonicContact NE-OD2 2.68Å; R732-D734 PolarHBondContact NE-OD2 2.66Å; R732-D734 IonicContact NH2-OD1 3.31Å; R732-D734 IonicContact NH2-OD2 3.88Å; R732-D734 PolarHBondContact NH2-OD2 2.87Å; D734-C746 WeakPolarHBondContact O-CA 3.48Å; D734-I747 HydrophobicContact CB-CD1 4.46Å; D734-I747 HydrophobicContact CB-CG1 4.12Å; D734-I747 PolarHBondContact N-O 2.93Å; D734-I747 WeakPolarHBondContact O-CG1 3.31Å; D734-I747 PolarHBondContact O-N 3.4Å; D734-K875 WeakPolarHBondContact OD1-CD 3.48Å; D734-K875 WeakPolarHBondContact OD1-CE 3.37Å; D734-K875 IonicContact OD1-NZ 3.27Å; D734-K875 PolarHBondContact OD1-NZ 2.93Å
735	I	86.3	Confident	76.4	Confident	100 Å²	100	69.6 Å²	69.6	51%	0.513	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	125.5	168.5	-59.2	177	0	0	0	107.9	P744 V745 C746	I735-P744 HydrophobicContact CG2-CB 3.78Å; I735-V745 WeakPolarHBondContact CA-O 3.5Å; I735-C746 HydrophobicContact CG1-CB 4.45Å
736	V	88.6	Confident	78	Confident	4 Å²	4	67.4 Å²	67.4	2%	0.024	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	155.4	179.3	-64.7	0	0	0	0	110.2	V738 V745 I747 L868 F870	V736-V738 HydrophobicContact CG2-CG2 4.28Å; V736-V745 HydrophobicContact CG2-CB 4.33Å; V736-V745 PolarHBondContact N-O 2.74Å; V736-V745 PolarHBondContact O-N 2.92Å; V736-I747 HydrophobicContact CG1-CD1 3.76Å; V736-I747 HydrophobicContact CG1-CG1 4.32Å; V736-I747 HydrophobicContact CG2-CD1 4Å; V736-I747 HydrophobicContact CG2-CG1 4.18Å; V736-I747 HydrophobicContact CG2-CG2 3.94Å; V736-L868 HydrophobicContact CG2-CD2 4.27Å; V736-F870 HydrophobicContact CG1-CD1 3.71Å; V736-F870 HydrophobicContact CG1-CD2 4.42Å; V736-F870 HydrophobicContact CG1-CE1 3.66Å; V736-F870 HydrophobicContact CG1-CE2 4.37Å; V736-F870 HydrophobicContact CG1-CG 4.09Å; V736-F870 HydrophobicContact CG1-CZ 4Å
737	S	86.2	Confident	79.9	Confident	54 Å²	54	60.9 Å²	60.9	38%	0.378	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	122.5	161.4	53.3	0	0	0	0	108.6	M869	S737-M869 PolarHBondContact N-O 2.92Å; S737-M869 VanDerWaalsContact N-O 3.16Å; S737-M869 PolarHBondContact O-N 3.36Å; S737-M869 WeakPolarHBondContact OG-CB 3.48Å
738	V	84.6	Confident	81.1	Confident	16 Å²	16	56.3 Å²	56.3	10%	0.097	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	136	172.5	-166.2	0	0	0	0	107.2	V736 R741 V745 L868	V736-V738 HydrophobicContact CG2-CG2 4.28Å; V738-R741 PolarHBondContact O-N 2.75Å; V738-R741 VanDerWaalsContact O-N 3.13Å; V738-V745 HydrophobicContact CG2-CB 3.89Å; V738-V745 HydrophobicContact CG2-CG1 4.17Å; V738-V745 HydrophobicContact CG2-CG2 3.74Å; V738-L868 HydrophobicContact CB-CD2 4.37Å; V738-L868 HydrophobicContact CG1-CD2 4.11Å; V738-L868 HydrophobicContact CG2-CD2 3.74Å
739	E	68	Low	81.8	Confident	135 Å²	135	55.2 Å²	55.2	63%	0.631	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	158.1	170.5	-159.5	142.6	-171.3	0	0	110.3	R741 E867	E739-R741 PolarHBondContact O-N 2.83Å; E739-R741 VanDerWaalsContact O-N 3.13Å; E739-E867 PolarHBondContact N-O 3.05Å
740	E	67.5	Low	82.5	Confident	194 Å²	194	53.4 Å²	53.4	91%	0.907	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.6	-22.6	-160.7	-46.3	-173.6	160.7	0	0	117.2
741	R	73	Confident	82.8	Confident	117 Å²	117	54.2 Å²	54.2	44%	0.442	27%	0.267	S	S	.	.			trans	-108.3	129.4	-175.3	-50.3	-155.8	91.1	83.3	4.7	113.8	V738 E739	V738-R741 PolarHBondContact O-N 2.75Å; V738-R741 VanDerWaalsContact O-N 3.13Å; E739-R741 PolarHBondContact O-N 2.83Å; E739-R741 VanDerWaalsContact O-N 3.13Å
742	K	73.6	Confident	82.5	Confident	213 Å²	213	55.5 Å²	55.5	93%	0.926	27%	0.273	S	S	*	.	S	Bend	trans	-83.1	-27.8	174	-68.5	-173.7	178.3	-179.2	0	114.2
743	D	78.6	Confident	82.5	Confident	103 Å²	103	55.2 Å²	55.2	55%	0.551	27%	0.273	S	S	*	.	S	Bend	trans	-82.2	138.5	177.3	-65.3	-46.3	0	0	0	110.2	V745 V758	D743-V745 PolarHBondContact O-N 2.9Å; D743-V758 HydrophobicContact CB-CG1 3.86Å
744	P	80	Confident	82.7	Confident	84 Å²	84	53.5 Å²	53.5	55%	0.545	27%	0.265	S	S	.	.	P	Polyproline II helix	trans	-63.5	134.3	175.3	26.8	-34	0	0	0	110.8	I735	I735-P744 HydrophobicContact CG2-CB 3.78Å
745	V	87.2	Confident	82.7	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	127.3	-178.9	174.7	0	0	0	0	108.9	I735 V736 V738 D743 I747 F756 T757 V758 Y792	I735-V745 WeakPolarHBondContact CA-O 3.5Å; V736-V745 HydrophobicContact CG2-CB 4.33Å; V736-V745 PolarHBondContact N-O 2.74Å; V736-V745 PolarHBondContact O-N 2.92Å; V738-V745 HydrophobicContact CG2-CB 3.89Å; V738-V745 HydrophobicContact CG2-CG1 4.17Å; V738-V745 HydrophobicContact CG2-CG2 3.74Å; D743-V745 PolarHBondContact O-N 2.9Å; V745-I747 HydrophobicContact CG1-CG2 4.05Å; V745-F756 HydrophobicContact CG1-CB 4.34Å; V745-F756 HydrophobicContact CG1-CD1 4.11Å; V745-T757 CarbonylContact C-O 3.57Å; V745-T757 WeakPolarHBondContact CA-O 3.36Å; V745-T757 WeakPolarHBondContact CG1-O 3.28Å; V745-V758 HydrophobicContact CG2-CG2 4.37Å; V745-Y792 HydrophobicContact CG1-CE1 3.93Å; V745-Y792 HydrophobicContact CG2-CE1 4.01Å
746	C	87	Confident	82.8	Confident	6 Å²	6	48.6 Å²	48.6	4%	0.041	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	119.5	168.9	-175.6	0	0	0	0	108.9	D734 I735 F748 T757 Y789	D734-C746 WeakPolarHBondContact O-CA 3.48Å; I735-C746 HydrophobicContact CG1-CB 4.45Å; C746-F748 HydrophobicContact CB-CE2 4.36Å; C746-T757 WeakPolarHBondContact CB-OG1 3.34Å; C746-T757 PolarHBondContact N-O 2.93Å; C746-T757 PolarHBondContact O-N 2.78Å; C746-T757 PolarHBondContact O-OG1 3.43Å; C746-Y789 HydrophobicContact CB-CD1 4.4Å; C746-Y789 HydrophobicContact CB-CE1 3.93Å
747	I	89	Confident	82.6	Confident	2 Å²	2	48.4 Å²	48.4	1%	0.01	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	124.4	175.8	54	176.8	0	0	0	109.5	H733 D734 V736 V745 I754 V755 F756 L868 F870 W879	H733-I747 WeakPolarHBondContact CA-O 3.39Å; H733-I747 WeakPolarHBondContact CB-O 3.23Å; D734-I747 HydrophobicContact CB-CD1 4.46Å; D734-I747 HydrophobicContact CB-CG1 4.12Å; D734-I747 PolarHBondContact N-O 2.93Å; D734-I747 WeakPolarHBondContact O-CG1 3.31Å; D734-I747 PolarHBondContact O-N 3.4Å; V736-I747 HydrophobicContact CG1-CD1 3.76Å; V736-I747 HydrophobicContact CG1-CG1 4.32Å; V736-I747 HydrophobicContact CG2-CD1 4Å; V736-I747 HydrophobicContact CG2-CG1 4.18Å; V736-I747 HydrophobicContact CG2-CG2 3.94Å; V745-I747 HydrophobicContact CG1-CG2 4.05Å; I747-I754 HydrophobicContact CB-CG2 4.45Å; I747-V755 WeakPolarHBondContact CA-O 3.5Å; I747-F756 HydrophobicContact CG2-CD1 3.43Å; I747-F756 VanDerWaalsContact CG2-CD1 3.43Å; I747-F756 HydrophobicContact CG2-CE1 3.46Å; I747-F756 VanDerWaalsContact CG2-CE1 3.46Å; I747-F756 HydrophobicContact CG2-CG 4.06Å; I747-F756 HydrophobicContact CG2-CZ 4.12Å; I747-L868 HydrophobicContact CD1-CD1 4.08Å; I747-F870 HydrophobicContact CD1-CE1 4.19Å; I747-F870 HydrophobicContact CD1-CZ 4.19Å; I747-W879 HydrophobicContact CD1-CZ2 3.86Å
748	F	87.8	Confident	82.5	Confident	4 Å²	4	46.9 Å²	46.9	2%	0.018	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	128.3	173.7	-65.6	-103.8	0	0	0	108.7	L719 Y730 H733 C746 F750 I754 V755 T757 I784 Y789	L719-F748 HydrophobicContact CD2-CD2 4.31Å; L719-F748 HydrophobicContact CD2-CE2 4.12Å; L719-F748 HydrophobicContact CD2-CZ 4.5Å; Y730-F748 HydrophobicContact CE2-CD1 4.21Å; H733-F748 HydrophobicContact CB-CD1 4.04Å; H733-F748 HydrophobicContact CB-CE1 4.4Å; H733-F748 HydrophobicContact CB-CG 4.35Å; C746-F748 HydrophobicContact CB-CE2 4.36Å; F748-F750 HydrophobicContact CB-CE2 3.77Å; F748-F750 HydrophobicContact CB-CZ 4.23Å; F748-I754 CarbonylContact O-C 3.56Å; F748-I754 WeakPolarHBondContact O-CA 3.37Å; F748-V755 HydrophobicContact CB-CB 4.4Å; F748-V755 PolarHBondContact N-O 3.06Å; F748-V755 PolarHBondContact O-N 2.69Å; F748-T757 HydrophobicContact CD2-CG2 3.9Å; F748-T757 HydrophobicContact CE2-CG2 3.85Å; F748-I784 HydrophobicContact CE1-CD1 3.4Å; F748-I784 VanDerWaalsContact CE1-CD1 3.4Å; F748-I784 HydrophobicContact CZ-CD1 3.35Å; F748-Y789 HydrophobicContact CE2-CD1 4.25Å; F748-Y789 HydrophobicContact CE2-CE1 4.43Å; F748-Y789 HydrophobicContact CE2-CG 4.39Å; F748-Y789 HydrophobicContact CZ-CD1 4.49Å; F748-Y789 HydrophobicContact CZ-CD2 4.26Å; F748-Y789 HydrophobicContact CZ-CE1 4.42Å; F748-Y789 HydrophobicContact CZ-CE2 4.22Å; F748-Y789 HydrophobicContact CZ-CG 4.43Å
749	M	89	Confident	81.8	Confident	1 Å²	1	48.3 Å²	48.3	1%	0.005	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	131.7	176.1	-178.2	-176.8	-74	0	0	109.5	V731 R732 I754 I797 W879 T882 I883 L886	V731-M749 HydrophobicContact CB-CB 4.43Å; V731-M749 HydrophobicContact CB-CG 4.09Å; V731-M749 WeakPolarHBondContact CB-O 3.36Å; V731-M749 HydrophobicContact CB-SD 4.42Å; V731-M749 HydrophobicContact CG1-CG 4.44Å; V731-M749 HydrophobicContact CG1-SD 4.12Å; V731-M749 PolarHBondContact N-O 3.42Å; R732-M749 HydrophobicContact CG-CB 3.83Å; R732-M749 HydrophobicContact CG-CG 4.45Å; R732-M749 HydrophobicContact CG-SD 3.97Å; R732-M749 PolarHBondContact N-O 3Å; R732-M749 PolarHBondContact O-N 3.36Å; M749-I754 HydrophobicContact CE-CD1 3.87Å; M749-I754 HydrophobicContact CG-CG1 4.34Å; M749-I797 HydrophobicContact CG-CD1 4.28Å; M749-W879 HydrophobicContact CE-CD2 4.07Å; M749-W879 HydrophobicContact CE-CG 4.09Å; M749-W879 HydrophobicContact CE-CZ2 4.31Å; M749-T882 HydrophobicContact SD-CG2 3.51Å; M749-T882 VanDerWaalsContact SD-CG2 3.51Å; M749-I883 HydrophobicContact CE-CD1 4.05Å; M749-I883 HydrophobicContact CE-CG1 3.51Å; M749-L886 HydrophobicContact CG-CD1 3.99Å; M749-L886 HydrophobicContact SD-CD1 3.76Å
750	F	86	Confident	81.5	Confident	7 Å²	7	50.2 Å²	50.2	3%	0.031	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	175.9	174.1	-59.1	-91.9	0	0	0	109.4	I715 L719 R728 Q729 Y730 V731 F748 D752 Q753 V755 I797	I715-F750 HydrophobicContact CG2-CE1 4.14Å; I715-F750 HydrophobicContact CG2-CZ 3.83Å; L719-F750 HydrophobicContact CD1-CE2 4.38Å; L719-F750 HydrophobicContact CD1-CZ 3.99Å; R728-F750 HydrophobicContact CG-CB 3.8Å; R728-F750 HydrophobicContact CG-CD1 3.85Å; R728-F750 HydrophobicContact CG-CG 4.1Å; Q729-F750 CarbonylContact O-C 3.55Å; Q729-F750 WeakPolarHBondContact O-CA 3.49Å; Q729-F750 WeakPolarHBondContact O-CB 3.48Å; Y730-F750 HydrophobicContact CD2-CE1 4.46Å; V731-F750 VanDerWaalsContact CG2-C 3.4Å; F748-F750 HydrophobicContact CB-CE2 3.77Å; F748-F750 HydrophobicContact CB-CZ 4.23Å; F750-D752 PolarHBondContact O-N 3.5Å; F750-Q753 HydrophobicContact CB-CG 4.12Å; F750-Q753 HydrophobicContact CD2-CG 3.86Å; F750-Q753 HydrophobicContact CG-CG 4.28Å; F750-Q753 PolarHBondContact N-O 3.46Å; F750-V755 HydrophobicContact CD2-CG2 4.14Å; F750-V755 HydrophobicContact CE2-CB 4.29Å; F750-V755 HydrophobicContact CE2-CG2 3.73Å; F750-I797 WeakPolarHBondContact O-CD1 3.34Å
751	T	83.1	Confident	80.9	Confident	24 Å²	24	52.2 Å²	52.2	15%	0.147	24%	0.241	C	C	.	.	S	Bend	trans	-64.5	-21	179.2	44.5	0	0	0	0	114.1	T727 Q729 V731 I778 L886	T727-T751 PolarHBondContact O-OG1 3.37Å; Q729-T751 HydrophobicContact CB-CG2 3.9Å; Q729-T751 PolarHBondContact N-OG1 3.47Å; Q729-T751 PolarHBondContact O-N 3.12Å; V731-T751 HydrophobicContact CG2-CG2 3.97Å; T751-I778 HydrophobicContact CG2-CD1 4.25Å; T751-L886 HydrophobicContact CG2-CD2 4.33Å
752	D	77.8	Confident	79.8	Confident	32 Å²	32	56.9 Å²	56.9	17%	0.171	26%	0.259	C	S	.	.	S	Bend	trans	-122.5	-22.1	-176.6	66.6	-24.9	0	0	0	115	R728 F750 I797	R728-D752 WeakPolarHBondContact CG-OD1 3.32Å; R728-D752 IonicContact CZ-OD1 3.76Å; R728-D752 IonicContact CZ-OD2 2.7Å; R728-D752 VanDerWaalsContact CZ-OD2 3.32Å; R728-D752 IonicContact NE-OD1 2.77Å; R728-D752 PolarHBondContact NE-OD1 3.45Å; R728-D752 IonicContact NE-OD2 2.73Å; R728-D752 PolarHBondContact NE-OD2 3.19Å; R728-D752 VanDerWaalsContact NE-OD2 3.16Å; R728-D752 IonicContact NH2-OD1 3.94Å; R728-D752 IonicContact NH2-OD2 3.45Å; R728-D752 PolarHBondContact NH2-OD2 3.09Å; F750-D752 PolarHBondContact O-N 3.5Å; D752-I797 PolarHBondContact O-N 2.95Å
753	Q	86.2	Confident	78.6	Confident	24 Å²	24	50 Å²	50	11%	0.112	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	163.3	-173.1	69.9	174.5	-11.4	0	0	114.3	R728 F750 V755 L795	R728-Q753 VanDerWaalsContact CZ-NE2 3.33Å; F750-Q753 HydrophobicContact CB-CG 4.12Å; F750-Q753 HydrophobicContact CD2-CG 3.86Å; F750-Q753 HydrophobicContact CG-CG 4.28Å; F750-Q753 PolarHBondContact N-O 3.46Å; Q753-V755 HydrophobicContact CG-CG2 4.22Å; Q753-L795 CarbonylContact C-O 3.49Å; Q753-L795 WeakPolarHBondContact CA-O 3.35Å; Q753-L795 VanDerWaalsContact CB-O 3.29Å; Q753-L795 WeakPolarHBondContact CB-O 3.36Å
754	I	88.9	Confident	77	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	132.3	169.3	-52	-172	0	0	0	109.5	I747 F748 M749 F756 R794 L795 I797 I800 W879 I883	I747-I754 HydrophobicContact CB-CG2 4.45Å; F748-I754 CarbonylContact O-C 3.56Å; F748-I754 WeakPolarHBondContact O-CA 3.37Å; M749-I754 HydrophobicContact CE-CD1 3.87Å; M749-I754 HydrophobicContact CG-CG1 4.34Å; I754-F756 HydrophobicContact CB-CE2 4.29Å; I754-F756 HydrophobicContact CG2-CD2 4.41Å; I754-F756 HydrophobicContact CG2-CE2 3.75Å; I754-F756 HydrophobicContact CG2-CZ 4.11Å; I754-R794 WeakPolarHBondContact O-CA 3.42Å; I754-L795 PolarHBondContact N-O 2.61Å; I754-L795 PolarHBondContact O-N 3.21Å; I754-I797 HydrophobicContact CD1-CG1 4.35Å; I754-I797 HydrophobicContact CG1-CD1 4.2Å; I754-I797 HydrophobicContact CG1-CG1 3.86Å; I754-I800 HydrophobicContact CD1-CD1 3.67Å; I754-I800 HydrophobicContact CG1-CD1 4.13Å; I754-W879 HydrophobicContact CD1-CH2 4.14Å; I754-W879 HydrophobicContact CD1-CZ2 3.68Å; I754-I883 HydrophobicContact CD1-CD1 3.58Å; I754-I883 HydrophobicContact CD1-CG1 4.12Å
755	V	87.2	Confident	75.4	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	124.9	-175.2	-178.2	0	0	0	0	110.4	L719 I747 F748 F750 Q753 T757 I791 R794	L719-V755 HydrophobicContact CD1-CG1 4.35Å; L719-V755 HydrophobicContact CD2-CG1 4.43Å; I747-V755 WeakPolarHBondContact CA-O 3.5Å; F748-V755 HydrophobicContact CB-CB 4.4Å; F748-V755 PolarHBondContact N-O 3.06Å; F748-V755 PolarHBondContact O-N 2.69Å; F750-V755 HydrophobicContact CD2-CG2 4.14Å; F750-V755 HydrophobicContact CE2-CB 4.29Å; F750-V755 HydrophobicContact CE2-CG2 3.73Å; Q753-V755 HydrophobicContact CG-CG2 4.22Å; V755-T757 HydrophobicContact CG1-CG2 4.11Å; V755-I791 HydrophobicContact CG1-CD1 3.66Å; V755-I791 HydrophobicContact CG1-CG1 3.79Å; V755-I791 HydrophobicContact CG1-CG2 4.28Å; V755-R794 HydrophobicContact CG1-CG 4.16Å; V755-R794 HydrophobicContact CG2-CG 4.11Å
756	F	88.6	Confident	73.1	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	127	-175.9	-67.5	-105.2	0	0	0	111	V745 I747 I754 I791 Y792 H793 L795 F855 L868	V745-F756 HydrophobicContact CG1-CB 4.34Å; V745-F756 HydrophobicContact CG1-CD1 4.11Å; I747-F756 HydrophobicContact CG2-CD1 3.43Å; I747-F756 VanDerWaalsContact CG2-CD1 3.43Å; I747-F756 HydrophobicContact CG2-CE1 3.46Å; I747-F756 VanDerWaalsContact CG2-CE1 3.46Å; I747-F756 HydrophobicContact CG2-CG 4.06Å; I747-F756 HydrophobicContact CG2-CZ 4.12Å; I754-F756 HydrophobicContact CB-CE2 4.29Å; I754-F756 HydrophobicContact CG2-CD2 4.41Å; I754-F756 HydrophobicContact CG2-CE2 3.75Å; I754-F756 HydrophobicContact CG2-CZ 4.11Å; F756-I791 WeakPolarHBondContact O-CA 3.37Å; F756-Y792 HydrophobicContact CB-CD1 4.35Å; F756-Y792 HydrophobicContact CB-CE1 3.83Å; F756-Y792 HydrophobicContact CB-CE2 4.26Å; F756-Y792 PolarHBondContact O-N 2.89Å; F756-H793 HydrophobicContact CB-CB 4.07Å; F756-H793 HydrophobicContact CD2-CB 4.32Å; F756-H793 HydrophobicContact CG-CB 4.39Å; F756-H793 PolarHBondContact N-O 2.94Å; F756-L795 HydrophobicContact CE2-CD1 4.12Å; F756-F855 AromaticContact CZ-CZ 3.95Å; F756-F855 HydrophobicContact CZ-CZ 3.95Å; F756-L868 HydrophobicContact CE1-CD1 4.43Å; F756-L868 HydrophobicContact CE1-CD2 4.15Å
757	T	85.6	Confident	71.1	Confident	0 Å²	0	67.1 Å²	67.1	0%	0	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	151.9	-172.5	73.8	0	0	0	0	114.1	L719 V745 C746 F748 V755 Y789 K790 I791	L719-T757 HydrophobicContact CD2-CG2 3.64Å; V745-T757 CarbonylContact C-O 3.57Å; V745-T757 WeakPolarHBondContact CA-O 3.36Å; V745-T757 WeakPolarHBondContact CG1-O 3.28Å; C746-T757 WeakPolarHBondContact CB-OG1 3.34Å; C746-T757 PolarHBondContact N-O 2.93Å; C746-T757 PolarHBondContact O-N 2.78Å; C746-T757 PolarHBondContact O-OG1 3.43Å; F748-T757 HydrophobicContact CD2-CG2 3.9Å; F748-T757 HydrophobicContact CE2-CG2 3.85Å; V755-T757 HydrophobicContact CG1-CG2 4.11Å; T757-Y789 VanDerWaalsContact OG1-CD1 3.31Å; T757-Y789 WeakPolarHBondContact OG1-CD1 3.47Å; T757-K790 CarbonylContact C-O 3.58Å; T757-K790 VanDerWaalsContact CA-O 3.28Å; T757-K790 WeakPolarHBondContact CA-O 3.45Å; T757-I791 HydrophobicContact CG2-CG1 4.12Å
758	V	83.4	Confident	69	Low	23 Å²	23	76 Å²	76	14%	0.139	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	132.8	169.5	-177.9	0	0	0	0	109.6	D743 V745 K790 Y792	D743-V758 HydrophobicContact CB-CG1 3.86Å; V745-V758 HydrophobicContact CG2-CG2 4.37Å; V758-K790 PolarHBondContact N-O 2.87Å; V758-K790 PolarHBondContact O-N 2.81Å; V758-Y792 HydrophobicContact CG2-CD1 3.96Å; V758-Y792 HydrophobicContact CG2-CE1 3.98Å
759	A	69.6	Low	67.2	Low	45 Å²	45	84.3 Å²	84.3	37%	0.372	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	127.9	-177.9	0	0	0	0	0	112.1	I787 Y789	A759-I787 HydrophobicContact CB-CG2 4.01Å; A759-Y789 HydrophobicContact CB-CD1 4.28Å; A759-Y789 HydrophobicContact CB-CE1 4.07Å
760	R	61.9	Low	65.4	Low	176 Å²	176	87.7 Å²	87.7	66%	0.664	44%	0.439	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.7	105.1	175.8	-81.5	-174.4	161	-175	-6.5	112.4	R762 K788	R760-R762 PolarHBondContact O-N 3.12Å; R760-K788 PolarHBondContact N-O 2.91Å
761	R	55.2	Low	63.8	Low	236 Å²	236	91.7 Å²	91.7	89%	0.891	46%	0.464	S	S	*	.	P	Polyproline II helix	trans	-63.2	124.1	163.4	-71	-179.1	173.9	162.6	-0.6	109.7
762	R	49.5	Very low	62.7	Low	215 Å²	215	96.2 Å²	96.2	81%	0.811	48%	0.481	S	S	*	.	P	Polyproline II helix	trans	-67.4	140.5	171	-91.5	-177.9	168.4	168.2	-3.6	109.9	R760 S764	R760-R762 PolarHBondContact O-N 3.12Å; R762-S764 PolarHBondContact O-N 3.11Å
763	G	48.9	Very low	61.9	Low	68 Å²	68	95.9 Å²	95.9	70%	0.701	48%	0.48	S	S	*	.	S	Bend	trans	-68.3	124.6	177.8	0	0	0	0	0	112.9	Q765	G763-Q765 PolarHBondContact O-N 2.95Å
764	S	44.4	Very low	60.6	Low	126 Å²	126	105 Å²	105	88%	0.881	51%	0.513	S	S	*	.	S	Bend	trans	53.9	3	156.3	-153.8	0	0	0	0	121	R762	R762-S764 PolarHBondContact O-N 3.11Å
765	Q	46.2	Very low	59.3	Low	174 Å²	174	105.3 Å²	105.3	81%	0.813	51%	0.514	S	S	*	.			trans	-102.2	120.3	170.3	-68.2	-138.9	7.9	0	0	111.5	G763 I767	G763-Q765 PolarHBondContact O-N 2.95Å; Q765-I767 PolarHBondContact O-N 3.29Å
766	V	40.1	Very low	58	Low	129 Å²	129	108.4 Å²	108.4	78%	0.782	53%	0.529	S	S	*	.			trans	-77	93.1	-172.7	-176.8	0	0	0	0	110.9	K768	V766-K768 HydrophobicContact CG1-CG 4.33Å; V766-K768 PolarHBondContact O-N 3.47Å
767	I	43.9	Very low	56.9	Low	123 Å²	123	109.2 Å²	109.2	63%	0.631	53%	0.534	S	S	*	.			trans	-69.1	117.3	158.1	-60.6	178.1	0	0	0	106.8	Q765 K769	Q765-I767 PolarHBondContact O-N 3.29Å; I767-K769 PolarHBondContact O-N 3.32Å
768	K	45.8	Very low	55.9	Low	190 Å²	190	111.3 Å²	111.3	83%	0.826	55%	0.545	S	S	*	.	S	Bend	trans	-76.6	111	-176.4	-69.3	-179	178.8	178.2	0	110.2	V766	V766-K768 HydrophobicContact CG1-CG 4.33Å; V766-K768 PolarHBondContact O-N 3.47Å
769	K	49.3	Very low	54.9	Low	178 Å²	178	116.2 Å²	116.2	77%	0.774	56%	0.561	S	S	*	*	S	Bend	trans	66.8	137.1	-173.1	-59.1	-175.5	175.4	-175	0	113.8	I767	I767-K769 PolarHBondContact O-N 3.32Å
770	P	51.2	Low	54.6	Low	72 Å²	72	115.9 Å²	115.9	47%	0.468	56%	0.563	S	S	.	*	P	Polyproline II helix	trans	-67.7	142.4	165.8	30.2	-33.2	0	0	0	109.5	F772 E785	P770-F772 HydrophobicContact CG-CE2 3.99Å; P770-F772 HydrophobicContact CG-CZ 4.21Å; P770-E785 HydrophobicContact CB-CG 4.44Å
771	V	52.2	Low	54.5	Low	91 Å²	91	112 Å²	112	55%	0.552	56%	0.558	S	S	*	*	P	Polyproline II helix	trans	-91.7	122.8	168.6	178.5	0	0	0	0	107.3	N786	V771-N786 HydrophobicContact CB-CB 4.38Å; V771-N786 VanDerWaalsContact O-CB 3.29Å; V771-N786 WeakPolarHBondContact O-CB 3.44Å; V771-N786 PolarHBondContact O-N 3.33Å
772	F	60.9	Low	55.1	Low	118 Å²	118	103 Å²	103	52%	0.518	53%	0.528	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	129.9	172.3	-67.7	-85.4	0	0	0	109.7	P770 A783 I784 E785	P770-F772 HydrophobicContact CG-CE2 3.99Å; P770-F772 HydrophobicContact CG-CZ 4.21Å; F772-A783 HydrophobicContact CD1-CB 4.46Å; F772-I784 CarbonylContact C-O 3.56Å; F772-I784 WeakPolarHBondContact CA-O 3.36Å; F772-E785 HydrophobicContact CD1-CG 4.07Å; F772-E785 HydrophobicContact CE1-CG 3.52Å; F772-E785 HydrophobicContact CZ-CG 4.09Å
773	L	60	Low	55.8	Low	26 Å²	26	95.5 Å²	95.5	14%	0.136	51%	0.512	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	127.2	172	-56.4	175	0	0	0	107.9	L714 L718 A783 I784 N786	L714-L773 HydrophobicContact CD2-CD1 3.74Å; L714-L773 HydrophobicContact CD2-CD2 3.84Å; L714-L773 HydrophobicContact CD2-CG 4.27Å; L714-L773 HydrophobicContact CG-CD1 4.1Å; L718-L773 HydrophobicContact CD1-CD1 3.77Å; L773-A783 WeakPolarHBondContact O-CA 3.46Å; L773-I784 HydrophobicContact CB-CG2 4Å; L773-I784 PolarHBondContact N-O 3.43Å; L773-I784 PolarHBondContact O-N 3.32Å; L773-N786 HydrophobicContact CD1-CB 4.16Å; L773-N786 HydrophobicContact CG-CB 4.18Å
774	R	59.6	Low	56.7	Low	215 Å²	215	92.5 Å²	92.5	81%	0.811	48%	0.479	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.7	133.4	172.6	-75.5	-179.9	177.1	175.2	-1.3	109.1	V781 D782	R774-V781 HydrophobicContact CB-CG1 3.66Å; R774-V781 HydrophobicContact CG-CG1 3.81Å; R774-D782 CarbonylContact C-O 3.6Å; R774-D782 WeakPolarHBondContact CA-O 3.25Å
775	L	62.3	Low	57.7	Low	6 Å²	6	90.3 Å²	90.3	3%	0.031	46%	0.455	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	125.2	180	-60.7	177.1	0	0	0	108.9	I715 Y730 S777 V781 D782 I784	I715-L775 HydrophobicContact CD1-CD1 3.85Å; I715-L775 HydrophobicContact CD1-CD2 3.84Å; I715-L775 HydrophobicContact CD1-CG 4.4Å; I715-L775 HydrophobicContact CG1-CD1 4.07Å; I715-L775 HydrophobicContact CG1-CD2 3.87Å; Y730-L775 HydrophobicContact CD1-CB 4.3Å; Y730-L775 HydrophobicContact CE1-CB 3.95Å; Y730-L775 HydrophobicContact CE1-CD1 4.47Å; Y730-L775 HydrophobicContact CE2-CD1 4.25Å; L775-S777 PolarHBondContact O-N 3.49Å; L775-V781 CarbonylContact O-C 3.48Å; L775-V781 WeakPolarHBondContact O-CA 3.26Å; L775-D782 HydrophobicContact CB-CB 4.41Å; L775-D782 PolarHBondContact N-O 3.22Å; L775-D782 PolarHBondContact O-N 2.87Å; L775-I784 HydrophobicContact CD1-CB 4.35Å; L775-I784 HydrophobicContact CD1-CG2 3.65Å; L775-I784 HydrophobicContact CG-CG2 4.21Å
776	Q	59.7	Low	58.6	Low	66 Å²	66	86.1 Å²	86.1	31%	0.308	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	111.5	173.8	-84.9	160.5	-72.1	0	0	110.3	I708 Y730 G780 V781	I708-Q776 HydrophobicContact CD1-CB 4.46Å; I708-Q776 HydrophobicContact CG1-CB 3.87Å; I708-Q776 HydrophobicContact CG1-CG 4.5Å; Y730-Q776 WeakPolarHBondContact CD1-O 3.39Å; Q776-G780 CarbonylContact C-O 3.5Å; Q776-G780 WeakPolarHBondContact CA-O 3.23Å; Q776-V781 HydrophobicContact CG-CG2 4.2Å
777	S	66	Low	59.8	Low	16 Å²	16	81.8 Å²	81.8	11%	0.112	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	158.2	164.9	166	0	0	0	0	109.7	V731 L775 R779 G780	V731-S777 WeakPolarHBondContact O-CB 3.26Å; V731-S777 PolarHBondContact O-OG 3.12Å; L775-S777 PolarHBondContact O-N 3.49Å; S777-R779 PolarHBondContact O-N 2.86Å; S777-R779 PolarHBondContact OG-N 2.78Å; S777-G780 WeakPolarHBondContact CA-O 3.33Å; S777-G780 PolarHBondContact N-O 3.42Å; S777-G780 PolarHBondContact O-N 3.31Å; S777-G780 VanDerWaalsContact O-N 3.08Å; S777-G780 VanDerWaalsContact O-O 3.09Å
778	I	63	Low	60.8	Low	44 Å²	44	83.6 Å²	83.6	23%	0.226	41%	0.414	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52	-12.3	164.5	-57.5	-174.7	0	0	0	112.8	T108 V731 T751	T108-I778 HydrophobicContact CG2-CB 4.35Å; T108-I778 HydrophobicContact CG2-CD1 4.15Å; T108-I778 HydrophobicContact CG2-CG1 3.85Å; T108-I778 HydrophobicContact CG2-CG2 3.99Å; V731-I778 HydrophobicContact CB-CD1 4.48Å; V731-I778 HydrophobicContact CG1-CD1 4.27Å; V731-I778 HydrophobicContact CG2-CD1 3.85Å; T751-I778 HydrophobicContact CG2-CD1 4.25Å
779	R	63.2	Low	62.2	Low	126 Å²	126	75.6 Å²	75.6	48%	0.475	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.6	7.8	-178.8	-56.5	-178.1	-177.3	-136.6	14.7	115.2	S777 E878 T882	S777-R779 PolarHBondContact O-N 2.86Å; S777-R779 PolarHBondContact OG-N 2.78Å; R779-E878 VanDerWaalsContact CZ-CD 3.49Å; R779-E878 IonicContact CZ-OE1 2.98Å; R779-E878 IonicContact CZ-OE2 3.85Å; R779-E878 IonicContact NH1-OE1 2.67Å; R779-E878 PolarHBondContact NH1-OE1 2.86Å; R779-E878 IonicContact NH1-OE2 3.89Å; R779-E878 PolarHBondContact NH1-OE2 3.22Å; R779-E878 IonicContact NH2-OE1 3.74Å; R779-E878 PolarHBondContact NH2-OE1 3.23Å; R779-E878 IonicContact NH2-OE2 2.72Å; R779-T882 PolarHBondContact NH2-OG1 2.9Å
780	G	62.8	Low	63.5	Low	39 Å²	39	72.9 Å²	72.9	40%	0.402	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	129.8	-147.7	-177.1	0	0	0	0	0	112.8	Q776 S777	Q776-G780 CarbonylContact C-O 3.5Å; Q776-G780 WeakPolarHBondContact CA-O 3.23Å; S777-G780 WeakPolarHBondContact CA-O 3.33Å; S777-G780 PolarHBondContact N-O 3.42Å; S777-G780 PolarHBondContact O-N 3.31Å; S777-G780 VanDerWaalsContact O-N 3.08Å; S777-G780 VanDerWaalsContact O-O 3.09Å
781	V	60.7	Low	64.8	Low	94 Å²	94	71.2 Å²	71.2	57%	0.57	35%	0.354	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110	108.7	-174.9	-176.4	0	0	0	0	111.3	R774 L775 Q776	R774-V781 HydrophobicContact CB-CG1 3.66Å; R774-V781 HydrophobicContact CG-CG1 3.81Å; L775-V781 CarbonylContact O-C 3.48Å; L775-V781 WeakPolarHBondContact O-CA 3.26Å; Q776-V781 HydrophobicContact CG-CG2 4.2Å
782	D	67	Low	66.1	Low	48 Å²	48	70 Å²	70	26%	0.257	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	156.9	167.3	-76.4	-31.3	0	0	0	110.7	Y730 R774 L775	Y730-D782 HydrophobicContact CE1-CB 4.33Å; Y730-D782 VanDerWaalsContact CE1-OD2 3.32Å; Y730-D782 WeakPolarHBondContact CE1-OD2 3.28Å; Y730-D782 PolarHBondContact OH-OD2 2.73Å; R774-D782 CarbonylContact C-O 3.6Å; R774-D782 WeakPolarHBondContact CA-O 3.25Å; L775-D782 HydrophobicContact CB-CB 4.41Å; L775-D782 PolarHBondContact N-O 3.22Å; L775-D782 PolarHBondContact O-N 2.87Å
783	A	63.8	Low	66.9	Low	57 Å²	57	66.2 Å²	66.2	47%	0.471	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	129.3	172.5	0	0	0	0	0	110.5	F772 L773	F772-A783 HydrophobicContact CD1-CB 4.46Å; L773-A783 WeakPolarHBondContact O-CA 3.46Å
784	I	68.3	Low	68	Low	5 Å²	5	69.4 Å²	69.4	3%	0.026	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	142.5	179.6	-163.7	168	0	0	0	112	F748 F772 L773 L775 Y789	F748-I784 HydrophobicContact CE1-CD1 3.4Å; F748-I784 VanDerWaalsContact CE1-CD1 3.4Å; F748-I784 HydrophobicContact CZ-CD1 3.35Å; F772-I784 CarbonylContact C-O 3.56Å; F772-I784 WeakPolarHBondContact CA-O 3.36Å; L773-I784 HydrophobicContact CB-CG2 4Å; L773-I784 PolarHBondContact N-O 3.43Å; L773-I784 PolarHBondContact O-N 3.32Å; L775-I784 HydrophobicContact CD1-CB 4.35Å; L775-I784 HydrophobicContact CD1-CG2 3.65Å; L775-I784 HydrophobicContact CG-CG2 4.21Å; I784-Y789 HydrophobicContact CD1-CE2 4.03Å; I784-Y789 WeakPolarHBondContact CD1-OH 3.49Å; I784-Y789 HydrophobicContact CG1-CE2 4.42Å; I784-Y789 VanDerWaalsContact CG1-OH 3.32Å; I784-Y789 WeakPolarHBondContact CG1-OH 3.3Å
785	E	65.2	Low	69.2	Low	79 Å²	79	59.7 Å²	59.7	37%	0.369	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	134.9	175.8	-64.6	-172	161	0	0	111.2	P770 F772 I787 Y789	P770-E785 HydrophobicContact CB-CG 4.44Å; F772-E785 HydrophobicContact CD1-CG 4.07Å; F772-E785 HydrophobicContact CE1-CG 3.52Å; F772-E785 HydrophobicContact CZ-CG 4.09Å; E785-I787 HydrophobicContact CB-CD1 4.07Å; E785-I787 HydrophobicContact CB-CG1 4.06Å; E785-I787 PolarHBondContact O-N 3Å; E785-I787 WeakPolarHBondContact OE2-CD1 3.41Å; E785-Y789 PolarHBondContact O-OH 3.07Å
786	N	64.7	Low	70.2	Confident	87 Å²	87	60.6 Å²	60.6	47%	0.465	31%	0.309	S	S	.	.			trans	-72.8	68.4	174.8	-169.7	-4.9	0	0	0	111.9	V771 L773	V771-N786 HydrophobicContact CB-CB 4.38Å; V771-N786 VanDerWaalsContact O-CB 3.29Å; V771-N786 WeakPolarHBondContact O-CB 3.44Å; V771-N786 PolarHBondContact O-N 3.33Å; L773-N786 HydrophobicContact CD1-CB 4.16Å; L773-N786 HydrophobicContact CG-CB 4.18Å
787	I	66.2	Low	71.5	Confident	38 Å²	38	57.5 Å²	57.5	20%	0.195	29%	0.294	C	S	.	.			trans	-108	147.8	175.8	-64.3	178.4	0	0	0	109.1	A759 E785 Y789	A759-I787 HydrophobicContact CB-CG2 4.01Å; E785-I787 HydrophobicContact CB-CD1 4.07Å; E785-I787 HydrophobicContact CB-CG1 4.06Å; E785-I787 PolarHBondContact O-N 3Å; E785-I787 WeakPolarHBondContact OE2-CD1 3.41Å; I787-Y789 WeakPolarHBondContact O-CD2 3.42Å; I787-Y789 VanDerWaalsContact O-CE2 3.29Å; I787-Y789 WeakPolarHBondContact O-CE2 3.44Å; I787-Y789 PolarHBondContact O-N 2.86Å; I787-Y789 VanDerWaalsContact O-N 3.11Å
788	K	65.6	Low	72	Confident	161 Å²	161	60.9 Å²	60.9	70%	0.7	31%	0.308	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.8	107.2	171.8	-175.3	160	-174.1	163.7	0	110.5	R760	R760-K788 PolarHBondContact N-O 2.91Å
789	Y	73.6	Confident	72.8	Confident	21 Å²	21	60 Å²	60	8%	0.082	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	152	168.7	-64.7	-80.8	0	0	0	111	C746 F748 T757 A759 I784 E785 I787	C746-Y789 HydrophobicContact CB-CD1 4.4Å; C746-Y789 HydrophobicContact CB-CE1 3.93Å; F748-Y789 HydrophobicContact CE2-CD1 4.25Å; F748-Y789 HydrophobicContact CE2-CE1 4.43Å; F748-Y789 HydrophobicContact CE2-CG 4.39Å; F748-Y789 HydrophobicContact CZ-CD1 4.49Å; F748-Y789 HydrophobicContact CZ-CD2 4.26Å; F748-Y789 HydrophobicContact CZ-CE1 4.42Å; F748-Y789 HydrophobicContact CZ-CE2 4.22Å; F748-Y789 HydrophobicContact CZ-CG 4.43Å; T757-Y789 VanDerWaalsContact OG1-CD1 3.31Å; T757-Y789 WeakPolarHBondContact OG1-CD1 3.47Å; A759-Y789 HydrophobicContact CB-CD1 4.28Å; A759-Y789 HydrophobicContact CB-CE1 4.07Å; I784-Y789 HydrophobicContact CD1-CE2 4.03Å; I784-Y789 WeakPolarHBondContact CD1-OH 3.49Å; I784-Y789 HydrophobicContact CG1-CE2 4.42Å; I784-Y789 VanDerWaalsContact CG1-OH 3.32Å; I784-Y789 WeakPolarHBondContact CG1-OH 3.3Å; E785-Y789 PolarHBondContact O-OH 3.07Å; I787-Y789 WeakPolarHBondContact O-CD2 3.42Å; I787-Y789 VanDerWaalsContact O-CE2 3.29Å; I787-Y789 WeakPolarHBondContact O-CE2 3.44Å; I787-Y789 PolarHBondContact O-N 2.86Å; I787-Y789 VanDerWaalsContact O-N 3.11Å
790	K	76.6	Confident	73.8	Confident	121 Å²	121	54 Å²	54	53%	0.526	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	114.7	165.3	-171	-149.8	170.2	-168.7	0	107.7	T757 V758	T757-K790 CarbonylContact C-O 3.58Å; T757-K790 VanDerWaalsContact CA-O 3.28Å; T757-K790 WeakPolarHBondContact CA-O 3.45Å; V758-K790 PolarHBondContact N-O 2.87Å; V758-K790 PolarHBondContact O-N 2.81Å
791	I	78.5	Confident	74.8	Confident	38 Å²	38	58 Å²	58	20%	0.195	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.8	142.4	167	-62.7	-177	0	0	0	109.2	L719 V755 F756 T757 R794	L719-I791 HydrophobicContact CB-CD1 4.08Å; L719-I791 HydrophobicContact CD2-CD1 4.38Å; L719-I791 HydrophobicContact CD2-CG1 4.13Å; L719-I791 WeakPolarHBondContact O-CD1 3.27Å; V755-I791 HydrophobicContact CG1-CD1 3.66Å; V755-I791 HydrophobicContact CG1-CG1 3.79Å; V755-I791 HydrophobicContact CG1-CG2 4.28Å; F756-I791 WeakPolarHBondContact O-CA 3.37Å; T757-I791 HydrophobicContact CG2-CG1 4.12Å; I791-R794 VanDerWaalsContact CD1-NH2 3.3Å; I791-R794 HydrophobicContact CG2-CG 4.19Å
792	Y	79.3	Confident	75.9	Confident	65 Å²	65	55.6 Å²	55.6	26%	0.255	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	-14	161.1	73.2	-90.2	0	0	0	114.1	V745 F756 V758	V745-Y792 HydrophobicContact CG1-CE1 3.93Å; V745-Y792 HydrophobicContact CG2-CE1 4.01Å; F756-Y792 HydrophobicContact CB-CD1 4.35Å; F756-Y792 HydrophobicContact CB-CE1 3.83Å; F756-Y792 HydrophobicContact CB-CE2 4.26Å; F756-Y792 PolarHBondContact O-N 2.89Å; V758-Y792 HydrophobicContact CG2-CD1 3.96Å; V758-Y792 HydrophobicContact CG2-CE1 3.98Å
793	H	78.9	Confident	76.4	Confident	38 Å²	38	58.1 Å²	58.1	18%	0.176	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154	153.6	177	-161.9	80.7	0	0	0	112.1	F756 L795 E864 Y866	F756-H793 HydrophobicContact CB-CB 4.07Å; F756-H793 HydrophobicContact CD2-CB 4.32Å; F756-H793 HydrophobicContact CG-CB 4.39Å; F756-H793 PolarHBondContact N-O 2.94Å; H793-L795 WeakPolarHBondContact NE2-CD2 3.45Å; H793-L795 VanDerWaalsContact NE2-CG 3.3Å; H793-L795 WeakPolarHBondContact NE2-CG 3.36Å; H793-E864 IonicContact CE1-OE2 2.68Å; H793-E864 PolarHBondContact CE1-OE2 2.83Å; H793-E864 IonicContact NE2-OE2 2.72Å; H793-Y866 PolarHBondContact CD2-OH 3.29Å; H793-Y866 PolarHBondContact CE1-OH 2.85Å; H793-Y866 PolarHBondContact ND1-OH 2.9Å; H793-Y866 AromaticContact NE2-CZ 3.85Å; H793-Y866 PolarHBondContact NE2-OH 2.97Å; H793-Y866 VanDerWaalsContact NE2-OH 3.16Å
794	R	83.9	Confident	76.1	Confident	94 Å²	94	60 Å²	60	36%	0.355	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	132.6	176.4	-66.6	-172	175.5	160	-0.4	108.9	A720 P721 I754 V755 I791	A720-R794 PolarHBondContact O-NH2 2.8Å; P721-R794 PolarHBondContact O-NH1 3Å; P721-R794 PolarHBondContact O-NH2 3.31Å; I754-R794 WeakPolarHBondContact O-CA 3.42Å; V755-R794 HydrophobicContact CG1-CG 4.16Å; V755-R794 HydrophobicContact CG2-CG 4.11Å; I791-R794 VanDerWaalsContact CD1-NH2 3.3Å; I791-R794 HydrophobicContact CG2-CG 4.19Å
795	L	84.8	Confident	75.7	Confident	10 Å²	10	63 Å²	63	5%	0.052	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	137.5	178.9	-71.6	173.9	0	0	0	111.6	Q753 I754 F756 H793 I800 F855 A857 Y866	Q753-L795 CarbonylContact C-O 3.49Å; Q753-L795 WeakPolarHBondContact CA-O 3.35Å; Q753-L795 VanDerWaalsContact CB-O 3.29Å; Q753-L795 WeakPolarHBondContact CB-O 3.36Å; I754-L795 PolarHBondContact N-O 2.61Å; I754-L795 PolarHBondContact O-N 3.21Å; F756-L795 HydrophobicContact CE2-CD1 4.12Å; H793-L795 WeakPolarHBondContact NE2-CD2 3.45Å; H793-L795 VanDerWaalsContact NE2-CG 3.3Å; H793-L795 WeakPolarHBondContact NE2-CG 3.36Å; L795-I800 HydrophobicContact CB-CD1 4.15Å; L795-I800 HydrophobicContact CB-CG1 4.39Å; L795-I800 HydrophobicContact CD1-CD1 4.33Å; L795-I800 HydrophobicContact CD1-CG1 4.32Å; L795-F855 HydrophobicContact CD1-CE2 3.69Å; L795-F855 HydrophobicContact CD1-CZ 4.15Å; L795-A857 HydrophobicContact CD1-CB 3.57Å; L795-A857 HydrophobicContact CD2-CB 3.71Å; L795-A857 HydrophobicContact CG-CB 4.26Å; L795-Y866 HydrophobicContact CD1-CD2 4.41Å; L795-Y866 HydrophobicContact CD1-CE2 4.18Å
796	G	82.5	Confident	74.6	Confident	26 Å²	26	65.8 Å²	65.8	27%	0.268	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	139.3	166.2	0	0	0	0	0	111	E798 A799	G796-E798 VanDerWaalsContact C-OE2 3.25Å; G796-E798 VanDerWaalsContact CA-OE2 3.3Å; G796-E798 WeakPolarHBondContact CA-OE2 3.35Å; G796-E798 PolarHBondContact O-N 2.87Å; G796-A799 PolarHBondContact O-N 3.3Å; G796-A799 VanDerWaalsContact O-N 3.08Å
797	I	86	Confident	73.8	Confident	0 Å²	0	65.5 Å²	65.5	0%	0	32%	0.321	C	S	.	.	G	3₁₀ helix	trans	-66.6	-26.7	-178.6	-73.7	175.7	0	0	0	111.5	M749 F750 D752 I754 A799 I800 L886 K887 L890	M749-I797 HydrophobicContact CG-CD1 4.28Å; F750-I797 WeakPolarHBondContact O-CD1 3.34Å; D752-I797 PolarHBondContact O-N 2.95Å; I754-I797 HydrophobicContact CD1-CG1 4.35Å; I754-I797 HydrophobicContact CG1-CD1 4.2Å; I754-I797 HydrophobicContact CG1-CG1 3.86Å; I797-A799 PolarHBondContact O-N 3.08Å; I797-I800 PolarHBondContact O-N 3.25Å; I797-L886 HydrophobicContact CD1-CB 4.2Å; I797-L886 HydrophobicContact CD1-CD1 3.64Å; I797-L886 HydrophobicContact CG2-CB 4.01Å; I797-K887 HydrophobicContact CG2-CG 3.62Å; I797-K887 WeakPolarHBondContact O-CD 3.33Å; I797-K887 WeakPolarHBondContact O-CE 3.49Å; I797-K887 WeakPolarHBondContact O-CG 3.22Å; I797-L890 HydrophobicContact CB-CD1 3.8Å; I797-L890 HydrophobicContact CG2-CD1 3.71Å
798	E	76.5	Confident	72.5	Confident	87 Å²	87	66.5 Å²	66.5	41%	0.407	33%	0.328	S	S	.	.	G	3₁₀ helix	trans	-60.4	-33.6	171.8	60.6	-91.2	-108.6	0	0	112.9	G796 K887 K894	G796-E798 VanDerWaalsContact C-OE2 3.25Å; G796-E798 VanDerWaalsContact CA-OE2 3.3Å; G796-E798 WeakPolarHBondContact CA-OE2 3.35Å; G796-E798 PolarHBondContact O-N 2.87Å; E798-K887 WeakPolarHBondContact O-CE 3.27Å; E798-K887 PolarHBondContact O-NZ 2.95Å; E798-K894 IonicContact OE1-NZ 3.57Å; E798-K894 PolarHBondContact OE1-NZ 2.82Å
799	A	80.9	Confident	71.1	Confident	26 Å²	26	64.6 Å²	64.6	22%	0.215	33%	0.326	C	S	.	.	G	3₁₀ helix	trans	-84.8	-5.6	-173.6	0	0	0	0	0	114.6	G796 I797 A857 T858	G796-A799 PolarHBondContact O-N 3.3Å; G796-A799 VanDerWaalsContact O-N 3.08Å; I797-A799 PolarHBondContact O-N 3.08Å; A799-A857 WeakPolarHBondContact O-CA 3.32Å; A799-T858 PolarHBondContact O-N 3Å
800	I	84.3	Confident	69.3	Low	1 Å²	1	68.1 Å²	68.1	1%	0.005	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	125.9	-176.1	-66.8	173.4	0	0	0	111.1	I754 L795 I797 L802 F855 T856 I883 K887	I754-I800 HydrophobicContact CD1-CD1 3.67Å; I754-I800 HydrophobicContact CG1-CD1 4.13Å; L795-I800 HydrophobicContact CB-CD1 4.15Å; L795-I800 HydrophobicContact CB-CG1 4.39Å; L795-I800 HydrophobicContact CD1-CD1 4.33Å; L795-I800 HydrophobicContact CD1-CG1 4.32Å; I797-I800 PolarHBondContact O-N 3.25Å; I800-L802 HydrophobicContact CG2-CD2 4.24Å; I800-F855 HydrophobicContact CB-CD2 4.45Å; I800-F855 HydrophobicContact CD1-CE2 4.42Å; I800-F855 HydrophobicContact CG1-CD2 4.27Å; I800-F855 HydrophobicContact CG1-CE2 4.23Å; I800-F855 HydrophobicContact CG2-CB 3.95Å; I800-F855 HydrophobicContact CG2-CD2 3.67Å; I800-F855 HydrophobicContact CG2-CE2 4.34Å; I800-F855 HydrophobicContact CG2-CG 3.87Å; I800-T856 CarbonylContact C-O 3.49Å; I800-T856 WeakPolarHBondContact CA-O 3.12Å; I800-I883 HydrophobicContact CG2-CD1 4.37Å; I800-I883 HydrophobicContact CG2-CG2 4.39Å; I800-K887 WeakPolarHBondContact O-CD 3.4Å; I800-K887 PolarHBondContact O-NZ 2.68Å
801	E	82.6	Confident	67.4	Low	121 Å²	121	70.4 Å²	70.4	57%	0.565	36%	0.358	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118	122.4	173.5	-62.3	-168.3	147.5	0	0	110.6	F855 T856	E801-F855 CarbonylContact O-C 3.5Å; E801-F855 WeakPolarHBondContact O-CA 3.35Å; E801-F855 VanDerWaalsContact O-CB 3.24Å; E801-F855 WeakPolarHBondContact O-CB 3.49Å; E801-T856 PolarHBondContact N-O 3.41Å; E801-T856 PolarHBondContact O-N 2.96Å
802	L	84.7	Confident	65.5	Low	45 Å²	45	74.2 Å²	74.2	24%	0.236	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	134.5	-177.8	-57.1	177.8	0	0	0	110.6	I800 S804 F855 E880 I883 L884	I800-L802 HydrophobicContact CG2-CD2 4.24Å; L802-S804 PolarHBondContact O-N 3.01Å; L802-F855 HydrophobicContact CD2-CB 3.9Å; L802-E880 HydrophobicContact CD1-CB 3.93Å; L802-E880 HydrophobicContact CD1-CG 4.12Å; L802-E880 HydrophobicContact CD2-CG 4.5Å; L802-I883 HydrophobicContact CD1-CG2 4.42Å; L802-I883 HydrophobicContact CD2-CD1 4.44Å; L802-L884 HydrophobicContact CD1-CD1 4.3Å; L802-L884 HydrophobicContact CD1-CD2 4.12Å; L802-L884 HydrophobicContact CD1-CG 3.91Å
803	E	77.4	Confident	63.5	Low	100 Å²	100	77.4 Å²	77.4	47%	0.467	41%	0.411	S	S	.	.			trans	-70.8	126	177.5	-167	172.2	165	0	0	110.9	R805 I854 R865	E803-R805 PolarHBondContact O-N 3Å; E803-I854 HydrophobicContact CB-CB 4.28Å; E803-I854 HydrophobicContact CB-CG2 4.4Å; E803-I854 PolarHBondContact N-O 2.71Å; E803-I854 WeakPolarHBondContact OE2-CG2 3.41Å; E803-R865 IonicContact OE2-CZ 3.19Å; E803-R865 VanDerWaalsContact OE2-CZ 3.27Å; E803-R865 IonicContact OE2-NH1 2.73Å; E803-R865 PolarHBondContact OE2-NH1 3.32Å; E803-R865 IonicContact OE2-NH2 2.86Å; E803-R865 PolarHBondContact OE2-NH2 3.49Å
804	S	56.6	Low	61.6	Low	98 Å²	98	78.4 Å²	78.4	69%	0.685	43%	0.432	S	S	*	.			trans	-79.1	112.4	-165.3	56.4	0	0	0	0	113.8	L802	L802-S804 PolarHBondContact O-N 3.01Å
805	R	60.8	Low	59.5	Low	67 Å²	67	82.2 Å²	82.2	25%	0.253	45%	0.454	S	S	.	.			trans	-84	128.5	168.8	-80.7	-170.6	161.7	123.8	-10.7	111.9	E803 E807 M848 P849 M852	E803-R805 PolarHBondContact O-N 3Å; R805-E807 HydrophobicContact CB-CG 4.27Å; R805-E807 WeakPolarHBondContact CD-OE1 3.45Å; R805-E807 PolarHBondContact O-N 3.25Å; R805-M848 VanDerWaalsContact CZ-SD 3.5Å; R805-M848 VanDerWaalsContact NH2-CG 3.31Å; R805-M848 PolarHBondContact NH2-O 3.47Å; R805-M848 PolarHBondContact NH2-SD 3.07Å; R805-M848 VanDerWaalsContact NH2-SD 3.44Å; R805-P849 PolarHBondContact NH2-O 3.5Å; R805-M852 PolarHBondContact NH1-O 3.5Å
806	L	42.5	Very low	57.6	Low	138 Å²	138	89.1 Å²	89.1	72%	0.723	49%	0.486	S	S	*	.			trans	-81.7	57.9	169.2	-69.5	169.4	0	0	0	111.6	V808	L806-V808 PolarHBondContact O-N 2.85Å; L806-V808 VanDerWaalsContact O-N 3.17Å
807	E	47.7	Very low	55.7	Low	81 Å²	81	96.2 Å²	96.2	38%	0.379	51%	0.509	S	S	.	.			trans	-76.4	94.2	169	-74.8	-179.9	-125.8	0	0	109.3	R805 D809 R876 K877	R805-E807 HydrophobicContact CB-CG 4.27Å; R805-E807 WeakPolarHBondContact CD-OE1 3.45Å; R805-E807 PolarHBondContact O-N 3.25Å; E807-D809 PolarHBondContact O-N 3.04Å; E807-R876 IonicContact OE1-CZ 3.95Å; E807-R876 IonicContact OE1-NH1 3.82Å; E807-R876 IonicContact OE1-NH2 3.81Å; E807-R876 PolarHBondContact OE1-NH2 3.12Å; E807-R876 IonicContact OE2-NH2 3.69Å; E807-K877 WeakPolarHBondContact OE2-CE 3.21Å; E807-K877 IonicContact OE2-NZ 2.74Å; E807-K877 PolarHBondContact OE2-NZ 3.38Å
808	V	37.7	Very low	54.2	Low	58 Å²	58	104.4 Å²	104.4	35%	0.352	55%	0.547	S	S	.	.			trans	-89	75.9	177.7	180	0	0	0	0	109.4	L806 I810 L835	L806-V808 PolarHBondContact O-N 2.85Å; L806-V808 VanDerWaalsContact O-N 3.17Å; V808-I810 HydrophobicContact CG1-CD1 3.78Å; V808-I810 HydrophobicContact CG1-CG1 3.84Å; V808-I810 PolarHBondContact O-N 3.17Å; V808-I810 VanDerWaalsContact O-N 3.08Å; V808-L835 HydrophobicContact CG1-CD1 4.48Å; V808-L835 HydrophobicContact CG2-CD1 4.46Å; V808-L835 HydrophobicContact CG2-CD2 4.39Å
809	D	37.7	Very low	53.1	Low	122 Å²	122	107.3 Å²	107.3	65%	0.652	57%	0.565	S	S	*	*			trans	-74.7	85.9	174.8	-72.3	-24.7	0	0	0	109.9	E807 K877	E807-D809 PolarHBondContact O-N 3.04Å; D809-K877 IonicContact OD2-NZ 3.2Å; D809-K877 PolarHBondContact OD2-NZ 3.14Å
810	I	35.9	Very low	51.7	Low	94 Å²	94	110 Å²	110	48%	0.482	58%	0.576	S	S	.	*			trans	-91.9	97.1	169.3	-61.9	167.6	0	0	0	108.3	V808 P812	V808-I810 HydrophobicContact CG1-CD1 3.78Å; V808-I810 HydrophobicContact CG1-CG1 3.84Å; V808-I810 PolarHBondContact O-N 3.17Å; V808-I810 VanDerWaalsContact O-N 3.08Å; I810-P812 WeakPolarHBondContact O-CD 3.24Å
811	E	36.1	Very low	50.7	Low	170 Å²	170	114.2 Å²	114.2	79%	0.794	60%	0.599	S	S	*	*			trans	-73.2	122.3	166.5	-72.8	-158.7	146.7	0	0	110.6	T813	E811-T813 PolarHBondContact O-N 3.41Å; E811-T813 VanDerWaalsContact O-N 3.17Å
812	P	38.8	Very low	50	Low	117 Å²	117	111.1 Å²	111.1	76%	0.76	59%	0.594	S	S	*	*			trans	-85.4	87.6	178.8	33.6	-32.9	0	0	0	110.8	I810 G814	I810-P812 WeakPolarHBondContact O-CD 3.24Å; P812-G814 PolarHBondContact O-N 3.29Å
813	T	36.9	Very low	49.1	Very low	132 Å²	132	112.6 Å²	112.6	81%	0.81	60%	0.604	S	S	*	*			trans	-62	102.6	172.3	50.6	0	0	0	0	110.5	E811 Q815	E811-T813 PolarHBondContact O-N 3.41Å; E811-T813 VanDerWaalsContact O-N 3.17Å; T813-Q815 VanDerWaalsContact C-N 3.31Å; T813-Q815 PolarHBondContact O-N 2.83Å
814	G	39.2	Very low	48.7	Very low	59 Å²	59	109.9 Å²	109.9	61%	0.608	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.3	14.5	-151.5	0	0	0	0	0	119.3	P812	P812-G814 PolarHBondContact O-N 3.29Å
815	Q	39.8	Very low	49.3	Very low	174 Å²	174	110 Å²	110	81%	0.813	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.8	-13.1	-164.4	-121.2	68.6	20.3	0	0	117.1	T813	T813-Q815 VanDerWaalsContact C-N 3.31Å; T813-Q815 PolarHBondContact O-N 2.83Å
816	H	44.6	Very low	50	Low	156 Å²	156	115 Å²	115	72%	0.722	60%	0.599	S	S	*	*			trans	-124.5	47.1	-174.7	-83.8	-74.2	0	0	0	113.6	E818	H816-E818 VanDerWaalsContact C-N 3.34Å; H816-E818 PolarHBondContact O-N 2.81Å
817	K	43.5	Very low	51.2	Low	174 Å²	174	113.3 Å²	113.3	76%	0.757	59%	0.589	S	S	*	*	S	Bend	trans	-81.4	-6.6	-171.4	-152.1	172.3	-177.3	178.7	0	115.1	R825	K817-R825 PolarHBondContact O-NH1 2.97Å; K817-R825 VanDerWaalsContact O-NH1 3.12Å; K817-R825 PolarHBondContact O-NH2 2.95Å
818	E	53.3	Low	52.2	Low	172 Å²	172	114.9 Å²	114.9	80%	0.804	59%	0.592	S	S	*	*	S	Bend	trans	-110.6	-44.9	-166.1	-59.1	-168.7	150.2	0	0	113.5	H816 L820 R825	H816-E818 VanDerWaalsContact C-N 3.34Å; H816-E818 PolarHBondContact O-N 2.81Å; E818-L820 PolarHBondContact O-N 3.09Å; E818-L820 VanDerWaalsContact O-N 3.08Å; E818-R825 VanDerWaalsContact C-NH2 3.3Å; E818-R825 PolarHBondContact O-NH2 3.04Å
819	D	53.9	Low	53.9	Low	148 Å²	148	117.9 Å²	117.9	79%	0.791	60%	0.603	S	S	*	*	S	Bend	trans	-77.1	8.8	-177.2	-60.5	-53	0	0	0	116.3	D821	D819-D821 PolarHBondContact O-N 3.3Å
820	L	50.6	Low	55.6	Low	82 Å²	82	115.6 Å²	115.6	43%	0.429	60%	0.597	S	S	.	*			trans	-79.6	115.4	179	-145.7	77.3	0	0	0	111.2	E818 V824 R825	E818-L820 PolarHBondContact O-N 3.09Å; E818-L820 VanDerWaalsContact O-N 3.08Å; L820-V824 HydrophobicContact CD1-CG1 4.25Å; L820-V824 HydrophobicContact CD2-CB 4.3Å; L820-V824 HydrophobicContact CD2-CG1 3.8Å; L820-V824 HydrophobicContact CG-CB 4.1Å; L820-V824 HydrophobicContact CG-CG1 3.92Å; L820-R825 HydrophobicContact CB-CG 4.23Å; L820-R825 HydrophobicContact CD2-CG 4.24Å; L820-R825 PolarHBondContact O-NE 3.27Å
821	D	64	Low	57.4	Low	91 Å²	91	114.8 Å²	114.8	49%	0.487	59%	0.593	S	S	.	*			trans	-56.8	150.2	-179.6	165.4	59.2	0	0	0	114	D819 V823 V824 R825	D819-D821 PolarHBondContact O-N 3.3Å; D821-V823 PolarHBondContact O-N 2.9Å; D821-V823 WeakPolarHBondContact OD2-CA 3.47Å; D821-V823 WeakPolarHBondContact OD2-CB 3.1Å; D821-V823 WeakPolarHBondContact OD2-CG2 3.42Å; D821-V823 PolarHBondContact OD2-N 3.5Å; D821-V824 PolarHBondContact O-N 3.22Å; D821-R825 PolarHBondContact O-N 3.44Å
822	A	67.8	Low	59.2	Low	56 Å²	56	110.4 Å²	110.4	46%	0.463	57%	0.572	S	S	.	*	H	α-helix	trans	-62.8	-19.7	-177.8	0	0	0	0	0	114.6	R826	A822-R826 WeakPolarHBondContact O-CB 3.49Å; A822-R826 WeakPolarHBondContact O-CG 3.38Å; A822-R826 PolarHBondContact O-N 2.89Å; A822-R826 PolarHBondContact O-NE 3.5Å
823	V	66.3	Low	60.9	Low	76 Å²	76	110.9 Å²	110.9	46%	0.461	56%	0.562	S	S	.	*	H	α-helix	trans	-74.9	-44.1	169.1	-175.6	0	0	0	0	110.2	D821 R826 M827	D821-V823 PolarHBondContact O-N 2.9Å; D821-V823 WeakPolarHBondContact OD2-CA 3.47Å; D821-V823 WeakPolarHBondContact OD2-CB 3.1Å; D821-V823 WeakPolarHBondContact OD2-CG2 3.42Å; D821-V823 PolarHBondContact OD2-N 3.5Å; V823-R826 PolarHBondContact O-N 3.01Å; V823-M827 WeakPolarHBondContact O-CB 3.39Å; V823-M827 PolarHBondContact O-N 2.82Å
824	V	69.2	Low	62.5	Low	43 Å²	43	110.3 Å²	110.3	26%	0.261	55%	0.55	S	S	.	*	H	α-helix	trans	-68.4	-41.8	179.8	-172.5	0	0	0	0	111.1	L820 D821 R826 M827 Y828	L820-V824 HydrophobicContact CD1-CG1 4.25Å; L820-V824 HydrophobicContact CD2-CB 4.3Å; L820-V824 HydrophobicContact CD2-CG1 3.8Å; L820-V824 HydrophobicContact CG-CB 4.1Å; L820-V824 HydrophobicContact CG-CG1 3.92Å; D821-V824 PolarHBondContact O-N 3.22Å; V824-R826 PolarHBondContact O-N 3.47Å; V824-M827 PolarHBondContact O-N 2.58Å; V824-Y828 WeakPolarHBondContact O-CB 3.05Å; V824-Y828 PolarHBondContact O-N 3Å
825	R	70	Confident	63.8	Low	99 Å²	99	110.1 Å²	110.1	37%	0.374	54%	0.535	S	S	.	.	H	α-helix	trans	-58.2	-44.6	173.6	-67.5	-174.4	-168.7	-102.5	-2.7	112	K817 E818 L820 D821 Y828 M829	K817-R825 PolarHBondContact O-NH1 2.97Å; K817-R825 VanDerWaalsContact O-NH1 3.12Å; K817-R825 PolarHBondContact O-NH2 2.95Å; E818-R825 VanDerWaalsContact C-NH2 3.3Å; E818-R825 PolarHBondContact O-NH2 3.04Å; L820-R825 HydrophobicContact CB-CG 4.23Å; L820-R825 HydrophobicContact CD2-CG 4.24Å; L820-R825 PolarHBondContact O-NE 3.27Å; D821-R825 PolarHBondContact O-N 3.44Å; R825-Y828 PolarHBondContact O-N 2.85Å; R825-M829 WeakPolarHBondContact O-CB 3.37Å; R825-M829 WeakPolarHBondContact O-CG 3.49Å; R825-M829 PolarHBondContact O-N 3.28Å
826	R	73.6	Confident	65.3	Low	172 Å²	172	106.1 Å²	106.1	65%	0.649	52%	0.516	S	S	*	.	H	α-helix	trans	-65	-42.5	176.1	-81.3	-179.1	-71.8	173.7	-3.3	112.6	A822 V823 V824 M829 S830	A822-R826 WeakPolarHBondContact O-CB 3.49Å; A822-R826 WeakPolarHBondContact O-CG 3.38Å; A822-R826 PolarHBondContact O-N 2.89Å; A822-R826 PolarHBondContact O-NE 3.5Å; V823-R826 PolarHBondContact O-N 3.01Å; V824-R826 PolarHBondContact O-N 3.47Å; R826-M829 PolarHBondContact O-N 2.61Å; R826-S830 WeakPolarHBondContact O-CB 3.34Å; R826-S830 PolarHBondContact O-N 3.23Å
827	M	69.3	Low	66.6	Low	104 Å²	104	102.4 Å²	102.4	51%	0.512	50%	0.502	S	S	.	.	H	α-helix	trans	-62.1	-43.7	176.5	-172.2	175.1	178.4	0	0	111.6	V823 V824 S830 I831	V823-M827 WeakPolarHBondContact O-CB 3.39Å; V823-M827 PolarHBondContact O-N 2.82Å; V824-M827 PolarHBondContact O-N 2.58Å; M827-S830 PolarHBondContact O-N 2.91Å; M827-I831 HydrophobicContact CE-CD1 4.29Å; M827-I831 HydrophobicContact CG-CD1 4.11Å; M827-I831 WeakPolarHBondContact O-CG1 3.34Å; M827-I831 PolarHBondContact O-N 2.93Å
828	Y	68.3	Low	67.6	Low	113 Å²	113	99.7 Å²	99.7	44%	0.443	50%	0.495	S	S	.	.	H	α-helix	trans	-62.3	-45.9	175	-174.6	-92.3	0	0	0	112.1	V824 R825 S830 I831 Q832	V824-Y828 WeakPolarHBondContact O-CB 3.05Å; V824-Y828 PolarHBondContact O-N 3Å; R825-Y828 PolarHBondContact O-N 2.85Å; Y828-S830 VanDerWaalsContact C-N 3.32Å; Y828-S830 PolarHBondContact O-N 3.03Å; Y828-I831 PolarHBondContact O-N 3.41Å; Y828-Q832 HydrophobicContact CD1-CG 3.79Å; Y828-Q832 HydrophobicContact CE1-CG 3.48Å; Y828-Q832 VanDerWaalsContact CE1-CG 3.48Å; Y828-Q832 HydrophobicContact CG-CG 4.46Å; Y828-Q832 WeakPolarHBondContact O-CB 3.43Å; Y828-Q832 WeakPolarHBondContact O-CG 3.42Å; Y828-Q832 PolarHBondContact O-N 3.24Å; Y828-Q832 PolarHBondContact OH-NE2 3.42Å
829	M	73.3	Confident	67.7	Low	122 Å²	122	96.4 Å²	96.4	60%	0.601	48%	0.475	S	S	*	.	H	α-helix	trans	-62.9	-36.4	176.6	-65.7	-102.9	66.9	0	0	112.5	R825 R826 K833	R825-M829 WeakPolarHBondContact O-CB 3.37Å; R825-M829 WeakPolarHBondContact O-CG 3.49Å; R825-M829 PolarHBondContact O-N 3.28Å; R826-M829 PolarHBondContact O-N 2.61Å; M829-K833 WeakPolarHBondContact O-CB 3.42Å; M829-K833 PolarHBondContact O-N 2.82Å
830	S	73.9	Confident	68.3	Low	73 Å²	73	93.7 Å²	93.7	51%	0.51	46%	0.464	S	S	.	.	H	α-helix	trans	-65.3	-48.2	175.6	-163.1	0	0	0	0	111.5	R826 M827 Y828 Q832 K833 E834	R826-S830 WeakPolarHBondContact O-CB 3.34Å; R826-S830 PolarHBondContact O-N 3.23Å; M827-S830 PolarHBondContact O-N 2.91Å; Y828-S830 VanDerWaalsContact C-N 3.32Å; Y828-S830 PolarHBondContact O-N 3.03Å; S830-Q832 VanDerWaalsContact C-N 3.35Å; S830-Q832 PolarHBondContact O-N 3.11Å; S830-K833 PolarHBondContact O-N 3.2Å; S830-E834 WeakPolarHBondContact O-CB 3.47Å; S830-E834 PolarHBondContact O-N 3.1Å
831	I	73.2	Confident	68.9	Low	77 Å²	77	93.5 Å²	93.5	40%	0.395	48%	0.475	S	S	.	.	H	α-helix	trans	-63.2	-41.3	177.6	-66.7	165.2	0	0	0	110.7	M827 Y828 K833 E834 L835	M827-I831 HydrophobicContact CE-CD1 4.29Å; M827-I831 HydrophobicContact CG-CD1 4.11Å; M827-I831 WeakPolarHBondContact O-CG1 3.34Å; M827-I831 PolarHBondContact O-N 2.93Å; Y828-I831 PolarHBondContact O-N 3.41Å; I831-K833 PolarHBondContact O-N 3.06Å; I831-E834 PolarHBondContact O-N 3.29Å; I831-L835 VanDerWaalsContact O-CB 3.25Å; I831-L835 WeakPolarHBondContact O-CB 3.19Å; I831-L835 PolarHBondContact O-N 2.74Å
832	Q	73.5	Confident	68.3	Low	78 Å²	78	97.5 Å²	97.5	36%	0.364	48%	0.483	S	S	.	.	H	α-helix	trans	-59.9	-44.5	174.7	-71.5	-96.5	-70.8	0	0	111.8	Y828 S830 E836	Y828-Q832 HydrophobicContact CD1-CG 3.79Å; Y828-Q832 HydrophobicContact CE1-CG 3.48Å; Y828-Q832 VanDerWaalsContact CE1-CG 3.48Å; Y828-Q832 HydrophobicContact CG-CG 4.46Å; Y828-Q832 WeakPolarHBondContact O-CB 3.43Å; Y828-Q832 WeakPolarHBondContact O-CG 3.42Å; Y828-Q832 PolarHBondContact O-N 3.24Å; Y828-Q832 PolarHBondContact OH-NE2 3.42Å; S830-Q832 VanDerWaalsContact C-N 3.35Å; S830-Q832 PolarHBondContact O-N 3.11Å; Q832-E836 PolarHBondContact O-N 3.36Å; Q832-E836 VanDerWaalsContact O-N 3.11Å
833	K	75.7	Confident	67.2	Low	128 Å²	128	100.8 Å²	100.8	56%	0.557	49%	0.493	S	S	*	.	H	α-helix	trans	-64.8	-48.3	177.4	-170.6	-175.9	-179.3	-68.8	0	111.5	M829 S830 I831 L835 E836 D837	M829-K833 WeakPolarHBondContact O-CB 3.42Å; M829-K833 PolarHBondContact O-N 2.82Å; S830-K833 PolarHBondContact O-N 3.2Å; I831-K833 PolarHBondContact O-N 3.06Å; K833-L835 VanDerWaalsContact C-N 3.27Å; K833-L835 PolarHBondContact O-N 2.93Å; K833-E836 PolarHBondContact O-N 2.87Å; K833-E836 VanDerWaalsContact O-N 3.1Å; K833-D837 IonicContact NZ-OD1 3.79Å; K833-D837 PolarHBondContact NZ-OD1 3.41Å; K833-D837 IonicContact NZ-OD2 3.54Å; K833-D837 PolarHBondContact NZ-OD2 2.88Å; K833-D837 WeakPolarHBondContact O-CB 3.34Å; K833-D837 VanDerWaalsContact O-CG 3.29Å; K833-D837 PolarHBondContact O-N 3.43Å
834	E	69.3	Low	66.3	Low	119 Å²	119	104 Å²	104	56%	0.556	51%	0.513	S	S	*	.	H	α-helix	trans	-60.5	-37.2	-179.8	-171.3	169.1	-152.2	0	0	111.9	S830 I831 L838	S830-E834 WeakPolarHBondContact O-CB 3.47Å; S830-E834 PolarHBondContact O-N 3.1Å; I831-E834 PolarHBondContact O-N 3.29Å; E834-L838 WeakPolarHBondContact O-CB 3.33Å; E834-L838 WeakPolarHBondContact O-CD1 3.33Å; E834-L838 VanDerWaalsContact O-CG 3.23Å; E834-L838 WeakPolarHBondContact O-CG 3.43Å; E834-L838 PolarHBondContact O-N 3.13Å
835	L	66.1	Low	65.4	Low	55 Å²	55	106.4 Å²	106.4	29%	0.288	53%	0.532	S	S	.	.	H	α-helix	trans	-71.7	-30.5	176	-156.8	151.5	0	0	0	112.6	V808 I831 K833 R839	V808-L835 HydrophobicContact CG1-CD1 4.48Å; V808-L835 HydrophobicContact CG2-CD1 4.46Å; V808-L835 HydrophobicContact CG2-CD2 4.39Å; I831-L835 VanDerWaalsContact O-CB 3.25Å; I831-L835 WeakPolarHBondContact O-CB 3.19Å; I831-L835 PolarHBondContact O-N 2.74Å; K833-L835 VanDerWaalsContact C-N 3.27Å; K833-L835 PolarHBondContact O-N 2.93Å; L835-R839 VanDerWaalsContact O-CG 3.32Å; L835-R839 WeakPolarHBondContact O-CG 2.87Å; L835-R839 PolarHBondContact O-N 3.14Å
836	E	71	Confident	64.4	Low	90 Å²	90	108 Å²	108	42%	0.421	55%	0.552	S	S	.	*	H	α-helix	trans	-81.2	-35.8	175	-160.2	60.9	-146.5	0	0	113	Q832 K833 L838 R839 T840	Q832-E836 PolarHBondContact O-N 3.36Å; Q832-E836 VanDerWaalsContact O-N 3.11Å; K833-E836 PolarHBondContact O-N 2.87Å; K833-E836 VanDerWaalsContact O-N 3.1Å; E836-L838 VanDerWaalsContact C-N 3.29Å; E836-L838 PolarHBondContact O-N 2.95Å; E836-R839 PolarHBondContact O-N 3.04Å; E836-R839 WeakPolarHBondContact OE2-CD 3.35Å; E836-R839 IonicContact OE2-CZ 3Å; E836-R839 IonicContact OE2-NE 2.7Å; E836-R839 IonicContact OE2-NH1 3.23Å; E836-R839 PolarHBondContact OE2-NH1 2.85Å; E836-T840 PolarHBondContact O-N 3.42Å; E836-T840 PolarHBondContact O-OG1 2.59Å
837	D	72.7	Confident	63.5	Low	79 Å²	79	105.9 Å²	105.9	42%	0.422	56%	0.561	S	S	.	*	H	α-helix	trans	-61.1	-39.7	168.7	-68.2	-24.3	0	0	0	109.8	K833 T840 A841	K833-D837 IonicContact NZ-OD1 3.79Å; K833-D837 PolarHBondContact NZ-OD1 3.41Å; K833-D837 IonicContact NZ-OD2 3.54Å; K833-D837 PolarHBondContact NZ-OD2 2.88Å; K833-D837 WeakPolarHBondContact O-CB 3.34Å; K833-D837 VanDerWaalsContact O-CG 3.29Å; K833-D837 PolarHBondContact O-N 3.43Å; D837-T840 WeakPolarHBondContact CA-OG1 3.48Å; D837-T840 PolarHBondContact O-OG1 3.03Å; D837-T840 VanDerWaalsContact O-OG1 3.06Å; D837-A841 WeakPolarHBondContact O-CB 3.3Å; D837-A841 PolarHBondContact O-N 3.49Å
838	L	64.4	Low	63.3	Low	117 Å²	117	103.6 Å²	103.6	61%	0.613	55%	0.55	S	S	*	.	H	α-helix	trans	-67.8	-35.4	172.8	-77.9	167.8	0	0	0	113.9	E834 E836 R842	E834-L838 WeakPolarHBondContact O-CB 3.33Å; E834-L838 WeakPolarHBondContact O-CD1 3.33Å; E834-L838 VanDerWaalsContact O-CG 3.23Å; E834-L838 WeakPolarHBondContact O-CG 3.43Å; E834-L838 PolarHBondContact O-N 3.13Å; E836-L838 VanDerWaalsContact C-N 3.29Å; E836-L838 PolarHBondContact O-N 2.95Å; L838-R842 PolarHBondContact O-N 2.89Å
839	R	56.7	Low	63.7	Low	103 Å²	103	101.1 Å²	101.1	39%	0.389	55%	0.547	S	S	.	.	H	α-helix	trans	-65.2	-50.3	173.9	-79.6	163.3	169.1	174.4	-1.5	111.2	L835 E836 A841 R842 N843	L835-R839 VanDerWaalsContact O-CG 3.32Å; L835-R839 WeakPolarHBondContact O-CG 2.87Å; L835-R839 PolarHBondContact O-N 3.14Å; E836-R839 PolarHBondContact O-N 3.04Å; E836-R839 WeakPolarHBondContact OE2-CD 3.35Å; E836-R839 IonicContact OE2-CZ 3Å; E836-R839 IonicContact OE2-NE 2.7Å; E836-R839 IonicContact OE2-NH1 3.23Å; E836-R839 PolarHBondContact OE2-NH1 2.85Å; R839-A841 VanDerWaalsContact C-N 3.3Å; R839-A841 PolarHBondContact O-N 2.79Å; R839-R842 PolarHBondContact O-N 3.37Å; R839-R842 VanDerWaalsContact O-N 3.17Å; R839-N843 PolarHBondContact O-N 3.37Å; R839-N843 PolarHBondContact O-ND2 3.5Å
840	T	65.8	Low	64	Low	90 Å²	90	97.2 Å²	97.2	55%	0.552	54%	0.538	S	S	*	.	H	α-helix	trans	-63.8	-35	-179.5	49	0	0	0	0	112.3	E836 D837 R842	E836-T840 PolarHBondContact O-N 3.42Å; E836-T840 PolarHBondContact O-OG1 2.59Å; D837-T840 WeakPolarHBondContact CA-OG1 3.48Å; D837-T840 PolarHBondContact O-OG1 3.03Å; D837-T840 VanDerWaalsContact O-OG1 3.06Å; T840-R842 VanDerWaalsContact C-N 3.31Å; T840-R842 PolarHBondContact O-N 3.14Å
841	A	62.7	Low	64.6	Low	79 Å²	79	96 Å²	96	65%	0.653	53%	0.526	S	S	*	.	H	α-helix	trans	-66.4	-23.2	174.7	0	0	0	0	0	115.1	D837 R839	D837-A841 WeakPolarHBondContact O-CB 3.3Å; D837-A841 PolarHBondContact O-N 3.49Å; R839-A841 VanDerWaalsContact C-N 3.3Å; R839-A841 PolarHBondContact O-N 2.79Å
842	R	51.8	Low	65.3	Low	174 Å²	174	93.2 Å²	93.2	66%	0.657	51%	0.511	S	S	*	.	H	α-helix	trans	-100.6	-8.7	-173.5	-164.7	166.7	178.3	173.5	-2.5	114.7	L838 R839 T840 T844	L838-R842 PolarHBondContact O-N 2.89Å; R839-R842 PolarHBondContact O-N 3.37Å; R839-R842 VanDerWaalsContact O-N 3.17Å; T840-R842 VanDerWaalsContact C-N 3.31Å; T840-R842 PolarHBondContact O-N 3.14Å; R842-T844 PolarHBondContact O-N 3.07Å
843	N	45.2	Very low	66	Low	125 Å²	125	89.5 Å²	89.5	67%	0.668	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.2	47.7	-173.2	-74.9	-21.8	0	0	0	114.8	R839	R839-N843 PolarHBondContact O-N 3.37Å; R839-N843 PolarHBondContact O-ND2 3.5Å
844	T	46.3	Very low	66.5	Low	145 Å²	145	83.9 Å²	83.9	89%	0.89	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.2	-5.6	171.9	50.1	0	0	0	0	113.9	R842	R842-T844 PolarHBondContact O-N 3.07Å
845	S	50.2	Low	67.3	Low	93 Å²	93	78.2 Å²	78.2	65%	0.65	44%	0.444	S	S	*	.	S	Bend	trans	-106.2	148.2	169.6	56.9	0	0	0	0	111.6
846	T	50.2	Low	68.1	Low	132 Å²	132	77.6 Å²	77.6	81%	0.81	44%	0.442	S	S	*	.			trans	-62.2	136.8	177.6	43.6	0	0	0	0	111.6	M848	T846-M848 PolarHBondContact O-N 3.13Å; T846-M848 VanDerWaalsContact O-N 3.15Å
847	P	54.9	Low	68.5	Low	127 Å²	127	73.3 Å²	73.3	83%	0.825	42%	0.422	S	S	*	.			trans	-65.8	115.6	-176.1	25.6	-34	0	0	0	112.1
848	M	64.3	Low	68.5	Low	57 Å²	57	73.5 Å²	73.5	28%	0.281	43%	0.426	S	S	.	.			trans	-54.9	123.7	177.5	-178.8	-165	170.5	0	0	111.8	R805 T846 G850 M852 I854	R805-M848 VanDerWaalsContact CZ-SD 3.5Å; R805-M848 VanDerWaalsContact NH2-CG 3.31Å; R805-M848 PolarHBondContact NH2-O 3.47Å; R805-M848 PolarHBondContact NH2-SD 3.07Å; R805-M848 VanDerWaalsContact NH2-SD 3.44Å; T846-M848 PolarHBondContact O-N 3.13Å; T846-M848 VanDerWaalsContact O-N 3.15Å; M848-G850 PolarHBondContact O-N 3.18Å; M848-M852 VanDerWaalsContact CE-O 3.26Å; M848-M852 WeakPolarHBondContact CE-O 3.49Å; M848-M852 HydrophobicContact CG-CE 4.12Å; M848-I854 HydrophobicContact CE-CB 3.96Å; M848-I854 HydrophobicContact CE-CD1 3.39Å; M848-I854 HydrophobicContact CE-CG1 3.44Å; M848-I854 VanDerWaalsContact CE-CG1 3.44Å; M848-I854 HydrophobicContact CG-CD1 4.15Å; M848-I854 HydrophobicContact SD-CD1 3.84Å
849	P	77.1	Confident	68.6	Low	61 Å²	61	69.6 Å²	69.6	40%	0.396	41%	0.409	S	S	.	.			trans	-55.4	135	-175.1	-27.9	34.9	0	0	0	113.9	R805 N851 M852	R805-P849 PolarHBondContact NH2-O 3.5Å; P849-N851 WeakPolarHBondContact CB-OD1 3.33Å; P849-N851 PolarHBondContact O-N 3.49Å; P849-M852 HydrophobicContact CB-CB 4.25Å; P849-M852 WeakPolarHBondContact O-CB 3.3Å; P849-M852 PolarHBondContact O-N 2.88Å
850	G	79.1	Confident	68.7	Low	39 Å²	39	75.2 Å²	75.2	40%	0.402	44%	0.436	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-16	-172.2	0	0	0	0	0	115.8	M848 S873 R876	M848-G850 PolarHBondContact O-N 3.18Å; G850-S873 WeakPolarHBondContact O-CA 3.41Å; G850-S873 WeakPolarHBondContact O-CB 3.25Å; G850-S873 PolarHBondContact O-OG 3.06Å; G850-S873 VanDerWaalsContact O-OG 3.11Å; G850-R876 WeakPolarHBondContact O-CD 3.35Å; G850-R876 PolarHBondContact O-NE 3.01Å
851	N	87.2	Confident	68.7	Low	48 Å²	48	80 Å²	80	26%	0.257	45%	0.452	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.3	-4.5	173.1	68.3	-55.9	0	0	0	113.8	P849 F870	P849-N851 WeakPolarHBondContact CB-OD1 3.33Å; P849-N851 PolarHBondContact O-N 3.49Å; N851-F870 WeakPolarHBondContact CB-O 3.42Å; N851-F870 PolarHBondContact ND2-O 3.08Å; N851-F870 WeakPolarHBondContact O-CB 3.28Å; N851-F870 PolarHBondContact O-N 3.11Å
852	M	87.7	Confident	68.7	Low	18 Å²	18	77.9 Å²	77.9	9%	0.089	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	129.3	176.6	-161.1	156.5	94.8	0	0	110.2	R805 M848 P849 I854 E867 L868 M869 R876	R805-M852 PolarHBondContact NH1-O 3.5Å; M848-M852 VanDerWaalsContact CE-O 3.26Å; M848-M852 WeakPolarHBondContact CE-O 3.49Å; M848-M852 HydrophobicContact CG-CE 4.12Å; P849-M852 HydrophobicContact CB-CB 4.25Å; P849-M852 WeakPolarHBondContact O-CB 3.3Å; P849-M852 PolarHBondContact O-N 2.88Å; M852-I854 HydrophobicContact CE-CD1 3.93Å; M852-I854 HydrophobicContact CE-CG1 4.28Å; M852-E867 WeakPolarHBondContact CE-OE2 3.27Å; M852-L868 CarbonylContact C-O 3.57Å; M852-L868 WeakPolarHBondContact CA-O 3.29Å; M852-M869 HydrophobicContact CB-CG 4.09Å; M852-M869 HydrophobicContact CG-CG 3.82Å; M852-M869 HydrophobicContact SD-CG 3.74Å; M852-M869 HydrophobicContact SD-SD 4.4Å; M852-R876 VanDerWaalsContact C-CD 3.49Å; M852-R876 WeakPolarHBondContact O-CD 3.26Å
853	S	86.9	Confident	69.8	Low	1 Å²	1	74.4 Å²	74.4	1%	0.007	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	144.9	164.6	-160.1	0	0	0	0	108.7	L868 E880	S853-L868 PolarHBondContact N-O 2.83Å; S853-L868 PolarHBondContact O-N 2.86Å; S853-E880 WeakPolarHBondContact CB-OE1 3.33Å; S853-E880 WeakPolarHBondContact OG-CG 3.49Å; S853-E880 PolarHBondContact OG-OE1 3.24Å
854	I	86.1	Confident	71.4	Confident	9 Å²	9	71 Å²	71	5%	0.046	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	135.6	171.8	-59.9	164.1	0	0	0	108.1	E803 M848 M852 R865 Y866 E867	E803-I854 HydrophobicContact CB-CB 4.28Å; E803-I854 HydrophobicContact CB-CG2 4.4Å; E803-I854 PolarHBondContact N-O 2.71Å; E803-I854 WeakPolarHBondContact OE2-CG2 3.41Å; M848-I854 HydrophobicContact CE-CB 3.96Å; M848-I854 HydrophobicContact CE-CD1 3.39Å; M848-I854 HydrophobicContact CE-CG1 3.44Å; M848-I854 VanDerWaalsContact CE-CG1 3.44Å; M848-I854 HydrophobicContact CG-CD1 4.15Å; M848-I854 HydrophobicContact SD-CD1 3.84Å; M852-I854 HydrophobicContact CE-CD1 3.93Å; M852-I854 HydrophobicContact CE-CG1 4.28Å; I854-R865 HydrophobicContact CG2-CG 4.2Å; I854-Y866 WeakPolarHBondContact CA-O 2.74Å; I854-E867 HydrophobicContact CD1-CG 4.39Å; I854-E867 WeakPolarHBondContact CD1-OE2 3.44Å; I854-E867 HydrophobicContact CG1-CB 4.18Å; I854-E867 HydrophobicContact CG1-CG 3.9Å; I854-E867 HydrophobicContact CG2-CG 4.15Å
855	F	86.5	Confident	73.2	Confident	0 Å²	0	70.3 Å²	70.3	0%	0	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	154.3	173.5	69.9	-94.8	0	0	0	111.3	F756 L795 I800 E801 L802 A857 Y866 L868 W879	F756-F855 AromaticContact CZ-CZ 3.95Å; F756-F855 HydrophobicContact CZ-CZ 3.95Å; L795-F855 HydrophobicContact CD1-CE2 3.69Å; L795-F855 HydrophobicContact CD1-CZ 4.15Å; I800-F855 HydrophobicContact CB-CD2 4.45Å; I800-F855 HydrophobicContact CD1-CE2 4.42Å; I800-F855 HydrophobicContact CG1-CD2 4.27Å; I800-F855 HydrophobicContact CG1-CE2 4.23Å; I800-F855 HydrophobicContact CG2-CB 3.95Å; I800-F855 HydrophobicContact CG2-CD2 3.67Å; I800-F855 HydrophobicContact CG2-CE2 4.34Å; I800-F855 HydrophobicContact CG2-CG 3.87Å; E801-F855 CarbonylContact O-C 3.5Å; E801-F855 WeakPolarHBondContact O-CA 3.35Å; E801-F855 VanDerWaalsContact O-CB 3.24Å; E801-F855 WeakPolarHBondContact O-CB 3.49Å; L802-F855 HydrophobicContact CD2-CB 3.9Å; F855-A857 HydrophobicContact CD2-CB 4.29Å; F855-A857 HydrophobicContact CE2-CB 4.06Å; F855-Y866 HydrophobicContact CD2-CD2 4.29Å; F855-Y866 HydrophobicContact CD2-CG 4.48Å; F855-Y866 VanDerWaalsContact CE1-CB 3.46Å; F855-Y866 HydrophobicContact CE1-CG 4.22Å; F855-Y866 AromaticContact CE2-CD2 3.54Å; F855-Y866 HydrophobicContact CE2-CD2 3.54Å; F855-Y866 HydrophobicContact CE2-CE2 4.5Å; F855-Y866 AromaticContact CE2-CG 3.66Å; F855-Y866 HydrophobicContact CE2-CG 3.66Å; F855-Y866 HydrophobicContact CZ-CD1 4.19Å; F855-Y866 AromaticContact CZ-CD2 3.89Å; F855-Y866 HydrophobicContact CZ-CD2 3.89Å; F855-Y866 AromaticContact CZ-CG 3.5Å; F855-Y866 HydrophobicContact CZ-CG 3.5Å; F855-Y866 VanDerWaalsContact CZ-CG 3.5Å; F855-Y866 PolarHBondContact N-O 3.4Å; F855-Y866 VanDerWaalsContact N-O 3.08Å; F855-Y866 PolarHBondContact O-N 2.76Å; F855-L868 HydrophobicContact CE1-CD1 3.72Å; F855-L868 HydrophobicContact CE1-CG 3.93Å; F855-W879 HydrophobicContact CD1-CH2 4.01Å; F855-W879 HydrophobicContact CD1-CZ3 4.17Å; F855-W879 AromaticContact CE1-CH2 3.74Å; F855-W879 HydrophobicContact CE1-CH2 3.74Å; F855-W879 HydrophobicContact CE1-CZ3 4.33Å
856	T	82.6	Confident	74.9	Confident	43 Å²	43	67.3 Å²	67.3	26%	0.264	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	147.5	166.3	39.1	0	0	0	0	110.1	I800 E801 V863 E864 R865	I800-T856 CarbonylContact C-O 3.49Å; I800-T856 WeakPolarHBondContact CA-O 3.12Å; E801-T856 PolarHBondContact N-O 3.41Å; E801-T856 PolarHBondContact O-N 2.96Å; T856-V863 HydrophobicContact CG2-CG1 3.96Å; T856-E864 CarbonylContact C-O 3.55Å; T856-E864 VanDerWaalsContact CA-O 3.27Å; T856-E864 WeakPolarHBondContact CA-O 3.1Å; T856-R865 HydrophobicContact CG2-CB 4.39Å
857	A	80.2	Confident	76.7	Confident	0 Å²	0	63.3 Å²	63.3	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	126.2	178.5	0	0	0	0	0	110.7	L795 A799 F855 S859 E864 Y866	L795-A857 HydrophobicContact CD1-CB 3.57Å; L795-A857 HydrophobicContact CD2-CB 3.71Å; L795-A857 HydrophobicContact CG-CB 4.26Å; A799-A857 WeakPolarHBondContact O-CA 3.32Å; F855-A857 HydrophobicContact CD2-CB 4.29Å; F855-A857 HydrophobicContact CE2-CB 4.06Å; A857-S859 PolarHBondContact O-N 3.37Å; A857-E864 PolarHBondContact N-O 3.05Å; A857-E864 PolarHBondContact O-N 3.32Å; A857-Y866 HydrophobicContact CB-CD2 4.26Å; A857-Y866 HydrophobicContact CB-CE2 4.26Å
858	T	72.9	Confident	78.3	Confident	82 Å²	82	57.3 Å²	57.3	50%	0.503	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	106.4	-179.9	-52.3	0	0	0	0	110.2	A799 V863	A799-T858 PolarHBondContact O-N 3Å; T858-V863 HydrophobicContact CG2-CG2 4.37Å
859	S	66.7	Low	79.5	Confident	36 Å²	36	58.3 Å²	58.3	25%	0.252	31%	0.31	S	S	.	.			trans	-95.8	-176.6	173.7	81.2	0	0	0	0	111.1	A857 E861 G862 E864	A857-S859 PolarHBondContact O-N 3.37Å; S859-E861 PolarHBondContact O-N 3.18Å; S859-E861 PolarHBondContact OG-N 2.94Å; S859-E861 VanDerWaalsContact OG-N 3.14Å; S859-G862 PolarHBondContact N-O 3.41Å; S859-G862 PolarHBondContact OG-N 3.48Å; S859-G862 PolarHBondContact OG-O 2.88Å; S859-E864 WeakPolarHBondContact CB-OE1 3.25Å; S859-E864 PolarHBondContact OG-OE1 3.28Å
860	K	59.1	Low	80.2	Confident	221 Å²	221	55.6 Å²	55.6	96%	0.961	29%	0.292	S	S	*	.	S	Bend	trans	-73.7	-15	170.9	-71.7	-170.7	177.1	-173.7	0	113
861	E	64.5	Low	80.5	Confident	190 Å²	190	57.9 Å²	57.9	89%	0.888	30%	0.3	S	S	*	.	S	Bend	trans	-101.6	-19.6	-174.5	-64.4	177	-155.9	0	0	111.9	S859	S859-E861 PolarHBondContact O-N 3.18Å; S859-E861 PolarHBondContact OG-N 2.94Å; S859-E861 VanDerWaalsContact OG-N 3.14Å
862	G	63.9	Low	80.5	Confident	35 Å²	35	59.2 Å²	59.2	36%	0.361	31%	0.307	S	S	.	.			trans	164	-161.7	172.1	0	0	0	0	0	113.2	S859	S859-G862 PolarHBondContact N-O 3.41Å; S859-G862 PolarHBondContact OG-N 3.48Å; S859-G862 PolarHBondContact OG-O 2.88Å
863	V	74.3	Confident	80.4	Confident	100 Å²	100	60.6 Å²	60.6	61%	0.606	32%	0.318	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.1	112.4	166.5	-178.7	0	0	0	0	108.3	T856 T858	T856-V863 HydrophobicContact CG2-CG1 3.96Å; T858-V863 HydrophobicContact CG2-CG2 4.37Å
864	E	78.9	Confident	80.3	Confident	53 Å²	53	64 Å²	64	25%	0.248	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	144.4	178.8	-68.2	163.7	-137.7	0	0	110.2	H793 T856 A857 S859 Y866	H793-E864 IonicContact CE1-OE2 2.68Å; H793-E864 PolarHBondContact CE1-OE2 2.83Å; H793-E864 IonicContact NE2-OE2 2.72Å; T856-E864 CarbonylContact C-O 3.55Å; T856-E864 VanDerWaalsContact CA-O 3.27Å; T856-E864 WeakPolarHBondContact CA-O 3.1Å; A857-E864 PolarHBondContact N-O 3.05Å; A857-E864 PolarHBondContact O-N 3.32Å; S859-E864 WeakPolarHBondContact CB-OE1 3.25Å; S859-E864 PolarHBondContact OG-OE1 3.28Å; E864-Y866 HydrophobicContact CB-CD2 4.29Å; E864-Y866 HydrophobicContact CB-CE2 3.58Å; E864-Y866 PolarHBondContact OE2-OH 2.87Å
865	R	83.8	Confident	80.3	Confident	132 Å²	132	67.6 Å²	67.6	50%	0.498	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	129.8	178.6	-178.7	178	173	93.6	-2.8	109.9	E803 I854 T856 E867	E803-R865 IonicContact OE2-CZ 3.19Å; E803-R865 VanDerWaalsContact OE2-CZ 3.27Å; E803-R865 IonicContact OE2-NH1 2.73Å; E803-R865 PolarHBondContact OE2-NH1 3.32Å; E803-R865 IonicContact OE2-NH2 2.86Å; E803-R865 PolarHBondContact OE2-NH2 3.49Å; I854-R865 HydrophobicContact CG2-CG 4.2Å; T856-R865 HydrophobicContact CG2-CB 4.39Å; R865-E867 IonicContact CZ-OE1 3.52Å; R865-E867 IonicContact NE-OE1 3.07Å; R865-E867 PolarHBondContact NE-OE1 2.96Å; R865-E867 IonicContact NH2-OE1 3.68Å; R865-E867 PolarHBondContact NH2-OE1 3.05Å
866	Y	85.8	Confident	80.5	Confident	29 Å²	29	67.8 Å²	67.8	11%	0.114	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	118.9	-175.6	-76.8	-88.4	0	0	0	110.9	H793 L795 I854 F855 A857 E864	H793-Y866 PolarHBondContact CD2-OH 3.29Å; H793-Y866 PolarHBondContact CE1-OH 2.85Å; H793-Y866 PolarHBondContact ND1-OH 2.9Å; H793-Y866 AromaticContact NE2-CZ 3.85Å; H793-Y866 PolarHBondContact NE2-OH 2.97Å; H793-Y866 VanDerWaalsContact NE2-OH 3.16Å; L795-Y866 HydrophobicContact CD1-CD2 4.41Å; L795-Y866 HydrophobicContact CD1-CE2 4.18Å; I854-Y866 WeakPolarHBondContact CA-O 2.74Å; F855-Y866 HydrophobicContact CD2-CD2 4.29Å; F855-Y866 HydrophobicContact CD2-CG 4.48Å; F855-Y866 VanDerWaalsContact CE1-CB 3.46Å; F855-Y866 HydrophobicContact CE1-CG 4.22Å; F855-Y866 AromaticContact CE2-CD2 3.54Å; F855-Y866 HydrophobicContact CE2-CD2 3.54Å; F855-Y866 HydrophobicContact CE2-CE2 4.5Å; F855-Y866 AromaticContact CE2-CG 3.66Å; F855-Y866 HydrophobicContact CE2-CG 3.66Å; F855-Y866 HydrophobicContact CZ-CD1 4.19Å; F855-Y866 AromaticContact CZ-CD2 3.89Å; F855-Y866 HydrophobicContact CZ-CD2 3.89Å; F855-Y866 AromaticContact CZ-CG 3.5Å; F855-Y866 HydrophobicContact CZ-CG 3.5Å; F855-Y866 VanDerWaalsContact CZ-CG 3.5Å; F855-Y866 PolarHBondContact N-O 3.4Å; F855-Y866 VanDerWaalsContact N-O 3.08Å; F855-Y866 PolarHBondContact O-N 2.76Å; A857-Y866 HydrophobicContact CB-CD2 4.26Å; A857-Y866 HydrophobicContact CB-CE2 4.26Å; E864-Y866 HydrophobicContact CB-CD2 4.29Å; E864-Y866 HydrophobicContact CB-CE2 3.58Å; E864-Y866 PolarHBondContact OE2-OH 2.87Å
867	E	88.6	Confident	80.7	Confident	49 Å²	49	69.6 Å²	69.6	23%	0.229	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	109.7	176.7	-48.7	-142.4	176.8	0	0	109	E739 M852 I854 R865	E739-E867 PolarHBondContact N-O 3.05Å; M852-E867 WeakPolarHBondContact CE-OE2 3.27Å; I854-E867 HydrophobicContact CD1-CG 4.39Å; I854-E867 WeakPolarHBondContact CD1-OE2 3.44Å; I854-E867 HydrophobicContact CG1-CB 4.18Å; I854-E867 HydrophobicContact CG1-CG 3.9Å; I854-E867 HydrophobicContact CG2-CG 4.15Å; R865-E867 IonicContact CZ-OE1 3.52Å; R865-E867 IonicContact NE-OE1 3.07Å; R865-E867 PolarHBondContact NE-OE1 2.96Å; R865-E867 IonicContact NH2-OE1 3.68Å; R865-E867 PolarHBondContact NH2-OE1 3.05Å
868	L	89.1	Confident	81	Confident	0 Å²	0	72.3 Å²	72.3	0%	0	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	114.1	-174.6	-59.6	-167.9	0	0	0	110.7	V736 V738 I747 F756 M852 S853 F855 F870 W879	V736-L868 HydrophobicContact CG2-CD2 4.27Å; V738-L868 HydrophobicContact CB-CD2 4.37Å; V738-L868 HydrophobicContact CG1-CD2 4.11Å; V738-L868 HydrophobicContact CG2-CD2 3.74Å; I747-L868 HydrophobicContact CD1-CD1 4.08Å; F756-L868 HydrophobicContact CE1-CD1 4.43Å; F756-L868 HydrophobicContact CE1-CD2 4.15Å; M852-L868 CarbonylContact C-O 3.57Å; M852-L868 WeakPolarHBondContact CA-O 3.29Å; S853-L868 PolarHBondContact N-O 2.83Å; S853-L868 PolarHBondContact O-N 2.86Å; F855-L868 HydrophobicContact CE1-CD1 3.72Å; F855-L868 HydrophobicContact CE1-CG 3.93Å; L868-F870 HydrophobicContact CB-CD2 4.4Å; L868-F870 HydrophobicContact CB-CE2 3.8Å; L868-F870 HydrophobicContact CB-CZ 4.45Å; L868-F870 HydrophobicContact CD1-CE2 4.29Å; L868-F870 HydrophobicContact CD1-CZ 4.2Å; L868-W879 HydrophobicContact CD1-CH2 3.75Å; L868-W879 HydrophobicContact CD1-CZ2 3.98Å; L868-W879 HydrophobicContact CD1-CZ3 4.33Å
869	M	89.4	Confident	81.9	Confident	79 Å²	79	68.5 Å²	68.5	39%	0.389	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	117	167.1	-76	-156.8	-66.7	0	0	111	S737 M852	S737-M869 PolarHBondContact N-O 2.92Å; S737-M869 VanDerWaalsContact N-O 3.16Å; S737-M869 PolarHBondContact O-N 3.36Å; S737-M869 WeakPolarHBondContact OG-CB 3.48Å; M852-M869 HydrophobicContact CB-CG 4.09Å; M852-M869 HydrophobicContact CG-CG 3.82Å; M852-M869 HydrophobicContact SD-CG 3.74Å; M852-M869 HydrophobicContact SD-SD 4.4Å
870	F	90.4	Very high	83	Confident	4 Å²	4	68.4 Å²	68.4	2%	0.018	35%	0.351	C	S	.	.			trans	-85.6	159.9	172.1	-69.6	-97.4	0	0	0	111	V736 I747 N851 L868 N872 K875 R876 W879	V736-F870 HydrophobicContact CG1-CD1 3.71Å; V736-F870 HydrophobicContact CG1-CD2 4.42Å; V736-F870 HydrophobicContact CG1-CE1 3.66Å; V736-F870 HydrophobicContact CG1-CE2 4.37Å; V736-F870 HydrophobicContact CG1-CG 4.09Å; V736-F870 HydrophobicContact CG1-CZ 4Å; I747-F870 HydrophobicContact CD1-CE1 4.19Å; I747-F870 HydrophobicContact CD1-CZ 4.19Å; N851-F870 WeakPolarHBondContact CB-O 3.42Å; N851-F870 PolarHBondContact ND2-O 3.08Å; N851-F870 WeakPolarHBondContact O-CB 3.28Å; N851-F870 PolarHBondContact O-N 3.11Å; L868-F870 HydrophobicContact CB-CD2 4.4Å; L868-F870 HydrophobicContact CB-CE2 3.8Å; L868-F870 HydrophobicContact CB-CZ 4.45Å; L868-F870 HydrophobicContact CD1-CE2 4.29Å; L868-F870 HydrophobicContact CD1-CZ 4.2Å; F870-N872 PolarHBondContact O-N 3.2Å; F870-N872 VanDerWaalsContact O-N 3.17Å; F870-K875 HydrophobicContact CB-CB 4.38Å; F870-K875 HydrophobicContact CD1-CB 4.29Å; F870-R876 HydrophobicContact CB-CB 4.28Å; F870-R876 HydrophobicContact CD2-CB 4.01Å; F870-R876 HydrophobicContact CD2-CG 4.13Å; F870-R876 HydrophobicContact CG-CB 4.2Å; F870-W879 HydrophobicContact CE1-CB 3.79Å; F870-W879 AromaticContact CE1-CD1 3.76Å; F870-W879 HydrophobicContact CE1-CD2 4.05Å; F870-W879 AromaticContact CE1-CG 3.62Å; F870-W879 HydrophobicContact CE1-CG 3.62Å; F870-W879 HydrophobicContact CE2-CD2 4.42Å; F870-W879 HydrophobicContact CE2-CE3 4.29Å; F870-W879 HydrophobicContact CZ-CB 3.89Å; F870-W879 AromaticContact CZ-CD1 3.96Å; F870-W879 AromaticContact CZ-CD2 3.45Å; F870-W879 HydrophobicContact CZ-CD2 3.45Å; F870-W879 VanDerWaalsContact CZ-CD2 3.45Å; F870-W879 AromaticContact CZ-CE2 3.87Å; F870-W879 AromaticContact CZ-CE3 3.74Å; F870-W879 HydrophobicContact CZ-CE3 3.74Å; F870-W879 AromaticContact CZ-CG 3.54Å; F870-W879 HydrophobicContact CZ-CG 3.54Å; F870-W879 HydrophobicContact CZ-CZ2 4.49Å; F870-W879 HydrophobicContact CZ-CZ3 4.36Å
871	P	85.1	Confident	84.4	Confident	87 Å²	87	63.5 Å²	63.5	57%	0.565	33%	0.326	S	S	*	.	S	Bend	trans	-59.4	-25.4	176.7	-26.8	35.8	0	0	0	114.8	K875	P871-K875 HydrophobicContact CG-CD 4.34Å
872	N	87.3	Confident	85.5	Confident	75 Å²	75	54.9 Å²	54.9	40%	0.401	29%	0.287	S	S	.	.	S	Bend	trans	-160.6	168.4	174	60.2	51.8	0	0	0	112	F870 A874 K875 R876	F870-N872 PolarHBondContact O-N 3.2Å; F870-N872 VanDerWaalsContact O-N 3.17Å; N872-A874 VanDerWaalsContact C-N 3.32Å; N872-A874 PolarHBondContact O-N 2.74Å; N872-A874 PolarHBondContact OD1-N 3.47Å; N872-K875 PolarHBondContact O-N 3.01Å; N872-K875 PolarHBondContact OD1-N 2.82Å; N872-R876 PolarHBondContact O-N 2.94Å
873	S	86.6	Confident	86.7	Confident	47 Å²	47	53.2 Å²	53.2	33%	0.329	27%	0.27	S	S	.	.	H	α-helix	trans	-63	-32.1	179.4	-177.1	0	0	0	0	113.6	G850 R876 K877	G850-S873 WeakPolarHBondContact O-CA 3.41Å; G850-S873 WeakPolarHBondContact O-CB 3.25Å; G850-S873 PolarHBondContact O-OG 3.06Å; G850-S873 VanDerWaalsContact O-OG 3.11Å; S873-R876 WeakPolarHBondContact O-CB 3.46Å; S873-R876 PolarHBondContact O-N 2.85Å; S873-K877 PolarHBondContact O-N 3.13Å
874	A	85.5	Confident	87.2	Confident	72 Å²	72	53.4 Å²	53.4	60%	0.595	27%	0.267	S	S	*	.	H	α-helix	trans	-67.1	-45	179	0	0	0	0	0	111.9	N872 R876 K877 E878	N872-A874 VanDerWaalsContact C-N 3.32Å; N872-A874 PolarHBondContact O-N 2.74Å; N872-A874 PolarHBondContact OD1-N 3.47Å; A874-R876 VanDerWaalsContact C-N 3.31Å; A874-R876 PolarHBondContact O-N 2.89Å; A874-K877 PolarHBondContact O-N 3.02Å; A874-E878 WeakPolarHBondContact O-CB 3.4Å; A874-E878 PolarHBondContact O-N 2.79Å
875	K	85.3	Confident	87.5	Confident	85 Å²	85	53 Å²	53	37%	0.37	27%	0.265	S	S	.	.	H	α-helix	trans	-59.9	-40.5	172.7	-80.8	-162.1	162	-147.9	0	111.8	D734 F870 P871 N872 W879	D734-K875 WeakPolarHBondContact OD1-CD 3.48Å; D734-K875 WeakPolarHBondContact OD1-CE 3.37Å; D734-K875 IonicContact OD1-NZ 3.27Å; D734-K875 PolarHBondContact OD1-NZ 2.93Å; F870-K875 HydrophobicContact CB-CB 4.38Å; F870-K875 HydrophobicContact CD1-CB 4.29Å; P871-K875 HydrophobicContact CG-CD 4.34Å; N872-K875 PolarHBondContact O-N 3.01Å; N872-K875 PolarHBondContact OD1-N 2.82Å; K875-W879 WeakPolarHBondContact O-CB 3.41Å; K875-W879 PolarHBondContact O-N 3.01Å
876	R	91	Very high	87.4	Confident	4 Å²	4	47 Å²	47	2%	0.015	24%	0.242	C	C	.	.	H	α-helix	trans	-58.9	-59.9	173.1	-175.5	-156.1	61.1	107.1	-12.1	111.9	E807 G850 M852 F870 N872 S873 A874 E878 W879 E880	E807-R876 IonicContact OE1-CZ 3.95Å; E807-R876 IonicContact OE1-NH1 3.82Å; E807-R876 IonicContact OE1-NH2 3.81Å; E807-R876 PolarHBondContact OE1-NH2 3.12Å; E807-R876 IonicContact OE2-NH2 3.69Å; G850-R876 WeakPolarHBondContact O-CD 3.35Å; G850-R876 PolarHBondContact O-NE 3.01Å; M852-R876 VanDerWaalsContact C-CD 3.49Å; M852-R876 WeakPolarHBondContact O-CD 3.26Å; F870-R876 HydrophobicContact CB-CB 4.28Å; F870-R876 HydrophobicContact CD2-CB 4.01Å; F870-R876 HydrophobicContact CD2-CG 4.13Å; F870-R876 HydrophobicContact CG-CB 4.2Å; N872-R876 PolarHBondContact O-N 2.94Å; S873-R876 WeakPolarHBondContact O-CB 3.46Å; S873-R876 PolarHBondContact O-N 2.85Å; A874-R876 VanDerWaalsContact C-N 3.31Å; A874-R876 PolarHBondContact O-N 2.89Å; R876-E878 PolarHBondContact O-N 2.82Å; R876-W879 PolarHBondContact O-N 3.48Å; R876-E880 VanDerWaalsContact CD-OE1 3.27Å; R876-E880 WeakPolarHBondContact CD-OE1 3.33Å; R876-E880 WeakPolarHBondContact CG-OE1 3.47Å; R876-E880 IonicContact CZ-OE1 3Å; R876-E880 IonicContact CZ-OE2 2.71Å; R876-E880 IonicContact NE-OE1 3.01Å; R876-E880 IonicContact NH1-OE1 3.23Å; R876-E880 PolarHBondContact NH1-OE1 2.96Å; R876-E880 IonicContact NH1-OE2 3Å; R876-E880 PolarHBondContact NH1-OE2 3.02Å; R876-E880 PolarHBondContact O-N 2.72Å
877	K	86.8	Confident	87.2	Confident	82 Å²	82	48.3 Å²	48.3	36%	0.357	25%	0.249	S	C	.	.	H	α-helix	trans	-54.3	-40.3	-178.4	-77.7	-161.6	175	-164.6	0	111.2	E807 D809 S873 A874 R881	E807-K877 WeakPolarHBondContact OE2-CE 3.21Å; E807-K877 IonicContact OE2-NZ 2.74Å; E807-K877 PolarHBondContact OE2-NZ 3.38Å; D809-K877 IonicContact OD2-NZ 3.2Å; D809-K877 PolarHBondContact OD2-NZ 3.14Å; S873-K877 PolarHBondContact O-N 3.13Å; A874-K877 PolarHBondContact O-N 3.02Å; K877-R881 VanDerWaalsContact O-CB 3.31Å; K877-R881 WeakPolarHBondContact O-CB 3.44Å; K877-R881 PolarHBondContact O-N 3.37Å
878	E	86.2	Confident	86.4	Confident	57 Å²	57	53.2 Å²	53.2	27%	0.266	27%	0.265	S	S	.	.	H	α-helix	trans	-74.2	-32.1	179.8	-168.2	62	-83.9	0	0	113.7	R779 A874 R876 R881 T882	R779-E878 VanDerWaalsContact CZ-CD 3.49Å; R779-E878 IonicContact CZ-OE1 2.98Å; R779-E878 IonicContact CZ-OE2 3.85Å; R779-E878 IonicContact NH1-OE1 2.67Å; R779-E878 PolarHBondContact NH1-OE1 2.86Å; R779-E878 IonicContact NH1-OE2 3.89Å; R779-E878 PolarHBondContact NH1-OE2 3.22Å; R779-E878 IonicContact NH2-OE1 3.74Å; R779-E878 PolarHBondContact NH2-OE1 3.23Å; R779-E878 IonicContact NH2-OE2 2.72Å; A874-E878 WeakPolarHBondContact O-CB 3.4Å; A874-E878 PolarHBondContact O-N 2.79Å; R876-E878 PolarHBondContact O-N 2.82Å; E878-R881 IonicContact OE1-CZ 3.33Å; E878-R881 IonicContact OE1-NE 3.71Å; E878-R881 PolarHBondContact OE1-NE 3.13Å; E878-R881 IonicContact OE1-NH2 3.42Å; E878-R881 PolarHBondContact OE1-NH2 3.06Å; E878-R881 IonicContact OE2-NE 2.95Å; E878-R881 IonicContact OE2-NH2 3.27Å; E878-T882 WeakPolarHBondContact O-CB 3.29Å; E878-T882 PolarHBondContact O-N 2.87Å; E878-T882 PolarHBondContact O-OG1 3.2Å
879	W	90.7	Very high	85.4	Confident	1 Å²	1	56.2 Å²	56.2	0%	0.004	28%	0.279	C	S	.	.	H	α-helix	trans	-68.8	-46.8	174.1	-170.1	93.1	0	0	0	111.1	I747 M749 I754 F855 L868 F870 K875 R876 R881 T882 I883	I747-W879 HydrophobicContact CD1-CZ2 3.86Å; M749-W879 HydrophobicContact CE-CD2 4.07Å; M749-W879 HydrophobicContact CE-CG 4.09Å; M749-W879 HydrophobicContact CE-CZ2 4.31Å; I754-W879 HydrophobicContact CD1-CH2 4.14Å; I754-W879 HydrophobicContact CD1-CZ2 3.68Å; F855-W879 HydrophobicContact CD1-CH2 4.01Å; F855-W879 HydrophobicContact CD1-CZ3 4.17Å; F855-W879 AromaticContact CE1-CH2 3.74Å; F855-W879 HydrophobicContact CE1-CH2 3.74Å; F855-W879 HydrophobicContact CE1-CZ3 4.33Å; L868-W879 HydrophobicContact CD1-CH2 3.75Å; L868-W879 HydrophobicContact CD1-CZ2 3.98Å; L868-W879 HydrophobicContact CD1-CZ3 4.33Å; F870-W879 HydrophobicContact CE1-CB 3.79Å; F870-W879 AromaticContact CE1-CD1 3.76Å; F870-W879 HydrophobicContact CE1-CD2 4.05Å; F870-W879 AromaticContact CE1-CG 3.62Å; F870-W879 HydrophobicContact CE1-CG 3.62Å; F870-W879 HydrophobicContact CE2-CD2 4.42Å; F870-W879 HydrophobicContact CE2-CE3 4.29Å; F870-W879 HydrophobicContact CZ-CB 3.89Å; F870-W879 AromaticContact CZ-CD1 3.96Å; F870-W879 AromaticContact CZ-CD2 3.45Å; F870-W879 HydrophobicContact CZ-CD2 3.45Å; F870-W879 VanDerWaalsContact CZ-CD2 3.45Å; F870-W879 AromaticContact CZ-CE2 3.87Å; F870-W879 AromaticContact CZ-CE3 3.74Å; F870-W879 HydrophobicContact CZ-CE3 3.74Å; F870-W879 AromaticContact CZ-CG 3.54Å; F870-W879 HydrophobicContact CZ-CG 3.54Å; F870-W879 HydrophobicContact CZ-CZ2 4.49Å; F870-W879 HydrophobicContact CZ-CZ3 4.36Å; K875-W879 WeakPolarHBondContact O-CB 3.41Å; K875-W879 PolarHBondContact O-N 3.01Å; R876-W879 PolarHBondContact O-N 3.48Å; W879-R881 PolarHBondContact O-N 2.97Å; W879-T882 PolarHBondContact O-N 3.35Å; W879-T882 VanDerWaalsContact O-N 3.16Å; W879-I883 HydrophobicContact CD2-CD1 4.05Å; W879-I883 HydrophobicContact CE3-CD1 3.64Å; W879-I883 HydrophobicContact CE3-CG1 4.44Å; W879-I883 HydrophobicContact CH2-CD1 3.38Å; W879-I883 HydrophobicContact CZ2-CD1 3.8Å; W879-I883 HydrophobicContact CZ3-CD1 3.3Å; W879-I883 PolarHBondContact O-N 2.89Å
880	E	90.3	Very high	84.3	Confident	35 Å²	35	53.7 Å²	53.7	16%	0.164	27%	0.268	C	S	.	.	H	α-helix	trans	-59.2	-45.9	173.4	-71	172	-166	0	0	111.8	L802 S853 R876 T882 I883 L884	L802-E880 HydrophobicContact CD1-CB 3.93Å; L802-E880 HydrophobicContact CD1-CG 4.12Å; L802-E880 HydrophobicContact CD2-CG 4.5Å; S853-E880 WeakPolarHBondContact CB-OE1 3.33Å; S853-E880 WeakPolarHBondContact OG-CG 3.49Å; S853-E880 PolarHBondContact OG-OE1 3.24Å; R876-E880 VanDerWaalsContact CD-OE1 3.27Å; R876-E880 WeakPolarHBondContact CD-OE1 3.33Å; R876-E880 WeakPolarHBondContact CG-OE1 3.47Å; R876-E880 IonicContact CZ-OE1 3Å; R876-E880 IonicContact CZ-OE2 2.71Å; R876-E880 IonicContact NE-OE1 3.01Å; R876-E880 IonicContact NH1-OE1 3.23Å; R876-E880 PolarHBondContact NH1-OE1 2.96Å; R876-E880 IonicContact NH1-OE2 3Å; R876-E880 PolarHBondContact NH1-OE2 3.02Å; R876-E880 PolarHBondContact O-N 2.72Å; E880-T882 VanDerWaalsContact C-N 3.29Å; E880-T882 PolarHBondContact O-N 3.42Å; E880-I883 PolarHBondContact O-N 3.27Å; E880-L884 WeakPolarHBondContact O-CG 3.3Å; E880-L884 PolarHBondContact O-N 2.86Å
881	R	88.6	Confident	82.7	Confident	117 Å²	117	56.8 Å²	56.8	44%	0.442	29%	0.289	S	S	.	.	H	α-helix	trans	-59.6	-40.1	174.6	-167.5	-175.5	79.5	104.6	-14.7	112	K877 E878 W879 L884 E885	K877-R881 VanDerWaalsContact O-CB 3.31Å; K877-R881 WeakPolarHBondContact O-CB 3.44Å; K877-R881 PolarHBondContact O-N 3.37Å; E878-R881 IonicContact OE1-CZ 3.33Å; E878-R881 IonicContact OE1-NE 3.71Å; E878-R881 PolarHBondContact OE1-NE 3.13Å; E878-R881 IonicContact OE1-NH2 3.42Å; E878-R881 PolarHBondContact OE1-NH2 3.06Å; E878-R881 IonicContact OE2-NE 2.95Å; E878-R881 IonicContact OE2-NH2 3.27Å; W879-R881 PolarHBondContact O-N 2.97Å; R881-L884 PolarHBondContact O-N 2.9Å; R881-E885 WeakPolarHBondContact O-CB 3.49Å; R881-E885 PolarHBondContact O-N 2.83Å
882	T	88.8	Confident	81	Confident	9 Å²	9	55.7 Å²	55.7	6%	0.055	28%	0.284	C	S	.	.	H	α-helix	trans	-67.3	-38.6	178.2	-52.4	0	0	0	0	111.2	V731 M749 R779 E878 W879 E880 E885 L886	V731-T882 HydrophobicContact CG1-CG2 3.65Å; M749-T882 HydrophobicContact SD-CG2 3.51Å; M749-T882 VanDerWaalsContact SD-CG2 3.51Å; R779-T882 PolarHBondContact NH2-OG1 2.9Å; E878-T882 WeakPolarHBondContact O-CB 3.29Å; E878-T882 PolarHBondContact O-N 2.87Å; E878-T882 PolarHBondContact O-OG1 3.2Å; W879-T882 PolarHBondContact O-N 3.35Å; W879-T882 VanDerWaalsContact O-N 3.16Å; E880-T882 VanDerWaalsContact C-N 3.29Å; E880-T882 PolarHBondContact O-N 3.42Å; T882-E885 PolarHBondContact O-N 3.03Å; T882-L886 HydrophobicContact CG2-CD1 4.09Å; T882-L886 HydrophobicContact CG2-CG 4.45Å; T882-L886 WeakPolarHBondContact O-CB 3.42Å; T882-L886 VanDerWaalsContact O-CG 3.29Å; T882-L886 WeakPolarHBondContact O-CG 3.48Å; T882-L886 PolarHBondContact O-N 3.42Å
883	I	88.5	Confident	79.1	Confident	0 Å²	0	55 Å²	55	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-64.2	-45.3	172.5	-70.5	-176.5	0	0	0	111.5	M749 I754 I800 L802 W879 E880 E885 L886 K887	M749-I883 HydrophobicContact CE-CD1 4.05Å; M749-I883 HydrophobicContact CE-CG1 3.51Å; I754-I883 HydrophobicContact CD1-CD1 3.58Å; I754-I883 HydrophobicContact CD1-CG1 4.12Å; I800-I883 HydrophobicContact CG2-CD1 4.37Å; I800-I883 HydrophobicContact CG2-CG2 4.39Å; L802-I883 HydrophobicContact CD1-CG2 4.42Å; L802-I883 HydrophobicContact CD2-CD1 4.44Å; W879-I883 HydrophobicContact CD2-CD1 4.05Å; W879-I883 HydrophobicContact CE3-CD1 3.64Å; W879-I883 HydrophobicContact CE3-CG1 4.44Å; W879-I883 HydrophobicContact CH2-CD1 3.38Å; W879-I883 HydrophobicContact CZ2-CD1 3.8Å; W879-I883 HydrophobicContact CZ3-CD1 3.3Å; W879-I883 PolarHBondContact O-N 2.89Å; E880-I883 PolarHBondContact O-N 3.27Å; I883-E885 VanDerWaalsContact C-N 3.29Å; I883-E885 PolarHBondContact O-N 3.22Å; I883-L886 PolarHBondContact O-N 3.3Å; I883-K887 HydrophobicContact CG2-CD 4.31Å; I883-K887 HydrophobicContact CG2-CG 4.18Å; I883-K887 WeakPolarHBondContact O-CB 3.26Å; I883-K887 WeakPolarHBondContact O-CG 3.46Å; I883-K887 PolarHBondContact O-N 3.23Å
884	L	85.1	Confident	77.2	Confident	105 Å²	105	57.1 Å²	57.1	55%	0.55	29%	0.285	S	S	.	.	H	α-helix	trans	-62.8	-37.5	178.5	-69.3	171.6	0	0	0	111.8	L802 E880 R881 R888	L802-L884 HydrophobicContact CD1-CD1 4.3Å; L802-L884 HydrophobicContact CD1-CD2 4.12Å; L802-L884 HydrophobicContact CD1-CG 3.91Å; E880-L884 WeakPolarHBondContact O-CG 3.3Å; E880-L884 PolarHBondContact O-N 2.86Å; R881-L884 PolarHBondContact O-N 2.9Å; L884-R888 VanDerWaalsContact O-CB 3.28Å; L884-R888 WeakPolarHBondContact O-CB 3.28Å; L884-R888 PolarHBondContact O-N 2.86Å
885	E	83.9	Confident	75.8	Confident	44 Å²	44	57.8 Å²	57.8	21%	0.206	27%	0.273	C	S	.	.	H	α-helix	trans	-65.6	-46.3	173.3	-174.9	57.1	-139.5	0	0	112	R881 T882 I883 R888 Q889	R881-E885 WeakPolarHBondContact O-CB 3.49Å; R881-E885 PolarHBondContact O-N 2.83Å; T882-E885 PolarHBondContact O-N 3.03Å; I883-E885 VanDerWaalsContact C-N 3.29Å; I883-E885 PolarHBondContact O-N 3.22Å; E885-R888 WeakPolarHBondContact O-CB 3.36Å; E885-R888 PolarHBondContact O-N 2.98Å; E885-R888 IonicContact OE1-CZ 3.8Å; E885-R888 IonicContact OE1-NE 3.65Å; E885-R888 PolarHBondContact OE1-NE 3.11Å; E885-R888 IonicContact OE1-NH2 3.45Å; E885-R888 PolarHBondContact OE1-NH2 2.98Å; E885-R888 IonicContact OE2-CZ 2.71Å; E885-R888 IonicContact OE2-NE 3.2Å; E885-R888 PolarHBondContact OE2-NE 2.92Å; E885-R888 IonicContact OE2-NH1 2.59Å; E885-R888 IonicContact OE2-NH2 2.66Å; E885-R888 PolarHBondContact OE2-NH2 2.67Å; E885-Q889 WeakPolarHBondContact O-CG 3.4Å; E885-Q889 PolarHBondContact O-N 3.02Å; E885-Q889 PolarHBondContact OE1-NE2 2.95Å
886	L	83.1	Confident	74.5	Confident	5 Å²	5	58.9 Å²	58.9	3%	0.026	28%	0.28	C	S	.	.	H	α-helix	trans	-68.1	-40.3	178.5	-69.4	172.6	0	0	0	112.2	V731 M749 T751 I797 T882 I883 R888 Q889 L890	V731-L886 HydrophobicContact CG1-CD1 4.27Å; V731-L886 HydrophobicContact CG2-CD1 4.05Å; V731-L886 HydrophobicContact CG2-CD2 4.38Å; M749-L886 HydrophobicContact CG-CD1 3.99Å; M749-L886 HydrophobicContact SD-CD1 3.76Å; T751-L886 HydrophobicContact CG2-CD2 4.33Å; I797-L886 HydrophobicContact CD1-CB 4.2Å; I797-L886 HydrophobicContact CD1-CD1 3.64Å; I797-L886 HydrophobicContact CG2-CB 4.01Å; T882-L886 HydrophobicContact CG2-CD1 4.09Å; T882-L886 HydrophobicContact CG2-CG 4.45Å; T882-L886 WeakPolarHBondContact O-CB 3.42Å; T882-L886 VanDerWaalsContact O-CG 3.29Å; T882-L886 WeakPolarHBondContact O-CG 3.48Å; T882-L886 PolarHBondContact O-N 3.42Å; I883-L886 PolarHBondContact O-N 3.3Å; L886-R888 VanDerWaalsContact C-N 3.27Å; L886-R888 PolarHBondContact O-N 2.87Å; L886-Q889 PolarHBondContact O-N 3.09Å; L886-L890 WeakPolarHBondContact O-CB 3.38Å; L886-L890 VanDerWaalsContact O-CG 3.26Å; L886-L890 WeakPolarHBondContact O-CG 3.29Å; L886-L890 PolarHBondContact O-N 2.93Å
887	K	80.7	Confident	73.8	Confident	57 Å²	57	59.3 Å²	59.3	25%	0.248	29%	0.285	C	S	.	.	H	α-helix	trans	-59.4	-39.1	170.2	-72.2	-159.9	83.3	166.2	0	111.1	I797 E798 I800 I883 S891	I797-K887 HydrophobicContact CG2-CG 3.62Å; I797-K887 WeakPolarHBondContact O-CD 3.33Å; I797-K887 WeakPolarHBondContact O-CE 3.49Å; I797-K887 WeakPolarHBondContact O-CG 3.22Å; E798-K887 WeakPolarHBondContact O-CE 3.27Å; E798-K887 PolarHBondContact O-NZ 2.95Å; I800-K887 WeakPolarHBondContact O-CD 3.4Å; I800-K887 PolarHBondContact O-NZ 2.68Å; I883-K887 HydrophobicContact CG2-CD 4.31Å; I883-K887 HydrophobicContact CG2-CG 4.18Å; I883-K887 WeakPolarHBondContact O-CB 3.26Å; I883-K887 WeakPolarHBondContact O-CG 3.46Å; I883-K887 PolarHBondContact O-N 3.23Å; K887-S891 WeakPolarHBondContact O-CB 3.35Å; K887-S891 PolarHBondContact O-N 3.43Å; K887-S891 PolarHBondContact O-OG 3.32Å
888	R	72.1	Confident	73.6	Confident	152 Å²	152	61.3 Å²	61.3	57%	0.574	29%	0.293	S	S	*	.	H	α-helix	trans	-63.6	-47	174.5	-173.6	178.8	75.8	165.2	9.5	111.5	L884 E885 L886 S891 S892	L884-R888 VanDerWaalsContact O-CB 3.28Å; L884-R888 WeakPolarHBondContact O-CB 3.28Å; L884-R888 PolarHBondContact O-N 2.86Å; E885-R888 WeakPolarHBondContact O-CB 3.36Å; E885-R888 PolarHBondContact O-N 2.98Å; E885-R888 IonicContact OE1-CZ 3.8Å; E885-R888 IonicContact OE1-NE 3.65Å; E885-R888 PolarHBondContact OE1-NE 3.11Å; E885-R888 IonicContact OE1-NH2 3.45Å; E885-R888 PolarHBondContact OE1-NH2 2.98Å; E885-R888 IonicContact OE2-CZ 2.71Å; E885-R888 IonicContact OE2-NE 3.2Å; E885-R888 PolarHBondContact OE2-NE 2.92Å; E885-R888 IonicContact OE2-NH1 2.59Å; E885-R888 IonicContact OE2-NH2 2.66Å; E885-R888 PolarHBondContact OE2-NH2 2.67Å; L886-R888 VanDerWaalsContact C-N 3.27Å; L886-R888 PolarHBondContact O-N 2.87Å; R888-S891 WeakPolarHBondContact CA-OG 3.42Å; R888-S891 PolarHBondContact O-N 3.07Å; R888-S891 PolarHBondContact O-OG 2.8Å; R888-S892 PolarHBondContact O-N 3.23Å; R888-S892 VanDerWaalsContact O-N 3.15Å
889	Q	68.7	Low	73.7	Confident	63 Å²	63	60.9 Å²	60.9	29%	0.294	29%	0.291	S	S	.	.	H	α-helix	trans	-63.9	-48.7	178.5	-70.4	174.1	11.3	0	0	111.5	E885 L886 S891 S892 V893	E885-Q889 WeakPolarHBondContact O-CG 3.4Å; E885-Q889 PolarHBondContact O-N 3.02Å; E885-Q889 PolarHBondContact OE1-NE2 2.95Å; L886-Q889 PolarHBondContact O-N 3.09Å; Q889-S891 VanDerWaalsContact C-N 3.32Å; Q889-S891 PolarHBondContact O-N 3.35Å; Q889-S892 CarbonylContact O-C 3.47Å; Q889-S892 WeakPolarHBondContact O-CA 3.38Å; Q889-S892 PolarHBondContact O-N 3.45Å; Q889-S892 PolarHBondContact O-OG 2.95Å; Q889-V893 WeakPolarHBondContact O-CG2 3.36Å; Q889-V893 PolarHBondContact O-N 3.41Å
890	L	66.3	Low	73.5	Confident	27 Å²	27	63.6 Å²	63.6	14%	0.141	31%	0.305	C	S	.	.	H	α-helix	trans	-57	-42.2	172.2	-69	165.7	0	0	0	111.6	I797 L886 S892 V893 K894	I797-L890 HydrophobicContact CB-CD1 3.8Å; I797-L890 HydrophobicContact CG2-CD1 3.71Å; L886-L890 WeakPolarHBondContact O-CB 3.38Å; L886-L890 VanDerWaalsContact O-CG 3.26Å; L886-L890 WeakPolarHBondContact O-CG 3.29Å; L886-L890 PolarHBondContact O-N 2.93Å; L890-S892 PolarHBondContact O-N 3.49Å; L890-S892 VanDerWaalsContact O-N 3.14Å; L890-V893 PolarHBondContact O-N 3.11Å; L890-K894 HydrophobicContact CD2-CD 4.5Å; L890-K894 WeakPolarHBondContact O-CA 3.45Å; L890-K894 WeakPolarHBondContact O-CB 3.45Å; L890-K894 PolarHBondContact O-N 3.11Å
891	S	56.3	Low	73.4	Confident	68 Å²	68	66.4 Å²	66.4	48%	0.476	32%	0.319	S	S	.	.	H	α-helix	trans	-69	-6.8	175.2	77.8	0	0	0	0	114.9	K887 R888 Q889 R895	K887-S891 WeakPolarHBondContact O-CB 3.35Å; K887-S891 PolarHBondContact O-N 3.43Å; K887-S891 PolarHBondContact O-OG 3.32Å; R888-S891 WeakPolarHBondContact CA-OG 3.42Å; R888-S891 PolarHBondContact O-N 3.07Å; R888-S891 PolarHBondContact O-OG 2.8Å; Q889-S891 VanDerWaalsContact C-N 3.32Å; Q889-S891 PolarHBondContact O-N 3.35Å; S891-R895 VanDerWaalsContact O-CG 3.26Å; S891-R895 WeakPolarHBondContact O-CG 3.4Å; S891-R895 PolarHBondContact O-NE 2.9Å
892	S	48.7	Very low	73.4	Confident	64 Å²	64	62 Å²	62	45%	0.448	31%	0.307	S	S	.	.	H	α-helix	trans	-105.8	-27.7	174	69.2	0	0	0	0	113.6	R888 Q889 L890	R888-S892 PolarHBondContact O-N 3.23Å; R888-S892 VanDerWaalsContact O-N 3.15Å; Q889-S892 CarbonylContact O-C 3.47Å; Q889-S892 WeakPolarHBondContact O-CA 3.38Å; Q889-S892 PolarHBondContact O-N 3.45Å; Q889-S892 PolarHBondContact O-OG 2.95Å; L890-S892 PolarHBondContact O-N 3.49Å; L890-S892 VanDerWaalsContact O-N 3.14Å
893	V	47.2	Very low	73.6	Confident	60 Å²	60	62.6 Å²	62.6	36%	0.364	31%	0.31	S	S	.	.	H	α-helix	trans	-97.4	-24.7	-179.7	175.9	0	0	0	0	112.4	Q889 L890	Q889-V893 WeakPolarHBondContact O-CG2 3.36Å; Q889-V893 PolarHBondContact O-N 3.41Å; L890-V893 PolarHBondContact O-N 3.11Å
894	K	48.1	Very low	73.7	Confident	92 Å²	92	66.9 Å²	66.9	40%	0.4	33%	0.33	S	S	.	.			trans	-120.7	40	-168.4	-154.4	177.9	-178.2	-177.2	0	112.2	E798 L890 M896	E798-K894 IonicContact OE1-NZ 3.57Å; E798-K894 PolarHBondContact OE1-NZ 2.82Å; L890-K894 HydrophobicContact CD2-CD 4.5Å; L890-K894 WeakPolarHBondContact O-CA 3.45Å; L890-K894 WeakPolarHBondContact O-CB 3.45Å; L890-K894 PolarHBondContact O-N 3.11Å; K894-M896 HydrophobicContact CG-CG 4Å; K894-M896 HydrophobicContact CG-SD 3.85Å; K894-M896 PolarHBondContact O-N 3.21Å
895	R	54.9	Low	73.9	Confident	87 Å²	87	62.1 Å²	62.1	33%	0.328	31%	0.305	S	S	.	.			trans	-78.2	57.3	173.5	-68	-177.1	-179.8	170.5	-14.8	111.1	S891 A897 D1447	S891-R895 VanDerWaalsContact O-CG 3.26Å; S891-R895 WeakPolarHBondContact O-CG 3.4Å; S891-R895 PolarHBondContact O-NE 2.9Å; R895-A897 PolarHBondContact O-N 3.24Å; R895-D1447 IonicContact CZ-OD2 2.74Å; R895-D1447 IonicContact NH1-OD2 3.87Å; R895-D1447 PolarHBondContact NH1-OD2 3.46Å; R895-D1447 IonicContact NH2-OD2 2.67Å
896	M	59.1	Low	73.8	Confident	107 Å²	107	63.4 Å²	63.4	53%	0.527	32%	0.318	S	S	.	.	P	Polyproline II helix	trans	-65.8	128	-174.1	-60.8	177.3	72.9	0	0	110.3	K894 K898	K894-M896 HydrophobicContact CG-CG 4Å; K894-M896 HydrophobicContact CG-SD 3.85Å; K894-M896 PolarHBondContact O-N 3.21Å; M896-K898 PolarHBondContact O-N 2.93Å
897	A	76	Confident	73.6	Confident	13 Å²	13	65.8 Å²	65.8	11%	0.107	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.7	116.6	155.4	0	0	0	0	0	108.2	R895 W1450 L1483 W1630	R895-A897 PolarHBondContact O-N 3.24Å; A897-W1450 HydrophobicContact CB-CH2 3.4Å; A897-W1450 HydrophobicContact CB-CZ2 3.56Å; A897-W1450 HydrophobicContact CB-CZ3 4.47Å; A897-L1483 HydrophobicContact CB-CD1 4.2Å; A897-L1483 HydrophobicContact CB-CD2 3.85Å; A897-W1630 HydrophobicContact CB-CE3 4.19Å
898	K	82.4	Confident	73.3	Confident	125 Å²	125	66 Å²	66	54%	0.543	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	121.3	173.9	-170.1	-137	167.9	-156.6	0	108.2	M896 N900 W1630 D1631	M896-K898 PolarHBondContact O-N 2.93Å; K898-N900 PolarHBondContact O-N 2.96Å; K898-W1630 CarbonylContact O-C 3.44Å; K898-W1630 WeakPolarHBondContact O-CA 3.17Å; K898-D1631 HydrophobicContact CB-CB 4.44Å; K898-D1631 PolarHBondContact N-O 3.38Å; K898-D1631 PolarHBondContact O-N 2.94Å
899	F	87.3	Confident	73.7	Confident	47 Å²	47	62.4 Å²	62.4	21%	0.206	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.6	132.4	167.2	179.7	-107	0	0	0	109.8	E901 A902 Y1485 L1628 W1630	F899-E901 WeakPolarHBondContact CE2-O 3.46Å; F899-E901 VanDerWaalsContact CZ-C 3.45Å; F899-A902 HydrophobicContact CE2-CB 4.25Å; F899-A902 HydrophobicContact CZ-CB 3.84Å; F899-Y1485 HydrophobicContact CB-CD2 3.57Å; F899-Y1485 HydrophobicContact CB-CE2 3.83Å; F899-Y1485 AromaticContact CD1-CD2 3.7Å; F899-Y1485 HydrophobicContact CD1-CD2 3.7Å; F899-Y1485 AromaticContact CD1-CE2 3.47Å; F899-Y1485 HydrophobicContact CD1-CE2 3.47Å; F899-Y1485 VanDerWaalsContact CD1-CE2 3.47Å; F899-Y1485 HydrophobicContact CD1-CG 4.4Å; F899-Y1485 AromaticContact CD2-CD2 3.81Å; F899-Y1485 HydrophobicContact CD2-CD2 3.81Å; F899-Y1485 HydrophobicContact CD2-CE2 4.44Å; F899-Y1485 HydrophobicContact CD2-CG 4.1Å; F899-Y1485 HydrophobicContact CE1-CD2 4.32Å; F899-Y1485 HydrophobicContact CE1-CE1 4.5Å; F899-Y1485 HydrophobicContact CE1-CE2 4.12Å; F899-Y1485 HydrophobicContact CE2-CD2 4.42Å; F899-Y1485 HydrophobicContact CE2-CG 4.35Å; F899-Y1485 AromaticContact CG-CD2 3.4Å; F899-Y1485 HydrophobicContact CG-CD2 3.4Å; F899-Y1485 VanDerWaalsContact CG-CD2 3.4Å; F899-Y1485 AromaticContact CG-CE2 3.66Å; F899-Y1485 HydrophobicContact CG-CE2 3.66Å; F899-Y1485 HydrophobicContact CG-CG 4.12Å; F899-L1628 HydrophobicContact CE2-CB 4.15Å; F899-L1628 HydrophobicContact CE2-CD2 4.18Å; F899-W1630 HydrophobicContact CB-CE3 3.99Å; F899-W1630 HydrophobicContact CB-CH2 4.39Å; F899-W1630 HydrophobicContact CB-CZ3 3.74Å; F899-W1630 HydrophobicContact CD2-CE3 4.46Å; F899-W1630 HydrophobicContact CD2-CH2 4.26Å; F899-W1630 HydrophobicContact CD2-CZ2 4.36Å; F899-W1630 HydrophobicContact CD2-CZ3 4.3Å
900	N	86.6	Confident	74.1	Confident	59 Å²	59	65.3 Å²	65.3	32%	0.316	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	-63.6	-179.6	-167.4	-23.5	0	0	0	109.5	K898 K1588 I1629 D1631	K898-N900 PolarHBondContact O-N 2.96Å; N900-K1588 WeakPolarHBondContact ND2-CE 3.44Å; N900-I1629 WeakPolarHBondContact CA-O 3.16Å; N900-I1629 HydrophobicContact CB-CG2 4.28Å; N900-I1629 VanDerWaalsContact CB-O 3.31Å; N900-I1629 WeakPolarHBondContact CB-O 3.47Å; N900-I1629 PolarHBondContact N-O 3.13Å; N900-D1631 VanDerWaalsContact ND2-CG 3.32Å; N900-D1631 PolarHBondContact ND2-OD1 3.31Å; N900-D1631 PolarHBondContact ND2-OD2 3.11Å
901	E	88.2	Confident	74.8	Confident	94 Å²	94	66.2 Å²	66.2	44%	0.439	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.6	158.7	-175.7	-167.4	161.9	-148.8	0	0	111.1	F899 P954 I1629	F899-E901 WeakPolarHBondContact CE2-O 3.46Å; F899-E901 VanDerWaalsContact CZ-C 3.45Å; E901-P954 WeakPolarHBondContact OE2-CG 3.42Å; E901-I1629 PolarHBondContact N-O 2.96Å; E901-I1629 PolarHBondContact O-N 3Å
902	A	90.2	Very high	76.2	Confident	23 Å²	23	63.1 Å²	63.1	19%	0.19	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	122.3	170.7	0	0	0	0	0	109.8	F899 Y1626 V1627 L1628	F899-A902 HydrophobicContact CE2-CB 4.25Å; F899-A902 HydrophobicContact CZ-CB 3.84Å; A902-Y1626 HydrophobicContact CB-CD1 4.38Å; A902-V1627 CarbonylContact C-O 3.6Å; A902-V1627 WeakPolarHBondContact CA-O 3.34Å; A902-L1628 HydrophobicContact CB-CD2 3.57Å
903	V	91.4	Very high	78.2	Confident	22 Å²	22	62.1 Å²	62.1	13%	0.133	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	123.1	179.2	-174.7	0	0	0	0	109.1	L948 P954 I956 V1627 I1629	V903-L948 HydrophobicContact CG1-CD1 4.25Å; V903-P954 HydrophobicContact CG2-CB 3.63Å; V903-I956 HydrophobicContact CG1-CD1 3.98Å; V903-I956 HydrophobicContact CG1-CG1 4.17Å; V903-V1627 PolarHBondContact N-O 3.03Å; V903-V1627 PolarHBondContact O-N 2.82Å; V903-I1629 HydrophobicContact CG2-CD1 3.92Å
904	Q	91.2	Very high	80.5	Confident	90 Å²	90	59.4 Å²	59.4	42%	0.421	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	129.2	171.8	-172.4	178.9	5.1	0	0	109.2	I956 D1624 Y1626	Q904-I956 WeakPolarHBondContact O-CD1 3.3Å; Q904-D1624 HydrophobicContact CG-CB 4.43Å; Q904-D1624 PolarHBondContact NE2-OD2 2.9Å; Q904-Y1626 HydrophobicContact CB-CD1 4.19Å; Q904-Y1626 HydrophobicContact CB-CE1 3.73Å; Q904-Y1626 HydrophobicContact CG-CE1 4.19Å; Q904-Y1626 HydrophobicContact CG-CE2 4.48Å
905	I	89.4	Confident	82.6	Confident	5 Å²	5	56 Å²	56	3%	0.026	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	104.6	166.3	-64.1	-178	0	0	0	106.3	R907 L914 I935 C946 I956 N1625 V1627	I905-R907 PolarHBondContact O-N 2.8Å; I905-L914 HydrophobicContact CD1-CD2 4.23Å; I905-I935 HydrophobicContact CD1-CB 4.47Å; I905-I935 HydrophobicContact CD1-CD1 3.87Å; I905-I935 HydrophobicContact CD1-CG2 3.99Å; I905-C946 HydrophobicContact CD1-CB 4.48Å; I905-C946 HydrophobicContact CG2-CB 4.48Å; I905-I956 HydrophobicContact CB-CD1 4.45Å; I905-I956 HydrophobicContact CG1-CD1 3.87Å; I905-N1625 HydrophobicContact CB-CB 4.41Å; I905-N1625 PolarHBondContact N-O 3.33Å; I905-N1625 WeakPolarHBondContact O-CB 3.49Å; I905-V1627 HydrophobicContact CD1-CG2 3.47Å; I905-V1627 VanDerWaalsContact CD1-CG2 3.47Å; I905-V1627 HydrophobicContact CG1-CG2 4.01Å
906	P	82.7	Confident	84.5	Confident	71 Å²	71	52.7 Å²	52.7	46%	0.461	29%	0.292	S	S	.	.			trans	-56.5	130.2	-173.9	-27.4	35.1	0	0	0	112.8	T908 N959	P906-T908 PolarHBondContact O-N 2.92Å; P906-N959 PolarHBondContact O-ND2 3.41Å
907	R	78.9	Confident	86.3	Confident	55 Å²	55	48.4 Å²	48.4	21%	0.208	27%	0.273	C	S	.	.			trans	-65.3	110.7	167.1	-81.3	173.5	175.9	-165.5	-4.9	110.6	I905 L909 I912 E1594 S1623 D1624 N1625	I905-R907 PolarHBondContact O-N 2.8Å; R907-L909 VanDerWaalsContact C-N 3.33Å; R907-I912 PolarHBondContact NE-O 2.88Å; R907-E1594 IonicContact CZ-OE1 3.36Å; R907-E1594 IonicContact NH1-OE1 3.85Å; R907-E1594 PolarHBondContact NH1-OE1 2.99Å; R907-E1594 VanDerWaalsContact NH2-CD 3.32Å; R907-E1594 IonicContact NH2-OE1 2.78Å; R907-E1594 PolarHBondContact NH2-OE1 2.71Å; R907-S1623 PolarHBondContact NE-O 3.14Å; R907-S1623 PolarHBondContact NH1-O 3.26Å; R907-S1623 PolarHBondContact NH2-O 3.27Å; R907-D1624 WeakPolarHBondContact CB-OD1 3.33Å; R907-D1624 WeakPolarHBondContact CG-OD1 3.48Å; R907-D1624 PolarHBondContact N-OD1 3.43Å; R907-N1625 WeakPolarHBondContact CG-ND2 3.45Å; R907-N1625 PolarHBondContact NE-ND2 2.93Å; R907-N1625 PolarHBondContact NE-OD1 3.12Å; R907-N1625 VanDerWaalsContact NE-OD1 3.16Å; R907-N1625 PolarHBondContact NH2-OD1 3.37Å
908	T	73.9	Confident	87.1	Confident	63 Å²	63	49 Å²	49	39%	0.387	28%	0.276	S	S	.	.	S	Bend	trans	-75.6	-21.3	176.6	39.9	0	0	0	0	113.3	P906 I912 Y944	P906-T908 PolarHBondContact O-N 2.92Å; T908-I912 VanDerWaalsContact OG1-CD1 3.25Å; T908-I912 WeakPolarHBondContact OG1-CD1 3.31Å; T908-Y944 HydrophobicContact CG2-CD1 4.39Å; T908-Y944 HydrophobicContact CG2-CE1 3.82Å; T908-Y944 WeakPolarHBondContact OG1-CD1 3.49Å; T908-Y944 WeakPolarHBondContact OG1-CE1 3.47Å
909	L	79.7	Confident	87.5	Confident	76 Å²	76	44.2 Å²	44.2	40%	0.398	26%	0.256	S	S	.	.	S	Bend	trans	-145.5	151.5	169	-60	171.5	0	0	0	108.8	R907 I912	R907-L909 VanDerWaalsContact C-N 3.33Å; L909-I912 HydrophobicContact CB-CD1 3.64Å; L909-I912 HydrophobicContact CB-CG1 4.06Å; L909-I912 HydrophobicContact CD1-CD1 4.23Å; L909-I912 HydrophobicContact CG-CD1 4.04Å; L909-I912 PolarHBondContact O-N 3.48Å
910	P	77.2	Confident	87.1	Confident	124 Å²	124	42.8 Å²	42.8	81%	0.805	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.5	140.5	169	-23.1	34.1	0	0	0	111.7	I912	P910-I912 VanDerWaalsContact C-N 3.32Å; P910-I912 PolarHBondContact O-N 3.34Å
911	G	81.1	Confident	86	Confident	45 Å²	45	42 Å²	42	46%	0.464	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	83.8	-8.3	178.2	0	0	0	0	0	115.8	Q913	G911-Q913 PolarHBondContact O-N 3.17Å; G911-Q913 VanDerWaalsContact O-N 3.17Å
912	I	86.6	Confident	84.3	Confident	4 Å²	4	40.1 Å²	40.1	2%	0.021	24%	0.243	C	C	.	.			trans	-66.5	116	170.9	-68.5	175.9	0	0	0	109.5	R907 T908 L909 P910 A937 D939 Y944 N1625	R907-I912 PolarHBondContact NE-O 2.88Å; T908-I912 VanDerWaalsContact OG1-CD1 3.25Å; T908-I912 WeakPolarHBondContact OG1-CD1 3.31Å; L909-I912 HydrophobicContact CB-CD1 3.64Å; L909-I912 HydrophobicContact CB-CG1 4.06Å; L909-I912 HydrophobicContact CD1-CD1 4.23Å; L909-I912 HydrophobicContact CG-CD1 4.04Å; L909-I912 PolarHBondContact O-N 3.48Å; P910-I912 VanDerWaalsContact C-N 3.32Å; P910-I912 PolarHBondContact O-N 3.34Å; I912-A937 HydrophobicContact CG2-CB 3.62Å; I912-D939 HydrophobicContact CG1-CB 4.08Å; I912-Y944 HydrophobicContact CD1-CD2 3.59Å; I912-Y944 HydrophobicContact CD1-CE2 3.31Å; I912-Y944 HydrophobicContact CD1-CG 4.34Å; I912-Y944 HydrophobicContact CG1-CE2 4.48Å; I912-N1625 PolarHBondContact O-ND2 2.85Å; I912-N1625 PolarHBondContact O-OD1 3.26Å
913	Q	90.3	Very high	82.4	Confident	43 Å²	43	41.3 Å²	41.3	20%	0.201	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	148.5	175.7	-68.5	-176.8	-12	0	0	111.1	G911 A937 S938	G911-Q913 PolarHBondContact O-N 3.17Å; G911-Q913 VanDerWaalsContact O-N 3.17Å; Q913-A937 CarbonylContact O-C 3.58Å; Q913-A937 WeakPolarHBondContact O-CA 3.48Å; Q913-A937 WeakPolarHBondContact O-CB 3.41Å; Q913-S938 PolarHBondContact N-O 3.09Å; Q913-S938 PolarHBondContact O-N 3.4Å
914	L	94.5	Very high	80	Confident	2 Å²	2	42.1 Å²	42.1	1%	0.01	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.7	140.5	171.8	-55.1	-174.5	0	0	0	110.4	I905 I935 A937 R1492 F1493 N1625 V1627	I905-L914 HydrophobicContact CD1-CD2 4.23Å; L914-I935 HydrophobicContact CD2-CG2 4.12Å; L914-A937 HydrophobicContact CD2-CB 3.97Å; L914-R1492 HydrophobicContact CB-CB 4.44Å; L914-R1492 WeakPolarHBondContact O-CB 3.46Å; L914-R1492 VanDerWaalsContact O-CG 3.24Å; L914-R1492 WeakPolarHBondContact O-CG 3.48Å; L914-R1492 PolarHBondContact O-NE 3.19Å; L914-F1493 HydrophobicContact CB-CE1 4.07Å; L914-F1493 HydrophobicContact CD1-CE1 3.97Å; L914-F1493 HydrophobicContact CD1-CZ 4.36Å; L914-N1625 HydrophobicContact CD1-CB 4.3Å; L914-N1625 HydrophobicContact CD2-CB 3.99Å; L914-N1625 HydrophobicContact CG-CB 3.94Å; L914-V1627 HydrophobicContact CD1-CG2 4.12Å
915	S	93.5	Very high	77.5	Confident	22 Å²	22	43.5 Å²	43.5	15%	0.154	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	-49.8	-178.8	77.3	0	0	0	0	113.8	C936 I969	S915-C936 PolarHBondContact N-O 2.82Å; S915-I969 VanDerWaalsContact CB-O 3.3Å; S915-I969 WeakPolarHBondContact CB-O 3.44Å; S915-I969 PolarHBondContact OG-O 2.9Å
916	C	95	Very high	75.1	Confident	16 Å²	16	47.3 Å²	47.3	11%	0.108	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.7	162.9	-175.2	57.8	0	0	0	0	111.6	C936 I972	C916-C936 PolarHBondContact O-N 3.41Å; C916-I972 HydrophobicContact CB-CG2 4.14Å
917	A	96.5	Very high	73.1	Confident	17 Å²	17	48 Å²	48	14%	0.14	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	158	-179.7	0	0	0	0	0	112.4	V933 W934 I935 F1493 V1495	A917-V933 HydrophobicContact CB-CG1 4.44Å; A917-W934 CarbonylContact C-O 3.51Å; A917-W934 WeakPolarHBondContact CA-O 3.44Å; A917-W934 WeakPolarHBondContact CB-O 3.43Å; A917-I935 HydrophobicContact CB-CB 4.39Å; A917-I935 HydrophobicContact CB-CG1 3.92Å; A917-F1493 HydrophobicContact CB-CD1 3.97Å; A917-F1493 HydrophobicContact CB-CD2 3.7Å; A917-F1493 HydrophobicContact CB-CE1 3.9Å; A917-F1493 HydrophobicContact CB-CE2 3.64Å; A917-F1493 HydrophobicContact CB-CG 3.87Å; A917-F1493 HydrophobicContact CB-CZ 3.74Å; A917-V1495 HydrophobicContact CB-CG2 3.67Å
918	S	93.4	Very high	71.6	Confident	25 Å²	25	53.6 Å²	53.6	18%	0.175	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153	143.4	178	-161	0	0	0	0	112.1	W934 A974	S918-W934 PolarHBondContact N-O 2.98Å; S918-W934 PolarHBondContact O-N 3.48Å; S918-A974 PolarHBondContact OG-N 3.08Å
919	M	89.3	Confident	70.7	Confident	25 Å²	25	52.7 Å²	52.7	12%	0.123	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	141	177.8	176.6	-175	65.1	0	0	110.9	A974 V1495 L1497	M919-A974 WeakPolarHBondContact O-CB 3.36Å; M919-V1495 HydrophobicContact CB-CG1 4.25Å; M919-L1497 HydrophobicContact CB-CD2 4.02Å; M919-L1497 HydrophobicContact CG-CD2 3.77Å; M919-L1497 HydrophobicContact SD-CB 4.24Å; M919-L1497 HydrophobicContact SD-CD2 3.45Å; M919-L1497 WeakPolarHBondContact SD-CD2 3.47Å; M919-L1497 HydrophobicContact SD-CG 4.43Å
920	I	78.7	Confident	69.8	Low	18 Å²	18	51.9 Å²	51.9	9%	0.092	32%	0.322	C	S	.	.			trans	-72.8	129.8	172.4	-52	-177.1	0	0	0	110.2	S922 D932 L947 A1265	I920-S922 VanDerWaalsContact C-N 3.28Å; I920-S922 PolarHBondContact O-N 3Å; I920-D932 HydrophobicContact CB-CB 4.4Å; I920-D932 HydrophobicContact CD1-CB 3.48Å; I920-D932 VanDerWaalsContact CD1-CB 3.48Å; I920-D932 HydrophobicContact CG1-CB 3.93Å; I920-D932 PolarHBondContact N-O 3.1Å; I920-L947 HydrophobicContact CD1-CD1 4.46Å; I920-A1265 HydrophobicContact CD1-CB 3.94Å; I920-A1265 WeakPolarHBondContact CD1-O 3.35Å; I920-A1265 HydrophobicContact CG1-CB 4.15Å; I920-A1265 HydrophobicContact CG2-CB 3.74Å
921	E	63.5	Low	69.8	Low	42 Å²	42	46.8 Å²	46.8	20%	0.196	29%	0.289	C	S	.	.			trans	-79.4	70.6	170.7	-63.8	-152.8	177.3	0	0	112.4	P976 R998	E921-P976 HydrophobicContact CB-CG 4.19Å; E921-P976 HydrophobicContact CG-CG 4.3Å; E921-P976 VanDerWaalsContact OE2-CG 3.31Å; E921-P976 WeakPolarHBondContact OE2-CG 3.39Å; E921-R998 VanDerWaalsContact CD-NH2 3.31Å; E921-R998 IonicContact OE1-CZ 3.75Å; E921-R998 VanDerWaalsContact OE1-CZ 3.27Å; E921-R998 IonicContact OE1-NH1 2.62Å; E921-R998 PolarHBondContact OE1-NH1 3.04Å; E921-R998 IonicContact OE1-NH2 2.8Å; E921-R998 PolarHBondContact OE1-NH2 3.27Å; E921-R998 IonicContact OE2-NH2 3.4Å
922	S	54.4	Low	70.1	Confident	55 Å²	55	46.2 Å²	46.2	39%	0.385	28%	0.275	S	S	.	.			trans	-71.1	136.9	164.7	54.5	0	0	0	0	110.7	I920 P924	I920-S922 VanDerWaalsContact C-N 3.28Å; I920-S922 PolarHBondContact O-N 3Å; S922-P924 WeakPolarHBondContact O-CD 3.45Å
923	S	48.5	Very low	70.3	Confident	47 Å²	47	46 Å²	46	33%	0.329	27%	0.274	S	S	.	.			trans	-70.7	121.4	177.7	-162	0	0	0	0	110.6	L925	S923-L925 PolarHBondContact O-N 3.28Å
924	P	41.4	Very low	70.5	Confident	39 Å²	39	44 Å²	44	25%	0.253	27%	0.265	S	S	.	.			trans	-81.4	55.2	-172.1	35	-38	0	0	0	111.8	S922 L990	S922-P924 WeakPolarHBondContact O-CD 3.45Å; P924-L990 HydrophobicContact CG-CB 4.3Å
925	L	38.2	Very low	70.5	Confident	119 Å²	119	43.9 Å²	43.9	62%	0.623	27%	0.265	S	S	*	.	S	Bend	trans	-84.9	-9.1	-178.9	-72.8	168.8	0	0	0	113.3	S923 L990	S923-L925 PolarHBondContact O-N 3.28Å; L925-L990 HydrophobicContact CD2-CD1 4.17Å
926	V	39.7	Very low	70.6	Confident	85 Å²	85	42.9 Å²	42.9	52%	0.515	26%	0.257	S	S	.	.	S	Bend	trans	-135.2	138.8	174.1	-169.6	0	0	0	0	107.2	E928 T929	V926-E928 HydrophobicContact CG1-CB 4.17Å; V926-E928 HydrophobicContact CG1-CG 4.38Å; V926-E928 PolarHBondContact O-N 3Å; V926-E928 VanDerWaalsContact O-N 3.15Å; V926-T929 HydrophobicContact CB-CG2 4.35Å; V926-T929 PolarHBondContact O-N 3.5Å; V926-T929 PolarHBondContact O-OG1 3Å
927	A	40.5	Very low	70.5	Confident	85 Å²	85	42.4 Å²	42.4	70%	0.702	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-13.1	-179.2	0	0	0	0	0	113.8
928	E	47.9	Very low	70.3	Confident	173 Å²	173	42 Å²	42	81%	0.808	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.7	4.5	-175.4	-56.8	177.3	157.8	0	0	113.4	V926	V926-E928 HydrophobicContact CG1-CB 4.17Å; V926-E928 HydrophobicContact CG1-CG 4.38Å; V926-E928 PolarHBondContact O-N 3Å; V926-E928 VanDerWaalsContact O-N 3.15Å
929	T	55	Low	70.1	Confident	44 Å²	44	43 Å²	43	27%	0.27	25%	0.254	S	S	.	.			trans	-64.2	125.5	-179.3	50.5	0	0	0	0	111.3	V926 C931	V926-T929 HydrophobicContact CB-CG2 4.35Å; V926-T929 PolarHBondContact O-N 3.5Å; V926-T929 PolarHBondContact O-OG1 3Å; T929-C931 PolarHBondContact O-N 3.29Å
930	P	60.9	Low	69.8	Low	60 Å²	60	42.8 Å²	42.8	39%	0.39	26%	0.258	S	S	.	.			trans	-63.7	134.5	179	25.4	-33.6	0	0	0	111.3	D932 T949	P930-D932 PolarHBondContact O-N 3.33Å; P930-T949 HydrophobicContact CB-CG2 3.85Å
931	C	77	Confident	70.2	Confident	17 Å²	17	50.8 Å²	50.8	12%	0.115	29%	0.288	C	S	.	.			trans	-87	93.2	175.8	-53.2	0	0	0	0	109.6	T929 V950 H951 L1497	T929-C931 PolarHBondContact O-N 3.29Å; C931-V950 HydrophobicContact CB-CB 4.42Å; C931-V950 PolarHBondContact O-N 2.99Å; C931-H951 HydrophobicContact CB-CB 4.38Å; C931-L1497 HydrophobicContact CB-CD1 4.12Å
932	D	86.9	Confident	71.3	Confident	32 Å²	32	50.9 Å²	50.9	17%	0.171	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	138.1	-175	-74.8	-22.3	0	0	0	113.2	I920 P930 L947 T949	I920-D932 HydrophobicContact CB-CB 4.4Å; I920-D932 HydrophobicContact CD1-CB 3.48Å; I920-D932 VanDerWaalsContact CD1-CB 3.48Å; I920-D932 HydrophobicContact CG1-CB 3.93Å; I920-D932 PolarHBondContact N-O 3.1Å; P930-D932 PolarHBondContact O-N 3.33Å; D932-L947 HydrophobicContact CB-CD1 4.07Å; D932-T949 WeakPolarHBondContact OD1-CA 3.31Å; D932-T949 VanDerWaalsContact OD1-CB 3.22Å; D932-T949 WeakPolarHBondContact OD1-CB 3.37Å; D932-T949 WeakPolarHBondContact OD1-CG2 3.46Å; D932-T949 PolarHBondContact OD1-OG1 3Å
933	V	91.3	Very high	73	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	120.6	-177.7	-174	0	0	0	0	110.2	A917 I935 L948 V950 V1495 L1497 I1590	A917-V933 HydrophobicContact CB-CG1 4.44Å; V933-I935 HydrophobicContact CG1-CG1 4.1Å; V933-L948 PolarHBondContact N-O 3.42Å; V933-L948 PolarHBondContact O-N 3.17Å; V933-V950 HydrophobicContact CG2-CG2 4.23Å; V933-V1495 HydrophobicContact CG1-CG1 4.33Å; V933-L1497 HydrophobicContact CG2-CD2 3.71Å; V933-I1590 HydrophobicContact CB-CD1 4.49Å; V933-I1590 HydrophobicContact CG1-CD1 4.5Å; V933-I1590 HydrophobicContact CG2-CD1 3.81Å
934	W	93.7	Very high	75.1	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	130.4	171.7	-75.3	52	0	0	0	109.1	A917 S918 V945 L947 F958 I972 M1251 F1263 A1265 L1269	A917-W934 CarbonylContact C-O 3.51Å; A917-W934 WeakPolarHBondContact CA-O 3.44Å; A917-W934 WeakPolarHBondContact CB-O 3.43Å; S918-W934 PolarHBondContact N-O 2.98Å; S918-W934 PolarHBondContact O-N 3.48Å; W934-V945 HydrophobicContact CD2-CG1 4.4Å; W934-V945 HydrophobicContact CE3-CG1 3.59Å; W934-V945 HydrophobicContact CZ3-CG1 3.96Å; W934-L947 HydrophobicContact CG-CD1 4.32Å; W934-F958 HydrophobicContact CZ2-CZ 4.49Å; W934-I972 HydrophobicContact CB-CD1 3.66Å; W934-I972 HydrophobicContact CE3-CD1 4.15Å; W934-I972 HydrophobicContact CG-CD1 4.44Å; W934-M1251 HydrophobicContact CB-CE 3.94Å; W934-M1251 HydrophobicContact CD2-CB 4.27Å; W934-M1251 HydrophobicContact CD2-CE 4.27Å; W934-M1251 HydrophobicContact CD2-CG 3.68Å; W934-M1251 HydrophobicContact CE3-CB 3.99Å; W934-M1251 HydrophobicContact CE3-CG 3.93Å; W934-M1251 HydrophobicContact CG-CE 3.9Å; W934-M1251 HydrophobicContact CG-CG 4.18Å; W934-M1251 HydrophobicContact CG-SD 4.47Å; W934-M1251 HydrophobicContact CH2-CB 4.35Å; W934-M1251 HydrophobicContact CH2-CG 4.18Å; W934-M1251 HydrophobicContact CZ2-CG 3.94Å; W934-M1251 HydrophobicContact CZ3-CB 4.02Å; W934-M1251 HydrophobicContact CZ3-CG 4.15Å; W934-F1263 HydrophobicContact CH2-CB 3.84Å; W934-F1263 HydrophobicContact CH2-CG 4.27Å; W934-F1263 HydrophobicContact CZ3-CB 4.25Å; W934-F1263 HydrophobicContact CZ3-CD2 4.25Å; W934-F1263 HydrophobicContact CZ3-CG 4.36Å; W934-A1265 PolarHBondContact NE1-O 3.33Å; W934-L1269 HydrophobicContact CH2-CD1 3.92Å; W934-L1269 HydrophobicContact CH2-CD2 4.11Å; W934-L1269 HydrophobicContact CH2-CG 4.1Å; W934-L1269 HydrophobicContact CZ3-CD1 3.81Å; W934-L1269 HydrophobicContact CZ3-CG 4.48Å
935	I	95.1	Very high	77.5	Confident	1 Å²	1	45.2 Å²	45.2	1%	0.005	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	124.5	-177.2	-60.1	173.5	0	0	0	108.1	I905 L914 A917 V933 C946 L948 F1493 V1627	I905-I935 HydrophobicContact CD1-CB 4.47Å; I905-I935 HydrophobicContact CD1-CD1 3.87Å; I905-I935 HydrophobicContact CD1-CG2 3.99Å; L914-I935 HydrophobicContact CD2-CG2 4.12Å; A917-I935 HydrophobicContact CB-CB 4.39Å; A917-I935 HydrophobicContact CB-CG1 3.92Å; V933-I935 HydrophobicContact CG1-CG1 4.1Å; I935-C946 HydrophobicContact CB-CB 4.26Å; I935-C946 PolarHBondContact N-O 3.28Å; I935-C946 PolarHBondContact O-N 2.96Å; I935-L948 HydrophobicContact CD1-CB 3.89Å; I935-L948 HydrophobicContact CD1-CD2 3.92Å; I935-F1493 HydrophobicContact CD1-CZ 4.16Å; I935-F1493 HydrophobicContact CG1-CZ 4.13Å; I935-F1493 HydrophobicContact CG2-CE1 3.71Å; I935-F1493 HydrophobicContact CG2-CZ 3.8Å; I935-V1627 HydrophobicContact CD1-CG2 4.07Å
936	C	95	Very high	80	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	145.7	177.5	-59.8	0	0	0	0	110.8	S915 C916 Y944 I969	S915-C936 PolarHBondContact N-O 2.82Å; C916-C936 PolarHBondContact O-N 3.41Å; C936-Y944 WeakPolarHBondContact CA-O 3.29Å; C936-I969 HydrophobicContact CB-CB 4.27Å; C936-I969 HydrophobicContact CB-CD1 4.05Å; C936-I969 HydrophobicContact CB-CG2 3.89Å
937	A	93.7	Very high	82.5	Confident	7 Å²	7	36.3 Å²	36.3	6%	0.058	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	155.7	170.9	0	0	0	0	0	110.2	I912 Q913 L914 Y944	I912-A937 HydrophobicContact CG2-CB 3.62Å; Q913-A937 CarbonylContact O-C 3.58Å; Q913-A937 WeakPolarHBondContact O-CA 3.48Å; Q913-A937 WeakPolarHBondContact O-CB 3.41Å; L914-A937 HydrophobicContact CD2-CB 3.97Å; A937-Y944 PolarHBondContact N-O 3.08Å; A937-Y944 PolarHBondContact O-N 2.92Å
938	S	92.1	Very high	84.9	Confident	7 Å²	7	32.3 Å²	32.3	5%	0.049	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.5	149.6	173.4	56.4	0	0	0	0	111.9	Q913 T942	Q913-S938 PolarHBondContact N-O 3.09Å; Q913-S938 PolarHBondContact O-N 3.4Å; S938-T942 VanDerWaalsContact CA-O 3.28Å; S938-T942 WeakPolarHBondContact CA-O 3.35Å; S938-T942 WeakPolarHBondContact CB-O 3.46Å
939	D	88.6	Confident	86.9	Confident	48 Å²	48	25.3 Å²	25.3	26%	0.257	14%	0.136	S	C	.	.	S	Bend	trans	-91.3	-8	168.8	54.6	20.9	0	0	0	112.8	I912 Y941 T942	I912-D939 HydrophobicContact CG1-CB 4.08Å; D939-Y941 WeakPolarHBondContact OD1-CA 3.29Å; D939-Y941 PolarHBondContact OD1-N 2.71Å; D939-T942 PolarHBondContact OD1-N 3.09Å; D939-T942 PolarHBondContact OD2-OG1 3.22Å
940	G	84.5	Confident	88.3	Confident	19 Å²	19	23.2 Å²	23.2	20%	0.196	12%	0.123	C	C	.	.	S	Bend	trans	112.4	-25.6	-173.9	0	0	0	0	0	113.7	S967 R968	G940-S967 CarbonylContact O-C 3.47Å; G940-S967 WeakPolarHBondContact O-CA 3.46Å; G940-R968 PolarHBondContact O-N 3.22Å
941	Y	86.6	Confident	88.9	Confident	187 Å²	187	21.4 Å²	21.4	73%	0.733	11%	0.109	S	C	*	.	S	Bend	trans	-113.5	-27.7	-177.8	-59.3	-79.9	0	0	0	113.2	D939 T966	D939-Y941 WeakPolarHBondContact OD1-CA 3.29Å; D939-Y941 PolarHBondContact OD1-N 2.71Å; Y941-T966 CarbonylContact O-C 3.59Å; Y941-T966 WeakPolarHBondContact O-CA 3.43Å
942	T	87.2	Confident	88.5	Confident	44 Å²	44	26.7 Å²	26.7	27%	0.27	14%	0.143	S	C	.	.			trans	-126	117.5	-176.9	-37.6	0	0	0	0	109.9	S938 D939 Y944	S938-T942 VanDerWaalsContact CA-O 3.28Å; S938-T942 WeakPolarHBondContact CA-O 3.35Å; S938-T942 WeakPolarHBondContact CB-O 3.46Å; D939-T942 PolarHBondContact OD1-N 3.09Å; D939-T942 PolarHBondContact OD2-OG1 3.22Å; T942-Y944 HydrophobicContact CG2-CD2 4.03Å; T942-Y944 HydrophobicContact CG2-CE2 3.52Å
943	G	90.1	Very high	88.1	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	142.5	167.3	0	0	0	0	0	112.3	L962 C965	G943-L962 WeakPolarHBondContact O-CB 3.36Å; G943-L962 PolarHBondContact O-N 3.4Å; G943-C965 PolarHBondContact N-O 2.95Å
944	Y	91.5	Very high	87.8	Confident	22 Å²	22	34.5 Å²	34.5	9%	0.086	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	146.8	170.2	-84.2	-103.1	0	0	0	110.4	T908 I912 C936 A937 T942 V960 P961	T908-Y944 HydrophobicContact CG2-CD1 4.39Å; T908-Y944 HydrophobicContact CG2-CE1 3.82Å; T908-Y944 WeakPolarHBondContact OG1-CD1 3.49Å; T908-Y944 WeakPolarHBondContact OG1-CE1 3.47Å; I912-Y944 HydrophobicContact CD1-CD2 3.59Å; I912-Y944 HydrophobicContact CD1-CE2 3.31Å; I912-Y944 HydrophobicContact CD1-CG 4.34Å; I912-Y944 HydrophobicContact CG1-CE2 4.48Å; C936-Y944 WeakPolarHBondContact CA-O 3.29Å; A937-Y944 PolarHBondContact N-O 3.08Å; A937-Y944 PolarHBondContact O-N 2.92Å; T942-Y944 HydrophobicContact CG2-CD2 4.03Å; T942-Y944 HydrophobicContact CG2-CE2 3.52Å; Y944-V960 CarbonylContact C-O 3.54Å; Y944-V960 WeakPolarHBondContact CA-O 3.5Å; Y944-V960 WeakPolarHBondContact CD1-O 3.46Å; Y944-P961 HydrophobicContact CD1-CB 4.24Å; Y944-P961 HydrophobicContact CE1-CB 3.77Å; Y944-P961 HydrophobicContact CE1-CG 4.19Å; Y944-P961 HydrophobicContact CE2-CB 4.14Å
945	V	92.2	Very high	87.6	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	127.5	176.2	-172.9	0	0	0	0	110.1	W934 F958 V960 L962 L1253 L1269	W934-V945 HydrophobicContact CD2-CG1 4.4Å; W934-V945 HydrophobicContact CE3-CG1 3.59Å; W934-V945 HydrophobicContact CZ3-CG1 3.96Å; V945-F958 HydrophobicContact CG1-CE2 4.26Å; V945-V960 PolarHBondContact N-O 2.75Å; V945-V960 PolarHBondContact O-N 3.37Å; V945-L962 HydrophobicContact CG2-CB 4.29Å; V945-L962 HydrophobicContact CG2-CD1 3.99Å; V945-L962 HydrophobicContact CG2-CD2 4.08Å; V945-L962 HydrophobicContact CG2-CG 4.36Å; V945-L1253 HydrophobicContact CG2-CD2 3.67Å; V945-L1269 HydrophobicContact CB-CD1 3.89Å; V945-L1269 HydrophobicContact CG1-CD1 3.84Å; V945-L1269 HydrophobicContact CG2-CD1 4.44Å
946	C	91.7	Very high	87.3	Confident	3 Å²	3	41.5 Å²	41.5	2%	0.02	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	140.3	178.6	176.7	0	0	0	0	110	I905 I935 F958 N959	I905-C946 HydrophobicContact CD1-CB 4.48Å; I905-C946 HydrophobicContact CG2-CB 4.48Å; I935-C946 HydrophobicContact CB-CB 4.26Å; I935-C946 PolarHBondContact N-O 3.28Å; I935-C946 PolarHBondContact O-N 2.96Å; C946-F958 CarbonylContact C-O 3.6Å; C946-F958 WeakPolarHBondContact CA-O 3.43Å; C946-N959 HydrophobicContact CB-CB 4.2Å
947	L	91.7	Very high	86.8	Confident	13 Å²	13	47.3 Å²	47.3	7%	0.068	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	111.8	173.8	-179.4	58	0	0	0	109.6	I920 D932 W934 I956 Y957 F958	I920-L947 HydrophobicContact CD1-CD1 4.46Å; D932-L947 HydrophobicContact CB-CD1 4.07Å; W934-L947 HydrophobicContact CG-CD1 4.32Å; L947-I956 WeakPolarHBondContact O-CA 3.49Å; L947-Y957 HydrophobicContact CD2-CD1 4.01Å; L947-Y957 HydrophobicContact CD2-CG 4.46Å; L947-Y957 PolarHBondContact O-N 2.92Å; L947-F958 HydrophobicContact CB-CD1 4.13Å; L947-F958 HydrophobicContact CB-CD2 3.97Å; L947-F958 HydrophobicContact CB-CE1 3.82Å; L947-F958 HydrophobicContact CB-CE2 3.66Å; L947-F958 HydrophobicContact CB-CG 4.19Å; L947-F958 HydrophobicContact CB-CZ 3.57Å; L947-F958 HydrophobicContact CD2-CD1 4.34Å; L947-F958 HydrophobicContact CD2-CE1 3.7Å; L947-F958 HydrophobicContact CD2-CZ 4.02Å; L947-F958 HydrophobicContact CG-CE1 4.43Å; L947-F958 HydrophobicContact CG-CZ 4.41Å; L947-F958 PolarHBondContact N-O 3.01Å
948	L	91.2	Very high	86.5	Confident	1 Å²	1	47.1 Å²	47.1	1%	0.005	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	110.2	176.7	176.8	65.8	0	0	0	109.5	V903 V933 I935 V950 I956 V1627	V903-L948 HydrophobicContact CG1-CD1 4.25Å; V933-L948 PolarHBondContact N-O 3.42Å; V933-L948 PolarHBondContact O-N 3.17Å; I935-L948 HydrophobicContact CD1-CB 3.89Å; I935-L948 HydrophobicContact CD1-CD2 3.92Å; L948-V950 HydrophobicContact CD2-CG2 4.11Å; L948-V950 HydrophobicContact CG-CG2 3.95Å; L948-I956 HydrophobicContact CD1-CG1 4.27Å; L948-V1627 HydrophobicContact CD2-CG1 3.86Å
949	T	88.5	Confident	86.4	Confident	27 Å²	27	48.5 Å²	48.5	17%	0.166	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	121.2	167.8	-61.8	0	0	0	0	108.1	P930 D932 H951 P954 N955	P930-T949 HydrophobicContact CB-CG2 3.85Å; D932-T949 WeakPolarHBondContact OD1-CA 3.31Å; D932-T949 VanDerWaalsContact OD1-CB 3.22Å; D932-T949 WeakPolarHBondContact OD1-CB 3.37Å; D932-T949 WeakPolarHBondContact OD1-CG2 3.46Å; D932-T949 PolarHBondContact OD1-OG1 3Å; T949-H951 VanDerWaalsContact CG2-O 3.23Å; T949-H951 WeakPolarHBondContact CG2-O 3.48Å; T949-P954 CarbonylContact O-C 3.5Å; T949-P954 VanDerWaalsContact O-CA 3.27Å; T949-P954 WeakPolarHBondContact O-CA 3.49Å; T949-N955 PolarHBondContact N-O 3.38Å; T949-N955 PolarHBondContact O-N 3.43Å
950	V	84.2	Confident	86.4	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	24%	0.237	C	C	.	.			trans	-95.8	-18.1	-173.8	-177.6	0	0	0	0	112.8	C931 V933 L948 K953 L1497 K1588 I1590 I1629	C931-V950 HydrophobicContact CB-CB 4.42Å; C931-V950 PolarHBondContact O-N 2.99Å; V933-V950 HydrophobicContact CG2-CG2 4.23Å; L948-V950 HydrophobicContact CD2-CG2 4.11Å; L948-V950 HydrophobicContact CG-CG2 3.95Å; V950-K953 CarbonylContact O-C 3.57Å; V950-L1497 HydrophobicContact CB-CD1 4.05Å; V950-L1497 HydrophobicContact CG1-CD1 3.98Å; V950-L1497 HydrophobicContact CG2-CD1 4.13Å; V950-K1588 HydrophobicContact CG1-CD 3.75Å; V950-I1590 HydrophobicContact CG2-CD1 3.86Å; V950-I1629 HydrophobicContact CG1-CD1 4.35Å; V950-I1629 HydrophobicContact CG1-CG2 4.43Å
951	H	74.3	Confident	86.6	Confident	21 Å²	21	49.7 Å²	49.7	10%	0.097	25%	0.25	C	C	.	.	S	Bend	trans	-131.5	137.6	-178.5	-82	-84.9	0	0	0	111.8	C931 T949 I1500 K1588	C931-H951 HydrophobicContact CB-CB 4.38Å; T949-H951 VanDerWaalsContact CG2-O 3.23Å; T949-H951 WeakPolarHBondContact CG2-O 3.48Å; H951-I1500 WeakPolarHBondContact CE1-CG2 3.38Å; H951-I1500 WeakPolarHBondContact NE2-CD1 3.26Å; H951-I1500 WeakPolarHBondContact NE2-CG1 3.45Å; H951-K1588 PolarHBondContact CE1-NZ 3.49Å; H951-K1588 WeakPolarHBondContact NE2-CE 3.31Å; H951-K1588 PolarHBondContact NE2-NZ 2.73Å
952	P	68.4	Low	86.6	Confident	128 Å²	128	41.4 Å²	41.4	83%	0.831	22%	0.218	S	C	*	.	S	Bend	cis	-76.7	-19.6	8	30.5	-36.6	0	0	0	115.1
953	K	78.7	Confident	86.4	Confident	167 Å²	167	44.2 Å²	44.2	73%	0.726	24%	0.24	S	C	*	.	S	Bend	trans	-135.4	155.8	169.3	-74.2	-167.4	175.5	-168.5	0	110.1	V950 N955	V950-K953 CarbonylContact O-C 3.57Å; K953-N955 PolarHBondContact O-N 2.83Å
954	P	85.7	Confident	86.1	Confident	29 Å²	29	46.5 Å²	46.5	19%	0.188	26%	0.264	C	S	.	.			trans	-59.2	126.8	171.4	-22.9	35.7	0	0	0	112.1	E901 V903 T949 I1629	E901-P954 WeakPolarHBondContact OE2-CG 3.42Å; V903-P954 HydrophobicContact CG2-CB 3.63Å; T949-P954 CarbonylContact O-C 3.5Å; T949-P954 VanDerWaalsContact O-CA 3.27Å; T949-P954 WeakPolarHBondContact O-CA 3.49Å; P954-I1629 HydrophobicContact CB-CD1 3.72Å; P954-I1629 HydrophobicContact CG-CD1 3.53Å
955	N	88.3	Confident	85.9	Confident	105 Å²	105	45.7 Å²	45.7	56%	0.561	26%	0.261	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-153.2	141.7	177.2	-170.9	15.1	0	0	0	111.4	T949 K953	T949-N955 PolarHBondContact N-O 3.38Å; T949-N955 PolarHBondContact O-N 3.43Å; K953-N955 PolarHBondContact O-N 2.83Å
956	I	88.5	Confident	85.6	Confident	44 Å²	44	50.5 Å²	50.5	23%	0.226	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	107.8	176.4	-64.6	172.1	0	0	0	109	V903 Q904 I905 L947 L948 F958 N959	V903-I956 HydrophobicContact CG1-CD1 3.98Å; V903-I956 HydrophobicContact CG1-CG1 4.17Å; Q904-I956 WeakPolarHBondContact O-CD1 3.3Å; I905-I956 HydrophobicContact CB-CD1 4.45Å; I905-I956 HydrophobicContact CG1-CD1 3.87Å; L947-I956 WeakPolarHBondContact O-CA 3.49Å; L948-I956 HydrophobicContact CD1-CG1 4.27Å; I956-F958 WeakPolarHBondContact CG2-O 3.37Å; I956-N959 HydrophobicContact CG2-CB 4.33Å
957	Y	85.2	Confident	85.6	Confident	122 Å²	122	50.9 Å²	50.9	48%	0.478	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	-37.9	-179.1	-171.3	-102.8	0	0	0	112.1	L947 N1268 K1270	L947-Y957 HydrophobicContact CD2-CD1 4.01Å; L947-Y957 HydrophobicContact CD2-CG 4.46Å; L947-Y957 PolarHBondContact O-N 2.92Å; Y957-N1268 HydrophobicContact CE1-CB 4.5Å; Y957-K1270 PolarHBondContact O-NZ 3.1Å
958	F	88.2	Confident	85.6	Confident	2 Å²	2	52.5 Å²	52.5	1%	0.009	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	156.4	165.7	58.5	-114.1	0	0	0	111.4	W934 V945 C946 L947 I956 V960 L1269 K1270	W934-F958 HydrophobicContact CZ2-CZ 4.49Å; V945-F958 HydrophobicContact CG1-CE2 4.26Å; C946-F958 CarbonylContact C-O 3.6Å; C946-F958 WeakPolarHBondContact CA-O 3.43Å; L947-F958 HydrophobicContact CB-CD1 4.13Å; L947-F958 HydrophobicContact CB-CD2 3.97Å; L947-F958 HydrophobicContact CB-CE1 3.82Å; L947-F958 HydrophobicContact CB-CE2 3.66Å; L947-F958 HydrophobicContact CB-CG 4.19Å; L947-F958 HydrophobicContact CB-CZ 3.57Å; L947-F958 HydrophobicContact CD2-CD1 4.34Å; L947-F958 HydrophobicContact CD2-CE1 3.7Å; L947-F958 HydrophobicContact CD2-CZ 4.02Å; L947-F958 HydrophobicContact CG-CE1 4.43Å; L947-F958 HydrophobicContact CG-CZ 4.41Å; L947-F958 PolarHBondContact N-O 3.01Å; I956-F958 WeakPolarHBondContact CG2-O 3.37Å; F958-V960 HydrophobicContact CB-CG1 4.35Å; F958-V960 HydrophobicContact CD2-CG2 3.98Å; F958-V960 HydrophobicContact CE2-CG2 4.43Å; F958-L1269 HydrophobicContact CD2-CB 4.48Å; F958-L1269 HydrophobicContact CE1-CB 4.27Å; F958-L1269 HydrophobicContact CE1-CG 4.24Å; F958-L1269 HydrophobicContact CE2-CB 4.07Å; F958-L1269 HydrophobicContact CE2-CD1 3.75Å; F958-L1269 HydrophobicContact CE2-CG 3.96Å; F958-L1269 HydrophobicContact CZ-CB 3.95Å; F958-L1269 HydrophobicContact CZ-CD1 3.83Å; F958-L1269 HydrophobicContact CZ-CG 3.62Å; F958-K1270 HydrophobicContact CB-CD 3.89Å; F958-K1270 VanDerWaalsContact CB-CE 3.47Å; F958-K1270 HydrophobicContact CB-CG 3.98Å
959	N	88.6	Confident	85.8	Confident	37 Å²	37	52.5 Å²	52.5	20%	0.198	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	113.9	160.7	179	17.6	0	0	0	105.5	P906 C946 I956	P906-N959 PolarHBondContact O-ND2 3.41Å; C946-N959 HydrophobicContact CB-CB 4.2Å; I956-N959 HydrophobicContact CG2-CB 4.33Å
960	V	89.5	Confident	86.1	Confident	21 Å²	21	53.5 Å²	53.5	13%	0.127	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	148.9	-169.8	-69.1	0	0	0	0	112.6	Y944 V945 F958 L1269 K1270	Y944-V960 CarbonylContact C-O 3.54Å; Y944-V960 WeakPolarHBondContact CA-O 3.5Å; Y944-V960 WeakPolarHBondContact CD1-O 3.46Å; V945-V960 PolarHBondContact N-O 2.75Å; V945-V960 PolarHBondContact O-N 3.37Å; F958-V960 HydrophobicContact CB-CG1 4.35Å; F958-V960 HydrophobicContact CD2-CG2 3.98Å; F958-V960 HydrophobicContact CE2-CG2 4.43Å; V960-L1269 HydrophobicContact CG2-CB 3.69Å; V960-L1269 HydrophobicContact CG2-CD1 4.44Å; V960-K1270 HydrophobicContact CG1-CG 3.69Å
961	P	88	Confident	86.6	Confident	70 Å²	70	54 Å²	54	46%	0.455	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	139.2	172.4	27.9	-33.4	0	0	0	111	Y944 S963	Y944-P961 HydrophobicContact CD1-CB 4.24Å; Y944-P961 HydrophobicContact CE1-CB 3.77Å; Y944-P961 HydrophobicContact CE1-CG 4.19Å; Y944-P961 HydrophobicContact CE2-CB 4.14Å; P961-S963 PolarHBondContact O-N 3.17Å
962	L	87.8	Confident	87.7	Confident	13 Å²	13	53.8 Å²	53.8	7%	0.068	31%	0.307	C	S	.	.			trans	-85.8	95.8	-179.9	-170.8	61.1	0	0	0	109.6	G943 V945 G964 C965 I969 L1253 F1261 F1263	G943-L962 WeakPolarHBondContact O-CB 3.36Å; G943-L962 PolarHBondContact O-N 3.4Å; V945-L962 HydrophobicContact CG2-CB 4.29Å; V945-L962 HydrophobicContact CG2-CD1 3.99Å; V945-L962 HydrophobicContact CG2-CD2 4.08Å; V945-L962 HydrophobicContact CG2-CG 4.36Å; L962-G964 PolarHBondContact O-N 2.99Å; L962-C965 HydrophobicContact CB-CB 3.82Å; L962-C965 HydrophobicContact CD2-CB 3.71Å; L962-C965 HydrophobicContact CG-CB 3.73Å; L962-C965 VanDerWaalsContact O-CB 3.25Å; L962-C965 WeakPolarHBondContact O-CB 3.33Å; L962-C965 PolarHBondContact O-N 3Å; L962-I969 HydrophobicContact CD2-CD1 3.85Å; L962-L1253 HydrophobicContact CD2-CD2 3.94Å; L962-F1261 HydrophobicContact CD2-CD1 4.44Å; L962-F1261 HydrophobicContact CD2-CG 4.37Å; L962-F1261 HydrophobicContact CG-CD1 4.43Å; L962-F1263 HydrophobicContact CD1-CE1 4.47Å; L962-F1263 HydrophobicContact CD1-CE2 3.78Å; L962-F1263 HydrophobicContact CD1-CZ 3.45Å; L962-F1263 VanDerWaalsContact CD1-CZ 3.45Å
963	S	82.9	Confident	88.9	Confident	103 Å²	103	48.4 Å²	48.4	72%	0.72	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.6	123.1	-175.5	-49.5	0	0	0	0	112.3	P961	P961-S963 PolarHBondContact O-N 3.17Å
964	G	82.3	Confident	89.5	Confident	49 Å²	49	41.1 Å²	41.1	51%	0.505	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	80.4	11.7	-179.3	0	0	0	0	0	115.5	L962 F1261 K1277	L962-G964 PolarHBondContact O-N 2.99Å; G964-F1261 VanDerWaalsContact O-CZ 3.28Å; G964-F1261 WeakPolarHBondContact O-CZ 3.29Å; G964-K1277 PolarHBondContact O-NZ 3.41Å
965	C	87.2	Confident	89.6	Confident	5 Å²	5	39.8 Å²	39.8	3%	0.034	24%	0.235	C	C	.	.			trans	-95.9	85.2	169.3	-171.7	0	0	0	0	110.5	G943 L962 S967 F1261	G943-C965 PolarHBondContact N-O 2.95Å; L962-C965 HydrophobicContact CB-CB 3.82Å; L962-C965 HydrophobicContact CD2-CB 3.71Å; L962-C965 HydrophobicContact CG-CB 3.73Å; L962-C965 VanDerWaalsContact O-CB 3.25Å; L962-C965 WeakPolarHBondContact O-CB 3.33Å; L962-C965 PolarHBondContact O-N 3Å; C965-S967 PolarHBondContact O-N 2.55Å; C965-S967 PolarHBondContact SG-O 3.08Å; C965-F1261 HydrophobicContact CB-CE1 4.16Å; C965-F1261 HydrophobicContact CB-CE2 4.29Å; C965-F1261 HydrophobicContact CB-CZ 3.83Å
966	T	86.9	Confident	89.3	Confident	101 Å²	101	35.9 Å²	35.9	62%	0.62	22%	0.215	S	C	*	.			trans	-82.9	20.9	-177.5	30.1	0	0	0	0	114.1	Y941 E1257	Y941-T966 CarbonylContact O-C 3.59Å; Y941-T966 WeakPolarHBondContact O-CA 3.43Å; T966-E1257 PolarHBondContact OG1-OE2 2.73Å
967	S	91.3	Very high	88.8	Confident	11 Å²	11	34.7 Å²	34.7	8%	0.077	21%	0.213	C	C	.	.	S	Bend	trans	-158.5	159.8	-162.4	-174.1	0	0	0	0	111.6	G940 C965 I969 E1256 E1257	G940-S967 CarbonylContact O-C 3.47Å; G940-S967 WeakPolarHBondContact O-CA 3.46Å; C965-S967 PolarHBondContact O-N 2.55Å; C965-S967 PolarHBondContact SG-O 3.08Å; S967-I969 PolarHBondContact O-N 3.36Å; S967-E1256 WeakPolarHBondContact OG-CB 3.22Å; S967-E1257 WeakPolarHBondContact CB-OE2 3.36Å; S967-E1257 PolarHBondContact OG-N 3.48Å
968	R	92.1	Very high	88.3	Confident	46 Å²	46	32 Å²	32	17%	0.174	20%	0.203	C	C	.	.			trans	-56	130.7	174.4	-172.8	-173.1	-65.9	-100.1	-5.7	111.6	D315 G940 T970 T1255 E1256	D315-R968 VanDerWaalsContact CG-NH1 3.3Å; D315-R968 IonicContact OD1-CZ 2.91Å; D315-R968 VanDerWaalsContact OD1-CZ 3.24Å; D315-R968 IonicContact OD1-NH1 2.68Å; D315-R968 PolarHBondContact OD1-NH1 2.79Å; D315-R968 IonicContact OD1-NH2 2.72Å; D315-R968 PolarHBondContact OD1-NH2 2.87Å; D315-R968 IonicContact OD2-NH1 3.72Å; D315-R968 PolarHBondContact OD2-NH1 3.45Å; G940-R968 PolarHBondContact O-N 3.22Å; R968-T970 PolarHBondContact O-N 3.33Å; R968-T1255 VanDerWaalsContact O-CA 3.27Å; R968-T1255 WeakPolarHBondContact O-CA 3.42Å; R968-T1255 WeakPolarHBondContact O-CB 3.49Å; R968-E1256 HydrophobicContact CB-CB 4.02Å; R968-E1256 WeakPolarHBondContact CB-OE2 3.41Å; R968-E1256 VanDerWaalsContact CD-OE2 3.28Å; R968-E1256 WeakPolarHBondContact CD-OE2 3.3Å; R968-E1256 IonicContact NE-OE1 3.71Å; R968-E1256 IonicContact NE-OE2 3.74Å; R968-E1256 PolarHBondContact NE-OE2 3.41Å; R968-E1256 PolarHBondContact O-N 2.7Å
969	I	95	Very high	87.3	Confident	1 Å²	1	35.6 Å²	35.6	1%	0.005	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	111.1	172.2	-56.5	171.2	0	0	0	108.3	S915 C936 L962 S967 L1253 T1255	S915-I969 VanDerWaalsContact CB-O 3.3Å; S915-I969 WeakPolarHBondContact CB-O 3.44Å; S915-I969 PolarHBondContact OG-O 2.9Å; C936-I969 HydrophobicContact CB-CB 4.27Å; C936-I969 HydrophobicContact CB-CD1 4.05Å; C936-I969 HydrophobicContact CB-CG2 3.89Å; L962-I969 HydrophobicContact CD2-CD1 3.85Å; S967-I969 PolarHBondContact O-N 3.36Å; I969-L1253 HydrophobicContact CD1-CD2 4.49Å; I969-L1253 HydrophobicContact CG2-CB 4.46Å; I969-T1255 HydrophobicContact CG1-CG2 4.41Å
970	T	94.6	Very high	85.8	Confident	48 Å²	48	39 Å²	39	29%	0.294	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	-32.9	-172.1	57.8	0	0	0	0	113.2	R968 G1254 E1256 I1284	R968-T970 PolarHBondContact O-N 3.33Å; T970-G1254 PolarHBondContact N-O 2.87Å; T970-G1254 PolarHBondContact OG1-O 2.84Å; T970-E1256 HydrophobicContact CG2-CB 3.98Å; T970-I1284 VanDerWaalsContact CB-O 3.31Å; T970-I1284 WeakPolarHBondContact CB-O 3.33Å; T970-I1284 PolarHBondContact OG1-O 2.85Å
971	C	95.8	Very high	84	Confident	10 Å²	10	41.1 Å²	41.1	7%	0.068	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.3	156	-178.4	57.5	0	0	0	0	112.6	L1253 G1254	C971-L1253 CarbonylContact O-C 3.47Å; C971-L1253 WeakPolarHBondContact O-CA 3.34Å; C971-G1254 PolarHBondContact O-N 3.49Å
972	I	95.9	Very high	81.7	Confident	18 Å²	18	40.5 Å²	40.5	9%	0.092	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	137.9	172.8	-179	170.2	0	0	0	109.5	C916 W934 M1251 W1252 L1253	C916-I972 HydrophobicContact CB-CG2 4.14Å; W934-I972 HydrophobicContact CB-CD1 3.66Å; W934-I972 HydrophobicContact CE3-CD1 4.15Å; W934-I972 HydrophobicContact CG-CD1 4.44Å; I972-M1251 HydrophobicContact CD1-CE 3.71Å; I972-M1251 HydrophobicContact CG1-CE 3.87Å; I972-W1252 CarbonylContact C-O 3.58Å; I972-W1252 WeakPolarHBondContact CA-O 3.47Å; I972-L1253 HydrophobicContact CB-CG 4.25Å; I972-L1253 HydrophobicContact CD1-CD1 3.89Å; I972-L1253 HydrophobicContact CD1-CD2 4.38Å; I972-L1253 HydrophobicContact CD1-CG 3.87Å; I972-L1253 HydrophobicContact CG1-CD1 4.05Å; I972-L1253 HydrophobicContact CG1-CG 3.93Å
973	C	94.5	Very high	79.5	Confident	14 Å²	14	45.6 Å²	45.6	10%	0.095	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	125	-179.1	-165.9	0	0	0	0	110.5	W1252 I1287	C973-W1252 PolarHBondContact N-O 3.32Å; C973-W1252 PolarHBondContact O-N 3.09Å; C973-I1287 HydrophobicContact CB-CB 4.01Å; C973-I1287 HydrophobicContact CB-CG2 3.67Å
974	A	91.1	Very high	77.4	Confident	14 Å²	14	46.3 Å²	46.3	12%	0.116	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	132.5	168.1	0	0	0	0	0	110.5	S918 M919 M1251	S918-A974 PolarHBondContact OG-N 3.08Å; M919-A974 WeakPolarHBondContact O-CB 3.36Å; A974-M1251 HydrophobicContact CB-CE 3.86Å; A974-M1251 HydrophobicContact CB-SD 3.73Å
975	I	88.8	Confident	75.1	Confident	1 Å²	1	55.5 Å²	55.5	1%	0.005	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	115.4	-176.6	-73.2	145.8	0	0	0	108.7	P1249 L1250 W1252 H1289 I1294 W1314	I975-P1249 CarbonylContact O-C 3.58Å; I975-P1249 WeakPolarHBondContact O-CA 3.27Å; I975-L1250 HydrophobicContact CB-CB 4.22Å; I975-L1250 HydrophobicContact CG2-CB 4.44Å; I975-L1250 PolarHBondContact N-O 2.82Å; I975-L1250 PolarHBondContact O-N 2.92Å; I975-W1252 HydrophobicContact CD1-CB 3.8Å; I975-W1252 HydrophobicContact CD1-CD2 3.68Å; I975-W1252 HydrophobicContact CD1-CE3 4.48Å; I975-W1252 HydrophobicContact CD1-CG 3.32Å; I975-H1289 HydrophobicContact CG1-CB 3.91Å; I975-I1294 HydrophobicContact CD1-CD1 3.52Å; I975-I1294 HydrophobicContact CD1-CG1 4.02Å; I975-I1294 HydrophobicContact CG1-CD1 4.03Å; I975-I1294 HydrophobicContact CG1-CG1 4.15Å; I975-I1294 HydrophobicContact CG2-CD1 4.25Å; I975-W1314 HydrophobicContact CG2-CZ2 3.54Å
976	P	82.1	Confident	72.7	Confident	24 Å²	24	61.3 Å²	61.3	16%	0.156	33%	0.325	C	S	.	.	P	Polyproline II helix	trans	-59.6	149.6	179.2	-28.1	37	0	0	0	114.8	E921 R1308	E921-P976 HydrophobicContact CB-CG 4.19Å; E921-P976 HydrophobicContact CG-CG 4.3Å; E921-P976 VanDerWaalsContact OE2-CG 3.31Å; E921-P976 WeakPolarHBondContact OE2-CG 3.39Å; P976-R1308 PolarHBondContact O-NH2 2.97Å
977	G	77.6	Confident	70	Confident	18 Å²	18	57.5 Å²	57.5	19%	0.186	30%	0.303	C	S	.	.	P	Polyproline II helix	trans	-68.1	160.8	169.3	0	0	0	0	0	112.6	I979 T1247	G977-I979 PolarHBondContact O-N 3.44Å; G977-T1247 WeakPolarHBondContact CA-O 3.49Å
978	Y	74.2	Confident	67.3	Low	67 Å²	67	61.6 Å²	61.6	26%	0.263	32%	0.32	S	S	.	.	P	Polyproline II helix	trans	-68.7	131.6	-178.8	-164.3	-129.9	0	0	0	112.2	H980 P981 S1246 R1308	Y978-H980 HydrophobicContact CD1-CB 4.48Å; Y978-H980 HydrophobicContact CE1-CB 4.04Å; Y978-H980 AromaticContact CE1-CD2 3.99Å; Y978-P981 WeakPolarHBondContact OH-CD 3.25Å; Y978-S1246 WeakPolarHBondContact CB-O 3.26Å; Y978-S1246 PolarHBondContact N-O 2.85Å; Y978-R1308 VanDerWaalsContact CB-NH1 3.35Å
979	I	66.2	Low	64.3	Low	76 Å²	76	63 Å²	63	39%	0.39	34%	0.337	S	S	.	.			trans	-118.7	102.3	167.9	-56.4	179.3	0	0	0	107.6	G977 I991	G977-I979 PolarHBondContact O-N 3.44Å; I979-I991 HydrophobicContact CD1-CD1 3.5Å; I979-I991 VanDerWaalsContact CD1-CD1 3.5Å
980	H	58.1	Low	61.2	Low	108 Å²	108	65.8 Å²	65.8	50%	0.5	35%	0.352	S	S	.	.			trans	-55.5	133.7	-175.8	-177.7	-107.4	0	0	0	111.6	Y978 G982 L983	Y978-H980 HydrophobicContact CD1-CB 4.48Å; Y978-H980 HydrophobicContact CE1-CB 4.04Å; Y978-H980 AromaticContact CE1-CD2 3.99Å; H980-G982 PolarHBondContact ND1-N 2.97Å; H980-G982 PolarHBondContact O-N 2.73Å; H980-L983 HydrophobicContact CB-CD1 4.41Å; H980-L983 PolarHBondContact O-N 3.31Å
981	P	52	Low	58.1	Low	67 Å²	67	65.4 Å²	65.4	44%	0.435	35%	0.347	S	S	.	.	G	3₁₀ helix	trans	-52.9	-30	-172.8	-31.1	36.6	0	0	0	115.5	Y978 L983 R984	Y978-P981 WeakPolarHBondContact OH-CD 3.25Å; P981-L983 VanDerWaalsContact C-N 3.3Å; P981-L983 PolarHBondContact O-N 3.19Å; P981-R984 VanDerWaalsContact O-CB 3.29Å; P981-R984 WeakPolarHBondContact O-CB 3.5Å; P981-R984 WeakPolarHBondContact O-CG 3.35Å; P981-R984 PolarHBondContact O-N 3.21Å
982	G	39.2	Very low	54.9	Low	57 Å²	57	66.2 Å²	66.2	59%	0.588	36%	0.355	S	S	*	.	G	3₁₀ helix	trans	-62.1	-28.5	177.6	0	0	0	0	0	115.1	H980 R984	H980-G982 PolarHBondContact ND1-N 2.97Å; H980-G982 PolarHBondContact O-N 2.73Å; G982-R984 VanDerWaalsContact C-N 3.33Å; G982-R984 PolarHBondContact O-N 2.81Å
983	L	41.8	Very low	51.7	Low	120 Å²	120	70 Å²	70	63%	0.628	37%	0.372	S	S	*	.	G	3₁₀ helix	trans	-86.4	0.4	-179.1	-79.2	83	0	0	0	113.5	H980 P981 R985	H980-L983 HydrophobicContact CB-CD1 4.41Å; H980-L983 PolarHBondContact O-N 3.31Å; P981-L983 VanDerWaalsContact C-N 3.3Å; P981-L983 PolarHBondContact O-N 3.19Å; L983-R985 PolarHBondContact O-N 2.9Å
984	R	39.6	Very low	48.7	Very low	118 Å²	118	70.3 Å²	70.3	45%	0.445	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	2.1	-172.3	-75.8	-177.4	171.9	-161.9	-4.6	116.3	P981 G982 H988	P981-R984 VanDerWaalsContact O-CB 3.29Å; P981-R984 WeakPolarHBondContact O-CB 3.5Å; P981-R984 WeakPolarHBondContact O-CG 3.35Å; P981-R984 PolarHBondContact O-N 3.21Å; G982-R984 VanDerWaalsContact C-N 3.33Å; G982-R984 PolarHBondContact O-N 2.81Å; R984-H988 VanDerWaalsContact CB-CD2 3.46Å; R984-H988 WeakPolarHBondContact CB-CD2 3.46Å; R984-H988 WeakPolarHBondContact CD-NE2 3.29Å; R984-H988 WeakPolarHBondContact CG-NE2 3.27Å; R984-H988 WeakPolarHBondContact O-CB 3.47Å; R984-H988 PolarHBondContact O-CD2 3.47Å
985	R	34	Very low	45.9	Very low	241 Å²	241	73 Å²	73	91%	0.909	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.2	-14.9	-173.9	-70.2	-169.8	178.2	-170.9	1	116	L983	L983-R985 PolarHBondContact O-N 2.9Å
986	T	35.7	Very low	43.4	Very low	127 Å²	127	79.9 Å²	79.9	78%	0.779	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-123.9	-39.7	-178.6	51.3	0	0	0	0	114.1	H988	T986-H988 VanDerWaalsContact C-N 3.27Å; T986-H988 PolarHBondContact O-N 3.43Å
987	S	30.6	Very low	41.2	Very low	22 Å²	22	81.4 Å²	81.4	15%	0.154	42%	0.423	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-16.8	-178.6	54.3	0	0	0	0	114.9	S989 L990	S987-S989 PolarHBondContact O-N 3.16Å; S987-S989 VanDerWaalsContact O-N 3.13Å; S987-L990 PolarHBondContact O-N 2.85Å
988	H	33.7	Very low	39.4	Very low	97 Å²	97	83.7 Å²	83.7	45%	0.449	43%	0.426	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-10.8	-169.9	-112.6	-90.9	0	0	0	116	R984 T986 A992	R984-H988 VanDerWaalsContact CB-CD2 3.46Å; R984-H988 WeakPolarHBondContact CB-CD2 3.46Å; R984-H988 WeakPolarHBondContact CD-NE2 3.29Å; R984-H988 WeakPolarHBondContact CG-NE2 3.27Å; R984-H988 WeakPolarHBondContact O-CB 3.47Å; R984-H988 PolarHBondContact O-CD2 3.47Å; T986-H988 VanDerWaalsContact C-N 3.27Å; T986-H988 PolarHBondContact O-N 3.43Å; H988-A992 WeakPolarHBondContact O-CB 3.28Å
989	S	28.9	Very low	37.9	Very low	75 Å²	75	82.8 Å²	82.8	52%	0.524	42%	0.422	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-53.4	176.3	-166.2	0	0	0	0	111.4	S987 Q993	S987-S989 PolarHBondContact O-N 3.16Å; S987-S989 VanDerWaalsContact O-N 3.13Å; S989-Q993 VanDerWaalsContact O-CG 3.25Å; S989-Q993 WeakPolarHBondContact O-CG 3.42Å; S989-Q993 PolarHBondContact O-N 3.27Å
990	L	29.9	Very low	36.5	Very low	60 Å²	60	80.2 Å²	80.2	31%	0.314	41%	0.414	S	S	.	.	H	α-helix	trans	-80.2	-44.6	-169.4	-65.6	167	0	0	0	112.6	P924 L925 S987 A992 Q993 S994	P924-L990 HydrophobicContact CG-CB 4.3Å; L925-L990 HydrophobicContact CD2-CD1 4.17Å; S987-L990 PolarHBondContact O-N 2.85Å; L990-A992 VanDerWaalsContact C-N 3.31Å; L990-A992 PolarHBondContact O-N 2.99Å; L990-Q993 WeakPolarHBondContact O-CB 3.24Å; L990-Q993 PolarHBondContact O-N 2.95Å; L990-S994 PolarHBondContact O-N 3.4Å
991	I	31.1	Very low	35.3	Very low	39 Å²	39	77.5 Å²	77.5	20%	0.2	40%	0.403	C	S	.	.	H	α-helix	trans	-64	-40.2	178.8	-59.2	177	0	0	0	110.1	I979 Q993 S994 M995	I979-I991 HydrophobicContact CD1-CD1 3.5Å; I979-I991 VanDerWaalsContact CD1-CD1 3.5Å; I991-Q993 VanDerWaalsContact C-N 3.27Å; I991-Q993 PolarHBondContact O-N 2.97Å; I991-S994 PolarHBondContact O-N 3.04Å; I991-M995 HydrophobicContact CG2-CE 4.05Å; I991-M995 HydrophobicContact CG2-SD 4.28Å; I991-M995 WeakPolarHBondContact O-CB 3.49Å; I991-M995 WeakPolarHBondContact O-CG 3.44Å; I991-M995 PolarHBondContact O-N 3.29Å
992	A	28.3	Very low	34.3	Very low	27 Å²	27	82.2 Å²	82.2	22%	0.223	42%	0.419	C	S	.	.	H	α-helix	trans	-70.9	-19.7	174.6	0	0	0	0	0	113.5	H988 L990 R996	H988-A992 WeakPolarHBondContact O-CB 3.28Å; L990-A992 VanDerWaalsContact C-N 3.31Å; L990-A992 PolarHBondContact O-N 2.99Å; A992-R996 VanDerWaalsContact O-CB 3.25Å; A992-R996 WeakPolarHBondContact O-CB 3.37Å; A992-R996 VanDerWaalsContact O-CD 3.32Å; A992-R996 WeakPolarHBondContact O-CD 3.19Å; A992-R996 WeakPolarHBondContact O-CG 3.48Å; A992-R996 PolarHBondContact O-N 3.16Å; A992-R996 VanDerWaalsContact O-N 3.11Å
993	Q	28.2	Very low	33.8	Very low	98 Å²	98	88.5 Å²	88.5	46%	0.458	43%	0.43	S	S	.	.	H	α-helix	trans	-75.5	-47.4	171.2	-81.4	168.8	-13.6	0	0	111.4	S989 L990 I991 R996 S997	S989-Q993 VanDerWaalsContact O-CG 3.25Å; S989-Q993 WeakPolarHBondContact O-CG 3.42Å; S989-Q993 PolarHBondContact O-N 3.27Å; L990-Q993 WeakPolarHBondContact O-CB 3.24Å; L990-Q993 PolarHBondContact O-N 2.95Å; I991-Q993 VanDerWaalsContact C-N 3.27Å; I991-Q993 PolarHBondContact O-N 2.97Å; Q993-R996 WeakPolarHBondContact O-CB 3.19Å; Q993-R996 PolarHBondContact O-N 2.82Å; Q993-R996 VanDerWaalsContact O-N 3.14Å; Q993-S997 PolarHBondContact O-N 2.73Å
994	S	32.1	Very low	33.2	Very low	20 Å²	20	91.7 Å²	91.7	14%	0.14	44%	0.439	C	S	.	.	H	α-helix	trans	-64.6	-42.4	175.2	178	0	0	0	0	112	L990 I991 R996 S997 R998 D1498	L990-S994 PolarHBondContact O-N 3.4Å; I991-S994 PolarHBondContact O-N 3.04Å; S994-R996 VanDerWaalsContact C-N 3.27Å; S994-R996 PolarHBondContact O-N 3.39Å; S994-S997 VanDerWaalsContact O-CB 3.3Å; S994-S997 WeakPolarHBondContact O-CB 3.33Å; S994-S997 PolarHBondContact O-N 3.4Å; S994-S997 VanDerWaalsContact O-N 3.13Å; S994-R998 PolarHBondContact O-N 3.02Å; S994-R998 PolarHBondContact OG-NE 3.29Å; S994-R998 PolarHBondContact OG-NH2 3.42Å; S994-D1498 WeakPolarHBondContact CB-OD2 3.5Å; S994-D1498 PolarHBondContact OG-OD2 2.81Å
995	M	31.7	Very low	32.6	Very low	71 Å²	71	97.6 Å²	97.6	35%	0.35	46%	0.461	S	S	.	.	H	α-helix	trans	-64.2	-28.2	172.3	-71.8	-174.7	176.5	0	0	113.2	I991 Y999	I991-M995 HydrophobicContact CG2-CE 4.05Å; I991-M995 HydrophobicContact CG2-SD 4.28Å; I991-M995 WeakPolarHBondContact O-CB 3.49Å; I991-M995 WeakPolarHBondContact O-CG 3.44Å; I991-M995 PolarHBondContact O-N 3.29Å; M995-Y999 HydrophobicContact CB-CD2 4.24Å; M995-Y999 HydrophobicContact CG-CD2 4.49Å; M995-Y999 WeakPolarHBondContact O-CA 3.41Å; M995-Y999 VanDerWaalsContact O-CB 3.29Å; M995-Y999 WeakPolarHBondContact O-CB 3.47Å; M995-Y999 WeakPolarHBondContact O-CD2 3.37Å; M995-Y999 PolarHBondContact O-N 3.11Å
996	R	35.9	Very low	32.3	Very low	146 Å²	146	91.7 Å²	91.7	55%	0.551	46%	0.457	S	S	*	.	H	α-helix	trans	-74.1	-36.3	171	-82.6	171.1	-174.9	167.8	5.9	112.7	A992 Q993 S994 G1000 M1001	A992-R996 VanDerWaalsContact O-CB 3.25Å; A992-R996 WeakPolarHBondContact O-CB 3.37Å; A992-R996 VanDerWaalsContact O-CD 3.32Å; A992-R996 WeakPolarHBondContact O-CD 3.19Å; A992-R996 WeakPolarHBondContact O-CG 3.48Å; A992-R996 PolarHBondContact O-N 3.16Å; A992-R996 VanDerWaalsContact O-N 3.11Å; Q993-R996 WeakPolarHBondContact O-CB 3.19Å; Q993-R996 PolarHBondContact O-N 2.82Å; Q993-R996 VanDerWaalsContact O-N 3.14Å; S994-R996 VanDerWaalsContact C-N 3.27Å; S994-R996 PolarHBondContact O-N 3.39Å; R996-G1000 WeakPolarHBondContact O-CA 3.37Å; R996-G1000 PolarHBondContact O-N 2.93Å; R996-M1001 HydrophobicContact CG-CB 4.32Å
997	S	35.8	Very low	31.8	Very low	56 Å²	56	89.9 Å²	89.9	39%	0.392	46%	0.455	S	S	.	.	H	α-helix	trans	-58.1	-51.9	172.9	-170.1	0	0	0	0	110.2	Q993 S994 D1498 M1587	Q993-S997 PolarHBondContact O-N 2.73Å; S994-S997 VanDerWaalsContact O-CB 3.3Å; S994-S997 WeakPolarHBondContact O-CB 3.33Å; S994-S997 PolarHBondContact O-N 3.4Å; S994-S997 VanDerWaalsContact O-N 3.13Å; S997-D1498 WeakPolarHBondContact CB-OD1 3.35Å; S997-D1498 PolarHBondContact OG-OD1 3.15Å; S997-M1587 WeakPolarHBondContact OG-CE 3.35Å
998	R	40	Very low	31.6	Very low	65 Å²	65	94.8 Å²	94.8	25%	0.245	48%	0.484	C	S	.	.	H	α-helix	trans	-86.9	-16.7	-173.1	-67.3	-175.4	-78.5	128	4.9	115.5	E921 S994 D1498	E921-R998 VanDerWaalsContact CD-NH2 3.31Å; E921-R998 IonicContact OE1-CZ 3.75Å; E921-R998 VanDerWaalsContact OE1-CZ 3.27Å; E921-R998 IonicContact OE1-NH1 2.62Å; E921-R998 PolarHBondContact OE1-NH1 3.04Å; E921-R998 IonicContact OE1-NH2 2.8Å; E921-R998 PolarHBondContact OE1-NH2 3.27Å; E921-R998 IonicContact OE2-NH2 3.4Å; S994-R998 PolarHBondContact O-N 3.02Å; S994-R998 PolarHBondContact OG-NE 3.29Å; S994-R998 PolarHBondContact OG-NH2 3.42Å; R998-D1498 IonicContact NE-OD2 3.24Å; R998-D1498 PolarHBondContact NE-OD2 2.83Å
999	Y	43.8	Very low	31.2	Very low	48 Å²	48	98.5 Å²	98.5	19%	0.188	50%	0.503	C	S	.	.	H	α-helix	trans	-128.1	16.4	178.5	-53.7	-71.3	0	0	0	115.6	M995 M1001 V1339 Y1383	M995-Y999 HydrophobicContact CB-CD2 4.24Å; M995-Y999 HydrophobicContact CG-CD2 4.49Å; M995-Y999 WeakPolarHBondContact O-CA 3.41Å; M995-Y999 VanDerWaalsContact O-CB 3.29Å; M995-Y999 WeakPolarHBondContact O-CB 3.47Å; M995-Y999 WeakPolarHBondContact O-CD2 3.37Å; M995-Y999 PolarHBondContact O-N 3.11Å; Y999-M1001 VanDerWaalsContact C-N 3.27Å; Y999-M1001 WeakPolarHBondContact O-CE 3.34Å; Y999-M1001 WeakPolarHBondContact O-CG 3.24Å; Y999-M1001 PolarHBondContact O-N 2.82Å; Y999-V1339 HydrophobicContact CD1-CB 3.75Å; Y999-V1339 HydrophobicContact CD1-CG1 3.93Å; Y999-V1339 HydrophobicContact CD1-CG2 4.32Å; Y999-V1339 HydrophobicContact CE1-CB 3.94Å; Y999-V1339 HydrophobicContact CE1-CG1 4.43Å; Y999-V1339 HydrophobicContact CE1-CG2 4.02Å; Y999-V1339 HydrophobicContact CG-CG1 4.45Å; Y999-Y1383 WeakPolarHBondContact O-CE1 3.08Å
1000	G	36.6	Very low	31.3	Very low	22 Å²	22	102.3 Å²	102.3	23%	0.227	52%	0.518	C	S	.	.			trans	64.4	11.1	164.5	0	0	0	0	0	118.5	R996 E1002	R996-G1000 WeakPolarHBondContact O-CA 3.37Å; R996-G1000 PolarHBondContact O-N 2.93Å; G1000-E1002 PolarHBondContact O-N 2.82Å
1001	M	32.1	Very low	31.2	Very low	52 Å²	52	108.3 Å²	108.3	26%	0.256	54%	0.544	S	S	.	.			trans	-75.2	86.9	-164.3	-61.2	-63.2	173.1	0	0	116	R996 Y999 K1003 V1339 G1342	R996-M1001 HydrophobicContact CG-CB 4.32Å; Y999-M1001 VanDerWaalsContact C-N 3.27Å; Y999-M1001 WeakPolarHBondContact O-CE 3.34Å; Y999-M1001 WeakPolarHBondContact O-CG 3.24Å; Y999-M1001 PolarHBondContact O-N 2.82Å; M1001-K1003 PolarHBondContact O-N 2.86Å; M1001-V1339 HydrophobicContact CE-CG1 3.92Å; M1001-G1342 VanDerWaalsContact CE-N 3.28Å
1002	E	30.7	Very low	30.9	Very low	165 Å²	165	112.4 Å²	112.4	77%	0.771	57%	0.573	S	S	*	*			trans	-80	92.3	162.8	-72.9	-157	138.6	0	0	112.5	G1000 K1004	G1000-E1002 PolarHBondContact O-N 2.82Å; E1002-K1004 PolarHBondContact O-N 3.5Å; E1002-K1004 VanDerWaalsContact O-N 3.1Å
1003	K	28.4	Very low	30.8	Very low	189 Å²	189	119.3 Å²	119.3	82%	0.822	61%	0.606	S	S	*	*			trans	-73.8	97.9	169.7	-82.4	-163.7	173.7	-172.9	0	112	M1001 R1005	M1001-K1003 PolarHBondContact O-N 2.86Å; K1003-R1005 PolarHBondContact O-N 2.78Å
1004	K	30.3	Very low	30.7	Very low	188 Å²	188	122.5 Å²	122.5	82%	0.817	63%	0.625	S	S	*	*			trans	-60.3	130.2	153.4	-76.5	-179.6	178.8	172.4	0	108.8	E1002 S1006	E1002-K1004 PolarHBondContact O-N 3.5Å; E1002-K1004 VanDerWaalsContact O-N 3.1Å; K1004-S1006 PolarHBondContact O-N 2.78Å
1005	R	27.1	Very low	30.3	Very low	242 Å²	242	130.3 Å²	130.3	91%	0.913	66%	0.659	S	S	*	*			trans	-78	115.1	177.4	-73.7	179.9	173.4	174.2	-3.4	110.3	K1003	K1003-R1005 PolarHBondContact O-N 2.78Å
1006	S	26.7	Very low	30.1	Very low	117 Å²	117	132.6 Å²	132.6	82%	0.818	68%	0.677	S	S	*	*			trans	-109.1	136.4	143.5	-169.1	0	0	0	0	107.3	K1004	K1004-S1006 PolarHBondContact O-N 2.78Å
1007	A	25.3	Very low	29.7	Very low	89 Å²	89	133.3 Å²	133.3	74%	0.736	69%	0.687	S	S	*	*			trans	-154.3	92.3	-171.4	0	0	0	0	0	111.7
1008	T	27.3	Very low	29.2	Very low	124 Å²	124	137.3 Å²	137.3	76%	0.761	70%	0.699	S	S	*	*			trans	-149	112	171.7	44.9	0	0	0	0	108.6
1009	M	25.4	Very low	28.4	Very low	176 Å²	176	141.8 Å²	141.8	87%	0.867	72%	0.723	S	S	*	*			trans	51.9	123.1	171.1	-70	156.9	57.7	0	0	116
1010	D	30	Very low	27.6	Very low	154 Å²	154	145.5 Å²	145.5	82%	0.824	75%	0.75	S	S	*	*				-140.6	163.2	67.3	-78.8	-41.3	0	0	0	114.3
1011	Q	27.3	Very low	27.1	Very low	186 Å²	186	149.1 Å²	149.1	87%	0.869	77%	0.768	S	S	*	*			trans	-101.6	143.7	171.4	-72.7	-175.4	-26.8	0	0	110.8
1012	P	26.5	Very low	26.9	Very low	125 Å²	125	154.9 Å²	154.9	81%	0.812	79%	0.794	S	S	*	*			trans	-78.3	136.8	169.7	32.7	-32.4	0	0	0	110.5
1013	L	26.1	Very low	26.8	Very low	173 Å²	173	154.2 Å²	154.2	91%	0.906	79%	0.791	S	S	*	*			trans	-135.8	119	161.8	-147.2	84.9	0	0	0	109.8
1014	L	25	Very low	26.9	Very low	165 Å²	165	151.1 Å²	151.1	86%	0.864	78%	0.784	S	S	*	*			trans	-119.4	135	163.8	-81.1	167	0	0	0	106.3
1015	E	24.1	Very low	26.8	Very low	183 Å²	183	148.3 Å²	148.3	86%	0.855	78%	0.778	S	S	*	*			trans	150.9	169.5	144.5	-84.8	-177.2	157.1	0	0	112.1
1016	V	28.7	Very low	26.8	Very low	119 Å²	119	141.3 Å²	141.3	72%	0.721	76%	0.764	S	S	*	*			trans	78.9	95.5	168.9	-168.1	0	0	0	0	116.6
1017	E	27.3	Very low	26.8	Very low	162 Å²	162	143.9 Å²	143.9	76%	0.757	76%	0.763	S	S	*	*				49	145.5	127.2	-61.9	-178.3	141.7	0	0	120.8
1018	Q	24.8	Very low	26.9	Very low	139 Å²	139	144.1 Å²	144.1	65%	0.65	76%	0.76	S	S	*	*			cis	172.2	155.3	-12.9	-113.8	-172.6	53.3	0	0	105.1
1019	Q	23.3	Very low	26.9	Very low	160 Å²	160	147.2 Å²	147.2	75%	0.748	76%	0.763	S	S	*	*			trans	69.7	148.9	153.9	-69.9	179.2	27	0	0	121.8
1020	V	26.6	Very low	27	Very low	126 Å²	126	146.4 Å²	146.4	76%	0.764	76%	0.761	S	S	*	*			trans	67	127.9	150.8	161.8	0	0	0	0	118.4
1021	T	25.9	Very low	26.7	Very low	97 Å²	97	147 Å²	147	60%	0.595	76%	0.759	S	S	*	*			cis	-173.4	159.9	-36	13.5	0	0	0	0	106.5
1022	E	27.2	Very low	26.6	Very low	173 Å²	173	142.4 Å²	142.4	81%	0.808	75%	0.752	S	S	*	*			trans	66.3	155.2	155.4	-70.3	155.6	-177	0	0	116.4
1023	E	29.6	Very low	26.5	Very low	152 Å²	152	140.8 Å²	140.8	71%	0.71	75%	0.75	S	S	*	*			cis	-152.7	154.8	0.1	-132.9	-165.6	160.7	0	0	110.9
1024	N	30.2	Very low	26.4	Very low	124 Å²	124	139.4 Å²	139.4	66%	0.663	75%	0.748	S	S	*	*			trans	38.9	153.5	137.9	-73.1	-25	0	0	0	123.9
1025	N	27.6	Very low	26.4	Very low	129 Å²	129	136.4 Å²	136.4	69%	0.69	74%	0.741	S	S	*	*			cis	-176	-173.5	-21.3	-161.1	-15.5	0	0	0	107.8
1026	C	28.7	Very low	26.5	Very low	94 Å²	94	134.6 Å²	134.6	64%	0.635	73%	0.732	S	S	*	*			trans	77.6	119.1	166.1	-61.9	0	0	0	0	116.4
1027	Q	26.8	Very low	26.5	Very low	171 Å²	171	136.8 Å²	136.8	80%	0.799	73%	0.732	S	S	*	*				74.5	136.4	66.1	-69.7	174.4	12.2	0	0	113.7
1028	S	27.5	Very low	27.2	Very low	95 Å²	95	134.9 Å²	134.9	66%	0.664	73%	0.734	S	S	*	*			cis	-173.5	153.5	-7.9	56.9	0	0	0	0	113.5
1029	K	26.1	Very low	27.4	Very low	189 Å²	189	133.4 Å²	133.4	82%	0.822	74%	0.739	S	S	*	*			trans	64.8	151.2	141.3	-84.7	-176.3	175.1	179.9	0	122.2
1030	L	26.9	Very low	27.6	Very low	159 Å²	159	133.1 Å²	133.1	83%	0.832	74%	0.741	S	S	*	*			trans	70.8	162.8	163.8	-61.6	162.2	0	0	0	117.7
1031	H	25.5	Very low	27.8	Very low	167 Å²	167	135 Å²	135	77%	0.773	74%	0.744	S	S	*	*				-171.1	130.5	-50.5	-147.8	-95.1	0	0	0	108.7
1032	A	24.1	Very low	27.9	Very low	88 Å²	88	136.4 Å²	136.4	73%	0.727	75%	0.748	S	S	*	*			trans	61.3	159.4	160.1	0	0	0	0	0	121.8
1033	A	24.2	Very low	28.1	Very low	92 Å²	92	133.3 Å²	133.3	76%	0.76	74%	0.741	S	S	*	*			trans	77.9	98.5	155.4	0	0	0	0	0	121.6
1034	V	24.1	Very low	28	Very low	144 Å²	144	131.8 Å²	131.8	87%	0.873	74%	0.737	S	S	*	*				53.5	135.4	124	-173.7	0	0	0	0	120.8
1035	S	25.2	Very low	27.9	Very low	101 Å²	101	132.1 Å²	132.1	71%	0.706	74%	0.735	S	S	*	*			trans	118.3	109.9	142.8	-131.1	0	0	0	0	118.8
1036	E	26.6	Very low	27.8	Very low	145 Å²	145	134 Å²	134	68%	0.678	74%	0.737	S	S	*	*				57.3	119	128.1	-66.6	-134.5	126	0	0	124.5
1037	K	28.8	Very low	27.7	Very low	166 Å²	166	135.1 Å²	135.1	72%	0.722	74%	0.741	S	S	*	*				100.6	152.8	122.3	-84	-173.8	172.5	84.4	0	120.5
1038	P	41.9	Very low	27.7	Very low	122 Å²	122	133.1 Å²	133.1	79%	0.792	74%	0.74	S	S	*	*			trans	-119.8	172.7	-164.4	43.7	-31.3	0	0	0	115.6
1039	S	28.9	Very low	27.7	Very low	107 Å²	107	134.4 Å²	134.4	75%	0.748	74%	0.74	S	S	*	*			trans	-153	118.6	166.8	45.6	0	0	0	0	108.6
1040	L	28	Very low	27.7	Very low	154 Å²	154	129.5 Å²	129.5	81%	0.806	73%	0.729	S	S	*	*				85	106.3	78.9	-88.9	161.3	0	0	0	114.6
1041	M	29.9	Very low	27.7	Very low	167 Å²	167	130 Å²	130	82%	0.823	73%	0.725	S	S	*	*				173	124.8	118.3	-92.4	-170.9	-178.9	0	0	109.4
1042	N	27.7	Very low	27.6	Very low	126 Å²	126	127.7 Å²	127.7	67%	0.674	72%	0.721	S	S	*	*				65.4	136	89.3	-82	0.1	0	0	0	113.6
1043	T	31.9	Very low	27.6	Very low	107 Å²	107	128.9 Å²	128.9	66%	0.656	72%	0.719	S	S	*	*			cis	-157.5	157	21.3	-5.2	0	0	0	0	111.7
1044	N	26.3	Very low	27.6	Very low	120 Å²	120	130.8 Å²	130.8	64%	0.642	72%	0.717	S	S	*	*				23.2	154.6	127.2	-61	28.9	0	0	0	120.1
1045	E	28.7	Very low	27.8	Very low	131 Å²	131	132.8 Å²	132.8	61%	0.612	71%	0.714	S	S	*	*			cis	-173.6	174.1	-2.9	-106.6	177.5	117.4	0	0	107.1
1046	K	26.7	Very low	27.8	Very low	169 Å²	169	134.2 Å²	134.2	74%	0.735	72%	0.718	S	S	*	*			cis	-152	169.4	4.7	-143.6	164.8	-180	132.9	0	112.7
1047	V	25.7	Very low	27.8	Very low	117 Å²	117	135.7 Å²	135.7	71%	0.709	73%	0.725	S	S	*	*			trans	-36.9	149.8	154.7	-179.2	0	0	0	0	115.8
1048	V	27.8	Very low	27.6	Very low	130 Å²	130	134.7 Å²	134.7	79%	0.788	73%	0.727	S	S	*	*				172.9	100.8	126.1	158.3	0	0	0	0	111.4
1049	D	25.8	Very low	26.9	Very low	122 Å²	122	135.8 Å²	135.8	65%	0.652	73%	0.726	S	S	*	*				43.5	149.7	119.6	-140.4	-36.1	0	0	0	122.4
1050	S	27.3	Very low	26.8	Very low	85 Å²	85	136.3 Å²	136.3	59%	0.594	73%	0.725	S	S	*	*			trans	75.8	149.4	146	-80.7	0	0	0	0	120.2
1051	K	26.2	Very low	26.7	Very low	171 Å²	171	135.4 Å²	135.4	74%	0.743	72%	0.721	S	S	*	*			cis	179.9	163.4	-23	-118.6	179.7	-164	143.5	0	108.2
1052	V	24.2	Very low	26.5	Very low	117 Å²	117	132.7 Å²	132.7	71%	0.709	72%	0.719	S	S	*	*			trans	63.3	105.8	138.3	168.6	0	0	0	0	119.5
1053	V	24.4	Very low	26.5	Very low	113 Å²	113	134.5 Å²	134.5	69%	0.685	73%	0.728	S	S	*	*				86.6	145.8	123.4	167.7	0	0	0	0	121.2
1054	D	24.5	Very low	26.5	Very low	133 Å²	133	132.9 Å²	132.9	71%	0.711	73%	0.733	S	S	*	*			trans	60.1	135.2	167.9	-70.8	-25	0	0	0	118
1055	K	27	Very low	26.5	Very low	185 Å²	185	131.9 Å²	131.9	80%	0.804	74%	0.735	S	S	*	*			cis	73.7	80.7	36.3	-167.9	-152.9	179.9	-168.1	0	112.8
1056	V	25.4	Very low	26.6	Very low	131 Å²	131	133.8 Å²	133.8	79%	0.794	74%	0.742	S	S	*	*			trans	-147.6	153.3	155.6	128.5	0	0	0	0	108.7	L1058	V1056-L1058 HydrophobicContact CG1-CD1 4.46Å
1057	E	26.7	Very low	26.6	Very low	177 Å²	177	133.1 Å²	133.1	83%	0.827	75%	0.746	S	S	*	*			trans	-80.5	-143.4	174.6	-63.2	159.3	104.9	0	0	110
1058	L	25.5	Very low	26.7	Very low	144 Å²	144	131 Å²	131	75%	0.754	74%	0.741	S	S	*	*			trans	71.3	100.1	-178.5	-45.8	172.5	0	0	0	111.9	V1056	V1056-L1058 HydrophobicContact CG1-CD1 4.46Å
1059	N	27.2	Very low	26.7	Very low	145 Å²	145	132.8 Å²	132.8	78%	0.775	74%	0.741	S	S	*	*			cis	65.7	62.2	23.7	-149.2	32.2	0	0	0	114.1
1060	T	25.7	Very low	26.8	Very low	119 Å²	119	132.8 Å²	132.8	73%	0.73	74%	0.741	S	S	*	*			trans	-139	116.8	159.1	48.5	0	0	0	0	107.7
1061	N	25.4	Very low	26.8	Very low	134 Å²	134	133 Å²	133	72%	0.717	74%	0.738	S	S	*	*				66.6	94.5	65.7	-65.2	-10.6	0	0	0	114
1062	S	27.4	Very low	27	Very low	111 Å²	111	133.5 Å²	133.5	78%	0.776	74%	0.741	S	S	*	*			trans	-166	107.6	138.3	-0	0	0	0	0	106.5
1063	D	26	Very low	27.2	Very low	163 Å²	163	134 Å²	134	87%	0.872	74%	0.739	S	S	*	*				76.9	118.6	71.2	-76	-51.1	0	0	0	113.8
1064	G	32.2	Very low	27.7	Very low	74 Å²	74	136.3 Å²	136.3	76%	0.763	75%	0.748	S	S	*	*			trans	138.4	44.3	-176.1	0	0	0	0	0	113
1065	S	26.7	Very low	28	Very low	99 Å²	99	136.3 Å²	136.3	69%	0.692	75%	0.748	S	S	*	*				74.8	140.8	67	-167.3	0	0	0	0	113.4
1066	K	31.5	Very low	28.1	Very low	171 Å²	171	132.4 Å²	132.4	74%	0.743	74%	0.739	S	S	*	*			trans	80.7	107.7	176.6	-57	170.2	-168.6	172.1	0	113.2
1067	N	26.6	Very low	28.2	Very low	154 Å²	154	136.5 Å²	136.5	82%	0.824	74%	0.741	S	S	*	*				89.9	146.7	75.4	-75.8	6.8	0	0	0	110.2
1068	A	27.3	Very low	28.1	Very low	73 Å²	73	132.4 Å²	132.4	60%	0.603	73%	0.731	S	S	*	*			cis	-173.4	-179.4	-19.5	0	0	0	0	0	105.8
1069	E	28	Very low	28.1	Very low	167 Å²	167	136.1 Å²	136.1	78%	0.78	74%	0.735	S	S	*	*			trans	68.8	152.9	161.7	-55.8	-172.1	171.3	0	0	115.9
1070	N	27.2	Very low	28	Very low	122 Å²	122	138.3 Å²	138.3	65%	0.652	74%	0.737	S	S	*	*			cis	-158.1	165.3	-24	-106.7	-23.6	0	0	0	109
1071	T	27.3	Very low	28	Very low	89 Å²	89	137.5 Å²	137.5	55%	0.546	74%	0.736	S	S	.	*			trans	28.7	123	148.8	59.5	0	0	0	0	119.9
1072	F	31.3	Very low	28.2	Very low	183 Å²	183	136.3 Å²	136.3	80%	0.803	74%	0.739	S	S	*	*				172.9	109.2	100.2	-90.5	-72.5	0	0	0	105.4
1073	D	28	Very low	28.1	Very low	126 Å²	126	137.9 Å²	137.9	67%	0.674	74%	0.737	S	S	*	*				52.2	100.3	71.2	-65.7	-45.4	0	0	0	112.3
1074	D	34.5	Very low	28.3	Very low	162 Å²	162	135.4 Å²	135.4	87%	0.866	73%	0.73	S	S	*	*			trans	170.1	147	130.2	-89.5	-10.7	0	0	0	110.3
1075	D	30.3	Very low	28	Very low	133 Å²	133	139.4 Å²	139.4	71%	0.711	73%	0.728	S	S	*	*			cis	-163.2	179.2	-35.8	-167.2	8.5	0	0	0	107
1076	V	29.9	Very low	28.1	Very low	103 Å²	103	140.2 Å²	140.2	62%	0.624	73%	0.725	S	S	*	*			trans	48.5	137.4	137.2	145.8	0	0	0	0	120.8
1077	R	28.2	Very low	27.8	Very low	218 Å²	218	137.6 Å²	137.6	82%	0.823	72%	0.724	S	S	*	*			cis	-175.8	138.3	-7.9	-171.4	-178.8	-155.3	155	2.5	111.9
1078	C	24.2	Very low	27.7	Very low	91 Å²	91	135.1 Å²	135.1	62%	0.615	72%	0.718	S	S	*	*			trans	-7.2	133.8	145.1	-105.1	0	0	0	0	120.8
1079	R	24.7	Very low	27.6	Very low	222 Å²	222	137.4 Å²	137.4	84%	0.838	73%	0.725	S	S	*	*			trans	74.9	122.8	140.4	-54.3	160.7	-175	-177.1	-1	120.7
1080	K	26.2	Very low	27.5	Very low	191 Å²	191	134.7 Å²	134.7	83%	0.83	72%	0.724	S	S	*	*				166.7	132	117.3	-91.8	173.2	-179.2	-177.6	0	110
1081	S	25.2	Very low	27.7	Very low	101 Å²	101	132.8 Å²	132.8	71%	0.706	72%	0.72	S	S	*	*				51.1	133.2	85.5	84.4	0	0	0	0	114
1082	S	29	Very low	28	Very low	110 Å²	110	137.2 Å²	137.2	77%	0.769	74%	0.735	S	S	*	*			cis	-166.1	167.6	23.2	44.4	0	0	0	0	114.7
1083	I	26.4	Very low	27.9	Very low	144 Å²	144	133.1 Å²	133.1	74%	0.738	73%	0.728	S	S	*	*			trans	-35.1	144.5	152.7	-65.8	161.2	0	0	0	111.6
1084	P	30.4	Very low	28.2	Very low	111 Å²	111	132.6 Å²	132.6	72%	0.721	73%	0.73	S	S	*	*			cis	-120.8	172.7	44.1	14.5	11.3	0	0	0	115.4
1085	Q	26	Very low	28	Very low	157 Å²	157	131 Å²	131	73%	0.734	73%	0.726	S	S	*	*			cis	86.5	146.8	32.4	-140.8	-166.4	-50.2	0	0	115
1086	D	27.4	Very low	28.5	Very low	116 Å²	116	130.3 Å²	130.3	62%	0.62	73%	0.729	S	S	*	*			trans	83.3	100.5	164.7	-59.2	-22.6	0	0	0	122.3
1087	T	25.1	Very low	29	Very low	117 Å²	117	130.7 Å²	130.7	72%	0.718	73%	0.734	S	S	*	*				68.3	134.4	127.1	63.6	0	0	0	0	123.6
1088	S	25.8	Very low	29.4	Very low	102 Å²	102	126.3 Å²	126.3	71%	0.713	73%	0.727	S	S	*	*			trans	71.9	155.1	140.8	81.4	0	0	0	0	117.9
1089	T	25	Very low	29.7	Very low	120 Å²	120	127.5 Å²	127.5	74%	0.736	73%	0.731	S	S	*	*			cis	-162.1	161.7	-19.9	14.4	0	0	0	0	108.2
1090	S	26.6	Very low	30.3	Very low	110 Å²	110	121.8 Å²	121.8	77%	0.769	72%	0.723	S	S	*	*			trans	66	166.3	162.2	74.2	0	0	0	0	115.6
1091	S	30	Very low	30.7	Very low	82 Å²	82	117.9 Å²	117.9	57%	0.573	72%	0.715	S	S	*	*			cis	-159.4	143.2	6.5	0.5	0	0	0	0	111.3
1092	H	33.3	Very low	30.9	Very low	183 Å²	183	120 Å²	120	85%	0.847	72%	0.719	S	S	*	*			trans	60.2	160.7	148.9	-57.8	-49	0	0	0	118.1
1093	S	29	Very low	31.1	Very low	96 Å²	96	120.5 Å²	120.5	67%	0.671	72%	0.717	S	S	*	*			cis	-169.7	153.5	-20.4	48	0	0	0	0	105.3
1094	T	34.2	Very low	31.4	Very low	115 Å²	115	122.3 Å²	122.3	71%	0.706	72%	0.722	S	S	*	*				-170.9	120.3	53.5	35.2	0	0	0	0	107.2
1095	T	31.9	Very low	31.5	Very low	129 Å²	129	121.7 Å²	121.7	79%	0.791	72%	0.721	S	S	*	*				81.1	125	78	55	0	0	0	0	117.3
1096	P	41	Very low	31.6	Very low	118 Å²	118	119.9 Å²	119.9	77%	0.766	72%	0.721	S	S	*	*			trans	-103.4	179.9	177.6	43.1	-37.3	0	0	0	114.1
1097	P	39.9	Very low	31.8	Very low	112 Å²	112	121.3 Å²	121.3	73%	0.727	73%	0.728	S	S	*	*				-128.3	-162.3	96.8	43.4	-36.9	0	0	0	111.5
1098	D	36.2	Very low	32	Very low	125 Å²	125	124 Å²	124	67%	0.668	73%	0.729	S	S	*	*			cis	-151	167.6	5.2	-126.3	-45.6	0	0	0	107.2
1099	T	31.4	Very low	32.3	Very low	116 Å²	116	126.3 Å²	126.3	71%	0.712	73%	0.733	S	S	*	*			cis	73.1	151.8	20.2	21.2	0	0	0	0	117.6
1100	P	36.5	Very low	32.4	Very low	102 Å²	102	124.4 Å²	124.4	66%	0.662	73%	0.725	S	S	*	*			cis	-141.9	-166	-4.1	41.1	-20.1	0	0	0	117.8
1101	T	33.7	Very low	32.6	Very low	110 Å²	110	127.1 Å²	127.1	68%	0.675	73%	0.73	S	S	*	*			trans	88.2	119.1	146.3	43.1	0	0	0	0	125.7
1102	N	30.1	Very low	32.7	Very low	146 Å²	146	126.8 Å²	126.8	78%	0.781	74%	0.74	S	S	*	*			trans	59.2	126.7	131.1	-52.5	-4.1	0	0	0	121
1103	T	33.7	Very low	32.7	Very low	119 Å²	119	125.7 Å²	125.7	73%	0.73	74%	0.74	S	S	*	*				-149.5	136.7	57.1	42.4	0	0	0	0	112.7
1104	E	32.5	Very low	32.6	Very low	182 Å²	182	129.5 Å²	129.5	85%	0.85	75%	0.748	S	S	*	*				55.6	134.3	101.6	-55.8	-174.5	143.3	0	0	116.7
1105	S	32.3	Very low	32.4	Very low	98 Å²	98	128.7 Å²	128.7	69%	0.685	75%	0.747	S	S	*	*			cis	-157.6	144.1	-7	53.9	0	0	0	0	109.5
1106	T	28.8	Very low	32.3	Very low	120 Å²	120	132.5 Å²	132.5	74%	0.736	75%	0.753	S	S	*	*				45.4	130.2	85.6	-8	0	0	0	0	113.5
1107	L	31.1	Very low	31.8	Very low	146 Å²	146	130.4 Å²	130.4	76%	0.764	75%	0.752	S	S	*	*			cis	-142.6	160.5	29.1	-73.3	151	0	0	0	109.7
1108	K	27.9	Very low	31.5	Very low	173 Å²	173	132.6 Å²	132.6	75%	0.752	76%	0.758	S	S	*	*			cis	91.8	137.7	32.3	-154.9	-173.3	-173.1	-178.5	0	114
1109	L	32.6	Very low	31.4	Very low	151 Å²	151	133.7 Å²	133.7	79%	0.791	76%	0.763	S	S	*	*			trans	80.9	156	174.4	-53.2	173.7	0	0	0	116.8
1110	S	28.1	Very low	31.4	Very low	80 Å²	80	133.8 Å²	133.8	56%	0.559	76%	0.764	S	S	*	*			cis	-177.5	141.7	-41.9	51.7	0	0	0	0	110.5
1111	D	30.5	Very low	31.1	Very low	166 Å²	166	133.4 Å²	133.4	89%	0.888	76%	0.764	S	S	*	*			trans	61.6	157.7	159.6	-43.9	-34	0	0	0	119.3
1112	G	32.4	Very low	31	Very low	76 Å²	76	135 Å²	135	78%	0.784	77%	0.768	S	S	*	*			trans	138.2	111.1	167.2	0	0	0	0	0	116.4
1113	D	32.1	Very low	31.1	Very low	159 Å²	159	135 Å²	135	85%	0.85	77%	0.767	S	S	*	*			trans	-81.3	163.2	-174.7	-68.2	-67.9	0	0	0	116.9
1114	E	28.1	Very low	31.2	Very low	176 Å²	176	134 Å²	134	82%	0.822	76%	0.762	S	S	*	*			trans	50.9	107.7	146.1	-72	-166.1	144.9	0	0	123.4
1115	S	29.3	Very low	31.2	Very low	99 Å²	99	134.1 Å²	134.1	69%	0.692	76%	0.76	S	S	*	*				93	134.9	117.7	83	0	0	0	0	122.8
1116	K	28.9	Very low	31.2	Very low	209 Å²	209	136.3 Å²	136.3	91%	0.909	76%	0.757	S	S	*	*			trans	53.8	128.3	147.5	-64.9	174	-179.4	175.2	0	121.1
1117	G	32	Very low	31.3	Very low	73 Å²	73	135.4 Å²	135.4	75%	0.753	76%	0.755	S	S	*	*			trans	168.9	125.4	158.6	0	0	0	0	0	113
1118	D	32.3	Very low	31.2	Very low	158 Å²	158	133.1 Å²	133.1	85%	0.845	74%	0.743	S	S	*	*			trans	-89.3	179	-170.3	-52.5	-77.9	0	0	0	115.1
1119	D	34	Very low	31.4	Very low	148 Å²	148	132.2 Å²	132.2	79%	0.791	75%	0.745	S	S	*	*			trans	89.5	107.5	148	-77.7	-11.3	0	0	0	124.8
1120	V	32	Very low	31.1	Very low	119 Å²	119	129.9 Å²	129.9	72%	0.721	74%	0.742	S	S	*	*				82.1	108.2	115.7	174.7	0	0	0	0	122
1121	S	29.9	Very low	31.5	Very low	94 Å²	94	131.4 Å²	131.4	66%	0.657	75%	0.749	S	S	*	*				109.2	151	128	76.7	0	0	0	0	124.3
1122	N	32.7	Very low	31.5	Very low	143 Å²	143	132 Å²	132	77%	0.765	75%	0.747	S	S	*	*			trans	80.7	92.8	149.6	-65	-39.9	0	0	0	122.2
1123	L	31.7	Very low	31.2	Very low	147 Å²	147	133.7 Å²	133.7	77%	0.77	75%	0.747	S	S	*	*				15.7	149.6	111.8	-111.3	77.9	0	0	0	118.8
1124	P	36	Very low	31.1	Very low	96 Å²	96	129.3 Å²	129.3	62%	0.623	74%	0.74	S	S	*	*				-158.5	167	70.4	43.2	-24	0	0	0	120.2
1125	K	33.5	Very low	31	Very low	185 Å²	185	130.1 Å²	130.1	80%	0.804	74%	0.743	S	S	*	*			trans	70.8	149.8	144.1	-78.5	159.6	-167.6	172.4	0	118.7
1126	K	31.1	Very low	31	Very low	144 Å²	144	133.3 Å²	133.3	63%	0.626	75%	0.751	S	S	*	*			cis	-166.7	138.6	-16.6	-155.3	-175.6	178.4	-65.7	0	105.5	D1128	K1126-D1128 IonicContact NZ-OD1 3.7Å; K1126-D1128 PolarHBondContact NZ-OD1 2.65Å; K1126-D1128 IonicContact NZ-OD2 2.79Å; K1126-D1128 PolarHBondContact NZ-OD2 3.49Å
1127	C	30.1	Very low	30.9	Very low	102 Å²	102	130.1 Å²	130.1	69%	0.689	74%	0.744	S	S	*	*				166.4	162.7	86.6	-76.1	0	0	0	0	106.6
1128	D	30	Very low	30.8	Very low	97 Å²	97	132.7 Å²	132.7	52%	0.519	74%	0.744	S	S	.	*			cis	-169.2	155.7	-25.7	-88.9	-26.6	0	0	0	106.2	K1126	K1126-D1128 IonicContact NZ-OD1 3.7Å; K1126-D1128 PolarHBondContact NZ-OD1 2.65Å; K1126-D1128 IonicContact NZ-OD2 2.79Å; K1126-D1128 PolarHBondContact NZ-OD2 3.49Å
1129	I	32.2	Very low	30.6	Very low	155 Å²	155	131.4 Å²	131.4	80%	0.795	73%	0.733	S	S	*	*			trans	68.8	110.9	168.1	-54.5	142.8	0	0	0	114.4
1130	S	27.2	Very low	30.3	Very low	102 Å²	102	131.2 Å²	131.2	71%	0.713	73%	0.728	S	S	*	*			cis	81.9	163	18.9	-31.1	0	0	0	0	114.6
1131	P	36.3	Very low	30.1	Very low	111 Å²	111	131.8 Å²	131.8	72%	0.721	73%	0.727	S	S	*	*				-130.2	-136.4	-102.6	35.5	-12.6	0	0	0	111.9
1132	E	30	Very low	30.2	Very low	178 Å²	178	133.2 Å²	133.2	83%	0.832	73%	0.727	S	S	*	*			trans	70.1	158.2	170.1	-66.7	171.6	169.4	0	0	115.4
1133	S	25.2	Very low	29.9	Very low	112 Å²	112	134 Å²	134	78%	0.783	73%	0.726	S	S	*	*			cis	169.9	130.3	-44.5	53.1	0	0	0	0	106.5
1134	G	30.9	Very low	29.8	Very low	68 Å²	68	133.5 Å²	133.5	70%	0.701	72%	0.724	S	S	*	*			trans	173.2	133.8	174.1	0	0	0	0	0	107.9
1135	E	25	Very low	29.3	Very low	193 Å²	193	135.2 Å²	135.2	90%	0.902	73%	0.726	S	S	*	*			cis	67.5	149	44.4	-62.1	-153.8	150.9	0	0	114.5
1136	I	30.6	Very low	29	Very low	165 Å²	165	131.8 Å²	131.8	85%	0.846	72%	0.721	S	S	*	*			trans	82.5	96.8	-156.2	-53.3	162.1	0	0	0	110.3
1137	N	25.4	Very low	28.7	Very low	142 Å²	142	132.4 Å²	132.4	76%	0.759	73%	0.726	S	S	*	*			cis	71	83.8	18.7	-170.6	23.7	0	0	0	115.7
1138	V	30.2	Very low	28.5	Very low	127 Å²	127	135.1 Å²	135.1	77%	0.77	73%	0.726	S	S	*	*			trans	-174.2	151.3	155.2	137.4	0	0	0	0	106.5
1139	Q	28.4	Very low	28.3	Very low	131 Å²	131	137.1 Å²	137.1	61%	0.612	74%	0.737	S	S	*	*			cis	177.2	155	-38.6	-118.7	-177.3	16	0	0	107.1
1140	Q	28.6	Very low	27.9	Very low	144 Å²	144	133.3 Å²	133.3	67%	0.673	72%	0.723	S	S	*	*			trans	70.1	119.5	160.6	-64.1	171.5	41.8	0	0	115.7
1141	N	27.3	Very low	27.8	Very low	131 Å²	131	135.4 Å²	135.4	70%	0.701	72%	0.722	S	S	*	*				103.3	142.5	77.4	-78.4	5.6	0	0	0	109.6
1142	N	31.2	Very low	27.2	Very low	124 Å²	124	138.4 Å²	138.4	66%	0.663	73%	0.726	S	S	*	*			cis	-127	153.8	4.7	-69.6	-64.1	0	0	0	108.7
1143	E	26.7	Very low	27	Very low	161 Å²	161	134.7 Å²	134.7	75%	0.752	72%	0.72	S	S	*	*				39.5	125.9	81.3	-45	-169.6	151.6	0	0	113.1
1144	L	28.9	Very low	26.9	Very low	136 Å²	136	136.8 Å²	136.8	71%	0.712	72%	0.722	S	S	*	*				-146.1	148.4	58.4	-101.5	81.4	0	0	0	110.9
1145	I	26.6	Very low	26.7	Very low	131 Å²	131	138.4 Å²	138.4	67%	0.672	72%	0.722	S	S	*	*				52.4	116.7	83.2	-52.9	170.1	0	0	0	111
1146	T	27.5	Very low	26.7	Very low	113 Å²	113	136.1 Å²	136.1	69%	0.693	72%	0.716	S	S	*	*			cis	-154.1	134.6	40.5	-16.5	0	0	0	0	107
1147	Q	24.5	Very low	26.5	Very low	158 Å²	158	134.3 Å²	134.3	74%	0.738	70%	0.704	S	S	*	*				52.6	129.2	71.5	-159.9	-160.5	87.6	0	0	114.9
1148	K	26.3	Very low	26.5	Very low	159 Å²	159	134.1 Å²	134.1	69%	0.691	70%	0.696	S	S	*	*			trans	99.3	132.3	162.4	-65.9	-173.3	-179.3	172.7	0	118.8
1149	N	24.9	Very low	26.4	Very low	139 Å²	139	133.9 Å²	133.9	74%	0.743	69%	0.691	S	S	*	*			trans	66.5	152.9	139.5	-68.6	38.3	0	0	0	117.2
1150	C	24.7	Very low	26.4	Very low	75 Å²	75	136.1 Å²	136.1	51%	0.507	70%	0.698	S	S	.	*			cis	-169.9	-177.5	-17.4	-107	0	0	0	0	107.3
1151	E	24.9	Very low	26.6	Very low	146 Å²	146	136.1 Å²	136.1	68%	0.682	70%	0.703	S	S	*	*			trans	37.8	105.1	139.3	-69	129.1	-135.9	0	0	117.6
1152	E	23.7	Very low	26.6	Very low	173 Å²	173	137.4 Å²	137.4	81%	0.808	71%	0.705	S	S	*	*				86	166.5	94.1	-79.2	178.3	157.9	0	0	113.4
1153	S	25.8	Very low	26.6	Very low	101 Å²	101	135.1 Å²	135.1	71%	0.706	70%	0.697	S	S	*	*			trans	64.2	119.2	176.1	60.7	0	0	0	0	115.8
1154	D	23.7	Very low	26.6	Very low	156 Å²	156	134.1 Å²	134.1	83%	0.834	69%	0.692	S	S	*	*				52.9	88.6	57.3	-65.6	-40.8	0	0	0	113.9
1155	S	25.5	Very low	26.3	Very low	101 Å²	101	136.9 Å²	136.9	71%	0.706	69%	0.693	S	S	*	*			trans	-161.9	127.5	140.9	-5.4	0	0	0	0	108
1156	L	25.4	Very low	26.2	Very low	145 Å²	145	138.6 Å²	138.6	76%	0.759	70%	0.698	S	S	*	*				56.1	117.3	67.3	-58.8	165.8	0	0	0	110.4
1157	E	25.3	Very low	26.1	Very low	128 Å²	128	140.2 Å²	140.2	60%	0.598	70%	0.701	S	S	*	*			cis	178.8	-164.3	7.3	-145.8	-176.6	130.4	0	0	109.2
1158	K	26.9	Very low	26.1	Very low	137 Å²	137	137.1 Å²	137.1	60%	0.596	70%	0.697	S	S	*	*			trans	64.4	104.5	138.8	-77.9	166.3	169.9	109.7	0	118.8
1159	N	27.2	Very low	26	Very low	122 Å²	122	136.6 Å²	136.6	65%	0.652	70%	0.701	S	S	*	*				104.6	128.2	105.8	-74.9	-11.5	0	0	0	119.5
1160	K	29.6	Very low	26.1	Very low	178 Å²	178	136 Å²	136	77%	0.774	70%	0.698	S	S	*	*			trans	99.3	129.8	151.2	-63.6	138.9	-178.8	179.6	0	117.1
1161	N	31.6	Very low	26.2	Very low	144 Å²	144	138.7 Å²	138.7	77%	0.77	71%	0.706	S	S	*	*			cis	-158.1	149.5	-13.9	-125.6	25.3	0	0	0	111.3
1162	E	27.5	Very low	26.5	Very low	158 Å²	158	143 Å²	143	74%	0.738	72%	0.717	S	S	*	*			trans	-30.2	168.9	141	-91	-152.2	105.5	0	0	116.4
1163	P	31.4	Very low	26.7	Very low	77 Å²	77	138 Å²	138	50%	0.5	71%	0.706	S	S	.	*			cis	-149.1	-159.4	-28.8	40.9	-22.1	0	0	0	112.4
1164	Q	25.8	Very low	26.7	Very low	140 Å²	140	141 Å²	141	65%	0.654	71%	0.708	S	S	*	*			trans	63.6	152.6	149.4	-70.4	169.9	50.1	0	0	116.3
1165	R	24.4	Very low	27.1	Very low	193 Å²	193	145.2 Å²	145.2	73%	0.728	72%	0.715	S	S	*	*			cis	177.1	-177.3	-7.5	-104.5	172.6	178	167.7	-3.8	103.1
1166	E	24.7	Very low	27.5	Very low	167 Å²	167	146.3 Å²	146.3	78%	0.78	72%	0.717	S	S	*	*			trans	75.3	108.4	162.2	-44.8	-150	142.1	0	0	113.5
1167	I	24.7	Very low	27.7	Very low	147 Å²	147	146.1 Å²	146.1	75%	0.754	72%	0.717	S	S	*	*				91.2	139.7	64.2	-74.7	161.2	0	0	0	111.2
1168	S	23.8	Very low	28.1	Very low	94 Å²	94	147.1 Å²	147.1	66%	0.657	73%	0.726	S	S	*	*			trans	74.3	125.8	177.3	-67.5	0	0	0	0	115.4
1169	L	25	Very low	28.4	Very low	148 Å²	148	148.5 Å²	148.5	78%	0.775	74%	0.735	S	S	*	*				63.6	114.6	69.4	-65.6	156.2	0	0	0	109.4
1170	D	27.3	Very low	28.8	Very low	126 Å²	126	148.9 Å²	148.9	67%	0.674	74%	0.737	S	S	*	*			cis	-164.2	155.6	48.6	-89.8	-46.4	0	0	0	115.1
1171	I	25.8	Very low	29	Very low	132 Å²	132	147.7 Å²	147.7	68%	0.677	74%	0.739	S	S	*	*			trans	29.8	111.5	135	-48.4	163.8	0	0	0	119.2
1172	Y	30.7	Very low	29.4	Very low	235 Å²	235	145 Å²	145	92%	0.922	73%	0.73	S	S	*	*				-160	112.5	128.9	-94.4	-79.3	0	0	0	105.8
1173	A	27.9	Very low	29.9	Very low	68 Å²	68	143.7 Å²	143.7	56%	0.562	73%	0.732	S	S	*	*			cis	95.9	133.1	42.6	0	0	0	0	0	113.1
1174	E	26.8	Very low	30	Very low	164 Å²	164	144 Å²	144	77%	0.766	74%	0.736	S	S	*	*			trans	53.1	112.2	157	-65.8	168	-176.8	0	0	119.8
1175	Y	32.1	Very low	30.6	Very low	246 Å²	246	143.8 Å²	143.8	97%	0.965	74%	0.74	S	S	*	*				-133.4	122.1	127.6	-89.3	-77.7	0	0	0	108.7
1176	T	34.1	Very low	31.2	Very low	124 Å²	124	141.6 Å²	141.6	76%	0.761	74%	0.743	S	S	*	*			trans	-100.2	167.8	-177.2	50.6	0	0	0	0	111.8
1177	D	29.7	Very low	31.7	Very low	140 Å²	140	138.4 Å²	138.4	75%	0.749	74%	0.739	S	S	*	*			trans	-59.5	162.5	167.5	-63	-61.7	0	0	0	112.7
1178	D	33.5	Very low	32.3	Very low	149 Å²	149	138.1 Å²	138.1	80%	0.797	74%	0.739	S	S	*	*			trans	49.3	118.4	156.9	-57.1	-27.5	0	0	0	118.1
1179	Q	32.8	Very low	32.9	Very low	167 Å²	167	139 Å²	139	78%	0.78	75%	0.745	S	S	*	*				-172.8	170.1	70.6	-92.5	-156.9	-114.7	0	0	113.8
1180	D	35	Very low	33.3	Very low	130 Å²	130	136.2 Å²	136.2	70%	0.695	74%	0.738	S	S	*	*			trans	69.4	82	153.8	-57.6	-8.3	0	0	0	120.4
1181	D	34.2	Very low	33.6	Very low	152 Å²	152	137.3 Å²	137.3	81%	0.813	74%	0.744	S	S	*	*				21.1	153.6	103	-122.7	30.3	0	0	0	119.5
1182	P	39.8	Very low	34.1	Very low	89 Å²	89	138.5 Å²	138.5	58%	0.578	75%	0.75	S	S	*	*			cis	-136.8	-152.2	-36.5	31.5	-8.8	0	0	0	111.9
1183	T	37.8	Very low	34.1	Very low	129 Å²	129	131.6 Å²	131.6	79%	0.791	74%	0.736	S	S	*	*			trans	78.8	150.3	166	77	0	0	0	0	117.4
1184	S	34.7	Very low	34.6	Very low	84 Å²	84	137.7 Å²	137.7	59%	0.587	75%	0.753	S	S	*	*			cis	-169.4	163.8	-18.9	48	0	0	0	0	111.2
1185	N	37.8	Very low	34.6	Very low	135 Å²	135	136.1 Å²	136.1	72%	0.722	75%	0.754	S	S	*	*			trans	72.4	126.9	173.6	-35.4	-55.9	0	0	0	114.1
1186	D	37.3	Very low	34.9	Very low	148 Å²	148	134.2 Å²	134.2	79%	0.791	75%	0.754	S	S	*	*			cis	90	132.6	33.8	-67.2	-45.2	0	0	0	115.6
1187	S	35.6	Very low	34.7	Very low	100 Å²	100	131.9 Å²	131.9	70%	0.699	75%	0.754	S	S	*	*			trans	84.4	121.5	151.8	-61.4	0	0	0	0	122.1
1188	D	36.7	Very low	34.7	Very low	140 Å²	140	132.5 Å²	132.5	75%	0.749	76%	0.758	S	S	*	*				83.7	117.2	129.9	-60.7	-4.5	0	0	0	123.3
1189	S	36.2	Very low	34.4	Very low	114 Å²	114	133 Å²	133	80%	0.797	76%	0.76	S	S	*	*			trans	73.3	151.3	135.5	73.1	0	0	0	0	119.8
1190	S	34.7	Very low	34.2	Very low	88 Å²	88	130.8 Å²	130.8	62%	0.615	76%	0.758	S	S	*	*			cis	-171.3	149.5	-20.8	49.5	0	0	0	0	111
1191	D	33.5	Very low	33.9	Very low	150 Å²	150	132.9 Å²	132.9	80%	0.802	76%	0.763	S	S	*	*			trans	68.3	165.3	154.1	-55.6	-20.1	0	0	0	121.3
1192	I	34.5	Very low	33.5	Very low	157 Å²	157	134 Å²	134	81%	0.805	76%	0.763	S	S	*	*			trans	85.6	74.9	166.5	-48.3	172.4	0	0	0	116.7
1193	S	30.5	Very low	33	Very low	89 Å²	89	137.1 Å²	137.1	62%	0.622	77%	0.773	S	S	*	*			trans	40.1	124.1	131.3	64.7	0	0	0	0	122
1194	E	38.6	Very low	32.6	Very low	197 Å²	197	137.3 Å²	137.3	92%	0.921	77%	0.768	S	S	*	*				-151.6	137.3	110.5	-107.1	164.6	-156.7	0	0	108.3
1195	T	28.6	Very low	32.1	Very low	130 Å²	130	139.1 Å²	139.1	80%	0.798	78%	0.781	S	S	*	*			trans	-143	102.1	-157.5	52.4	0	0	0	0	115.5
1196	E	37	Very low	31.7	Very low	207 Å²	207	139.8 Å²	139.8	97%	0.967	78%	0.78	S	S	*	*			trans	-148.8	137.7	152.3	-64.3	-169.5	150.7	0	0	106.5
1197	G	30.3	Very low	31.2	Very low	74 Å²	74	138.2 Å²	138.2	76%	0.763	77%	0.771	S	S	*	*			cis	150.7	77	-0.1	0	0	0	0	0	109.3
1198	D	29	Very low	30.9	Very low	153 Å²	153	140.2 Å²	140.2	82%	0.818	77%	0.774	S	S	*	*				83.4	165.2	95.1	-160.7	11.4	0	0	0	112.9
1199	L	28.4	Very low	30.4	Very low	160 Å²	160	137.3 Å²	137.3	84%	0.838	76%	0.764	S	S	*	*			trans	77.7	123.4	-161.1	-53.1	156.1	0	0	0	112.7
1200	T	28.1	Very low	30	Very low	120 Å²	120	139.4 Å²	139.4	74%	0.736	77%	0.766	S	S	*	*			cis	-140.2	110	10.7	-55.8	0	0	0	0	112.2
1201	Q	28.5	Very low	29.6	Very low	175 Å²	175	140.8 Å²	140.8	82%	0.818	77%	0.767	S	S	*	*	S	Bend	trans	-133.5	164.3	151.3	-74.4	-167.5	-5.2	0	0	108.4
1202	H	26.5	Very low	29.2	Very low	174 Å²	174	138.7 Å²	138.7	81%	0.806	76%	0.764	S	S	*	*			trans	62.7	61.5	-179.8	-82.3	-85.7	0	0	0	117
1203	I	28.1	Very low	28.9	Very low	155 Å²	155	138 Å²	138	80%	0.795	76%	0.761	S	S	*	*				-149.2	143.3	126.7	22.8	173	0	0	0	108.2
1204	I	29.4	Very low	28.8	Very low	133 Å²	133	142.9 Å²	142.9	68%	0.682	77%	0.772	S	S	*	*			cis	-123.9	134.9	-2	-56.9	176.2	0	0	0	109	E1206	I1204-E1206 HydrophobicContact CG2-CB 4.27Å; I1204-E1206 VanDerWaalsContact CG2-O 3.24Å; I1204-E1206 WeakPolarHBondContact CG2-O 3.42Å
1205	S	25.3	Very low	28.1	Very low	123 Å²	123	141.9 Å²	141.9	86%	0.86	76%	0.764	S	S	*	*			trans	-133.7	51.7	166.9	-74.8	0	0	0	0	110.8
1206	E	28.5	Very low	28	Very low	149 Å²	149	143.9 Å²	143.9	70%	0.696	77%	0.765	S	S	*	*			trans	-148	144.2	-177.5	-81.5	-169.5	-137.5	0	0	107.2	I1204	I1204-E1206 HydrophobicContact CG2-CB 4.27Å; I1204-E1206 VanDerWaalsContact CG2-O 3.24Å; I1204-E1206 WeakPolarHBondContact CG2-O 3.42Å
1207	N	27.5	Very low	27.6	Very low	114 Å²	114	139.9 Å²	139.9	61%	0.61	76%	0.755	S	S	*	*			cis	-148.1	151.2	1.8	-103.1	-38.2	0	0	0	111.7
1208	L	28.6	Very low	27.3	Very low	143 Å²	143	145.1 Å²	145.1	75%	0.749	76%	0.759	S	S	*	*			trans	41	102.1	138.1	-53.7	169.3	0	0	0	117.8
1209	S	25.8	Very low	27.3	Very low	79 Å²	79	146.1 Å²	146.1	55%	0.552	76%	0.758	S	S	*	*				70.7	101.9	69.7	81.7	0	0	0	0	116.1	N1211	S1209-N1211 PolarHBondContact O-ND2 3.15Å
1210	D	28.8	Very low	27.1	Very low	157 Å²	157	144.1 Å²	144.1	84%	0.84	75%	0.748	S	S	*	*			trans	-132.3	106.1	133.1	-101.1	-27.4	0	0	0	107.2
1211	N	26.5	Very low	27.1	Very low	117 Å²	117	145.5 Å²	145.5	63%	0.626	75%	0.75	S	S	*	*				63.9	90.7	67.3	-62.9	-51.5	0	0	0	114	S1209	S1209-N1211 PolarHBondContact O-ND2 3.15Å
1212	S	25.4	Very low	27	Very low	107 Å²	107	144.2 Å²	144.2	75%	0.748	74%	0.744	S	S	*	*				168.9	158.3	103.2	50	0	0	0	0	111.9
1213	L	27.4	Very low	26.8	Very low	142 Å²	142	140.9 Å²	140.9	74%	0.743	74%	0.74	S	S	*	*	S	Bend	trans	64.4	118.3	-172.8	-77.2	64	0	0	0	113.4
1214	F	28.1	Very low	26.7	Very low	192 Å²	192	143.2 Å²	143.2	84%	0.842	74%	0.741	S	S	*	*			cis	-129.3	154.5	0.1	-101.1	-85.4	0	0	0	111.5
1215	K	24.1	Very low	26.4	Very low	176 Å²	176	145.5 Å²	145.5	77%	0.765	75%	0.748	S	S	*	*			trans	-119.5	165.7	175.7	-149.6	-179.4	-172.9	-177.7	0	108.5
1216	E	26.7	Very low	26.6	Very low	172 Å²	172	149.5 Å²	149.5	80%	0.804	75%	0.746	S	S	*	*			trans	69	142.4	178.3	-63.2	139.7	-133.7	0	0	114.1
1217	T	27.6	Very low	26.4	Very low	123 Å²	123	147.9 Å²	147.9	76%	0.755	74%	0.742	S	S	*	*			cis	-140.2	141.4	16.8	-26	0	0	0	0	111.3
1218	E	24.1	Very low	26.6	Very low	184 Å²	184	146.8 Å²	146.8	86%	0.86	74%	0.744	S	S	*	*			trans	-77.1	142.1	162.4	-59.4	174	122.4	0	0	109.8
1219	H	29.5	Very low	26.6	Very low	173 Å²	173	147 Å²	147	80%	0.801	74%	0.739	S	S	*	*			trans	-162.5	139.3	153.5	-100.9	-52.4	0	0	0	113.7
1220	N	24.6	Very low	26.8	Very low	118 Å²	118	149.4 Å²	149.4	63%	0.631	75%	0.75	S	S	*	*			trans	-22.9	131.8	171.1	-59.1	-27.9	0	0	0	118.9
1221	I	27.7	Very low	26.9	Very low	149 Å²	149	149.6 Å²	149.6	76%	0.764	75%	0.751	S	S	*	*				-151.1	93.3	120.3	-80.8	123.5	0	0	0	103.7	Y1224	I1221-Y1224 HydrophobicContact CG2-CD2 4.49Å; I1221-Y1224 HydrophobicContact CG2-CE2 4.28Å
1222	Q	26.4	Very low	27	Very low	148 Å²	148	151.4 Å²	151.4	69%	0.692	76%	0.755	S	S	*	*				50.2	125.4	77.8	-93.7	-176.6	-17.1	0	0	115.3
1223	S	22.6	Very low	27.2	Very low	105 Å²	105	156.3 Å²	156.3	73%	0.734	76%	0.759	S	S	*	*			trans	-58.3	135.1	-179.2	47.9	0	0	0	0	113.6
1224	Y	25.8	Very low	27.3	Very low	204 Å²	204	156.4 Å²	156.4	80%	0.8	77%	0.765	S	S	*	*			trans	-117.6	94.5	156.2	-73.7	-77.7	0	0	0	109.1	I1221	I1221-Y1224 HydrophobicContact CG2-CD2 4.49Å; I1221-Y1224 HydrophobicContact CG2-CE2 4.28Å
1225	E	23.4	Very low	27.2	Very low	181 Å²	181	154.6 Å²	154.6	85%	0.846	77%	0.765	S	S	*	*			trans	-61.3	137.4	154.2	-66.4	176.1	108	0	0	108.2
1226	Y	29.7	Very low	27.3	Very low	207 Å²	207	150.6 Å²	150.6	81%	0.812	76%	0.759	S	S	*	*			trans	-118.2	90.2	167.1	-157.1	-87.1	0	0	0	108.9	S1228	Y1226-S1228 WeakPolarHBondContact CD1-OG 3.48Å; Y1226-S1228 WeakPolarHBondContact CE1-OG 3.21Å; Y1226-S1228 PolarHBondContact O-N 2.9Å
1227	D	24.6	Very low	27.4	Very low	115 Å²	115	151.6 Å²	151.6	62%	0.615	76%	0.763	S	S	*	*			trans	-63.9	120.2	177.7	-176.3	28.3	0	0	0	110.1	K1229	D1227-K1229 IonicContact OD1-NZ 3.97Å; D1227-K1229 PolarHBondContact OD1-NZ 2.94Å; D1227-K1229 IonicContact OD2-NZ 3.06Å; D1227-K1229 PolarHBondContact OD2-NZ 2.92Å
1228	S	32.1	Very low	27.4	Very low	91 Å²	91	148.5 Å²	148.5	64%	0.636	76%	0.756	S	S	*	*			trans	-141.1	82.2	178.4	-72.1	0	0	0	0	109	Y1226	Y1226-S1228 WeakPolarHBondContact CD1-OG 3.48Å; Y1226-S1228 WeakPolarHBondContact CE1-OG 3.21Å; Y1226-S1228 PolarHBondContact O-N 2.9Å
1229	K	28.7	Very low	27.6	Very low	148 Å²	148	149.7 Å²	149.7	64%	0.643	76%	0.758	S	S	*	*			trans	-70.7	165.6	172.7	-67.2	169.7	172.1	62.7	0	110.8	D1227	D1227-K1229 IonicContact OD1-NZ 3.97Å; D1227-K1229 PolarHBondContact OD1-NZ 2.94Å; D1227-K1229 IonicContact OD2-NZ 3.06Å; D1227-K1229 PolarHBondContact OD2-NZ 2.92Å
1230	T	29.1	Very low	27.7	Very low	128 Å²	128	148.4 Å²	148.4	79%	0.785	76%	0.757	S	S	*	*			trans	69.2	131.7	-172.4	66.5	0	0	0	0	113.2
1231	D	31.1	Very low	28.9	Very low	161 Å²	161	149.9 Å²	149.9	86%	0.861	76%	0.76	S	S	*	*			cis	-109.7	158.3	13.6	-71.2	-51.6	0	0	0	115.5
1232	E	27.9	Very low	30.2	Very low	155 Å²	155	146.8 Å²	146.8	72%	0.724	75%	0.751	S	S	*	*			trans	-94.6	174.3	171.6	-64.7	-178.9	115	0	0	111.9
1233	Y	29.8	Very low	32.2	Very low	211 Å²	211	140 Å²	140	83%	0.827	72%	0.719	S	S	*	*			trans	70.3	122.4	175.2	-46.9	-80.2	0	0	0	114.6
1234	T	30.5	Very low	34.1	Very low	143 Å²	143	140.9 Å²	140.9	88%	0.877	72%	0.72	S	S	*	*			cis	-140.8	-177	22.1	51	0	0	0	0	113.5
1235	N	25.5	Very low	36.5	Very low	155 Å²	155	132.4 Å²	132.4	83%	0.829	69%	0.691	S	S	*	*			trans	-89.6	167	-162.2	-114.6	-35.7	0	0	0	116.2
1236	S	25.7	Very low	39	Very low	92 Å²	92	125.1 Å²	125.1	64%	0.643	66%	0.66	S	S	*	*			trans	61.7	102	154.9	57.3	0	0	0	0	120.5
1237	H	29.5	Very low	41.2	Very low	192 Å²	192	119.6 Å²	119.6	89%	0.889	65%	0.648	S	S	*	*				-179.2	142.3	99.1	-97.2	-64.6	0	0	0	113.7
1238	G	28.2	Very low	43.8	Very low	59 Å²	59	117.8 Å²	117.8	61%	0.608	64%	0.635	S	S	*	*			trans	65.6	107.5	148.9	0	0	0	0	0	119.8	N1240	G1238-N1240 PolarHBondContact O-N 2.6Å
1239	K	26.8	Very low	46.3	Very low	209 Å²	209	115.1 Å²	115.1	91%	0.909	62%	0.616	S	S	*	*			trans	-72.5	70.8	165.7	-70.7	179.5	180	172.1	0	111.6
1240	N	32.8	Very low	49.1	Very low	146 Å²	146	108.2 Å²	108.2	78%	0.781	59%	0.586	S	S	*	*			trans	-89.3	117.5	174.4	-73.5	-7.5	0	0	0	110.7	G1238 C1242	G1238-N1240 PolarHBondContact O-N 2.6Å; N1240-C1242 PolarHBondContact O-N 3.3Å
1241	H	49.3	Very low	52.1	Low	149 Å²	149	102.2 Å²	102.2	69%	0.69	55%	0.549	S	S	*	.			trans	-66.4	117.1	173.4	-64.6	-73.4	0	0	0	109.8
1242	C	55.9	Low	55.1	Low	83 Å²	83	94.5 Å²	94.5	56%	0.561	51%	0.508	S	S	*	.			trans	-124.4	154.4	-171.6	-166.9	0	0	0	0	110.9	N1240 T1244	N1240-C1242 PolarHBondContact O-N 3.3Å; C1242-T1244 PolarHBondContact O-N 3.35Å
1243	L	67.5	Low	58.3	Low	6 Å²	6	87.1 Å²	87.1	3%	0.031	47%	0.474	C	S	.	.			trans	-65	115.2	166.9	-66	-178.8	0	0	0	109.7	L1250 M1262 R1275 L1313	L1243-L1250 HydrophobicContact CD1-CD1 3.77Å; L1243-L1250 HydrophobicContact CD2-CD1 4.35Å; L1243-L1250 HydrophobicContact CD2-CD2 3.73Å; L1243-M1262 HydrophobicContact CD1-CE 3.58Å; L1243-M1262 HydrophobicContact CD2-CE 4.22Å; L1243-M1262 HydrophobicContact CG-CE 3.99Å; L1243-R1275 HydrophobicContact CD2-CB 4.41Å; L1243-L1313 HydrophobicContact CB-CD2 4.37Å; L1243-L1313 WeakPolarHBondContact O-CD2 3.32Å
1244	T	62.8	Low	61.5	Low	124 Å²	124	77.1 Å²	77.1	76%	0.761	43%	0.434	S	S	*	.			trans	-97.4	-32.1	-178.9	54.2	0	0	0	0	113.3	C1242 Y1264	C1242-T1244 PolarHBondContact O-N 3.35Å; T1244-Y1264 PolarHBondContact N-OH 3.48Å
1245	S	75	Confident	64.5	Low	26 Å²	26	70.3 Å²	70.3	18%	0.182	39%	0.393	C	S	.	.			trans	-98	123.7	177.5	-177.1	0	0	0	0	111.5	T1247 Q1248 Y1264	S1245-T1247 PolarHBondContact OG-N 2.87Å; S1245-T1247 PolarHBondContact OG-OG1 2.88Å; S1245-Q1248 PolarHBondContact OG-N 2.92Å; S1245-Y1264 PolarHBondContact N-OH 3.23Å; S1245-Y1264 PolarHBondContact O-OH 2.88Å
1246	S	76.1	Confident	67.8	Low	27 Å²	27	67.4 Å²	67.4	19%	0.189	37%	0.374	C	S	.	.	S	Bend	trans	-83.2	-24.8	171.3	52.5	0	0	0	0	113.3	Y978 R1308 D1311 G1312	Y978-S1246 WeakPolarHBondContact CB-O 3.26Å; Y978-S1246 PolarHBondContact N-O 2.85Å; S1246-R1308 PolarHBondContact O-NH2 3.46Å; S1246-D1311 WeakPolarHBondContact CB-O 3.3Å; S1246-D1311 PolarHBondContact OG-O 3.47Å; S1246-G1312 WeakPolarHBondContact CA-O 3.32Å; S1246-G1312 WeakPolarHBondContact CB-O 3.42Å
1247	T	76.3	Confident	71	Confident	91 Å²	91	66.1 Å²	66.1	56%	0.558	36%	0.358	S	S	*	.	S	Bend	trans	-93.3	-16.9	-170.8	54.6	0	0	0	0	114.3	G977 S1245	G977-T1247 WeakPolarHBondContact CA-O 3.49Å; S1245-T1247 PolarHBondContact OG-N 2.87Å; S1245-T1247 PolarHBondContact OG-OG1 2.88Å
1248	Q	79.3	Confident	74.1	Confident	77 Å²	77	57 Å²	57	36%	0.36	32%	0.315	S	S	.	.	S	Bend	trans	-79.7	141.5	173.6	-79	176.5	-32.5	0	0	111.5	S1245 Y1264	S1245-Q1248 PolarHBondContact OG-N 2.92Å; Q1248-Y1264 HydrophobicContact CB-CD1 3.44Å; Q1248-Y1264 VanDerWaalsContact CB-CD1 3.44Å; Q1248-Y1264 HydrophobicContact CB-CE1 3.76Å; Q1248-Y1264 HydrophobicContact CB-CG 4.28Å; Q1248-Y1264 HydrophobicContact CG-CD1 4.47Å
1249	P	84.5	Confident	77.2	Confident	35 Å²	35	54.3 Å²	54.3	23%	0.227	29%	0.288	C	S	.	.			trans	-67.9	149.6	171.2	29.1	-34	0	0	0	111.4	I975 Y1264 A1265	I975-P1249 CarbonylContact O-C 3.58Å; I975-P1249 WeakPolarHBondContact O-CA 3.27Å; P1249-Y1264 WeakPolarHBondContact O-CA 3.22Å; P1249-A1265 HydrophobicContact CB-CB 4.19Å; P1249-A1265 HydrophobicContact CG-CB 4.01Å; P1249-A1265 PolarHBondContact O-N 2.81Å
1250	L	88.6	Confident	80.5	Confident	4 Å²	4	44.4 Å²	44.4	2%	0.021	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	151.4	-177.7	-69.4	167.2	0	0	0	111.2	I975 L1243 F1263 Y1264	I975-L1250 HydrophobicContact CB-CB 4.22Å; I975-L1250 HydrophobicContact CG2-CB 4.44Å; I975-L1250 PolarHBondContact N-O 2.82Å; I975-L1250 PolarHBondContact O-N 2.92Å; L1243-L1250 HydrophobicContact CD1-CD1 3.77Å; L1243-L1250 HydrophobicContact CD2-CD1 4.35Å; L1243-L1250 HydrophobicContact CD2-CD2 3.73Å; L1250-F1263 CarbonylContact C-O 3.59Å; L1250-F1263 VanDerWaalsContact CA-O 3.27Å; L1250-F1263 WeakPolarHBondContact CA-O 3.48Å; L1250-F1263 VanDerWaalsContact CD2-O 3.31Å; L1250-F1263 WeakPolarHBondContact CD2-O 3.49Å; L1250-Y1264 HydrophobicContact CD2-CD1 3.41Å; L1250-Y1264 VanDerWaalsContact CD2-CD1 3.41Å; L1250-Y1264 HydrophobicContact CD2-CE1 3.5Å; L1250-Y1264 HydrophobicContact CD2-CG 4.12Å; L1250-Y1264 HydrophobicContact CG-CD1 4.22Å; L1250-Y1264 HydrophobicContact CG-CE1 4.27Å
1251	M	91.2	Very high	83.3	Confident	1 Å²	1	37.4 Å²	37.4	1%	0.005	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	125.9	166.8	-56.6	-56.8	-61.7	0	0	108.4	W934 I972 A974 L1253 F1263 A1265	W934-M1251 HydrophobicContact CB-CE 3.94Å; W934-M1251 HydrophobicContact CD2-CB 4.27Å; W934-M1251 HydrophobicContact CD2-CE 4.27Å; W934-M1251 HydrophobicContact CD2-CG 3.68Å; W934-M1251 HydrophobicContact CE3-CB 3.99Å; W934-M1251 HydrophobicContact CE3-CG 3.93Å; W934-M1251 HydrophobicContact CG-CE 3.9Å; W934-M1251 HydrophobicContact CG-CG 4.18Å; W934-M1251 HydrophobicContact CG-SD 4.47Å; W934-M1251 HydrophobicContact CH2-CB 4.35Å; W934-M1251 HydrophobicContact CH2-CG 4.18Å; W934-M1251 HydrophobicContact CZ2-CG 3.94Å; W934-M1251 HydrophobicContact CZ3-CB 4.02Å; W934-M1251 HydrophobicContact CZ3-CG 4.15Å; I972-M1251 HydrophobicContact CD1-CE 3.71Å; I972-M1251 HydrophobicContact CG1-CE 3.87Å; A974-M1251 HydrophobicContact CB-CE 3.86Å; A974-M1251 HydrophobicContact CB-SD 3.73Å; M1251-L1253 HydrophobicContact CB-CD1 4.16Å; M1251-F1263 PolarHBondContact N-O 2.84Å; M1251-F1263 PolarHBondContact O-N 2.9Å; M1251-F1263 VanDerWaalsContact O-N 3.09Å; M1251-A1265 HydrophobicContact CG-CB 3.76Å; M1251-A1265 HydrophobicContact SD-CB 3.92Å
1252	W	94.3	Very high	85.4	Confident	0 Å²	0	30.3 Å²	30.3	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	124.3	175	-75.9	33.1	0	0	0	109.2	I972 C973 I975 I1260 F1261 M1262 I1278 I1287 I1294 Y1306 W1314 V1316	I972-W1252 CarbonylContact C-O 3.58Å; I972-W1252 WeakPolarHBondContact CA-O 3.47Å; C973-W1252 PolarHBondContact N-O 3.32Å; C973-W1252 PolarHBondContact O-N 3.09Å; I975-W1252 HydrophobicContact CD1-CB 3.8Å; I975-W1252 HydrophobicContact CD1-CD2 3.68Å; I975-W1252 HydrophobicContact CD1-CE3 4.48Å; I975-W1252 HydrophobicContact CD1-CG 3.32Å; W1252-I1260 HydrophobicContact CB-CG2 4.23Å; W1252-I1260 HydrophobicContact CD2-CG2 4.24Å; W1252-I1260 HydrophobicContact CE3-CG2 3.84Å; W1252-I1260 HydrophobicContact CG-CG2 4.43Å; W1252-F1261 WeakPolarHBondContact CA-O 3.34Å; W1252-M1262 HydrophobicContact CD2-CG 4.11Å; W1252-M1262 HydrophobicContact CG-CG 4.1Å; W1252-M1262 HydrophobicContact CZ2-CE 3.69Å; W1252-M1262 HydrophobicContact CZ2-SD 4.06Å; W1252-I1278 HydrophobicContact CH2-CD1 4.21Å; W1252-I1278 HydrophobicContact CZ3-CD1 4.33Å; W1252-I1287 HydrophobicContact CB-CD1 4.36Å; W1252-I1294 HydrophobicContact CD2-CD1 4.16Å; W1252-I1294 HydrophobicContact CE3-CD1 4.25Å; W1252-I1294 HydrophobicContact CE3-CG2 4.01Å; W1252-I1294 HydrophobicContact CH2-CD1 3.68Å; W1252-I1294 HydrophobicContact CZ2-CD1 3.53Å; W1252-I1294 HydrophobicContact CZ3-CB 4.49Å; W1252-I1294 HydrophobicContact CZ3-CD1 4.04Å; W1252-I1294 HydrophobicContact CZ3-CG2 3.95Å; W1252-Y1306 AromaticContact CH2-CD2 4Å; W1252-Y1306 HydrophobicContact CH2-CD2 4Å; W1252-Y1306 HydrophobicContact CH2-CG 4.09Å; W1252-Y1306 AromaticContact CZ3-CD2 3.78Å; W1252-Y1306 HydrophobicContact CZ3-CD2 3.78Å; W1252-Y1306 HydrophobicContact CZ3-CE2 4.12Å; W1252-Y1306 HydrophobicContact CZ3-CG 4.35Å; W1252-W1314 HydrophobicContact CZ2-CG 4.48Å; W1252-V1316 HydrophobicContact CH2-CG1 4.42Å
1253	L	95.1	Very high	86.9	Confident	0 Å²	0	26.7 Å²	26.7	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	120.7	-179	-68.4	71.8	0	0	0	109.1	V945 L962 I969 C971 I972 M1251 I1260 F1261 F1263	V945-L1253 HydrophobicContact CG2-CD2 3.67Å; L962-L1253 HydrophobicContact CD2-CD2 3.94Å; I969-L1253 HydrophobicContact CD1-CD2 4.49Å; I969-L1253 HydrophobicContact CG2-CB 4.46Å; C971-L1253 CarbonylContact O-C 3.47Å; C971-L1253 WeakPolarHBondContact O-CA 3.34Å; I972-L1253 HydrophobicContact CB-CG 4.25Å; I972-L1253 HydrophobicContact CD1-CD1 3.89Å; I972-L1253 HydrophobicContact CD1-CD2 4.38Å; I972-L1253 HydrophobicContact CD1-CG 3.87Å; I972-L1253 HydrophobicContact CG1-CD1 4.05Å; I972-L1253 HydrophobicContact CG1-CG 3.93Å; M1251-L1253 HydrophobicContact CB-CD1 4.16Å; L1253-I1260 CarbonylContact O-C 3.36Å; L1253-I1260 VanDerWaalsContact O-CA 3.26Å; L1253-I1260 WeakPolarHBondContact O-CA 3.15Å; L1253-F1261 HydrophobicContact CB-CB 4.38Å; L1253-F1261 PolarHBondContact N-O 3.36Å; L1253-F1261 PolarHBondContact O-N 2.9Å; L1253-F1263 HydrophobicContact CD1-CD2 4.06Å; L1253-F1263 HydrophobicContact CD1-CE2 4.35Å
1254	G	95.7	Very high	87.8	Confident	0 Å²	0	26.7 Å²	26.7	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	151.6	175.1	0	0	0	0	0	112.4	T970 C971	T970-G1254 PolarHBondContact N-O 2.87Å; T970-G1254 PolarHBondContact OG1-O 2.84Å; C971-G1254 PolarHBondContact O-N 3.49Å
1255	T	95.3	Very high	88.8	Confident	0 Å²	0	21 Å²	21	0%	0	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	162.2	-177.6	56.5	0	0	0	0	113.1	R968 I969 E1257 G1258 S1259 F1261 I1284	R968-T1255 VanDerWaalsContact O-CA 3.27Å; R968-T1255 WeakPolarHBondContact O-CA 3.42Å; R968-T1255 WeakPolarHBondContact O-CB 3.49Å; I969-T1255 HydrophobicContact CG1-CG2 4.41Å; T1255-E1257 VanDerWaalsContact C-N 3.3Å; T1255-E1257 PolarHBondContact O-N 2.82Å; T1255-E1257 VanDerWaalsContact OG1-CG 3.31Å; T1255-E1257 WeakPolarHBondContact OG1-CG 3.31Å; T1255-G1258 PolarHBondContact O-N 2.8Å; T1255-G1258 VanDerWaalsContact O-N 3.16Å; T1255-S1259 PolarHBondContact N-O 3.39Å; T1255-S1259 WeakPolarHBondContact OG1-CA 3.45Å; T1255-S1259 WeakPolarHBondContact OG1-CB 3.27Å; T1255-S1259 PolarHBondContact OG1-N 2.9Å; T1255-S1259 PolarHBondContact OG1-O 3.26Å; T1255-F1261 HydrophobicContact CG2-CD2 4.09Å; T1255-F1261 HydrophobicContact CG2-CE2 3.74Å; T1255-I1284 PolarHBondContact O-N 2.86Å
1256	E	94.4	Very high	88.9	Confident	95 Å²	95	23.6 Å²	23.6	44%	0.444	13%	0.132	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-27.6	177.9	-172.8	161.2	-127.8	0	0	112.3	S967 R968 T970 G1258 G1283	S967-E1256 WeakPolarHBondContact OG-CB 3.22Å; R968-E1256 HydrophobicContact CB-CB 4.02Å; R968-E1256 WeakPolarHBondContact CB-OE2 3.41Å; R968-E1256 VanDerWaalsContact CD-OE2 3.28Å; R968-E1256 WeakPolarHBondContact CD-OE2 3.3Å; R968-E1256 IonicContact NE-OE1 3.71Å; R968-E1256 IonicContact NE-OE2 3.74Å; R968-E1256 PolarHBondContact NE-OE2 3.41Å; R968-E1256 PolarHBondContact O-N 2.7Å; T970-E1256 HydrophobicContact CG2-CB 3.98Å; E1256-G1258 PolarHBondContact O-N 2.99Å; E1256-G1283 WeakPolarHBondContact O-CA 3.22Å
1257	E	92.8	Very high	88.9	Confident	64 Å²	64	22.9 Å²	22.9	30%	0.299	13%	0.126	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-3.2	170.6	67.5	171.6	-130.4	0	0	114.9	T966 S967 T1255 S1259 K1277	T966-E1257 PolarHBondContact OG1-OE2 2.73Å; S967-E1257 WeakPolarHBondContact CB-OE2 3.36Å; S967-E1257 PolarHBondContact OG-N 3.48Å; T1255-E1257 VanDerWaalsContact C-N 3.3Å; T1255-E1257 PolarHBondContact O-N 2.82Å; T1255-E1257 VanDerWaalsContact OG1-CG 3.31Å; T1255-E1257 WeakPolarHBondContact OG1-CG 3.31Å; E1257-S1259 WeakPolarHBondContact OE1-CB 3.42Å; E1257-S1259 PolarHBondContact OE1-OG 2.79Å; E1257-K1277 IonicContact OE1-NZ 2.65Å; E1257-K1277 PolarHBondContact OE1-NZ 2.83Å
1258	G	94.2	Very high	88.8	Confident	0 Å²	0	20.8 Å²	20.8	0%	0	11%	0.112	C	C	.	.	S	Bend	trans	85.7	6.6	-178.1	0	0	0	0	0	114.9	T1255 E1256 L1280 H1282	T1255-G1258 PolarHBondContact O-N 2.8Å; T1255-G1258 VanDerWaalsContact O-N 3.16Å; E1256-G1258 PolarHBondContact O-N 2.99Å; G1258-L1280 WeakPolarHBondContact O-CB 3.32Å; G1258-L1280 PolarHBondContact O-N 3.35Å; G1258-H1282 WeakPolarHBondContact CA-O 3.13Å
1259	S	94.2	Very high	88.7	Confident	4 Å²	4	18.2 Å²	18.2	3%	0.028	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	140.1	176.7	-68.8	0	0	0	0	112.7	T1255 E1257 K1277 I1278 S1279	T1255-S1259 PolarHBondContact N-O 3.39Å; T1255-S1259 WeakPolarHBondContact OG1-CA 3.45Å; T1255-S1259 WeakPolarHBondContact OG1-CB 3.27Å; T1255-S1259 PolarHBondContact OG1-N 2.9Å; T1255-S1259 PolarHBondContact OG1-O 3.26Å; E1257-S1259 WeakPolarHBondContact OE1-CB 3.42Å; E1257-S1259 PolarHBondContact OE1-OG 2.79Å; S1259-K1277 WeakPolarHBondContact OG-CE 3.33Å; S1259-K1277 PolarHBondContact OG-NZ 3.09Å; S1259-I1278 CarbonylContact C-O 3.58Å; S1259-I1278 WeakPolarHBondContact CA-O 2.9Å; S1259-S1279 PolarHBondContact OG-OG 3.1Å
1260	I	95.1	Very high	88	Confident	0 Å²	0	22.6 Å²	22.6	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	124.5	169.4	-52.6	175.3	0	0	0	108.8	W1252 L1253 M1262 K1277 I1278 L1280 I1284 I1287 V1296	W1252-I1260 HydrophobicContact CB-CG2 4.23Å; W1252-I1260 HydrophobicContact CD2-CG2 4.24Å; W1252-I1260 HydrophobicContact CE3-CG2 3.84Å; W1252-I1260 HydrophobicContact CG-CG2 4.43Å; L1253-I1260 CarbonylContact O-C 3.36Å; L1253-I1260 VanDerWaalsContact O-CA 3.26Å; L1253-I1260 WeakPolarHBondContact O-CA 3.15Å; I1260-M1262 HydrophobicContact CG2-CG 4.4Å; I1260-K1277 WeakPolarHBondContact O-CA 3.26Å; I1260-I1278 HydrophobicContact CB-CB 4.27Å; I1260-I1278 PolarHBondContact N-O 3.3Å; I1260-I1278 PolarHBondContact O-N 3.24Å; I1260-L1280 HydrophobicContact CD1-CD1 4.05Å; I1260-I1284 HydrophobicContact CD1-CD1 4.43Å; I1260-I1284 HydrophobicContact CG1-CD1 4.2Å; I1260-I1284 HydrophobicContact CG1-CG1 4.09Å; I1260-I1287 HydrophobicContact CD1-CD1 4.43Å; I1260-I1287 HydrophobicContact CG1-CD1 4.44Å; I1260-I1287 HydrophobicContact CG2-CD1 4.14Å; I1260-V1296 HydrophobicContact CD1-CG1 3.97Å; I1260-V1296 HydrophobicContact CD1-CG2 4.14Å
1261	F	92.5	Very high	86.7	Confident	0 Å²	0	27.9 Å²	27.9	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	134.3	177.6	-61.5	-110.3	0	0	0	109.8	L962 G964 C965 W1252 L1253 T1255 F1263 Q1274 K1277	L962-F1261 HydrophobicContact CD2-CD1 4.44Å; L962-F1261 HydrophobicContact CD2-CG 4.37Å; L962-F1261 HydrophobicContact CG-CD1 4.43Å; G964-F1261 VanDerWaalsContact O-CZ 3.28Å; G964-F1261 WeakPolarHBondContact O-CZ 3.29Å; C965-F1261 HydrophobicContact CB-CE1 4.16Å; C965-F1261 HydrophobicContact CB-CE2 4.29Å; C965-F1261 HydrophobicContact CB-CZ 3.83Å; W1252-F1261 WeakPolarHBondContact CA-O 3.34Å; L1253-F1261 HydrophobicContact CB-CB 4.38Å; L1253-F1261 PolarHBondContact N-O 3.36Å; L1253-F1261 PolarHBondContact O-N 2.9Å; T1255-F1261 HydrophobicContact CG2-CD2 4.09Å; T1255-F1261 HydrophobicContact CG2-CE2 3.74Å; F1261-F1263 HydrophobicContact CB-CE2 3.73Å; F1261-F1263 HydrophobicContact CB-CZ 4.32Å; F1261-Q1274 VanDerWaalsContact CD1-CD 3.47Å; F1261-K1277 HydrophobicContact CE1-CD 4.21Å; F1261-K1277 HydrophobicContact CZ-CD 4.25Å; F1261-K1277 VanDerWaalsContact CZ-CE 3.49Å
1262	M	91.7	Very high	85.4	Confident	0 Å²	0	29 Å²	29	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	128.9	-172.5	-61.3	162.6	56	0	0	111.2	L1243 W1252 I1260 R1275 Q1276 I1278 V1316	L1243-M1262 HydrophobicContact CD1-CE 3.58Å; L1243-M1262 HydrophobicContact CD2-CE 4.22Å; L1243-M1262 HydrophobicContact CG-CE 3.99Å; W1252-M1262 HydrophobicContact CD2-CG 4.11Å; W1252-M1262 HydrophobicContact CG-CG 4.1Å; W1252-M1262 HydrophobicContact CZ2-CE 3.69Å; W1252-M1262 HydrophobicContact CZ2-SD 4.06Å; I1260-M1262 HydrophobicContact CG2-CG 4.4Å; M1262-R1275 WeakPolarHBondContact O-CB 3.29Å; M1262-R1275 PolarHBondContact O-N 3.5Å; M1262-R1275 VanDerWaalsContact O-N 3.11Å; M1262-Q1276 HydrophobicContact CB-CB 4.21Å; M1262-Q1276 HydrophobicContact CE-CB 4.06Å; M1262-Q1276 HydrophobicContact CE-CG 4.36Å; M1262-Q1276 PolarHBondContact N-O 3.49Å; M1262-Q1276 PolarHBondContact O-N 3.24Å; M1262-Q1276 HydrophobicContact SD-CB 3.91Å; M1262-Q1276 HydrophobicContact SD-CG 4.01Å; M1262-I1278 HydrophobicContact SD-CD1 3.85Å; M1262-I1278 HydrophobicContact SD-CG1 3.9Å; M1262-V1316 HydrophobicContact CE-CG1 4.13Å
1263	F	89	Confident	84	Confident	6 Å²	6	39.3 Å²	39.3	3%	0.026	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	154.7	180	-57.1	-86.2	0	0	0	110.4	W934 L962 L1250 M1251 L1253 F1261 L1269 Q1274	W934-F1263 HydrophobicContact CH2-CB 3.84Å; W934-F1263 HydrophobicContact CH2-CG 4.27Å; W934-F1263 HydrophobicContact CZ3-CB 4.25Å; W934-F1263 HydrophobicContact CZ3-CD2 4.25Å; W934-F1263 HydrophobicContact CZ3-CG 4.36Å; L962-F1263 HydrophobicContact CD1-CE1 4.47Å; L962-F1263 HydrophobicContact CD1-CE2 3.78Å; L962-F1263 HydrophobicContact CD1-CZ 3.45Å; L962-F1263 VanDerWaalsContact CD1-CZ 3.45Å; L1250-F1263 CarbonylContact C-O 3.59Å; L1250-F1263 VanDerWaalsContact CA-O 3.27Å; L1250-F1263 WeakPolarHBondContact CA-O 3.48Å; L1250-F1263 VanDerWaalsContact CD2-O 3.31Å; L1250-F1263 WeakPolarHBondContact CD2-O 3.49Å; M1251-F1263 PolarHBondContact N-O 2.84Å; M1251-F1263 PolarHBondContact O-N 2.9Å; M1251-F1263 VanDerWaalsContact O-N 3.09Å; L1253-F1263 HydrophobicContact CD1-CD2 4.06Å; L1253-F1263 HydrophobicContact CD1-CE2 4.35Å; F1261-F1263 HydrophobicContact CB-CE2 3.73Å; F1261-F1263 HydrophobicContact CB-CZ 4.32Å; F1263-L1269 HydrophobicContact CD1-CD2 3.34Å; F1263-L1269 HydrophobicContact CE1-CD2 3.65Å; F1263-L1269 HydrophobicContact CG-CD2 3.98Å; F1263-Q1274 VanDerWaalsContact CE1-CA 3.5Å; F1263-Q1274 HydrophobicContact CE1-CB 3.95Å; F1263-Q1274 HydrophobicContact CE1-CG 4.37Å; F1263-Q1274 HydrophobicContact CZ-CB 4.15Å; F1263-Q1274 HydrophobicContact CZ-CG 4.25Å
1264	Y	86.7	Confident	83	Confident	6 Å²	6	41.9 Å²	41.9	2%	0.024	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	141.8	160.7	-67.8	-68.4	0	0	0	109	T1244 S1245 Q1248 P1249 L1250 S1266 D1267 R1275	T1244-Y1264 PolarHBondContact N-OH 3.48Å; S1245-Y1264 PolarHBondContact N-OH 3.23Å; S1245-Y1264 PolarHBondContact O-OH 2.88Å; Q1248-Y1264 HydrophobicContact CB-CD1 3.44Å; Q1248-Y1264 VanDerWaalsContact CB-CD1 3.44Å; Q1248-Y1264 HydrophobicContact CB-CE1 3.76Å; Q1248-Y1264 HydrophobicContact CB-CG 4.28Å; Q1248-Y1264 HydrophobicContact CG-CD1 4.47Å; P1249-Y1264 WeakPolarHBondContact O-CA 3.22Å; L1250-Y1264 HydrophobicContact CD2-CD1 3.41Å; L1250-Y1264 VanDerWaalsContact CD2-CD1 3.41Å; L1250-Y1264 HydrophobicContact CD2-CE1 3.5Å; L1250-Y1264 HydrophobicContact CD2-CG 4.12Å; L1250-Y1264 HydrophobicContact CG-CD1 4.22Å; L1250-Y1264 HydrophobicContact CG-CE1 4.27Å; Y1264-S1266 PolarHBondContact O-N 2.83Å; Y1264-S1266 VanDerWaalsContact O-N 3.09Å; Y1264-D1267 PolarHBondContact N-OD2 2.89Å; Y1264-D1267 VanDerWaalsContact O-CB 3.28Å; Y1264-D1267 WeakPolarHBondContact O-CB 3.11Å; Y1264-D1267 PolarHBondContact O-N 3.16Å; Y1264-R1275 HydrophobicContact CD2-CG 3.99Å; Y1264-R1275 HydrophobicContact CE2-CG 4.23Å
1265	A	82.5	Confident	81.9	Confident	4 Å²	4	46.4 Å²	46.4	3%	0.033	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-16.5	-177.5	0	0	0	0	0	112.9	I920 W934 P1249 M1251	I920-A1265 HydrophobicContact CD1-CB 3.94Å; I920-A1265 WeakPolarHBondContact CD1-O 3.35Å; I920-A1265 HydrophobicContact CG1-CB 4.15Å; I920-A1265 HydrophobicContact CG2-CB 3.74Å; W934-A1265 PolarHBondContact NE1-O 3.33Å; P1249-A1265 HydrophobicContact CB-CB 4.19Å; P1249-A1265 HydrophobicContact CG-CB 4.01Å; P1249-A1265 PolarHBondContact O-N 2.81Å; M1251-A1265 HydrophobicContact CG-CB 3.76Å; M1251-A1265 HydrophobicContact SD-CB 3.92Å
1266	S	76.5	Confident	81.3	Confident	81 Å²	81	48.1 Å²	48.1	57%	0.566	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92	4	171.6	58.8	0	0	0	0	114.7	Y1264 N1268	Y1264-S1266 PolarHBondContact O-N 2.83Å; Y1264-S1266 VanDerWaalsContact O-N 3.09Å; S1266-N1268 PolarHBondContact O-N 3.49Å
1267	D	76.6	Confident	81	Confident	12 Å²	12	47.3 Å²	47.3	6%	0.064	23%	0.228	C	C	.	.			trans	-72.9	117.3	178.8	-77.9	-23.7	0	0	0	110.8	Y1264 L1269 R1275	Y1264-D1267 PolarHBondContact N-OD2 2.89Å; Y1264-D1267 VanDerWaalsContact O-CB 3.28Å; Y1264-D1267 WeakPolarHBondContact O-CB 3.11Å; Y1264-D1267 PolarHBondContact O-N 3.16Å; D1267-L1269 HydrophobicContact CB-CD2 4.19Å; D1267-L1269 PolarHBondContact O-N 3.12Å; D1267-R1275 IonicContact OD1-CZ 2.8Å; D1267-R1275 IonicContact OD1-NE 2.69Å; D1267-R1275 PolarHBondContact OD1-NE 3.09Å; D1267-R1275 IonicContact OD1-NH2 3.81Å; D1267-R1275 PolarHBondContact OD1-NH2 2.82Å; D1267-R1275 WeakPolarHBondContact OD2-CG 3.47Å; D1267-R1275 IonicContact OD2-CZ 3.37Å; D1267-R1275 IonicContact OD2-NE 2.74Å; D1267-R1275 PolarHBondContact OD2-NE 3.3Å; D1267-R1275 IonicContact OD2-NH2 2.74Å
1268	N	74.8	Confident	81	Confident	47 Å²	47	45.2 Å²	45.2	25%	0.251	22%	0.218	S	C	.	.			trans	-71.6	99.4	167.1	-177.2	-0.1	0	0	0	109.4	Y957 S1266 K1270 T1271 S1272	Y957-N1268 HydrophobicContact CE1-CB 4.5Å; S1266-N1268 PolarHBondContact O-N 3.49Å; N1268-K1270 PolarHBondContact O-N 2.85Å; N1268-K1270 VanDerWaalsContact O-N 3.11Å; N1268-K1270 WeakPolarHBondContact OD1-CB 3.37Å; N1268-K1270 PolarHBondContact OD1-N 3.39Å; N1268-T1271 PolarHBondContact O-N 3.36Å; N1268-T1271 PolarHBondContact O-OG1 3.32Å; N1268-S1272 WeakPolarHBondContact O-CB 3.45Å; N1268-S1272 PolarHBondContact O-N 3.26Å
1269	L	77.1	Confident	80.9	Confident	23 Å²	23	49.2 Å²	49.2	12%	0.12	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64	-14.6	-175.4	-61.2	-172.3	0	0	0	114.4	W934 V945 F958 V960 F1263 D1267 T1271	W934-L1269 HydrophobicContact CH2-CD1 3.92Å; W934-L1269 HydrophobicContact CH2-CD2 4.11Å; W934-L1269 HydrophobicContact CH2-CG 4.1Å; W934-L1269 HydrophobicContact CZ3-CD1 3.81Å; W934-L1269 HydrophobicContact CZ3-CG 4.48Å; V945-L1269 HydrophobicContact CB-CD1 3.89Å; V945-L1269 HydrophobicContact CG1-CD1 3.84Å; V945-L1269 HydrophobicContact CG2-CD1 4.44Å; F958-L1269 HydrophobicContact CD2-CB 4.48Å; F958-L1269 HydrophobicContact CE1-CB 4.27Å; F958-L1269 HydrophobicContact CE1-CG 4.24Å; F958-L1269 HydrophobicContact CE2-CB 4.07Å; F958-L1269 HydrophobicContact CE2-CD1 3.75Å; F958-L1269 HydrophobicContact CE2-CG 3.96Å; F958-L1269 HydrophobicContact CZ-CB 3.95Å; F958-L1269 HydrophobicContact CZ-CD1 3.83Å; F958-L1269 HydrophobicContact CZ-CG 3.62Å; V960-L1269 HydrophobicContact CG2-CB 3.69Å; V960-L1269 HydrophobicContact CG2-CD1 4.44Å; F1263-L1269 HydrophobicContact CD1-CD2 3.34Å; F1263-L1269 HydrophobicContact CE1-CD2 3.65Å; F1263-L1269 HydrophobicContact CG-CD2 3.98Å; D1267-L1269 HydrophobicContact CB-CD2 4.19Å; D1267-L1269 PolarHBondContact O-N 3.12Å; L1269-T1271 PolarHBondContact O-N 3.07Å
1270	K	70	Confident	80.8	Confident	127 Å²	127	50.7 Å²	50.7	55%	0.552	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-21.5	168.6	-69	167.3	167.3	164	0	112.8	Y957 F958 V960 N1268	Y957-K1270 PolarHBondContact O-NZ 3.1Å; F958-K1270 HydrophobicContact CB-CD 3.89Å; F958-K1270 VanDerWaalsContact CB-CE 3.47Å; F958-K1270 HydrophobicContact CB-CG 3.98Å; V960-K1270 HydrophobicContact CG1-CG 3.69Å; N1268-K1270 PolarHBondContact O-N 2.85Å; N1268-K1270 VanDerWaalsContact O-N 3.11Å; N1268-K1270 WeakPolarHBondContact OD1-CB 3.37Å; N1268-K1270 PolarHBondContact OD1-N 3.39Å
1271	T	62	Low	80.4	Confident	116 Å²	116	55.5 Å²	55.5	71%	0.712	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-131.1	-25.2	-173.4	50.2	0	0	0	0	114.3	N1268 L1269	N1268-T1271 PolarHBondContact O-N 3.36Å; N1268-T1271 PolarHBondContact O-OG1 3.32Å; L1269-T1271 PolarHBondContact O-N 3.07Å
1272	S	62.4	Low	80.5	Confident	24 Å²	24	59.5 Å²	59.5	17%	0.168	31%	0.306	C	S	.	.	P	Polyproline II helix	trans	-89.5	129.9	-178.8	-170	0	0	0	0	111.1	N1268 R1275	N1268-S1272 WeakPolarHBondContact O-CB 3.45Å; N1268-S1272 PolarHBondContact O-N 3.26Å; S1272-R1275 PolarHBondContact OG-NE 3.22Å; S1272-R1275 PolarHBondContact OG-NH2 3.3Å
1273	R	66.4	Low	80.7	Confident	216 Å²	216	60.2 Å²	60.2	82%	0.815	31%	0.313	S	S	*	.	P	Polyproline II helix	trans	-71.4	158.6	165.4	-63.8	-175.5	-179.6	-171.9	-0.8	110.3	R1275	R1273-R1275 PolarHBondContact O-N 2.89Å
1274	Q	72.8	Confident	81	Confident	54 Å²	54	60 Å²	60	25%	0.252	31%	0.312	S	S	.	.	P	Polyproline II helix	trans	-49.5	133.4	168.1	177	173.6	12.8	0	0	111	F1261 F1263 Q1276 K1277	F1261-Q1274 VanDerWaalsContact CD1-CD 3.47Å; F1263-Q1274 VanDerWaalsContact CE1-CA 3.5Å; F1263-Q1274 HydrophobicContact CE1-CB 3.95Å; F1263-Q1274 HydrophobicContact CE1-CG 4.37Å; F1263-Q1274 HydrophobicContact CZ-CB 4.15Å; F1263-Q1274 HydrophobicContact CZ-CG 4.25Å; Q1274-Q1276 WeakPolarHBondContact CG-O 3.37Å; Q1274-Q1276 PolarHBondContact NE2-O 3.15Å; Q1274-K1277 VanDerWaalsContact NE2-CA 3.32Å
1275	R	73.6	Confident	81.5	Confident	96 Å²	96	61.2 Å²	61.2	36%	0.362	32%	0.319	S	S	.	.	S	Bend	trans	-78.9	-41.5	-178.9	-56	-55.7	-171.5	168.1	2.4	111.5	L1243 M1262 Y1264 D1267 S1272 R1273	L1243-R1275 HydrophobicContact CD2-CB 4.41Å; M1262-R1275 WeakPolarHBondContact O-CB 3.29Å; M1262-R1275 PolarHBondContact O-N 3.5Å; M1262-R1275 VanDerWaalsContact O-N 3.11Å; Y1264-R1275 HydrophobicContact CD2-CG 3.99Å; Y1264-R1275 HydrophobicContact CE2-CG 4.23Å; D1267-R1275 IonicContact OD1-CZ 2.8Å; D1267-R1275 IonicContact OD1-NE 2.69Å; D1267-R1275 PolarHBondContact OD1-NE 3.09Å; D1267-R1275 IonicContact OD1-NH2 3.81Å; D1267-R1275 PolarHBondContact OD1-NH2 2.82Å; D1267-R1275 WeakPolarHBondContact OD2-CG 3.47Å; D1267-R1275 IonicContact OD2-CZ 3.37Å; D1267-R1275 IonicContact OD2-NE 2.74Å; D1267-R1275 PolarHBondContact OD2-NE 3.3Å; D1267-R1275 IonicContact OD2-NH2 2.74Å; S1272-R1275 PolarHBondContact OG-NE 3.22Å; S1272-R1275 PolarHBondContact OG-NH2 3.3Å; R1273-R1275 PolarHBondContact O-N 2.89Å
1276	Q	82.1	Confident	82.2	Confident	35 Å²	35	61.7 Å²	61.7	16%	0.164	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.2	148.6	176	-171.6	162.3	15.5	0	0	111.5	M1262 Q1274	M1262-Q1276 HydrophobicContact CB-CB 4.21Å; M1262-Q1276 HydrophobicContact CE-CB 4.06Å; M1262-Q1276 HydrophobicContact CE-CG 4.36Å; M1262-Q1276 PolarHBondContact N-O 3.49Å; M1262-Q1276 PolarHBondContact O-N 3.24Å; M1262-Q1276 HydrophobicContact SD-CB 3.91Å; M1262-Q1276 HydrophobicContact SD-CG 4.01Å; Q1274-Q1276 WeakPolarHBondContact CG-O 3.37Å; Q1274-Q1276 PolarHBondContact NE2-O 3.15Å
1277	K	88.5	Confident	83.2	Confident	79 Å²	79	58.3 Å²	58.3	34%	0.343	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	135.9	165.8	-160.2	169.4	-179	177.9	0	108	G964 E1257 S1259 I1260 F1261 Q1274	G964-K1277 PolarHBondContact O-NZ 3.41Å; E1257-K1277 IonicContact OE1-NZ 2.65Å; E1257-K1277 PolarHBondContact OE1-NZ 2.83Å; S1259-K1277 WeakPolarHBondContact OG-CE 3.33Å; S1259-K1277 PolarHBondContact OG-NZ 3.09Å; I1260-K1277 WeakPolarHBondContact O-CA 3.26Å; F1261-K1277 HydrophobicContact CE1-CD 4.21Å; F1261-K1277 HydrophobicContact CZ-CD 4.25Å; F1261-K1277 VanDerWaalsContact CZ-CE 3.49Å; Q1274-K1277 VanDerWaalsContact NE2-CA 3.32Å
1278	I	92.1	Very high	84.1	Confident	20 Å²	20	58.8 Å²	58.8	10%	0.103	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	127.1	160.8	-53.3	175.5	0	0	0	105.5	W1252 S1259 I1260 M1262 L1280 Y1306 V1316	W1252-I1278 HydrophobicContact CH2-CD1 4.21Å; W1252-I1278 HydrophobicContact CZ3-CD1 4.33Å; S1259-I1278 CarbonylContact C-O 3.58Å; S1259-I1278 WeakPolarHBondContact CA-O 2.9Å; I1260-I1278 HydrophobicContact CB-CB 4.27Å; I1260-I1278 PolarHBondContact N-O 3.3Å; I1260-I1278 PolarHBondContact O-N 3.24Å; M1262-I1278 HydrophobicContact SD-CD1 3.85Å; M1262-I1278 HydrophobicContact SD-CG1 3.9Å; I1278-L1280 HydrophobicContact CG2-CD2 4.18Å; I1278-L1280 HydrophobicContact CG2-CG 4.21Å; I1278-Y1306 HydrophobicContact CD1-CE1 4.24Å; I1278-V1316 HydrophobicContact CD1-CB 4.16Å; I1278-V1316 HydrophobicContact CD1-CG1 3.93Å
1279	S	91.9	Very high	84.9	Confident	84 Å²	84	57.3 Å²	57.3	59%	0.587	29%	0.29	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.6	111.9	173.2	-72.6	0	0	0	0	108.8	S1259	S1259-S1279 PolarHBondContact OG-OG 3.1Å
1280	L	92.4	Very high	85.5	Confident	35 Å²	35	58.1 Å²	58.1	18%	0.183	29%	0.293	C	S	.	.			trans	-95	162	171.6	-59.8	172.4	0	0	0	109	G1258 I1260 I1278 H1282 I1284 V1296 I1304	G1258-L1280 WeakPolarHBondContact O-CB 3.32Å; G1258-L1280 PolarHBondContact O-N 3.35Å; I1260-L1280 HydrophobicContact CD1-CD1 4.05Å; I1278-L1280 HydrophobicContact CG2-CD2 4.18Å; I1278-L1280 HydrophobicContact CG2-CG 4.21Å; L1280-H1282 VanDerWaalsContact C-N 3.3Å; L1280-H1282 PolarHBondContact O-N 3.34Å; L1280-I1284 HydrophobicContact CB-CD1 4.43Å; L1280-I1284 HydrophobicContact CD1-CD1 3.78Å; L1280-V1296 HydrophobicContact CD1-CG1 4.28Å; L1280-I1304 HydrophobicContact CD1-CD1 3.92Å; L1280-I1304 HydrophobicContact CD2-CD1 3.92Å
1281	S	87.5	Confident	86.1	Confident	100 Å²	100	57 Å²	57	70%	0.699	29%	0.293	S	S	*	.	S	Bend	trans	-78.4	-7.3	-171.9	44.6	0	0	0	0	115.2
1282	H	93.9	Very high	87.1	Confident	85 Å²	85	54.5 Å²	54.5	39%	0.394	28%	0.277	S	S	.	.	S	Bend	trans	-148.3	151.7	-174.6	-55.4	91.1	0	0	0	110.6	G1258 L1280 N1300	G1258-H1282 WeakPolarHBondContact CA-O 3.13Å; L1280-H1282 VanDerWaalsContact C-N 3.3Å; L1280-H1282 PolarHBondContact O-N 3.34Å; H1282-N1300 HydrophobicContact CB-CB 4.11Å; H1282-N1300 PolarHBondContact ND1-ND2 2.9Å
1283	G	95.1	Very high	88.5	Confident	14 Å²	14	54 Å²	54	14%	0.144	27%	0.272	C	S	.	.			trans	-52.3	147.7	-177	0	0	0	0	0	115.4	E1256 C1298 A1299	E1256-G1283 WeakPolarHBondContact O-CA 3.22Å; G1283-C1298 CarbonylContact O-C 3.54Å; G1283-C1298 WeakPolarHBondContact O-CA 3.25Å; G1283-A1299 WeakPolarHBondContact O-CB 3.47Å; G1283-A1299 PolarHBondContact O-N 2.88Å
1284	I	97	Very high	89.8	Confident	2 Å²	2	43.7 Å²	43.7	1%	0.01	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	115.1	-177.9	-47.8	-54.8	0	0	0	109.8	T970 T1255 I1260 L1280 I1287 V1296	T970-I1284 VanDerWaalsContact CB-O 3.31Å; T970-I1284 WeakPolarHBondContact CB-O 3.33Å; T970-I1284 PolarHBondContact OG1-O 2.85Å; T1255-I1284 PolarHBondContact O-N 2.86Å; I1260-I1284 HydrophobicContact CD1-CD1 4.43Å; I1260-I1284 HydrophobicContact CG1-CD1 4.2Å; I1260-I1284 HydrophobicContact CG1-CG1 4.09Å; L1280-I1284 HydrophobicContact CB-CD1 4.43Å; L1280-I1284 HydrophobicContact CD1-CD1 3.78Å; I1284-I1287 HydrophobicContact CG2-CD1 4.23Å; I1284-I1287 HydrophobicContact CG2-CG1 3.82Å; I1284-V1296 HydrophobicContact CD1-CG1 4.14Å; I1284-V1296 HydrophobicContact CG2-CG1 3.92Å
1285	N	95.8	Very high	91	Very high	32 Å²	32	41.1 Å²	41.1	17%	0.171	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	-46.9	174.8	-69.5	-33.4	0	0	0	111.1	A1297 C1298 V1334	N1285-A1297 HydrophobicContact CB-CB 4.45Å; N1285-A1297 WeakPolarHBondContact CB-O 3.29Å; N1285-A1297 PolarHBondContact N-O 3.33Å; N1285-C1298 PolarHBondContact ND2-O 2.8Å; N1285-V1334 WeakPolarHBondContact CB-O 3.48Å; N1285-V1334 PolarHBondContact ND2-O 2.97Å
1286	N	97	Very high	92.1	Very high	13 Å²	13	36.6 Å²	36.6	7%	0.07	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.5	142.3	-171.9	-168.2	-128.4	0	0	0	112.9	A1297 M1337	N1286-A1297 HydrophobicContact CB-CB 4.47Å; N1286-A1297 PolarHBondContact N-O 3.04Å; N1286-A1297 PolarHBondContact O-N 3.37Å; N1286-M1337 HydrophobicContact CB-CE 4.19Å; N1286-M1337 VanDerWaalsContact O-CE 3.3Å; N1286-M1337 WeakPolarHBondContact O-CE 3.45Å; N1286-M1337 WeakPolarHBondContact OD1-CB 3.35Å; N1286-M1337 PolarHBondContact OD1-N 3.48Å
1287	I	97.4	Very high	92.8	Very high	10 Å²	10	34.9 Å²	34.9	5%	0.051	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	132.8	172.2	-58.3	174.7	0	0	0	108.4	C973 W1252 I1260 I1284 I1294 F1295 V1296	C973-I1287 HydrophobicContact CB-CB 4.01Å; C973-I1287 HydrophobicContact CB-CG2 3.67Å; W1252-I1287 HydrophobicContact CB-CD1 4.36Å; I1260-I1287 HydrophobicContact CD1-CD1 4.43Å; I1260-I1287 HydrophobicContact CG1-CD1 4.44Å; I1260-I1287 HydrophobicContact CG2-CD1 4.14Å; I1284-I1287 HydrophobicContact CG2-CD1 4.23Å; I1284-I1287 HydrophobicContact CG2-CG1 3.82Å; I1287-I1294 HydrophobicContact CG2-CG2 3.71Å; I1287-F1295 CarbonylContact C-O 3.56Å; I1287-F1295 WeakPolarHBondContact CA-O 3.37Å; I1287-V1296 HydrophobicContact CG1-CG1 4.41Å; I1287-V1296 HydrophobicContact CG1-CG2 4.27Å; I1287-V1296 HydrophobicContact CG2-CG2 4.42Å
1288	L	96.2	Very high	93.2	Very high	22 Å²	22	31.3 Å²	31.3	12%	0.115	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	119.7	-179.6	177.8	65.6	0	0	0	111.2	F1295 M1337 V1339 I1344	L1288-F1295 HydrophobicContact CB-CB 4.47Å; L1288-F1295 PolarHBondContact N-O 2.74Å; L1288-F1295 PolarHBondContact O-N 2.98Å; L1288-M1337 HydrophobicContact CB-CB 4.2Å; L1288-M1337 HydrophobicContact CB-CE 4.02Å; L1288-M1337 HydrophobicContact CD2-CB 3.63Å; L1288-V1339 HydrophobicContact CD1-CG2 4.2Å; L1288-V1339 HydrophobicContact CD2-CG2 4.08Å; L1288-V1339 HydrophobicContact CG-CG2 4.45Å; L1288-I1344 HydrophobicContact CD2-CD1 4.28Å; L1288-I1344 HydrophobicContact CD2-CG1 4.35Å; L1288-I1344 HydrophobicContact CD2-CG2 3.86Å
1289	H	92.5	Very high	93.3	Very high	17 Å²	17	32.3 Å²	32.3	8%	0.079	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	134.9	168.9	174.6	-99.1	0	0	0	111.6	I975 W1314	I975-H1289 HydrophobicContact CG1-CB 3.91Å; H1289-W1314 AromaticContact CD2-CH2 3.94Å
1290	F	89.6	Confident	93.4	Very high	40 Å²	40	30.4 Å²	30.4	18%	0.175	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	124.6	168.5	-176	-101.7	0	0	0	112.7	V1292 H1293 F1295 V1339 I1344 P1357	F1290-V1292 PolarHBondContact O-N 3.13Å; F1290-H1293 PolarHBondContact N-O 3.49Å; F1290-H1293 PolarHBondContact O-N 2.66Å; F1290-F1295 HydrophobicContact CB-CE2 4.32Å; F1290-V1339 HydrophobicContact CB-CG2 4.15Å; F1290-V1339 HydrophobicContact CD2-CB 4.31Å; F1290-V1339 HydrophobicContact CD2-CG1 3.74Å; F1290-V1339 HydrophobicContact CD2-CG2 3.55Å; F1290-V1339 HydrophobicContact CE2-CG1 3.54Å; F1290-V1339 HydrophobicContact CE2-CG2 4.25Å; F1290-V1339 HydrophobicContact CG-CG2 4.05Å; F1290-V1339 HydrophobicContact CZ-CG1 4.4Å; F1290-I1344 HydrophobicContact CB-CD1 4.42Å; F1290-P1357 HydrophobicContact CD1-CB 3.59Å; F1290-P1357 HydrophobicContact CD1-CG 3.84Å; F1290-P1357 HydrophobicContact CE1-CB 3.77Å; F1290-P1357 HydrophobicContact CE1-CG 3.46Å; F1290-P1357 VanDerWaalsContact CE1-CG 3.46Å; F1290-P1357 HydrophobicContact CZ-CG 4.46Å
1291	D	82.3	Confident	93.4	Very high	103 Å²	103	29.7 Å²	29.7	55%	0.551	18%	0.177	S	C	*	.	T	Hydrogen-bonded Turn	trans	53	-90.9	-179.1	-167.2	35.6	0	0	0	114.9
1292	V	82.8	Confident	93.7	Very high	64 Å²	64	27.5 Å²	27.5	39%	0.388	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-119.6	12.6	-179.9	-61.9	0	0	0	0	113.3	F1290 R1308 W1314	F1290-V1292 PolarHBondContact O-N 3.13Å; V1292-R1308 PolarHBondContact O-N 3.27Å; V1292-W1314 WeakPolarHBondContact O-CZ3 3.5Å
1293	H	91	Very high	93.8	Very high	13 Å²	13	23.5 Å²	23.5	6%	0.06	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	146	-172.8	-64	115.9	0	0	0	112	F1290 F1295 V1305 Y1306 K1307 P1357	F1290-H1293 PolarHBondContact N-O 3.49Å; F1290-H1293 PolarHBondContact O-N 2.66Å; H1293-F1295 HydrophobicContact CB-CD2 4.11Å; H1293-F1295 HydrophobicContact CB-CE2 3.37Å; H1293-F1295 HydrophobicContact CB-CZ 3.76Å; H1293-V1305 HydrophobicContact CB-CG1 4.02Å; H1293-Y1306 WeakPolarHBondContact CA-O 3.49Å; H1293-K1307 VanDerWaalsContact CD2-CG 3.44Å; H1293-K1307 WeakPolarHBondContact CD2-CG 3.47Å; H1293-K1307 WeakPolarHBondContact NE2-CE 3.46Å; H1293-P1357 PolarHBondContact CE1-O 3.49Å; H1293-P1357 PolarHBondContact ND1-O 3.25Å; H1293-P1357 VanDerWaalsContact ND1-O 3.11Å
1294	I	94.8	Very high	93.8	Very high	0 Å²	0	23 Å²	23	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	121.7	162.4	-60.6	159.9	0	0	0	107.5	I975 W1252 I1287 V1296 V1305 Y1306 W1314	I975-I1294 HydrophobicContact CD1-CD1 3.52Å; I975-I1294 HydrophobicContact CD1-CG1 4.02Å; I975-I1294 HydrophobicContact CG1-CD1 4.03Å; I975-I1294 HydrophobicContact CG1-CG1 4.15Å; I975-I1294 HydrophobicContact CG2-CD1 4.25Å; W1252-I1294 HydrophobicContact CD2-CD1 4.16Å; W1252-I1294 HydrophobicContact CE3-CD1 4.25Å; W1252-I1294 HydrophobicContact CE3-CG2 4.01Å; W1252-I1294 HydrophobicContact CH2-CD1 3.68Å; W1252-I1294 HydrophobicContact CZ2-CD1 3.53Å; W1252-I1294 HydrophobicContact CZ3-CB 4.49Å; W1252-I1294 HydrophobicContact CZ3-CD1 4.04Å; W1252-I1294 HydrophobicContact CZ3-CG2 3.95Å; I1287-I1294 HydrophobicContact CG2-CG2 3.71Å; I1294-V1296 HydrophobicContact CG2-CG2 4.21Å; I1294-V1305 CarbonylContact O-C 3.58Å; I1294-V1305 WeakPolarHBondContact O-CA 3.45Å; I1294-Y1306 PolarHBondContact N-O 2.86Å; I1294-Y1306 PolarHBondContact O-N 2.99Å; I1294-W1314 HydrophobicContact CB-CZ3 4.49Å; I1294-W1314 HydrophobicContact CD1-CD2 3.63Å; I1294-W1314 HydrophobicContact CD1-CE3 3.7Å; I1294-W1314 HydrophobicContact CD1-CG 4.35Å; I1294-W1314 HydrophobicContact CD1-CH2 3.81Å; I1294-W1314 HydrophobicContact CD1-CZ2 3.71Å; I1294-W1314 HydrophobicContact CD1-CZ3 3.79Å; I1294-W1314 HydrophobicContact CG1-CD2 4.48Å; I1294-W1314 HydrophobicContact CG1-CE3 4.14Å; I1294-W1314 HydrophobicContact CG1-CH2 3.64Å; I1294-W1314 HydrophobicContact CG1-CZ2 3.97Å; I1294-W1314 HydrophobicContact CG1-CZ3 3.72Å
1295	F	96.7	Very high	93.8	Very high	0 Å²	0	23 Å²	23	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	135.2	176.1	-59.1	-100.5	0	0	0	108.9	I1287 L1288 F1290 H1293 L1303 I1304 V1305 M1337 I1344 L1355 P1357 L1360	I1287-F1295 CarbonylContact C-O 3.56Å; I1287-F1295 WeakPolarHBondContact CA-O 3.37Å; L1288-F1295 HydrophobicContact CB-CB 4.47Å; L1288-F1295 PolarHBondContact N-O 2.74Å; L1288-F1295 PolarHBondContact O-N 2.98Å; F1290-F1295 HydrophobicContact CB-CE2 4.32Å; H1293-F1295 HydrophobicContact CB-CD2 4.11Å; H1293-F1295 HydrophobicContact CB-CE2 3.37Å; H1293-F1295 HydrophobicContact CB-CZ 3.76Å; F1295-L1303 HydrophobicContact CB-CD1 4.4Å; F1295-I1304 CarbonylContact C-O 3.54Å; F1295-I1304 WeakPolarHBondContact CA-O 3.19Å; F1295-V1305 HydrophobicContact CD1-CB 4.48Å; F1295-V1305 HydrophobicContact CD1-CG1 4.27Å; F1295-V1305 HydrophobicContact CD1-CG2 3.46Å; F1295-V1305 VanDerWaalsContact CD1-CG2 3.46Å; F1295-V1305 HydrophobicContact CE1-CG1 4.07Å; F1295-V1305 HydrophobicContact CE1-CG2 3.68Å; F1295-V1305 HydrophobicContact CG-CG2 4.31Å; F1295-V1305 HydrophobicContact CZ-CG1 4.3Å; F1295-M1337 HydrophobicContact CB-CE 4.01Å; F1295-M1337 HydrophobicContact CB-SD 3.79Å; F1295-I1344 HydrophobicContact CD1-CD1 4.06Å; F1295-I1344 HydrophobicContact CD2-CD1 3.53Å; F1295-I1344 HydrophobicContact CE1-CD1 3.8Å; F1295-I1344 HydrophobicContact CE2-CD1 3.23Å; F1295-I1344 HydrophobicContact CG-CD1 3.96Å; F1295-I1344 HydrophobicContact CZ-CD1 3.41Å; F1295-I1344 VanDerWaalsContact CZ-CD1 3.41Å; F1295-L1355 HydrophobicContact CD1-CD2 4.05Å; F1295-L1355 HydrophobicContact CE1-CD2 3.8Å; F1295-P1357 HydrophobicContact CZ-CB 4.13Å; F1295-L1360 HydrophobicContact CE1-CD2 3.75Å; F1295-L1360 HydrophobicContact CZ-CD2 3.92Å
1296	V	97.5	Very high	93.7	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	117.9	-179.5	-179.6	0	0	0	0	108.3	I1260 L1280 I1284 I1287 I1294 I1304 Y1306	I1260-V1296 HydrophobicContact CD1-CG1 3.97Å; I1260-V1296 HydrophobicContact CD1-CG2 4.14Å; L1280-V1296 HydrophobicContact CD1-CG1 4.28Å; I1284-V1296 HydrophobicContact CD1-CG1 4.14Å; I1284-V1296 HydrophobicContact CG2-CG1 3.92Å; I1287-V1296 HydrophobicContact CG1-CG1 4.41Å; I1287-V1296 HydrophobicContact CG1-CG2 4.27Å; I1287-V1296 HydrophobicContact CG2-CG2 4.42Å; I1294-V1296 HydrophobicContact CG2-CG2 4.21Å; V1296-I1304 HydrophobicContact CB-CB 4.39Å; V1296-I1304 PolarHBondContact N-O 2.96Å; V1296-I1304 PolarHBondContact O-N 3.02Å; V1296-Y1306 HydrophobicContact CG2-CD2 4.06Å; V1296-Y1306 HydrophobicContact CG2-CE2 3.87Å
1297	A	97.2	Very high	93.4	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	122.9	176.5	0	0	0	0	0	110.3	N1285 N1286 L1303 V1334 M1337	N1285-A1297 HydrophobicContact CB-CB 4.45Å; N1285-A1297 WeakPolarHBondContact CB-O 3.29Å; N1285-A1297 PolarHBondContact N-O 3.33Å; N1286-A1297 HydrophobicContact CB-CB 4.47Å; N1286-A1297 PolarHBondContact N-O 3.04Å; N1286-A1297 PolarHBondContact O-N 3.37Å; A1297-L1303 HydrophobicContact CB-CD1 4.47Å; A1297-V1334 HydrophobicContact CB-CB 3.87Å; A1297-V1334 HydrophobicContact CB-CG1 3.91Å; A1297-V1334 WeakPolarHBondContact CB-O 3.46Å; A1297-M1337 HydrophobicContact CB-CE 3.81Å; A1297-M1337 HydrophobicContact CB-SD 4.27Å
1298	C	96.9	Very high	92.8	Very high	4 Å²	4	26.2 Å²	26.2	3%	0.027	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	155.6	-177	-51.4	0	0	0	0	111.6	G1283 N1285 N1300 G1301 D1302	G1283-C1298 CarbonylContact O-C 3.54Å; G1283-C1298 WeakPolarHBondContact O-CA 3.25Å; N1285-C1298 PolarHBondContact ND2-O 2.8Å; C1298-N1300 WeakPolarHBondContact CB-OD1 3.39Å; C1298-N1300 PolarHBondContact O-N 3.31Å; C1298-G1301 PolarHBondContact O-N 3.44Å; C1298-D1302 HydrophobicContact CB-CB 4.09Å; C1298-D1302 WeakPolarHBondContact CB-O 3.45Å; C1298-D1302 PolarHBondContact N-O 2.9Å
1299	A	94.5	Very high	92.2	Very high	40 Å²	40	28.3 Å²	28.3	33%	0.331	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-27.5	-175.7	0	0	0	0	0	113.8	G1283 G1301 I1333	G1283-A1299 WeakPolarHBondContact O-CB 3.47Å; G1283-A1299 PolarHBondContact O-N 2.88Å; A1299-G1301 VanDerWaalsContact C-N 3.29Å; A1299-G1301 PolarHBondContact O-N 2.93Å; A1299-I1333 WeakPolarHBondContact O-CD1 3.45Å; A1299-I1333 WeakPolarHBondContact O-CG2 3.25Å
1300	N	93.1	Very high	91.5	Very high	44 Å²	44	33.4 Å²	33.4	24%	0.235	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.4	-0.1	174.6	71.1	-29.3	0	0	0	114.5	H1282 C1298 D1302 P1331	H1282-N1300 HydrophobicContact CB-CB 4.11Å; H1282-N1300 PolarHBondContact ND1-ND2 2.9Å; C1298-N1300 WeakPolarHBondContact CB-OD1 3.39Å; C1298-N1300 PolarHBondContact O-N 3.31Å; N1300-D1302 PolarHBondContact ND2-OD2 3.42Å; N1300-D1302 WeakPolarHBondContact OD1-CB 3.4Å; N1300-D1302 PolarHBondContact OD1-N 2.94Å; N1300-D1302 VanDerWaalsContact OD1-N 3.12Å; N1300-P1331 WeakPolarHBondContact O-CB 3.26Å
1301	G	92.7	Very high	91	Very high	20 Å²	20	35.6 Å²	35.6	21%	0.206	21%	0.205	C	C	.	.	S	Bend	trans	86.7	6.6	-176.3	0	0	0	0	0	115.9	C1298 A1299 L1303	C1298-G1301 PolarHBondContact O-N 3.44Å; A1299-G1301 VanDerWaalsContact C-N 3.29Å; A1299-G1301 PolarHBondContact O-N 2.93Å; G1301-L1303 PolarHBondContact O-N 3.09Å
1302	D	93.8	Very high	90.7	Very high	54 Å²	54	30.7 Å²	30.7	29%	0.289	18%	0.179	S	C	.	.			trans	-67.4	122.2	165	-91.3	-59.1	0	0	0	110.5	C1298 N1300 I1304 H1321	C1298-D1302 HydrophobicContact CB-CB 4.09Å; C1298-D1302 WeakPolarHBondContact CB-O 3.45Å; C1298-D1302 PolarHBondContact N-O 2.9Å; N1300-D1302 PolarHBondContact ND2-OD2 3.42Å; N1300-D1302 WeakPolarHBondContact OD1-CB 3.4Å; N1300-D1302 PolarHBondContact OD1-N 2.94Å; N1300-D1302 VanDerWaalsContact OD1-N 3.12Å; D1302-I1304 HydrophobicContact CB-CD1 4.35Å; D1302-I1304 HydrophobicContact CB-CG1 4.12Å; D1302-H1321 IonicContact OD1-CE1 3.64Å; D1302-H1321 IonicContact OD1-CG 3.96Å; D1302-H1321 IonicContact OD1-ND1 2.84Å; D1302-H1321 PolarHBondContact OD1-ND1 2.86Å
1303	L	95.8	Very high	90.8	Very high	2 Å²	2	29.6 Å²	29.6	1%	0.01	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	102.8	166.5	177.9	58.2	0	0	0	108.7	F1295 A1297 G1301 V1322 L1324 M1337 L1355	F1295-L1303 HydrophobicContact CB-CD1 4.4Å; A1297-L1303 HydrophobicContact CB-CD1 4.47Å; G1301-L1303 PolarHBondContact O-N 3.09Å; L1303-V1322 HydrophobicContact CB-CB 4.47Å; L1303-V1322 HydrophobicContact CD2-CB 4.34Å; L1303-V1322 HydrophobicContact CD2-CG1 4.26Å; L1303-V1322 HydrophobicContact CG-CB 4.29Å; L1303-V1322 PolarHBondContact O-N 3.18Å; L1303-L1324 HydrophobicContact CD2-CD1 4.32Å; L1303-L1324 HydrophobicContact CD2-CD2 3.93Å; L1303-L1324 HydrophobicContact CD2-CG 4.09Å; L1303-M1337 HydrophobicContact CD1-CE 4.43Å; L1303-M1337 HydrophobicContact CD1-SD 3.54Å; L1303-M1337 VanDerWaalsContact CD1-SD 3.54Å; L1303-L1355 HydrophobicContact CD2-CD2 3.87Å
1304	I	96	Very high	90.5	Very high	4 Å²	4	29.6 Å²	29.6	2%	0.021	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	137.5	-174.1	-59	179.3	0	0	0	109.7	L1280 F1295 V1296 D1302 Y1306 P1319 I1320	L1280-I1304 HydrophobicContact CD1-CD1 3.92Å; L1280-I1304 HydrophobicContact CD2-CD1 3.92Å; F1295-I1304 CarbonylContact C-O 3.54Å; F1295-I1304 WeakPolarHBondContact CA-O 3.19Å; V1296-I1304 HydrophobicContact CB-CB 4.39Å; V1296-I1304 PolarHBondContact N-O 2.96Å; V1296-I1304 PolarHBondContact O-N 3.02Å; D1302-I1304 HydrophobicContact CB-CD1 4.35Å; D1302-I1304 HydrophobicContact CB-CG1 4.12Å; I1304-Y1306 HydrophobicContact CG2-CD2 4.33Å; I1304-Y1306 HydrophobicContact CG2-CE1 4.49Å; I1304-Y1306 HydrophobicContact CG2-CE2 3.73Å; I1304-P1319 HydrophobicContact CG2-CB 3.48Å; I1304-P1319 VanDerWaalsContact CG2-CB 3.48Å; I1304-I1320 CarbonylContact C-O 3.52Å
1305	V	96	Very high	90	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	118.8	-179.9	-173	0	0	0	0	110.6	H1293 I1294 F1295 I1320 V1322 L1360	H1293-V1305 HydrophobicContact CB-CG1 4.02Å; I1294-V1305 CarbonylContact O-C 3.58Å; I1294-V1305 WeakPolarHBondContact O-CA 3.45Å; F1295-V1305 HydrophobicContact CD1-CB 4.48Å; F1295-V1305 HydrophobicContact CD1-CG1 4.27Å; F1295-V1305 HydrophobicContact CD1-CG2 3.46Å; F1295-V1305 VanDerWaalsContact CD1-CG2 3.46Å; F1295-V1305 HydrophobicContact CE1-CG1 4.07Å; F1295-V1305 HydrophobicContact CE1-CG2 3.68Å; F1295-V1305 HydrophobicContact CG-CG2 4.31Å; F1295-V1305 HydrophobicContact CZ-CG1 4.3Å; V1305-I1320 HydrophobicContact CB-CB 4.33Å; V1305-I1320 PolarHBondContact N-O 3.28Å; V1305-I1320 PolarHBondContact O-N 3.46Å; V1305-V1322 HydrophobicContact CG2-CG2 3.66Å; V1305-L1360 HydrophobicContact CG1-CD1 4.31Å; V1305-L1360 HydrophobicContact CG1-CD2 4.28Å; V1305-L1360 HydrophobicContact CG2-CD2 4.49Å
1306	Y	94.7	Very high	89.6	Confident	2 Å²	2	31.2 Å²	31.2	1%	0.008	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	139.8	171.5	-61.3	-81	0	0	0	110.2	W1252 I1278 H1293 I1294 V1296 I1304 P1319	W1252-Y1306 AromaticContact CH2-CD2 4Å; W1252-Y1306 HydrophobicContact CH2-CD2 4Å; W1252-Y1306 HydrophobicContact CH2-CG 4.09Å; W1252-Y1306 AromaticContact CZ3-CD2 3.78Å; W1252-Y1306 HydrophobicContact CZ3-CD2 3.78Å; W1252-Y1306 HydrophobicContact CZ3-CE2 4.12Å; W1252-Y1306 HydrophobicContact CZ3-CG 4.35Å; I1278-Y1306 HydrophobicContact CD1-CE1 4.24Å; H1293-Y1306 WeakPolarHBondContact CA-O 3.49Å; I1294-Y1306 PolarHBondContact N-O 2.86Å; I1294-Y1306 PolarHBondContact O-N 2.99Å; V1296-Y1306 HydrophobicContact CG2-CD2 4.06Å; V1296-Y1306 HydrophobicContact CG2-CE2 3.87Å; I1304-Y1306 HydrophobicContact CG2-CD2 4.33Å; I1304-Y1306 HydrophobicContact CG2-CE1 4.49Å; I1304-Y1306 HydrophobicContact CG2-CE2 3.73Å; Y1306-P1319 HydrophobicContact CD1-CB 4.33Å; Y1306-P1319 HydrophobicContact CE1-CB 3.81Å; Y1306-P1319 HydrophobicContact CE1-CG 4.44Å
1307	K	90.3	Very high	89.1	Confident	83 Å²	83	37.8 Å²	37.8	36%	0.361	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	151.5	-179.3	-83.9	178.5	174.3	170.6	0	111.9	H1293 W1314 D1315 I1320	H1293-K1307 VanDerWaalsContact CD2-CG 3.44Å; H1293-K1307 WeakPolarHBondContact CD2-CG 3.47Å; H1293-K1307 WeakPolarHBondContact NE2-CE 3.46Å; K1307-W1314 VanDerWaalsContact C-CE3 3.49Å; K1307-D1315 PolarHBondContact O-N 2.77Å; K1307-I1320 HydrophobicContact CD-CD1 3.65Å; K1307-I1320 HydrophobicContact CG-CD1 4.38Å; K1307-I1320 VanDerWaalsContact NZ-CD1 3.34Å
1308	R	84.8	Confident	88.7	Confident	38 Å²	38	44.7 Å²	44.7	14%	0.143	25%	0.245	C	C	.	.	B	Isolated β-bridge	trans	-75.9	132.3	162.1	-91.4	163.8	167	-73.3	-2.6	110.9	P976 Y978 S1246 V1292 G1312 L1313 W1314	P976-R1308 PolarHBondContact O-NH2 2.97Å; Y978-R1308 VanDerWaalsContact CB-NH1 3.35Å; S1246-R1308 PolarHBondContact O-NH2 3.46Å; V1292-R1308 PolarHBondContact O-N 3.27Å; R1308-G1312 VanDerWaalsContact NH1-C 3.34Å; R1308-G1312 PolarHBondContact NH1-O 2.85Å; R1308-L1313 CarbonylContact C-O 3.55Å; R1308-L1313 VanDerWaalsContact CA-O 3.32Å; R1308-L1313 WeakPolarHBondContact CA-O 3.3Å; R1308-W1314 HydrophobicContact CB-CE3 4.42Å; R1308-W1314 HydrophobicContact CB-CZ3 4.34Å; R1308-W1314 HydrophobicContact CG-CD2 3.73Å; R1308-W1314 HydrophobicContact CG-CE3 3.73Å; R1308-W1314 HydrophobicContact CG-CG 4.46Å; R1308-W1314 HydrophobicContact CG-CH2 3.74Å; R1308-W1314 HydrophobicContact CG-CZ2 3.76Å; R1308-W1314 HydrophobicContact CG-CZ3 3.73Å
1309	N	82.1	Confident	88.5	Confident	66 Å²	66	46.7 Å²	46.7	35%	0.353	26%	0.258	S	S	.	.			trans	-75.8	171.6	168.7	-83.5	-23.7	0	0	0	111.2	D1311 G1312 L1313	N1309-D1311 VanDerWaalsContact C-N 3.25Å; N1309-D1311 WeakPolarHBondContact CB-OD1 3.43Å; N1309-D1311 PolarHBondContact O-N 2.91Å; N1309-G1312 PolarHBondContact O-N 2.66Å; N1309-L1313 PolarHBondContact N-O 3.44Å
1310	S	78.4	Confident	88.5	Confident	124 Å²	124	47.5 Å²	47.5	87%	0.867	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-21	179.9	46.1	0	0	0	0	114.6	G1312	S1310-G1312 VanDerWaalsContact C-N 3.29Å
1311	D	79.8	Confident	88.5	Confident	86 Å²	86	50.4 Å²	50.4	46%	0.46	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78	-11.6	170.1	57.1	7.4	0	0	0	113.4	S1246 N1309 L1313	S1246-D1311 WeakPolarHBondContact CB-O 3.3Å; S1246-D1311 PolarHBondContact OG-O 3.47Å; N1309-D1311 VanDerWaalsContact C-N 3.25Å; N1309-D1311 WeakPolarHBondContact CB-OD1 3.43Å; N1309-D1311 PolarHBondContact O-N 2.91Å; D1311-L1313 PolarHBondContact OD1-N 2.8Å
1312	G	76.6	Confident	88.5	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	26%	0.262	C	S	.	.	S	Bend	trans	78.9	16.2	-172.5	0	0	0	0	0	114.6	S1246 R1308 N1309 S1310	S1246-G1312 WeakPolarHBondContact CA-O 3.32Å; S1246-G1312 WeakPolarHBondContact CB-O 3.42Å; R1308-G1312 VanDerWaalsContact NH1-C 3.34Å; R1308-G1312 PolarHBondContact NH1-O 2.85Å; N1309-G1312 PolarHBondContact O-N 2.66Å; S1310-G1312 VanDerWaalsContact C-N 3.29Å
1313	L	83	Confident	88.3	Confident	42 Å²	42	53.4 Å²	53.4	22%	0.22	27%	0.274	C	S	.	.			trans	-88.3	165.7	164.9	-61.3	177.7	0	0	0	110.1	L1243 R1308 N1309 D1311	L1243-L1313 HydrophobicContact CB-CD2 4.37Å; L1243-L1313 WeakPolarHBondContact O-CD2 3.32Å; R1308-L1313 CarbonylContact C-O 3.55Å; R1308-L1313 VanDerWaalsContact CA-O 3.32Å; R1308-L1313 WeakPolarHBondContact CA-O 3.3Å; N1309-L1313 PolarHBondContact N-O 3.44Å; D1311-L1313 PolarHBondContact OD1-N 2.8Å
1314	W	86	Confident	88.1	Confident	12 Å²	12	53.9 Å²	53.9	5%	0.045	28%	0.276	C	S	.	.	B	Isolated β-bridge	trans	-93.1	127.2	177.3	-68	101.3	0	0	0	110.1	I975 W1252 H1289 V1292 I1294 K1307 R1308 V1316	I975-W1314 HydrophobicContact CG2-CZ2 3.54Å; W1252-W1314 HydrophobicContact CZ2-CG 4.48Å; H1289-W1314 AromaticContact CD2-CH2 3.94Å; V1292-W1314 WeakPolarHBondContact O-CZ3 3.5Å; I1294-W1314 HydrophobicContact CB-CZ3 4.49Å; I1294-W1314 HydrophobicContact CD1-CD2 3.63Å; I1294-W1314 HydrophobicContact CD1-CE3 3.7Å; I1294-W1314 HydrophobicContact CD1-CG 4.35Å; I1294-W1314 HydrophobicContact CD1-CH2 3.81Å; I1294-W1314 HydrophobicContact CD1-CZ2 3.71Å; I1294-W1314 HydrophobicContact CD1-CZ3 3.79Å; I1294-W1314 HydrophobicContact CG1-CD2 4.48Å; I1294-W1314 HydrophobicContact CG1-CE3 4.14Å; I1294-W1314 HydrophobicContact CG1-CH2 3.64Å; I1294-W1314 HydrophobicContact CG1-CZ2 3.97Å; I1294-W1314 HydrophobicContact CG1-CZ3 3.72Å; K1307-W1314 VanDerWaalsContact C-CE3 3.49Å; R1308-W1314 HydrophobicContact CB-CE3 4.42Å; R1308-W1314 HydrophobicContact CB-CZ3 4.34Å; R1308-W1314 HydrophobicContact CG-CD2 3.73Å; R1308-W1314 HydrophobicContact CG-CE3 3.73Å; R1308-W1314 HydrophobicContact CG-CG 4.46Å; R1308-W1314 HydrophobicContact CG-CH2 3.74Å; R1308-W1314 HydrophobicContact CG-CZ2 3.76Å; R1308-W1314 HydrophobicContact CG-CZ3 3.73Å; W1314-V1316 HydrophobicContact CB-CG1 4.33Å; W1314-V1316 PolarHBondContact O-N 3.17Å
1315	D	84.9	Confident	87.7	Confident	16 Å²	16	57.3 Å²	57.3	9%	0.086	29%	0.292	C	S	.	.			trans	-78.8	77.3	173.8	-160.4	-16.4	0	0	0	110.9	K1307 N1317 K1318	K1307-D1315 PolarHBondContact O-N 2.77Å; D1315-N1317 PolarHBondContact O-N 2.99Å; D1315-N1317 WeakPolarHBondContact OD1-CA 3.5Å; D1315-N1317 WeakPolarHBondContact OD1-CB 3.16Å; D1315-N1317 PolarHBondContact OD1-N 3.27Å; D1315-K1318 PolarHBondContact O-N 3.39Å; D1315-K1318 PolarHBondContact OD1-N 3.25Å; D1315-K1318 WeakPolarHBondContact OD2-CG 3.25Å; D1315-K1318 IonicContact OD2-NZ 3.64Å; D1315-K1318 PolarHBondContact OD2-NZ 2.71Å
1316	V	87.6	Confident	87	Confident	19 Å²	19	61.4 Å²	61.4	12%	0.115	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-16.9	171.1	-64.6	0	0	0	0	113.5	W1252 M1262 I1278 W1314	W1252-V1316 HydrophobicContact CH2-CG1 4.42Å; M1262-V1316 HydrophobicContact CE-CG1 4.13Å; I1278-V1316 HydrophobicContact CD1-CB 4.16Å; I1278-V1316 HydrophobicContact CD1-CG1 3.93Å; W1314-V1316 HydrophobicContact CB-CG1 4.33Å; W1314-V1316 PolarHBondContact O-N 3.17Å
1317	N	87.3	Confident	86.5	Confident	138 Å²	138	69.5 Å²	69.5	74%	0.738	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.3	-14.6	-177	-56.6	-59.1	0	0	0	113	D1315	D1315-N1317 PolarHBondContact O-N 2.99Å; D1315-N1317 WeakPolarHBondContact OD1-CA 3.5Å; D1315-N1317 WeakPolarHBondContact OD1-CB 3.16Å; D1315-N1317 PolarHBondContact OD1-N 3.27Å
1318	K	88.7	Confident	86.3	Confident	145 Å²	145	66.9 Å²	66.9	63%	0.63	35%	0.354	S	S	*	.	S	Bend	trans	-125.3	63.2	176.5	-55.5	-166.5	-152.5	83.7	0	112.2	D1315	D1315-K1318 PolarHBondContact O-N 3.39Å; D1315-K1318 PolarHBondContact OD1-N 3.25Å; D1315-K1318 WeakPolarHBondContact OD2-CG 3.25Å; D1315-K1318 IonicContact OD2-NZ 3.64Å; D1315-K1318 PolarHBondContact OD2-NZ 2.71Å
1319	P	92.5	Very high	86.2	Confident	46 Å²	46	72.4 Å²	72.4	30%	0.299	39%	0.387	S	S	.	.	P	Polyproline II helix	trans	-56.4	140.6	171	23	-32.3	0	0	0	111.9	I1304 Y1306	I1304-P1319 HydrophobicContact CG2-CB 3.48Å; I1304-P1319 VanDerWaalsContact CG2-CB 3.48Å; Y1306-P1319 HydrophobicContact CD1-CB 4.33Å; Y1306-P1319 HydrophobicContact CE1-CB 3.81Å; Y1306-P1319 HydrophobicContact CE1-CG 4.44Å
1320	I	93.9	Very high	86.4	Confident	57 Å²	57	76.2 Å²	76.2	29%	0.292	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	117.5	171.6	-63.2	173.3	0	0	0	108.3	I1304 V1305 K1307 V1322 L1360	I1304-I1320 CarbonylContact C-O 3.52Å; V1305-I1320 HydrophobicContact CB-CB 4.33Å; V1305-I1320 PolarHBondContact N-O 3.28Å; V1305-I1320 PolarHBondContact O-N 3.46Å; K1307-I1320 HydrophobicContact CD-CD1 3.65Å; K1307-I1320 HydrophobicContact CG-CD1 4.38Å; K1307-I1320 VanDerWaalsContact NZ-CD1 3.34Å; I1320-V1322 HydrophobicContact CG2-CG2 4.3Å; I1320-L1360 HydrophobicContact CD1-CD1 4.23Å; I1320-L1360 HydrophobicContact CG2-CD1 4.03Å
1321	H	93.1	Very high	86.8	Confident	105 Å²	105	74.5 Å²	74.5	49%	0.486	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	126.7	173.7	-68.3	-113.2	0	0	0	110	D1302	D1302-H1321 IonicContact OD1-CE1 3.64Å; D1302-H1321 IonicContact OD1-CG 3.96Å; D1302-H1321 IonicContact OD1-ND1 2.84Å; D1302-H1321 PolarHBondContact OD1-ND1 2.86Å
1322	V	93.6	Very high	87.4	Confident	14 Å²	14	71.4 Å²	71.4	9%	0.085	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	114.7	-178	176	0	0	0	0	109.7	L1303 V1305 I1320 L1355 L1360	L1303-V1322 HydrophobicContact CB-CB 4.47Å; L1303-V1322 HydrophobicContact CD2-CB 4.34Å; L1303-V1322 HydrophobicContact CD2-CG1 4.26Å; L1303-V1322 HydrophobicContact CG-CB 4.29Å; L1303-V1322 PolarHBondContact O-N 3.18Å; V1305-V1322 HydrophobicContact CG2-CG2 3.66Å; I1320-V1322 HydrophobicContact CG2-CG2 4.3Å; V1322-L1355 HydrophobicContact CG1-CD1 4.07Å; V1322-L1355 HydrophobicContact CG1-CD2 4.49Å; V1322-L1360 WeakPolarHBondContact CG1-O 3.35Å; V1322-L1360 HydrophobicContact CG2-CB 4.08Å; V1322-L1360 HydrophobicContact CG2-CD1 4.49Å
1323	K	90	Very high	88.3	Confident	123 Å²	123	74.6 Å²	74.6	54%	0.535	39%	0.389	S	S	.	.			trans	-83.9	114.7	170.3	-74	-165.3	168.6	-160.1	0	110.6	Q1325	K1323-Q1325 PolarHBondContact O-N 3.37Å
1324	L	90.7	Very high	88.9	Confident	11 Å²	11	72.7 Å²	72.7	6%	0.058	38%	0.379	C	S	.	.	S	Bend	trans	-68.5	-21.8	173.8	-68.7	-179.6	0	0	0	113.6	L1303 V1332 V1334 C1346 F1353 P1362	L1303-L1324 HydrophobicContact CD2-CD1 4.32Å; L1303-L1324 HydrophobicContact CD2-CD2 3.93Å; L1303-L1324 HydrophobicContact CD2-CG 4.09Å; L1324-V1332 HydrophobicContact CB-CB 4.38Å; L1324-V1332 HydrophobicContact CB-CG1 4.2Å; L1324-V1332 HydrophobicContact CD1-CG1 3.96Å; L1324-V1334 HydrophobicContact CD1-CG2 3.37Å; L1324-C1346 HydrophobicContact CD1-CB 3.95Å; L1324-F1353 HydrophobicContact CB-CD1 4.1Å; L1324-F1353 HydrophobicContact CB-CE1 4.48Å; L1324-F1353 HydrophobicContact CB-CG 4.27Å; L1324-F1353 HydrophobicContact CD1-CB 4.09Å; L1324-F1353 HydrophobicContact CD1-CD2 4.28Å; L1324-F1353 HydrophobicContact CD1-CG 4.15Å; L1324-F1353 HydrophobicContact CD2-CB 4.24Å; L1324-P1362 WeakPolarHBondContact O-CG 3.31Å
1325	Q	88.5	Confident	89.2	Confident	77 Å²	77	76.4 Å²	76.4	36%	0.36	40%	0.396	S	S	.	.	S	Bend	trans	-125.7	88.2	168.2	-71.9	-177	-12	0	0	109.6	K1323 N1327 S1328 V1332 F1353	K1323-Q1325 PolarHBondContact O-N 3.37Å; Q1325-N1327 PolarHBondContact O-N 3.5Å; Q1325-N1327 VanDerWaalsContact O-N 3.14Å; Q1325-S1328 PolarHBondContact O-N 3.25Å; Q1325-S1328 VanDerWaalsContact O-N 3.13Å; Q1325-V1332 HydrophobicContact CB-CG2 4.21Å; Q1325-V1332 HydrophobicContact CG-CG2 3.94Å; Q1325-F1353 HydrophobicContact CG-CE1 3.75Å; Q1325-F1353 HydrophobicContact CG-CZ 4.08Å
1326	P	80.9	Confident	89.7	Confident	85 Å²	85	80 Å²	80	55%	0.552	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-25.7	-179.4	-26.3	35.7	0	0	0	114.3
1327	N	84	Confident	90.2	Very high	173 Å²	173	79.4 Å²	79.4	93%	0.925	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.7	-2.1	-178	-59.8	-13.4	0	0	0	113.6	Q1325	Q1325-N1327 PolarHBondContact O-N 3.5Å; Q1325-N1327 VanDerWaalsContact O-N 3.14Å
1328	S	85.1	Confident	90.6	Very high	27 Å²	27	74.3 Å²	74.3	19%	0.189	38%	0.377	C	S	.	.			trans	-111.7	151.9	175.5	-168.1	0	0	0	0	111.2	Q1325 E1330	Q1325-S1328 PolarHBondContact O-N 3.25Å; Q1325-S1328 VanDerWaalsContact O-N 3.13Å; S1328-E1330 WeakPolarHBondContact OG-CB 3.35Å; S1328-E1330 PolarHBondContact OG-N 3.23Å
1329	N	83.1	Confident	90.8	Very high	154 Å²	154	67.5 Å²	67.5	82%	0.824	35%	0.347	S	S	*	.			trans	-99.4	-3.6	167	-73.2	-31.9	0	0	0	112.2
1330	E	86.5	Confident	90.8	Very high	146 Å²	146	65.3 Å²	65.3	68%	0.682	33%	0.333	S	S	*	.	S	Bend	trans	-73.9	136.8	176.4	-62.3	178.9	157	0	0	110.9	S1328 V1332	S1328-E1330 WeakPolarHBondContact OG-CB 3.35Å; S1328-E1330 PolarHBondContact OG-N 3.23Å; E1330-V1332 PolarHBondContact O-N 2.94Å
1331	P	87.6	Confident	90.4	Very high	89 Å²	89	64.7 Å²	64.7	58%	0.578	34%	0.336	S	S	*	.			trans	-74.2	120.9	-179.5	27.9	-32.8	0	0	0	111.9	N1300 I1333	N1300-P1331 WeakPolarHBondContact O-CB 3.26Å; P1331-I1333 PolarHBondContact O-N 3.46Å
1332	V	92.3	Very high	90.1	Very high	21 Å²	21	61.1 Å²	61.1	13%	0.127	33%	0.328	C	S	.	.			trans	-87.9	88.5	176.9	-177.4	0	0	0	0	109.3	L1324 Q1325 E1330 V1334 A1348 F1353	L1324-V1332 HydrophobicContact CB-CB 4.38Å; L1324-V1332 HydrophobicContact CB-CG1 4.2Å; L1324-V1332 HydrophobicContact CD1-CG1 3.96Å; Q1325-V1332 HydrophobicContact CB-CG2 4.21Å; Q1325-V1332 HydrophobicContact CG-CG2 3.94Å; E1330-V1332 PolarHBondContact O-N 2.94Å; V1332-V1334 PolarHBondContact O-N 2.89Å; V1332-A1348 HydrophobicContact CG1-CB 3.52Å; V1332-F1353 HydrophobicContact CG1-CD2 4.08Å; V1332-F1353 HydrophobicContact CG1-CE2 3.57Å; V1332-F1353 HydrophobicContact CG1-CZ 3.96Å
1333	I	94.3	Very high	90	Very high	67 Å²	67	64.7 Å²	64.7	34%	0.344	34%	0.342	S	S	.	.			trans	-69.3	97	-176.9	-54.4	174.9	0	0	0	110.9	A1299 P1331 K1335 A1348	A1299-I1333 WeakPolarHBondContact O-CD1 3.45Å; A1299-I1333 WeakPolarHBondContact O-CG2 3.25Å; P1331-I1333 PolarHBondContact O-N 3.46Å; I1333-K1335 PolarHBondContact O-N 2.87Å; I1333-A1348 WeakPolarHBondContact O-CA 3.46Å; I1333-A1348 WeakPolarHBondContact O-CB 2.99Å
1334	V	95.8	Very high	90.2	Very high	2 Å²	2	58.8 Å²	58.8	1%	0.012	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	114.5	173.8	179.9	0	0	0	0	109.6	N1285 A1297 L1324 V1332 M1337 C1346 A1347	N1285-V1334 WeakPolarHBondContact CB-O 3.48Å; N1285-V1334 PolarHBondContact ND2-O 2.97Å; A1297-V1334 HydrophobicContact CB-CB 3.87Å; A1297-V1334 HydrophobicContact CB-CG1 3.91Å; A1297-V1334 WeakPolarHBondContact CB-O 3.46Å; L1324-V1334 HydrophobicContact CD1-CG2 3.37Å; V1332-V1334 PolarHBondContact O-N 2.89Å; V1334-M1337 HydrophobicContact CG1-CG 3.68Å; V1334-C1346 HydrophobicContact CG1-CB 3.92Å; V1334-C1346 HydrophobicContact CG2-CB 4.02Å; V1334-A1347 CarbonylContact C-O 3.59Å; V1334-A1347 WeakPolarHBondContact CA-O 3.49Å
1335	K	94	Very high	90.5	Very high	90 Å²	90	58.4 Å²	58.4	39%	0.391	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	-31.8	176.3	-71.7	-70.4	-173.4	178	0	112.6	I1333 A1347	I1333-K1335 PolarHBondContact O-N 2.87Å; K1335-A1347 PolarHBondContact N-O 2.88Å
1336	R	95.3	Very high	90.9	Very high	90 Å²	90	54.8 Å²	54.8	34%	0.34	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	141.5	-178.4	-158.7	73.2	177.2	-162.1	-1.1	111.8	A1347 M1381	R1336-A1347 HydrophobicContact CB-CB 4.23Å; R1336-A1347 PolarHBondContact O-N 2.98Å; R1336-M1381 HydrophobicContact CB-CE 4.18Å; R1336-M1381 HydrophobicContact CG-CE 4.38Å; R1336-M1381 HydrophobicContact CG-CG 4.45Å; R1336-M1381 WeakPolarHBondContact O-CE 3.43Å
1337	M	96.9	Very high	91.6	Very high	7 Å²	7	50.7 Å²	50.7	3%	0.034	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	148.3	170.5	-60.2	178.2	-75.1	0	0	110.6	N1286 L1288 F1295 A1297 L1303 V1334 I1344 W1345	N1286-M1337 HydrophobicContact CB-CE 4.19Å; N1286-M1337 VanDerWaalsContact O-CE 3.3Å; N1286-M1337 WeakPolarHBondContact O-CE 3.45Å; N1286-M1337 WeakPolarHBondContact OD1-CB 3.35Å; N1286-M1337 PolarHBondContact OD1-N 3.48Å; L1288-M1337 HydrophobicContact CB-CB 4.2Å; L1288-M1337 HydrophobicContact CB-CE 4.02Å; L1288-M1337 HydrophobicContact CD2-CB 3.63Å; F1295-M1337 HydrophobicContact CB-CE 4.01Å; F1295-M1337 HydrophobicContact CB-SD 3.79Å; A1297-M1337 HydrophobicContact CB-CE 3.81Å; A1297-M1337 HydrophobicContact CB-SD 4.27Å; L1303-M1337 HydrophobicContact CD1-CE 4.43Å; L1303-M1337 HydrophobicContact CD1-SD 3.54Å; L1303-M1337 VanDerWaalsContact CD1-SD 3.54Å; V1334-M1337 HydrophobicContact CG1-CG 3.68Å; M1337-I1344 HydrophobicContact CB-CG2 4.21Å; M1337-W1345 CarbonylContact C-O 3.58Å; M1337-W1345 WeakPolarHBondContact CA-O 3.47Å
1338	L	95.9	Very high	92	Very high	32 Å²	32	42.9 Å²	42.9	17%	0.168	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	138.3	178.3	-178.5	62.1	0	0	0	111.4	V1340 I1344 W1345 M1381 V1388	L1338-V1340 HydrophobicContact CB-CG2 4.47Å; L1338-V1340 HydrophobicContact CD2-CG2 4.06Å; L1338-V1340 HydrophobicContact CG-CG2 3.95Å; L1338-I1344 CarbonylContact O-C 3.55Å; L1338-I1344 WeakPolarHBondContact O-CA 3.39Å; L1338-W1345 PolarHBondContact N-O 2.62Å; L1338-W1345 PolarHBondContact O-N 3.43Å; L1338-M1381 HydrophobicContact CB-CB 4.26Å; L1338-M1381 HydrophobicContact CB-CE 3.93Å; L1338-M1381 HydrophobicContact CD2-CB 3.65Å; L1338-V1388 HydrophobicContact CD2-CG1 4.38Å
1339	V	93.9	Very high	92.2	Very high	1 Å²	1	47 Å²	47	1%	0.006	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	122.5	172.1	177.6	0	0	0	0	109.4	Y999 M1001 L1288 F1290 K1343 I1344 Y1383	Y999-V1339 HydrophobicContact CD1-CB 3.75Å; Y999-V1339 HydrophobicContact CD1-CG1 3.93Å; Y999-V1339 HydrophobicContact CD1-CG2 4.32Å; Y999-V1339 HydrophobicContact CE1-CB 3.94Å; Y999-V1339 HydrophobicContact CE1-CG1 4.43Å; Y999-V1339 HydrophobicContact CE1-CG2 4.02Å; Y999-V1339 HydrophobicContact CG-CG1 4.45Å; M1001-V1339 HydrophobicContact CE-CG1 3.92Å; L1288-V1339 HydrophobicContact CD1-CG2 4.2Å; L1288-V1339 HydrophobicContact CD2-CG2 4.08Å; L1288-V1339 HydrophobicContact CG-CG2 4.45Å; F1290-V1339 HydrophobicContact CB-CG2 4.15Å; F1290-V1339 HydrophobicContact CD2-CB 4.31Å; F1290-V1339 HydrophobicContact CD2-CG1 3.74Å; F1290-V1339 HydrophobicContact CD2-CG2 3.55Å; F1290-V1339 HydrophobicContact CE2-CG1 3.54Å; F1290-V1339 HydrophobicContact CE2-CG2 4.25Å; F1290-V1339 HydrophobicContact CG-CG2 4.05Å; F1290-V1339 HydrophobicContact CZ-CG1 4.4Å; V1339-K1343 WeakPolarHBondContact CA-O 3.21Å; V1339-I1344 HydrophobicContact CG2-CG1 4.48Å; V1339-Y1383 VanDerWaalsContact O-CD1 3.29Å; V1339-Y1383 WeakPolarHBondContact O-CD1 3.22Å
1340	V	92.1	Very high	92.5	Very high	1 Å²	1	42.3 Å²	42.3	1%	0.006	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	121.2	-178.9	-177	0	0	0	0	109.2	L1338 G1342 K1343 W1345 Y1383 V1388 A1403	L1338-V1340 HydrophobicContact CB-CG2 4.47Å; L1338-V1340 HydrophobicContact CD2-CG2 4.06Å; L1338-V1340 HydrophobicContact CG-CG2 3.95Å; V1340-G1342 PolarHBondContact O-N 3.08Å; V1340-K1343 PolarHBondContact N-O 2.92Å; V1340-K1343 PolarHBondContact O-N 3.22Å; V1340-W1345 HydrophobicContact CB-CD2 4.3Å; V1340-W1345 HydrophobicContact CB-CG 4.06Å; V1340-W1345 HydrophobicContact CG1-CD2 4.47Å; V1340-W1345 HydrophobicContact CG1-CZ2 4.15Å; V1340-W1345 HydrophobicContact CG2-CB 4.19Å; V1340-W1345 HydrophobicContact CG2-CD2 3.97Å; V1340-W1345 HydrophobicContact CG2-CG 3.74Å; V1340-Y1383 HydrophobicContact CB-CD1 4.49Å; V1340-Y1383 HydrophobicContact CB-CG 4.5Å; V1340-Y1383 HydrophobicContact CG1-CD1 4.49Å; V1340-Y1383 HydrophobicContact CG1-CD2 4.02Å; V1340-Y1383 HydrophobicContact CG1-CE2 4.16Å; V1340-Y1383 HydrophobicContact CG1-CG 4.25Å; V1340-Y1383 HydrophobicContact CG2-CD1 4.5Å; V1340-Y1383 HydrophobicContact CG2-CG 4.23Å; V1340-V1388 HydrophobicContact CB-CG2 4.33Å; V1340-V1388 HydrophobicContact CG1-CG2 3.52Å; V1340-V1388 HydrophobicContact CG2-CG2 3.8Å; V1340-A1403 HydrophobicContact CG1-CB 3.72Å; V1340-A1403 WeakPolarHBondContact CG1-O 3.24Å
1341	A	85.7	Confident	92.8	Very high	44 Å²	44	37.5 Å²	37.5	36%	0.364	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.1	22.2	174.3	0	0	0	0	0	116.8	T1404	A1341-T1404 HydrophobicContact CB-CG2 4.11Å
1342	G	85.3	Confident	93.1	Very high	30 Å²	30	33.3 Å²	33.3	31%	0.309	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	101.7	1.9	179.4	0	0	0	0	0	114.8	M1001 V1340 P1357	M1001-G1342 VanDerWaalsContact CE-N 3.28Å; V1340-G1342 PolarHBondContact O-N 3.08Å; G1342-P1357 WeakPolarHBondContact O-CG 3.3Å
1343	K	91.5	Very high	93.2	Very high	88 Å²	88	32.7 Å²	32.7	38%	0.383	17%	0.168	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	169.3	175.8	-53.4	-176	-176.2	-169.8	0	109.9	V1339 V1340 I1354 E1363	V1339-K1343 WeakPolarHBondContact CA-O 3.21Å; V1340-K1343 PolarHBondContact N-O 2.92Å; V1340-K1343 PolarHBondContact O-N 3.22Å; K1343-I1354 HydrophobicContact CB-CG2 3.64Å; K1343-I1354 HydrophobicContact CD-CG2 3.47Å; K1343-I1354 VanDerWaalsContact CD-CG2 3.47Å; K1343-I1354 HydrophobicContact CG-CG2 4.18Å; K1343-E1363 VanDerWaalsContact CD-OE2 3.3Å; K1343-E1363 WeakPolarHBondContact CD-OE2 3.41Å; K1343-E1363 WeakPolarHBondContact CE-OE2 3.44Å; K1343-E1363 IonicContact NZ-OE2 2.64Å; K1343-E1363 PolarHBondContact NZ-OE2 2.66Å
1344	I	95.3	Very high	93.1	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	122.8	174	-62	174.4	0	0	0	108.6	L1288 F1290 F1295 M1337 L1338 V1339 I1354 L1355 P1357	L1288-I1344 HydrophobicContact CD2-CD1 4.28Å; L1288-I1344 HydrophobicContact CD2-CG1 4.35Å; L1288-I1344 HydrophobicContact CD2-CG2 3.86Å; F1290-I1344 HydrophobicContact CB-CD1 4.42Å; F1295-I1344 HydrophobicContact CD1-CD1 4.06Å; F1295-I1344 HydrophobicContact CD2-CD1 3.53Å; F1295-I1344 HydrophobicContact CE1-CD1 3.8Å; F1295-I1344 HydrophobicContact CE2-CD1 3.23Å; F1295-I1344 HydrophobicContact CG-CD1 3.96Å; F1295-I1344 HydrophobicContact CZ-CD1 3.41Å; F1295-I1344 VanDerWaalsContact CZ-CD1 3.41Å; M1337-I1344 HydrophobicContact CB-CG2 4.21Å; L1338-I1344 CarbonylContact O-C 3.55Å; L1338-I1344 WeakPolarHBondContact O-CA 3.39Å; V1339-I1344 HydrophobicContact CG2-CG1 4.48Å; I1344-I1354 CarbonylContact O-C 3.52Å; I1344-I1354 WeakPolarHBondContact O-CA 3.4Å; I1344-L1355 HydrophobicContact CB-CB 4.34Å; I1344-L1355 PolarHBondContact N-O 2.67Å; I1344-L1355 PolarHBondContact O-N 3.31Å; I1344-P1357 HydrophobicContact CD1-CB 4.01Å; I1344-P1357 HydrophobicContact CG1-CB 4.33Å
1345	W	96.2	Very high	93.1	Very high	3 Å²	3	30 Å²	30	1%	0.011	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	124.9	168.8	-72.7	30.4	0	0	0	108.1	M1337 L1338 V1340 I1352 I1354 F1366 M1381 V1388	M1337-W1345 CarbonylContact C-O 3.58Å; M1337-W1345 WeakPolarHBondContact CA-O 3.47Å; L1338-W1345 PolarHBondContact N-O 2.62Å; L1338-W1345 PolarHBondContact O-N 3.43Å; V1340-W1345 HydrophobicContact CB-CD2 4.3Å; V1340-W1345 HydrophobicContact CB-CG 4.06Å; V1340-W1345 HydrophobicContact CG1-CD2 4.47Å; V1340-W1345 HydrophobicContact CG1-CZ2 4.15Å; V1340-W1345 HydrophobicContact CG2-CB 4.19Å; V1340-W1345 HydrophobicContact CG2-CD2 3.97Å; V1340-W1345 HydrophobicContact CG2-CG 3.74Å; W1345-I1352 HydrophobicContact CB-CG2 4.24Å; W1345-I1352 HydrophobicContact CD2-CG2 4.06Å; W1345-I1352 HydrophobicContact CE3-CD1 4.11Å; W1345-I1352 HydrophobicContact CE3-CG2 3.77Å; W1345-I1352 HydrophobicContact CG-CG2 4.28Å; W1345-I1352 HydrophobicContact CZ3-CD1 4.13Å; W1345-I1352 HydrophobicContact CZ3-CG2 4.47Å; W1345-I1354 HydrophobicContact CG-CG1 4.32Å; W1345-I1354 HydrophobicContact CZ2-CD1 4.18Å; W1345-F1366 HydrophobicContact CE3-CZ 4.42Å; W1345-F1366 AromaticContact CH2-CZ 3.94Å; W1345-F1366 HydrophobicContact CH2-CZ 3.94Å; W1345-F1366 HydrophobicContact CZ2-CZ 4.47Å; W1345-F1366 AromaticContact CZ3-CZ 3.91Å; W1345-F1366 HydrophobicContact CZ3-CZ 3.91Å; W1345-M1381 HydrophobicContact CB-CE 4.36Å; W1345-M1381 WeakPolarHBondContact O-CE 3.5Å; W1345-V1388 HydrophobicContact CD2-CG2 4.48Å; W1345-V1388 HydrophobicContact CE3-CB 4.38Å; W1345-V1388 HydrophobicContact CE3-CG1 3.99Å; W1345-V1388 HydrophobicContact CE3-CG2 4.15Å; W1345-V1388 HydrophobicContact CH2-CB 4.19Å; W1345-V1388 HydrophobicContact CH2-CG2 3.83Å; W1345-V1388 HydrophobicContact CZ2-CG2 4.16Å; W1345-V1388 HydrophobicContact CZ3-CB 3.87Å; W1345-V1388 HydrophobicContact CZ3-CG1 3.88Å; W1345-V1388 HydrophobicContact CZ3-CG2 3.83Å
1346	C	96.8	Very high	93	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	115	175.8	-63.8	0	0	0	0	108.7	L1324 V1334 F1353	L1324-C1346 HydrophobicContact CD1-CB 3.95Å; V1334-C1346 HydrophobicContact CG1-CB 3.92Å; V1334-C1346 HydrophobicContact CG2-CB 4.02Å; C1346-F1353 HydrophobicContact CB-CB 4.36Å; C1346-F1353 PolarHBondContact N-O 2.95Å; C1346-F1353 PolarHBondContact O-N 3.21Å
1347	A	95.4	Very high	92.8	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	119.3	174.2	0	0	0	0	0	110.2	V1334 K1335 R1336 I1378 M1381	V1334-A1347 CarbonylContact C-O 3.59Å; V1334-A1347 WeakPolarHBondContact CA-O 3.49Å; K1335-A1347 PolarHBondContact N-O 2.88Å; R1336-A1347 HydrophobicContact CB-CB 4.23Å; R1336-A1347 PolarHBondContact O-N 2.98Å; A1347-I1378 HydrophobicContact CB-CB 3.86Å; A1347-I1378 HydrophobicContact CB-CD1 4.09Å; A1347-I1378 HydrophobicContact CB-CG2 3.67Å; A1347-M1381 HydrophobicContact CB-CE 3.67Å; A1347-M1381 HydrophobicContact CB-CG 4.39Å; A1347-M1381 HydrophobicContact CB-SD 3.8Å
1348	A	93.1	Very high	92.5	Very high	9 Å²	9	28.3 Å²	28.3	7%	0.074	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	102.8	176.8	0	0	0	0	0	109.5	V1332 I1333 R1350 S1351 F1353	V1332-A1348 HydrophobicContact CG1-CB 3.52Å; I1333-A1348 WeakPolarHBondContact O-CA 3.46Å; I1333-A1348 WeakPolarHBondContact O-CB 2.99Å; A1348-R1350 PolarHBondContact O-N 2.79Å; A1348-S1351 PolarHBondContact N-O 3.44Å; A1348-S1351 PolarHBondContact O-N 2.88Å; A1348-F1353 HydrophobicContact CB-CD2 4.23Å; A1348-F1353 HydrophobicContact CB-CE2 4.08Å
1349	H	90.4	Very high	92.3	Very high	114 Å²	114	30.7 Å²	30.7	53%	0.528	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.2	-116.6	-171.1	-169.1	31.4	0	0	0	111.7	P1375 G1377 I1378	H1349-P1375 PolarHBondContact CE1-O 2.92Å; H1349-G1377 WeakPolarHBondContact ND1-CA 3.2Å; H1349-I1378 WeakPolarHBondContact O-CG1 3.48Å; H1349-I1378 PolarHBondContact O-N 2.65Å
1350	R	89.3	Confident	92.3	Very high	55 Å²	55	31.7 Å²	31.7	21%	0.208	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.4	11.9	178	-62.3	-169.9	70.1	-168.1	9.4	114.8	A1348 P1367 L1368 N1371 Y1372 D1374	A1348-R1350 PolarHBondContact O-N 2.79Å; R1350-P1367 CarbonylContact O-C 3.57Å; R1350-P1367 WeakPolarHBondContact O-CA 3.41Å; R1350-L1368 HydrophobicContact CB-CD1 4.42Å; R1350-L1368 PolarHBondContact O-N 2.8Å; R1350-N1371 PolarHBondContact NH2-O 3.29Å; R1350-Y1372 PolarHBondContact NH1-O 2.88Å; R1350-D1374 PolarHBondContact NE-O 2.92Å; R1350-D1374 VanDerWaalsContact NE-O 3.15Å; R1350-D1374 PolarHBondContact NH1-O 2.64Å; R1350-D1374 PolarHBondContact NH2-O 3.22Å
1351	S	91	Very high	92.2	Very high	45 Å²	45	35 Å²	35	32%	0.315	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	143.9	-178	-65.4	0	0	0	0	112.4	A1348	A1348-S1351 PolarHBondContact N-O 3.44Å; A1348-S1351 PolarHBondContact O-N 2.88Å
1352	I	93.8	Very high	92.4	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	127.8	173.2	-59.8	178.8	0	0	0	108.8	W1345 S1365 F1366 I1378 L1390	W1345-I1352 HydrophobicContact CB-CG2 4.24Å; W1345-I1352 HydrophobicContact CD2-CG2 4.06Å; W1345-I1352 HydrophobicContact CE3-CD1 4.11Å; W1345-I1352 HydrophobicContact CE3-CG2 3.77Å; W1345-I1352 HydrophobicContact CG-CG2 4.28Å; W1345-I1352 HydrophobicContact CZ3-CD1 4.13Å; W1345-I1352 HydrophobicContact CZ3-CG2 4.47Å; I1352-S1365 CarbonylContact O-C 3.56Å; I1352-S1365 VanDerWaalsContact O-CA 3.25Å; I1352-S1365 WeakPolarHBondContact O-CA 3.2Å; I1352-F1366 HydrophobicContact CB-CD1 4.4Å; I1352-F1366 HydrophobicContact CB-CE1 3.98Å; I1352-F1366 HydrophobicContact CB-CE2 4.14Å; I1352-F1366 HydrophobicContact CB-CZ 3.84Å; I1352-F1366 HydrophobicContact CD1-CE2 3.84Å; I1352-F1366 HydrophobicContact CD1-CZ 3.92Å; I1352-F1366 HydrophobicContact CG1-CE2 4.43Å; I1352-F1366 HydrophobicContact CG1-CZ 4.44Å; I1352-F1366 HydrophobicContact CG2-CE1 3.81Å; I1352-F1366 HydrophobicContact CG2-CZ 3.78Å; I1352-F1366 PolarHBondContact N-O 2.68Å; I1352-F1366 PolarHBondContact O-N 2.91Å; I1352-I1378 HydrophobicContact CD1-CD1 3.94Å; I1352-I1378 HydrophobicContact CG1-CD1 3.5Å; I1352-I1378 VanDerWaalsContact CG1-CD1 3.5Å; I1352-L1390 HydrophobicContact CD1-CD1 3.64Å; I1352-L1390 HydrophobicContact CD1-CD2 4.46Å
1353	F	94.4	Very high	92.6	Very high	8 Å²	8	37.5 Å²	37.5	4%	0.035	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	126.4	172.5	-64.6	-97.9	0	0	0	109.3	L1324 Q1325 V1332 C1346 A1348	L1324-F1353 HydrophobicContact CB-CD1 4.1Å; L1324-F1353 HydrophobicContact CB-CE1 4.48Å; L1324-F1353 HydrophobicContact CB-CG 4.27Å; L1324-F1353 HydrophobicContact CD1-CB 4.09Å; L1324-F1353 HydrophobicContact CD1-CD2 4.28Å; L1324-F1353 HydrophobicContact CD1-CG 4.15Å; L1324-F1353 HydrophobicContact CD2-CB 4.24Å; Q1325-F1353 HydrophobicContact CG-CE1 3.75Å; Q1325-F1353 HydrophobicContact CG-CZ 4.08Å; V1332-F1353 HydrophobicContact CG1-CD2 4.08Å; V1332-F1353 HydrophobicContact CG1-CE2 3.57Å; V1332-F1353 HydrophobicContact CG1-CZ 3.96Å; C1346-F1353 HydrophobicContact CB-CB 4.36Å; C1346-F1353 PolarHBondContact N-O 2.95Å; C1346-F1353 PolarHBondContact O-N 3.21Å; A1348-F1353 HydrophobicContact CB-CD2 4.23Å; A1348-F1353 HydrophobicContact CB-CE2 4.08Å
1354	I	94.2	Very high	92.4	Very high	13 Å²	13	37.4 Å²	37.4	7%	0.067	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	110.5	173.4	-55.9	-171.7	0	0	0	108.7	K1343 I1344 W1345 P1362 E1363 L1364 F1366	K1343-I1354 HydrophobicContact CB-CG2 3.64Å; K1343-I1354 HydrophobicContact CD-CG2 3.47Å; K1343-I1354 VanDerWaalsContact CD-CG2 3.47Å; K1343-I1354 HydrophobicContact CG-CG2 4.18Å; I1344-I1354 CarbonylContact O-C 3.52Å; I1344-I1354 WeakPolarHBondContact O-CA 3.4Å; W1345-I1354 HydrophobicContact CG-CG1 4.32Å; W1345-I1354 HydrophobicContact CZ2-CD1 4.18Å; I1354-P1362 WeakPolarHBondContact O-CA 3.44Å; I1354-E1363 PolarHBondContact O-N 2.74Å; I1354-L1364 HydrophobicContact CB-CB 4.26Å; I1354-L1364 HydrophobicContact CD1-CB 4.33Å; I1354-L1364 HydrophobicContact CD1-CD2 4.04Å; I1354-L1364 HydrophobicContact CG1-CB 4.4Å; I1354-L1364 PolarHBondContact N-O 3.38Å; I1354-F1366 HydrophobicContact CD1-CE1 4.04Å; I1354-F1366 HydrophobicContact CG1-CE1 4.15Å
1355	L	94.3	Very high	92	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	131.9	177	177.9	62.1	0	0	0	110.7	F1295 L1303 V1322 I1344 P1357 L1360	F1295-L1355 HydrophobicContact CD1-CD2 4.05Å; F1295-L1355 HydrophobicContact CE1-CD2 3.8Å; L1303-L1355 HydrophobicContact CD2-CD2 3.87Å; V1322-L1355 HydrophobicContact CG1-CD1 4.07Å; V1322-L1355 HydrophobicContact CG1-CD2 4.49Å; I1344-L1355 HydrophobicContact CB-CB 4.34Å; I1344-L1355 PolarHBondContact N-O 2.67Å; I1344-L1355 PolarHBondContact O-N 3.31Å; L1355-P1357 WeakPolarHBondContact O-CD 3.34Å; L1355-L1360 VanDerWaalsContact CD1-C 3.47Å
1356	N	92.5	Very high	91.7	Very high	30 Å²	30	41.9 Å²	41.9	16%	0.16	23%	0.234	C	C	.	.			trans	-78.1	118.7	167.8	-176.7	-51.3	0	0	0	109.6	T1358 T1359 L1360 T1361 E1363	N1356-T1358 PolarHBondContact O-N 2.83Å; N1356-T1358 WeakPolarHBondContact OD1-CA 3.28Å; N1356-T1358 WeakPolarHBondContact OD1-CB 3.36Å; N1356-T1358 PolarHBondContact OD1-N 2.84Å; N1356-T1359 VanDerWaalsContact CB-OG1 3.28Å; N1356-T1359 WeakPolarHBondContact CB-OG1 2.95Å; N1356-T1359 VanDerWaalsContact CG-OG1 3.23Å; N1356-T1359 PolarHBondContact OD1-N 3.09Å; N1356-T1359 PolarHBondContact OD1-OG1 2.89Å; N1356-L1360 VanDerWaalsContact O-CA 3.26Å; N1356-L1360 WeakPolarHBondContact O-CA 3.38Å; N1356-L1360 PolarHBondContact O-N 3.31Å; N1356-T1361 PolarHBondContact N-O 2.69Å; N1356-E1363 HydrophobicContact CB-CG 3.92Å; N1356-E1363 WeakPolarHBondContact CB-OE1 3.27Å; N1356-E1363 PolarHBondContact ND2-OE1 2.87Å
1357	P	91.1	Very high	91.1	Very high	6 Å²	6	45 Å²	45	4%	0.039	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.9	-10.1	-175.3	28.9	-35.1	0	0	0	114.3	F1290 H1293 F1295 G1342 I1344 L1355	F1290-P1357 HydrophobicContact CD1-CB 3.59Å; F1290-P1357 HydrophobicContact CD1-CG 3.84Å; F1290-P1357 HydrophobicContact CE1-CB 3.77Å; F1290-P1357 HydrophobicContact CE1-CG 3.46Å; F1290-P1357 VanDerWaalsContact CE1-CG 3.46Å; F1290-P1357 HydrophobicContact CZ-CG 4.46Å; H1293-P1357 PolarHBondContact CE1-O 3.49Å; H1293-P1357 PolarHBondContact ND1-O 3.25Å; H1293-P1357 VanDerWaalsContact ND1-O 3.11Å; F1295-P1357 HydrophobicContact CZ-CB 4.13Å; G1342-P1357 WeakPolarHBondContact O-CG 3.3Å; I1344-P1357 HydrophobicContact CD1-CB 4.01Å; I1344-P1357 HydrophobicContact CG1-CB 4.33Å; L1355-P1357 WeakPolarHBondContact O-CD 3.34Å
1358	T	90.3	Very high	90.5	Very high	116 Å²	116	45.6 Å²	45.6	71%	0.712	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.7	-46.7	179.7	-52.7	0	0	0	0	111.5	N1356	N1356-T1358 PolarHBondContact O-N 2.83Å; N1356-T1358 WeakPolarHBondContact OD1-CA 3.28Å; N1356-T1358 WeakPolarHBondContact OD1-CB 3.36Å; N1356-T1358 PolarHBondContact OD1-N 2.84Å
1359	T	92.3	Very high	89.2	Confident	81 Å²	81	48.5 Å²	48.5	50%	0.497	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.6	-16.7	178.8	59.6	0	0	0	0	113.1	N1356 T1361	N1356-T1359 VanDerWaalsContact CB-OG1 3.28Å; N1356-T1359 WeakPolarHBondContact CB-OG1 2.95Å; N1356-T1359 VanDerWaalsContact CG-OG1 3.23Å; N1356-T1359 PolarHBondContact OD1-N 3.09Å; N1356-T1359 PolarHBondContact OD1-OG1 2.89Å; T1359-T1361 PolarHBondContact O-N 2.86Å; T1359-T1361 PolarHBondContact OG1-N 3.04Å; T1359-T1361 PolarHBondContact OG1-OG1 2.97Å
1360	L	92.6	Very high	87.7	Confident	22 Å²	22	44.8 Å²	44.8	12%	0.115	26%	0.264	C	S	.	.			trans	58.7	27.2	-172.7	-51.7	179.4	0	0	0	113.4	F1295 V1305 I1320 V1322 L1355 N1356	F1295-L1360 HydrophobicContact CE1-CD2 3.75Å; F1295-L1360 HydrophobicContact CZ-CD2 3.92Å; V1305-L1360 HydrophobicContact CG1-CD1 4.31Å; V1305-L1360 HydrophobicContact CG1-CD2 4.28Å; V1305-L1360 HydrophobicContact CG2-CD2 4.49Å; I1320-L1360 HydrophobicContact CD1-CD1 4.23Å; I1320-L1360 HydrophobicContact CG2-CD1 4.03Å; V1322-L1360 WeakPolarHBondContact CG1-O 3.35Å; V1322-L1360 HydrophobicContact CG2-CB 4.08Å; V1322-L1360 HydrophobicContact CG2-CD1 4.49Å; L1355-L1360 VanDerWaalsContact CD1-C 3.47Å; N1356-L1360 VanDerWaalsContact O-CA 3.26Å; N1356-L1360 WeakPolarHBondContact O-CA 3.38Å; N1356-L1360 PolarHBondContact O-N 3.31Å
1361	T	91.5	Very high	86.2	Confident	71 Å²	71	47.1 Å²	47.1	44%	0.436	28%	0.281	S	S	.	.			trans	-107	139	176.3	57.1	0	0	0	0	111.7	N1356 T1359	N1356-T1361 PolarHBondContact N-O 2.69Å; T1359-T1361 PolarHBondContact O-N 2.86Å; T1359-T1361 PolarHBondContact OG1-N 3.04Å; T1359-T1361 PolarHBondContact OG1-OG1 2.97Å
1362	P	90	Very high	84.8	Confident	40 Å²	40	53 Å²	53	26%	0.26	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	134.5	166.9	29.3	-34.2	0	0	0	110	L1324 I1354	L1324-P1362 WeakPolarHBondContact O-CG 3.31Å; I1354-P1362 WeakPolarHBondContact O-CA 3.44Å
1363	E	88.4	Confident	83.3	Confident	86 Å²	86	57 Å²	57	40%	0.402	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	-31.6	-179.8	-65.8	-176	156.7	0	0	113.1	K1343 I1354 N1356	K1343-E1363 VanDerWaalsContact CD-OE2 3.3Å; K1343-E1363 WeakPolarHBondContact CD-OE2 3.41Å; K1343-E1363 WeakPolarHBondContact CE-OE2 3.44Å; K1343-E1363 IonicContact NZ-OE2 2.64Å; K1343-E1363 PolarHBondContact NZ-OE2 2.66Å; I1354-E1363 PolarHBondContact O-N 2.74Å; N1356-E1363 HydrophobicContact CB-CG 3.92Å; N1356-E1363 WeakPolarHBondContact CB-OE1 3.27Å; N1356-E1363 PolarHBondContact ND2-OE1 2.87Å
1364	L	86.8	Confident	82.2	Confident	86 Å²	86	57.9 Å²	57.9	45%	0.45	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	145.3	-179.6	-175.4	65.9	0	0	0	109.2	I1354 F1366	I1354-L1364 HydrophobicContact CB-CB 4.26Å; I1354-L1364 HydrophobicContact CD1-CB 4.33Å; I1354-L1364 HydrophobicContact CD1-CD2 4.04Å; I1354-L1364 HydrophobicContact CG1-CB 4.4Å; I1354-L1364 PolarHBondContact N-O 3.38Å; L1364-F1366 HydrophobicContact CD2-CD1 4.1Å; L1364-F1366 HydrophobicContact CD2-CE1 4.39Å; L1364-F1366 HydrophobicContact CG-CD1 4.22Å
1365	S	88.6	Confident	81.7	Confident	73 Å²	73	61.8 Å²	61.8	51%	0.51	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	136.1	167.5	58.9	0	0	0	0	109.9	I1352	I1352-S1365 CarbonylContact O-C 3.56Å; I1352-S1365 VanDerWaalsContact O-CA 3.25Å; I1352-S1365 WeakPolarHBondContact O-CA 3.2Å
1366	F	88.2	Confident	81.4	Confident	24 Å²	24	65.6 Å²	65.6	11%	0.105	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	146.4	178.2	58.3	-79	0	0	0	111	W1345 I1352 I1354 L1364 Y1401	W1345-F1366 HydrophobicContact CE3-CZ 4.42Å; W1345-F1366 AromaticContact CH2-CZ 3.94Å; W1345-F1366 HydrophobicContact CH2-CZ 3.94Å; W1345-F1366 HydrophobicContact CZ2-CZ 4.47Å; W1345-F1366 AromaticContact CZ3-CZ 3.91Å; W1345-F1366 HydrophobicContact CZ3-CZ 3.91Å; I1352-F1366 HydrophobicContact CB-CD1 4.4Å; I1352-F1366 HydrophobicContact CB-CE1 3.98Å; I1352-F1366 HydrophobicContact CB-CE2 4.14Å; I1352-F1366 HydrophobicContact CB-CZ 3.84Å; I1352-F1366 HydrophobicContact CD1-CE2 3.84Å; I1352-F1366 HydrophobicContact CD1-CZ 3.92Å; I1352-F1366 HydrophobicContact CG1-CE2 4.43Å; I1352-F1366 HydrophobicContact CG1-CZ 4.44Å; I1352-F1366 HydrophobicContact CG2-CE1 3.81Å; I1352-F1366 HydrophobicContact CG2-CZ 3.78Å; I1352-F1366 PolarHBondContact N-O 2.68Å; I1352-F1366 PolarHBondContact O-N 2.91Å; I1354-F1366 HydrophobicContact CD1-CE1 4.04Å; I1354-F1366 HydrophobicContact CG1-CE1 4.15Å; L1364-F1366 HydrophobicContact CD2-CD1 4.1Å; L1364-F1366 HydrophobicContact CD2-CE1 4.39Å; L1364-F1366 HydrophobicContact CG-CD1 4.22Å; F1366-Y1401 HydrophobicContact CE2-CD1 4.33Å; F1366-Y1401 HydrophobicContact CE2-CE1 4.33Å
1367	P	85.7	Confident	81.4	Confident	67 Å²	67	64.2 Å²	64.2	44%	0.435	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	164.4	171.4	33	-35.7	0	0	0	111	R1350 N1369	R1350-P1367 CarbonylContact O-C 3.57Å; R1350-P1367 WeakPolarHBondContact O-CA 3.41Å; P1367-N1369 PolarHBondContact O-N 2.69Å
1368	L	82.4	Confident	81.5	Confident	12 Å²	12	64 Å²	64	6%	0.063	37%	0.366	C	S	.	.			trans	-60.2	114.7	161.9	-76.4	177.5	0	0	0	110	R1350 G1370 I1378 L1390 T1392 Y1401	R1350-L1368 HydrophobicContact CB-CD1 4.42Å; R1350-L1368 PolarHBondContact O-N 2.8Å; L1368-G1370 PolarHBondContact O-N 2.64Å; L1368-I1378 HydrophobicContact CD1-CD1 4.27Å; L1368-I1378 HydrophobicContact CD1-CG1 3.69Å; L1368-I1378 HydrophobicContact CD2-CD1 3.82Å; L1368-I1378 HydrophobicContact CD2-CG1 3.92Å; L1368-I1378 HydrophobicContact CG-CD1 3.95Å; L1368-I1378 HydrophobicContact CG-CG1 3.95Å; L1368-L1390 HydrophobicContact CD2-CD1 3.64Å; L1368-T1392 HydrophobicContact CD1-CG2 4.04Å; L1368-Y1401 HydrophobicContact CD2-CE2 4.25Å; L1368-Y1401 WeakPolarHBondContact CD2-OH 3.37Å
1369	N	66.3	Low	81.6	Confident	70 Å²	70	62 Å²	62	37%	0.374	35%	0.349	S	S	.	.			trans	-77.6	116.1	167.5	-69.9	-20.1	0	0	0	108.3	P1367 Y1401 F1408	P1367-N1369 PolarHBondContact O-N 2.69Å; N1369-Y1401 PolarHBondContact N-OH 3.21Å; N1369-Y1401 VanDerWaalsContact N-OH 3.11Å; N1369-Y1401 PolarHBondContact O-OH 3.36Å; N1369-F1408 HydrophobicContact CB-CB 4.08Å
1370	G	57.8	Low	81.8	Confident	35 Å²	35	58.7 Å²	58.7	36%	0.361	33%	0.328	S	S	.	.	S	Bend	trans	172.5	-159	-174.4	0	0	0	0	0	110.9	L1368 Y1372	L1368-G1370 PolarHBondContact O-N 2.64Å; G1370-Y1372 PolarHBondContact O-N 3.34Å
1371	N	57.8	Low	82	Confident	105 Å²	105	58 Å²	58	56%	0.561	33%	0.325	S	S	*	.			trans	-65.1	109.7	176.3	-175.5	-0.2	0	0	0	110.6	R1350 A1373 D1374	R1350-N1371 PolarHBondContact NH2-O 3.29Å; N1371-A1373 PolarHBondContact O-N 3.16Å; N1371-A1373 WeakPolarHBondContact OD1-CB 3.33Å; N1371-A1373 PolarHBondContact OD1-N 3.19Å; N1371-D1374 PolarHBondContact O-N 2.94Å; N1371-D1374 VanDerWaalsContact O-N 3.14Å
1372	Y	62.5	Low	82.2	Confident	169 Å²	169	55 Å²	55	66%	0.663	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-26.9	178.7	-70.2	-75.3	0	0	0	112.9	R1350 G1370 D1374	R1350-Y1372 PolarHBondContact NH1-O 2.88Å; G1370-Y1372 PolarHBondContact O-N 3.34Å; Y1372-D1374 VanDerWaalsContact C-N 3.32Å; Y1372-D1374 PolarHBondContact O-N 2.82Å
1373	A	61.8	Low	82.3	Confident	83 Å²	83	54.3 Å²	54.3	69%	0.686	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.9	-9.8	178.5	0	0	0	0	0	114.9	N1371 P1375	N1371-A1373 PolarHBondContact O-N 3.16Å; N1371-A1373 WeakPolarHBondContact OD1-CB 3.33Å; N1371-A1373 PolarHBondContact OD1-N 3.19Å; A1373-P1375 VanDerWaalsContact O-CD 3.3Å; A1373-P1375 WeakPolarHBondContact O-CD 3.42Å
1374	D	72.2	Confident	82.1	Confident	27 Å²	27	50.5 Å²	50.5	14%	0.144	28%	0.283	C	S	.	.			trans	-82.7	110.3	175	-173.2	-16.1	0	0	0	110.6	R1350 N1371 Y1372 R1376	R1350-D1374 PolarHBondContact NE-O 2.92Å; R1350-D1374 VanDerWaalsContact NE-O 3.15Å; R1350-D1374 PolarHBondContact NH1-O 2.64Å; R1350-D1374 PolarHBondContact NH2-O 3.22Å; N1371-D1374 PolarHBondContact O-N 2.94Å; N1371-D1374 VanDerWaalsContact O-N 3.14Å; Y1372-D1374 VanDerWaalsContact C-N 3.32Å; Y1372-D1374 PolarHBondContact O-N 2.82Å; D1374-R1376 VanDerWaalsContact C-N 3.28Å; D1374-R1376 PolarHBondContact O-N 2.86Å; D1374-R1376 WeakPolarHBondContact OD1-CB 2.99Å; D1374-R1376 WeakPolarHBondContact OD1-CG 3.42Å; D1374-R1376 IonicContact OD1-CZ 3.82Å; D1374-R1376 PolarHBondContact OD1-N 2.8Å; D1374-R1376 VanDerWaalsContact OD1-N 3.1Å; D1374-R1376 IonicContact OD1-NE 2.73Å; D1374-R1376 PolarHBondContact OD1-NE 3.09Å; D1374-R1376 IonicContact OD1-NH2 2.87Å; D1374-R1376 IonicContact OD2-CZ 2.69Å; D1374-R1376 IonicContact OD2-NE 3.14Å; D1374-R1376 PolarHBondContact OD2-NE 3.27Å; D1374-R1376 IonicContact OD2-NH2 2.78Å; D1374-R1376 PolarHBondContact OD2-NH2 2.81Å
1375	P	82.7	Confident	81.8	Confident	94 Å²	94	49.4 Å²	49.4	61%	0.61	28%	0.275	S	S	*	.			trans	-76.6	-9.7	-174.3	32.7	-36.7	0	0	0	114.1	H1349 A1373	H1349-P1375 PolarHBondContact CE1-O 2.92Å; A1373-P1375 VanDerWaalsContact O-CD 3.3Å; A1373-P1375 WeakPolarHBondContact O-CD 3.42Å
1376	R	89	Confident	81.6	Confident	81 Å²	81	49.9 Å²	49.9	31%	0.306	27%	0.269	S	S	.	.	P	Polyproline II helix	trans	-73	136.4	-163.7	-62	169.7	-59.8	175.8	-4.6	112.1	D1374 E1393 N1394	D1374-R1376 VanDerWaalsContact C-N 3.28Å; D1374-R1376 PolarHBondContact O-N 2.86Å; D1374-R1376 WeakPolarHBondContact OD1-CB 2.99Å; D1374-R1376 WeakPolarHBondContact OD1-CG 3.42Å; D1374-R1376 IonicContact OD1-CZ 3.82Å; D1374-R1376 PolarHBondContact OD1-N 2.8Å; D1374-R1376 VanDerWaalsContact OD1-N 3.1Å; D1374-R1376 IonicContact OD1-NE 2.73Å; D1374-R1376 PolarHBondContact OD1-NE 3.09Å; D1374-R1376 IonicContact OD1-NH2 2.87Å; D1374-R1376 IonicContact OD2-CZ 2.69Å; D1374-R1376 IonicContact OD2-NE 3.14Å; D1374-R1376 PolarHBondContact OD2-NE 3.27Å; D1374-R1376 IonicContact OD2-NH2 2.78Å; D1374-R1376 PolarHBondContact OD2-NH2 2.81Å; R1376-E1393 HydrophobicContact CB-CB 4.5Å; R1376-E1393 WeakPolarHBondContact CB-O 3.37Å; R1376-E1393 VanDerWaalsContact CD-O 3.24Å; R1376-E1393 WeakPolarHBondContact CD-O 3.09Å; R1376-N1394 PolarHBondContact NH1-O 3.06Å
1377	G	90.8	Very high	81.6	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	26%	0.264	C	S	.	.	P	Polyproline II helix	trans	-78.8	166.8	-178.6	0	0	0	0	0	113.4	H1349 Q1379 T1392 E1393	H1349-G1377 WeakPolarHBondContact ND1-CA 3.2Å; G1377-Q1379 PolarHBondContact O-N 3Å; G1377-T1392 CarbonylContact O-C 3.57Å; G1377-T1392 WeakPolarHBondContact O-CA 3.23Å; G1377-T1392 WeakPolarHBondContact O-CB 3.26Å; G1377-E1393 VanDerWaalsContact CA-OE2 3.24Å; G1377-E1393 WeakPolarHBondContact CA-OE2 3.42Å; G1377-E1393 PolarHBondContact N-OE2 2.88Å; G1377-E1393 WeakPolarHBondContact O-CG 3.3Å; G1377-E1393 PolarHBondContact O-N 3.43Å
1378	I	93.5	Very high	82	Confident	1 Å²	1	45.7 Å²	45.7	1%	0.005	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	116	172.9	-56.7	165	0	0	0	109.3	A1347 H1349 I1352 L1368 M1381 L1390	A1347-I1378 HydrophobicContact CB-CB 3.86Å; A1347-I1378 HydrophobicContact CB-CD1 4.09Å; A1347-I1378 HydrophobicContact CB-CG2 3.67Å; H1349-I1378 WeakPolarHBondContact O-CG1 3.48Å; H1349-I1378 PolarHBondContact O-N 2.65Å; I1352-I1378 HydrophobicContact CD1-CD1 3.94Å; I1352-I1378 HydrophobicContact CG1-CD1 3.5Å; I1352-I1378 VanDerWaalsContact CG1-CD1 3.5Å; L1368-I1378 HydrophobicContact CD1-CD1 4.27Å; L1368-I1378 HydrophobicContact CD1-CG1 3.69Å; L1368-I1378 HydrophobicContact CD2-CD1 3.82Å; L1368-I1378 HydrophobicContact CD2-CG1 3.92Å; L1368-I1378 HydrophobicContact CG-CD1 3.95Å; L1368-I1378 HydrophobicContact CG-CG1 3.95Å; I1378-M1381 HydrophobicContact CG2-CG 3.87Å; I1378-M1381 HydrophobicContact CG2-SD 4.4Å; I1378-L1390 HydrophobicContact CD1-CD1 4.49Å; I1378-L1390 HydrophobicContact CG2-CD2 4.49Å
1379	Q	93	Very high	82.6	Confident	76 Å²	76	45.1 Å²	45.1	36%	0.355	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	-40.4	177.1	-160.4	173.3	17.7	0	0	112.2	G1377 A1391 E1393	G1377-Q1379 PolarHBondContact O-N 3Å; Q1379-A1391 PolarHBondContact N-O 3.44Å; Q1379-E1393 HydrophobicContact CB-CG 3.75Å; Q1379-E1393 HydrophobicContact CG-CG 4.1Å
1380	L	95.8	Very high	84	Confident	10 Å²	10	41.9 Å²	41.9	5%	0.052	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	144.1	-169.1	-61.5	169.1	0	0	0	111	L1390 A1391 I1439 L1442	L1380-L1390 WeakPolarHBondContact O-CA 3.46Å; L1380-A1391 HydrophobicContact CB-CB 4.31Å; L1380-A1391 PolarHBondContact N-O 2.97Å; L1380-A1391 PolarHBondContact O-N 3Å; L1380-I1439 HydrophobicContact CD1-CG2 3.9Å; L1380-L1442 HydrophobicContact CB-CD1 3.94Å; L1380-L1442 HydrophobicContact CB-CG 4.18Å; L1380-L1442 HydrophobicContact CD1-CG 4.28Å
1381	M	96.3	Very high	85.7	Confident	9 Å²	9	40.3 Å²	40.3	4%	0.044	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	139.6	173.9	-54.5	-160.2	-78.1	0	0	110.1	R1336 L1338 W1345 A1347 I1378 W1389 L1390	R1336-M1381 HydrophobicContact CB-CE 4.18Å; R1336-M1381 HydrophobicContact CG-CE 4.38Å; R1336-M1381 HydrophobicContact CG-CG 4.45Å; R1336-M1381 WeakPolarHBondContact O-CE 3.43Å; L1338-M1381 HydrophobicContact CB-CB 4.26Å; L1338-M1381 HydrophobicContact CB-CE 3.93Å; L1338-M1381 HydrophobicContact CD2-CB 3.65Å; W1345-M1381 HydrophobicContact CB-CE 4.36Å; W1345-M1381 WeakPolarHBondContact O-CE 3.5Å; A1347-M1381 HydrophobicContact CB-CE 3.67Å; A1347-M1381 HydrophobicContact CB-CG 4.39Å; A1347-M1381 HydrophobicContact CB-SD 3.8Å; I1378-M1381 HydrophobicContact CG2-CG 3.87Å; I1378-M1381 HydrophobicContact CG2-SD 4.4Å; M1381-W1389 CarbonylContact C-O 3.14Å; M1381-W1389 WeakPolarHBondContact CA-O 3.43Å; M1381-L1390 HydrophobicContact CB-CD2 4.02Å; M1381-L1390 HydrophobicContact CG-CD2 3.5Å; M1381-L1390 HydrophobicContact SD-CD2 3.64Å
1382	A	95.6	Very high	87.4	Confident	6 Å²	6	36 Å²	36	5%	0.05	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	147.3	170.5	0	0	0	0	0	110.7	V1388 W1389 L1442 V1444 L1449	A1382-V1388 WeakPolarHBondContact O-CA 3.47Å; A1382-W1389 PolarHBondContact N-O 2.9Å; A1382-W1389 PolarHBondContact O-N 3Å; A1382-L1442 HydrophobicContact CB-CB 3.93Å; A1382-V1444 HydrophobicContact CB-CG2 4.28Å; A1382-L1449 HydrophobicContact CB-CD1 3.83Å
1383	Y	92.8	Very high	88.9	Confident	27 Å²	27	30.7 Å²	30.7	11%	0.106	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	135.9	-175.9	168.4	-128.7	0	0	0	110.4	Y999 V1339 V1340 K1385 T1387 V1388 A1403	Y999-Y1383 WeakPolarHBondContact O-CE1 3.08Å; V1339-Y1383 VanDerWaalsContact O-CD1 3.29Å; V1339-Y1383 WeakPolarHBondContact O-CD1 3.22Å; V1340-Y1383 HydrophobicContact CB-CD1 4.49Å; V1340-Y1383 HydrophobicContact CB-CG 4.5Å; V1340-Y1383 HydrophobicContact CG1-CD1 4.49Å; V1340-Y1383 HydrophobicContact CG1-CD2 4.02Å; V1340-Y1383 HydrophobicContact CG1-CE2 4.16Å; V1340-Y1383 HydrophobicContact CG1-CG 4.25Å; V1340-Y1383 HydrophobicContact CG2-CD1 4.5Å; V1340-Y1383 HydrophobicContact CG2-CG 4.23Å; Y1383-K1385 VanDerWaalsContact CE2-O 3.29Å; Y1383-K1385 WeakPolarHBondContact CE2-O 3.42Å; Y1383-K1385 PolarHBondContact OH-O 2.88Å; Y1383-T1387 WeakPolarHBondContact CD2-O 3.19Å; Y1383-V1388 HydrophobicContact CD2-CG2 4Å; Y1383-A1403 HydrophobicContact CD2-CB 4.09Å; Y1383-A1403 HydrophobicContact CE2-CB 3.56Å
1384	G	84.7	Confident	90.4	Very high	6 Å²	6	31.5 Å²	31.5	6%	0.062	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	139.9	175.5	0	0	0	0	0	111.2	Q1386 T1387	G1384-Q1386 PolarHBondContact O-N 2.84Å; G1384-T1387 PolarHBondContact N-O 3.38Å; G1384-T1387 PolarHBondContact O-N 3.39Å; G1384-T1387 PolarHBondContact O-OG1 3.15Å
1385	K	79.9	Confident	91.4	Very high	63 Å²	63	30.3 Å²	30.3	27%	0.274	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.3	-107.9	-178.2	-55	172.3	-176.1	171.8	0	111.9	Y1383 D1447 I1463	Y1383-K1385 VanDerWaalsContact CE2-O 3.29Å; Y1383-K1385 WeakPolarHBondContact CE2-O 3.42Å; Y1383-K1385 PolarHBondContact OH-O 2.88Å; K1385-D1447 WeakPolarHBondContact CE-OD1 3.45Å; K1385-D1447 WeakPolarHBondContact CE-OD2 3.45Å; K1385-D1447 IonicContact NZ-OD1 2.83Å; K1385-D1447 PolarHBondContact NZ-OD1 3.41Å; K1385-D1447 IonicContact NZ-OD2 3.71Å; K1385-D1447 PolarHBondContact NZ-OD2 3.2Å; K1385-I1463 HydrophobicContact CD-CB 4.43Å; K1385-I1463 HydrophobicContact CD-CG2 3.93Å; K1385-I1463 PolarHBondContact NZ-O 3.03Å
1386	Q	84.2	Confident	91.9	Very high	83 Å²	83	26.7 Å²	26.7	39%	0.388	13%	0.129	S	C	.	.	T	Hydrogen-bonded Turn	trans	-119.7	18.3	179.5	-62.7	176.3	26.3	0	0	111.4	G1384 H1402 A1403 L1466	G1384-Q1386 PolarHBondContact O-N 2.84Å; Q1386-H1402 PolarHBondContact O-CD2 3.44Å; Q1386-A1403 VanDerWaalsContact C-CB 3.44Å; Q1386-A1403 VanDerWaalsContact O-CB 3.26Å; Q1386-A1403 WeakPolarHBondContact O-CB 3.39Å; Q1386-A1403 PolarHBondContact O-N 3.22Å; Q1386-L1466 HydrophobicContact CB-CD1 4.31Å
1387	T	89.6	Confident	92.1	Very high	2 Å²	2	26.8 Å²	26.8	1%	0.012	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	134	-175.2	51	0	0	0	0	112.7	Y1383 G1384 W1389 L1400 Y1401 L1409 I1463 L1466	Y1383-T1387 WeakPolarHBondContact CD2-O 3.19Å; G1384-T1387 PolarHBondContact N-O 3.38Å; G1384-T1387 PolarHBondContact O-N 3.39Å; G1384-T1387 PolarHBondContact O-OG1 3.15Å; T1387-W1389 PolarHBondContact OG1-NE1 3.38Å; T1387-L1400 HydrophobicContact CG2-CD1 3.83Å; T1387-L1400 HydrophobicContact CG2-CD2 4.35Å; T1387-L1400 HydrophobicContact CG2-CG 4.31Å; T1387-Y1401 CarbonylContact C-O 3.53Å; T1387-Y1401 VanDerWaalsContact CA-O 3.32Å; T1387-Y1401 WeakPolarHBondContact CA-O 3.37Å; T1387-L1409 HydrophobicContact CG2-CD1 4.33Å; T1387-I1463 WeakPolarHBondContact OG1-CG2 3.27Å; T1387-L1466 HydrophobicContact CG2-CD1 3.82Å; T1387-L1466 HydrophobicContact CG2-CG 4.26Å
1388	V	93.3	Very high	92.3	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	136.2	167.5	-177.3	0	0	0	0	108.5	L1338 V1340 W1345 A1382 Y1383 L1390 Y1401 A1403	L1338-V1388 HydrophobicContact CD2-CG1 4.38Å; V1340-V1388 HydrophobicContact CB-CG2 4.33Å; V1340-V1388 HydrophobicContact CG1-CG2 3.52Å; V1340-V1388 HydrophobicContact CG2-CG2 3.8Å; W1345-V1388 HydrophobicContact CD2-CG2 4.48Å; W1345-V1388 HydrophobicContact CE3-CB 4.38Å; W1345-V1388 HydrophobicContact CE3-CG1 3.99Å; W1345-V1388 HydrophobicContact CE3-CG2 4.15Å; W1345-V1388 HydrophobicContact CH2-CB 4.19Å; W1345-V1388 HydrophobicContact CH2-CG2 3.83Å; W1345-V1388 HydrophobicContact CZ2-CG2 4.16Å; W1345-V1388 HydrophobicContact CZ3-CB 3.87Å; W1345-V1388 HydrophobicContact CZ3-CG1 3.88Å; W1345-V1388 HydrophobicContact CZ3-CG2 3.83Å; A1382-V1388 WeakPolarHBondContact O-CA 3.47Å; Y1383-V1388 HydrophobicContact CD2-CG2 4Å; V1388-L1390 HydrophobicContact CG1-CD2 3.74Å; V1388-L1390 HydrophobicContact CG1-CG 4.47Å; V1388-Y1401 PolarHBondContact N-O 2.75Å; V1388-Y1401 PolarHBondContact O-N 2.9Å; V1388-A1403 HydrophobicContact CG2-CB 4.07Å
1389	W	94.9	Very high	92.2	Very high	1 Å²	1	27.1 Å²	27.1	0%	0.004	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	131.4	177.8	-59.9	84.7	0	0	0	108.8	M1381 A1382 T1387 I1398 S1399 L1400 I1412 L1449 V1461 I1463 P1478	M1381-W1389 CarbonylContact C-O 3.14Å; M1381-W1389 WeakPolarHBondContact CA-O 3.43Å; A1382-W1389 PolarHBondContact N-O 2.9Å; A1382-W1389 PolarHBondContact O-N 3Å; T1387-W1389 PolarHBondContact OG1-NE1 3.38Å; W1389-I1398 HydrophobicContact CB-CG2 4.1Å; W1389-I1398 HydrophobicContact CE3-CG2 3.73Å; W1389-S1399 WeakPolarHBondContact CA-O 3.5Å; W1389-L1400 HydrophobicContact CD2-CD1 3.42Å; W1389-L1400 VanDerWaalsContact CD2-CD1 3.42Å; W1389-L1400 HydrophobicContact CE3-CB 4.34Å; W1389-L1400 HydrophobicContact CE3-CD1 3.61Å; W1389-L1400 HydrophobicContact CG-CD1 4.1Å; W1389-L1400 HydrophobicContact CH2-CD1 3.79Å; W1389-L1400 HydrophobicContact CZ2-CD1 3.57Å; W1389-L1400 HydrophobicContact CZ3-CB 4.37Å; W1389-L1400 HydrophobicContact CZ3-CD1 3.8Å; W1389-I1412 HydrophobicContact CH2-CD1 4.44Å; W1389-I1412 HydrophobicContact CZ3-CD1 3.97Å; W1389-L1449 HydrophobicContact CB-CD1 3.94Å; W1389-L1449 HydrophobicContact CB-CD2 4.1Å; W1389-L1449 HydrophobicContact CD2-CD1 4.4Å; W1389-L1449 HydrophobicContact CD2-CD2 3.62Å; W1389-L1449 HydrophobicContact CD2-CG 4.42Å; W1389-L1449 HydrophobicContact CE3-CD2 3.67Å; W1389-L1449 HydrophobicContact CG-CD1 3.85Å; W1389-L1449 HydrophobicContact CG-CD2 3.85Å; W1389-L1449 HydrophobicContact CG-CG 4.37Å; W1389-L1449 HydrophobicContact CZ3-CD2 4.23Å; W1389-V1461 HydrophobicContact CH2-CG1 3.97Å; W1389-V1461 HydrophobicContact CZ3-CG1 4.38Å; W1389-I1463 HydrophobicContact CZ2-CB 4.34Å; W1389-I1463 HydrophobicContact CZ2-CG1 4.02Å; W1389-I1463 HydrophobicContact CZ2-CG2 4.21Å; W1389-P1478 HydrophobicContact CH2-CG 4.39Å
1390	L	95	Very high	92.2	Very high	2 Å²	2	23.6 Å²	23.6	1%	0.01	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	145.1	-177.4	-50.5	178.5	0	0	0	109.8	I1352 L1368 I1378 L1380 M1381 V1388 I1398 S1399 Y1401	I1352-L1390 HydrophobicContact CD1-CD1 3.64Å; I1352-L1390 HydrophobicContact CD1-CD2 4.46Å; L1368-L1390 HydrophobicContact CD2-CD1 3.64Å; I1378-L1390 HydrophobicContact CD1-CD1 4.49Å; I1378-L1390 HydrophobicContact CG2-CD2 4.49Å; L1380-L1390 WeakPolarHBondContact O-CA 3.46Å; M1381-L1390 HydrophobicContact CB-CD2 4.02Å; M1381-L1390 HydrophobicContact CG-CD2 3.5Å; M1381-L1390 HydrophobicContact SD-CD2 3.64Å; V1388-L1390 HydrophobicContact CG1-CD2 3.74Å; V1388-L1390 HydrophobicContact CG1-CG 4.47Å; L1390-I1398 CarbonylContact O-C 3.44Å; L1390-I1398 VanDerWaalsContact O-CA 3.31Å; L1390-I1398 WeakPolarHBondContact O-CA 3.36Å; L1390-I1398 VanDerWaalsContact O-CG2 3.3Å; L1390-I1398 WeakPolarHBondContact O-CG2 3.43Å; L1390-S1399 PolarHBondContact N-O 2.98Å; L1390-S1399 PolarHBondContact O-N 2.63Å; L1390-Y1401 HydrophobicContact CD1-CD2 3.53Å; L1390-Y1401 HydrophobicContact CD1-CE2 3.49Å; L1390-Y1401 VanDerWaalsContact CD1-CE2 3.49Å; L1390-Y1401 HydrophobicContact CD1-CG 4.3Å; L1390-Y1401 HydrophobicContact CG-CD2 4.01Å; L1390-Y1401 HydrophobicContact CG-CE2 4.31Å
1391	A	94.7	Very high	91.9	Very high	1 Å²	1	23.1 Å²	23.1	1%	0.008	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	139.3	165	0	0	0	0	0	110.3	Q1379 L1380 I1439 L1442	Q1379-A1391 PolarHBondContact N-O 3.44Å; L1380-A1391 HydrophobicContact CB-CB 4.31Å; L1380-A1391 PolarHBondContact N-O 2.97Å; L1380-A1391 PolarHBondContact O-N 3Å; A1391-I1439 HydrophobicContact CB-CB 4.13Å; A1391-I1439 HydrophobicContact CB-CD1 3.8Å; A1391-I1439 HydrophobicContact CB-CG2 4.07Å; A1391-L1442 HydrophobicContact CB-CD1 4.07Å
1392	T	93.4	Very high	91.5	Very high	14 Å²	14	23 Å²	23	9%	0.086	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	155.6	176.2	48.3	0	0	0	0	112.2	L1368 G1377 S1395	L1368-T1392 HydrophobicContact CD1-CG2 4.04Å; G1377-T1392 CarbonylContact O-C 3.57Å; G1377-T1392 WeakPolarHBondContact O-CA 3.23Å; G1377-T1392 WeakPolarHBondContact O-CB 3.26Å; T1392-S1395 WeakPolarHBondContact O-CB 3.25Å; T1392-S1395 PolarHBondContact O-N 3.25Å; T1392-S1395 WeakPolarHBondContact OG1-CB 3.2Å; T1392-S1395 PolarHBondContact OG1-OG 3.49Å
1393	E	93.1	Very high	91.1	Very high	59 Å²	59	22.9 Å²	22.9	28%	0.276	11%	0.111	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.2	138.8	174.7	-65.6	163.4	148.1	0	0	110.4	R1376 G1377 Q1379 S1395	R1376-E1393 HydrophobicContact CB-CB 4.5Å; R1376-E1393 WeakPolarHBondContact CB-O 3.37Å; R1376-E1393 VanDerWaalsContact CD-O 3.24Å; R1376-E1393 WeakPolarHBondContact CD-O 3.09Å; G1377-E1393 VanDerWaalsContact CA-OE2 3.24Å; G1377-E1393 WeakPolarHBondContact CA-OE2 3.42Å; G1377-E1393 PolarHBondContact N-OE2 2.88Å; G1377-E1393 WeakPolarHBondContact O-CG 3.3Å; G1377-E1393 PolarHBondContact O-N 3.43Å; Q1379-E1393 HydrophobicContact CB-CG 3.75Å; Q1379-E1393 HydrophobicContact CG-CG 4.1Å; E1393-S1395 VanDerWaalsContact C-N 3.27Å; E1393-S1395 PolarHBondContact O-N 3.06Å
1394	N	93.1	Very high	90.7	Very high	100 Å²	100	26.5 Å²	26.5	54%	0.535	14%	0.136	S	C	.	.	T	Hydrogen-bonded Turn	trans	47.3	45.6	178.1	-68.2	-23.8	0	0	0	114.2	R1376 R1438	R1376-N1394 PolarHBondContact NH1-O 3.06Å; N1394-R1438 PolarHBondContact OD1-NH1 2.96Å
1395	S	93.3	Very high	90.6	Very high	2 Å²	2	29.8 Å²	29.8	1%	0.014	16%	0.155	C	C	.	.			trans	-133.8	142.3	-177.9	-173.1	0	0	0	0	112.1	T1392 E1393 R1397 R1438 I1439	T1392-S1395 WeakPolarHBondContact O-CB 3.25Å; T1392-S1395 PolarHBondContact O-N 3.25Å; T1392-S1395 WeakPolarHBondContact OG1-CB 3.2Å; T1392-S1395 PolarHBondContact OG1-OG 3.49Å; E1393-S1395 VanDerWaalsContact C-N 3.27Å; E1393-S1395 PolarHBondContact O-N 3.06Å; S1395-R1397 VanDerWaalsContact C-N 3.29Å; S1395-R1397 PolarHBondContact OG-N 2.96Å; S1395-R1438 CarbonylContact O-C 3.55Å; S1395-R1438 WeakPolarHBondContact O-CA 3.04Å; S1395-I1439 PolarHBondContact O-N 3.03Å
1396	S	94.4	Very high	90.8	Very high	18 Å²	18	27.1 Å²	27.1	13%	0.126	15%	0.146	C	C	.	.	S	Bend	trans	-86.5	2.5	170.2	59	0	0	0	0	113.3	D1413 L1414	S1396-D1413 VanDerWaalsContact CB-OD1 3.27Å; S1396-D1413 WeakPolarHBondContact CB-OD1 3.35Å; S1396-D1413 PolarHBondContact OG-OD1 2.89Å; S1396-L1414 WeakPolarHBondContact O-CB 3.26Å; S1396-L1414 PolarHBondContact O-N 2.81Å
1397	R	93.3	Very high	90.8	Very high	82 Å²	82	27 Å²	27	31%	0.309	15%	0.145	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	135	-167	-49.5	176.5	75.3	-117.3	-6.7	111.6	S1395 E1411 I1412 D1413 I1439	S1395-R1397 VanDerWaalsContact C-N 3.29Å; S1395-R1397 PolarHBondContact OG-N 2.96Å; R1397-E1411 IonicContact CZ-OE1 3.45Å; R1397-E1411 VanDerWaalsContact NH1-CD 3.28Å; R1397-E1411 IonicContact NH1-OE1 3.29Å; R1397-E1411 PolarHBondContact NH1-OE1 3.44Å; R1397-E1411 IonicContact NH1-OE2 3.06Å; R1397-E1411 IonicContact NH2-OE1 3.29Å; R1397-E1411 PolarHBondContact NH2-OE1 3.18Å; R1397-I1412 CarbonylContact C-O 3.58Å; R1397-I1412 VanDerWaalsContact CA-O 3.27Å; R1397-I1412 WeakPolarHBondContact CA-O 3.25Å; R1397-D1413 HydrophobicContact CG-CB 3.99Å; R1397-I1439 WeakPolarHBondContact O-CD1 3.44Å
1398	I	93.9	Very high	90.7	Very high	2 Å²	2	30.3 Å²	30.3	1%	0.01	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	127.1	175.9	-53	178.1	0	0	0	109.5	W1389 L1390 E1411 I1412 L1414 I1439 L1442 L1449 A1451	W1389-I1398 HydrophobicContact CB-CG2 4.1Å; W1389-I1398 HydrophobicContact CE3-CG2 3.73Å; L1390-I1398 CarbonylContact O-C 3.44Å; L1390-I1398 VanDerWaalsContact O-CA 3.31Å; L1390-I1398 WeakPolarHBondContact O-CA 3.36Å; L1390-I1398 VanDerWaalsContact O-CG2 3.3Å; L1390-I1398 WeakPolarHBondContact O-CG2 3.43Å; I1398-E1411 WeakPolarHBondContact O-CA 3.28Å; I1398-I1412 PolarHBondContact N-O 2.83Å; I1398-I1412 PolarHBondContact O-N 3.3Å; I1398-L1414 HydrophobicContact CD1-CD1 3.77Å; I1398-L1414 HydrophobicContact CD1-CG 4.29Å; I1398-L1414 HydrophobicContact CG1-CD1 4.38Å; I1398-I1439 HydrophobicContact CD1-CD1 4.23Å; I1398-I1439 HydrophobicContact CG1-CD1 3.41Å; I1398-I1439 VanDerWaalsContact CG1-CD1 3.41Å; I1398-I1439 HydrophobicContact CG1-CG1 4.34Å; I1398-L1442 HydrophobicContact CD1-CD2 3.82Å; I1398-L1449 HydrophobicContact CD1-CD2 3.88Å; I1398-L1449 HydrophobicContact CG2-CD2 4.3Å; I1398-A1451 HydrophobicContact CD1-CB 4.05Å
1399	S	92.1	Very high	90.3	Very high	7 Å²	7	31.6 Å²	31.6	5%	0.049	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	137.1	176.4	-36.3	0	0	0	0	110.6	W1389 L1390 E1411	W1389-S1399 WeakPolarHBondContact CA-O 3.5Å; L1390-S1399 PolarHBondContact N-O 2.98Å; L1390-S1399 PolarHBondContact O-N 2.63Å; S1399-E1411 PolarHBondContact OG-OE2 2.7Å
1400	L	92.1	Very high	90	Very high	1 Å²	1	32.9 Å²	32.9	1%	0.005	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	132.2	179.7	-174.2	69.8	0	0	0	110.9	T1387 W1389 L1409 M1410 P1464	T1387-L1400 HydrophobicContact CG2-CD1 3.83Å; T1387-L1400 HydrophobicContact CG2-CD2 4.35Å; T1387-L1400 HydrophobicContact CG2-CG 4.31Å; W1389-L1400 HydrophobicContact CD2-CD1 3.42Å; W1389-L1400 VanDerWaalsContact CD2-CD1 3.42Å; W1389-L1400 HydrophobicContact CE3-CB 4.34Å; W1389-L1400 HydrophobicContact CE3-CD1 3.61Å; W1389-L1400 HydrophobicContact CG-CD1 4.1Å; W1389-L1400 HydrophobicContact CH2-CD1 3.79Å; W1389-L1400 HydrophobicContact CZ2-CD1 3.57Å; W1389-L1400 HydrophobicContact CZ3-CB 4.37Å; W1389-L1400 HydrophobicContact CZ3-CD1 3.8Å; L1400-L1409 HydrophobicContact CB-CB 4.3Å; L1400-L1409 HydrophobicContact CD2-CB 3.91Å; L1400-L1409 HydrophobicContact CD2-CD1 4.08Å; L1400-L1409 HydrophobicContact CG-CB 4.02Å; L1400-L1409 HydrophobicContact CG-CD1 4.15Å; L1400-L1409 PolarHBondContact O-N 3.41Å; L1400-M1410 HydrophobicContact CB-CG 3.57Å; L1400-M1410 HydrophobicContact CD2-CG 3.61Å; L1400-M1410 HydrophobicContact CD2-SD 4.02Å; L1400-M1410 HydrophobicContact CG-CG 4.21Å; L1400-M1410 PolarHBondContact N-O 3.23Å; L1400-P1464 HydrophobicContact CD2-CG 4.06Å
1401	Y	90.8	Very high	89.7	Confident	1 Å²	1	35.7 Å²	35.7	0%	0.004	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	148.8	179	-75.3	-101.6	0	0	0	112	F1366 L1368 N1369 T1387 V1388 L1390 G1406 E1407 F1408	F1366-Y1401 HydrophobicContact CE2-CD1 4.33Å; F1366-Y1401 HydrophobicContact CE2-CE1 4.33Å; L1368-Y1401 HydrophobicContact CD2-CE2 4.25Å; L1368-Y1401 WeakPolarHBondContact CD2-OH 3.37Å; N1369-Y1401 PolarHBondContact N-OH 3.21Å; N1369-Y1401 VanDerWaalsContact N-OH 3.11Å; N1369-Y1401 PolarHBondContact O-OH 3.36Å; T1387-Y1401 CarbonylContact C-O 3.53Å; T1387-Y1401 VanDerWaalsContact CA-O 3.32Å; T1387-Y1401 WeakPolarHBondContact CA-O 3.37Å; V1388-Y1401 PolarHBondContact N-O 2.75Å; V1388-Y1401 PolarHBondContact O-N 2.9Å; L1390-Y1401 HydrophobicContact CD1-CD2 3.53Å; L1390-Y1401 HydrophobicContact CD1-CE2 3.49Å; L1390-Y1401 VanDerWaalsContact CD1-CE2 3.49Å; L1390-Y1401 HydrophobicContact CD1-CG 4.3Å; L1390-Y1401 HydrophobicContact CG-CD2 4.01Å; L1390-Y1401 HydrophobicContact CG-CE2 4.31Å; Y1401-G1406 WeakPolarHBondContact CD1-O 3.43Å; Y1401-E1407 CarbonylContact C-O 3.55Å; Y1401-E1407 WeakPolarHBondContact CA-O 3.38Å; Y1401-F1408 HydrophobicContact CD1-CB 4.19Å; Y1401-F1408 HydrophobicContact CD2-CD2 4.49Å; Y1401-F1408 HydrophobicContact CE1-CB 3.79Å; Y1401-F1408 HydrophobicContact CE1-CD2 4.41Å; Y1401-F1408 AromaticContact CE2-CD2 3.87Å; Y1401-F1408 HydrophobicContact CE2-CD2 3.87Å; Y1401-F1408 AromaticContact CZ-CD2 3.84Å
1402	H	88.2	Confident	89.6	Confident	6 Å²	6	36 Å²	36	3%	0.028	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	126.5	174.7	-175.7	-125.8	0	0	0	111.6	Q1386 T1404 T1405 G1406 E1407 L1409 Y1472	Q1386-H1402 PolarHBondContact O-CD2 3.44Å; H1402-T1404 VanDerWaalsContact C-N 3.28Å; H1402-T1404 PolarHBondContact CE1-OG1 2.86Å; H1402-T1404 PolarHBondContact O-N 2.78Å; H1402-T1404 VanDerWaalsContact O-N 3.15Å; H1402-T1405 WeakPolarHBondContact CB-OG1 3.37Å; H1402-T1405 PolarHBondContact ND1-OG1 2.87Å; H1402-G1406 PolarHBondContact O-N 2.8Å; H1402-E1407 HydrophobicContact CB-CB 4.27Å; H1402-E1407 PolarHBondContact N-O 3.35Å; H1402-L1409 HydrophobicContact CB-CD1 3.98Å; H1402-L1409 HydrophobicContact CB-CD2 4.33Å; H1402-L1409 HydrophobicContact CB-CG 4.27Å; H1402-Y1472 PolarHBondContact CE1-OH 3.32Å; H1402-Y1472 VanDerWaalsContact CE1-OH 3.3Å; H1402-Y1472 PolarHBondContact NE2-OH 3.43Å
1403	A	86.8	Confident	89.6	Confident	4 Å²	4	38.1 Å²	38.1	3%	0.033	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-17.2	-166	0	0	0	0	0	115.7	V1340 Y1383 Q1386 V1388	V1340-A1403 HydrophobicContact CG1-CB 3.72Å; V1340-A1403 WeakPolarHBondContact CG1-O 3.24Å; Y1383-A1403 HydrophobicContact CD2-CB 4.09Å; Y1383-A1403 HydrophobicContact CE2-CB 3.56Å; Q1386-A1403 VanDerWaalsContact C-CB 3.44Å; Q1386-A1403 VanDerWaalsContact O-CB 3.26Å; Q1386-A1403 WeakPolarHBondContact O-CB 3.39Å; Q1386-A1403 PolarHBondContact O-N 3.22Å; V1388-A1403 HydrophobicContact CG2-CB 4.07Å
1404	T	83.9	Confident	89.7	Confident	102 Å²	102	35.4 Å²	35.4	63%	0.626	19%	0.186	S	C	*	.	T	Hydrogen-bonded Turn	trans	-114.9	-18.8	179.4	67.9	0	0	0	0	114.9	A1341 H1402	A1341-T1404 HydrophobicContact CB-CG2 4.11Å; H1402-T1404 VanDerWaalsContact C-N 3.28Å; H1402-T1404 PolarHBondContact CE1-OG1 2.86Å; H1402-T1404 PolarHBondContact O-N 2.78Å; H1402-T1404 VanDerWaalsContact O-N 3.15Å
1405	T	82.1	Confident	89.8	Confident	75 Å²	75	33.9 Å²	33.9	46%	0.46	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.4	-18.3	176.7	56.1	0	0	0	0	113.4	H1402 E1407	H1402-T1405 WeakPolarHBondContact CB-OG1 3.37Å; H1402-T1405 PolarHBondContact ND1-OG1 2.87Å; T1405-E1407 PolarHBondContact O-N 3.29Å; T1405-E1407 VanDerWaalsContact OG1-CB 3.23Å; T1405-E1407 WeakPolarHBondContact OG1-CB 3.45Å; T1405-E1407 PolarHBondContact OG1-OE2 3.18Å
1406	G	83.8	Confident	89.8	Confident	8 Å²	8	37.8 Å²	37.8	8%	0.082	20%	0.199	C	C	.	.			trans	72.4	10	-172.7	0	0	0	0	0	113.6	Y1401 H1402	Y1401-G1406 WeakPolarHBondContact CD1-O 3.43Å; H1402-G1406 PolarHBondContact O-N 2.8Å
1407	E	84.4	Confident	89.7	Confident	80 Å²	80	38 Å²	38	37%	0.374	20%	0.199	S	C	.	.			trans	-73.6	135.1	-178.2	-175.8	-179.5	174.1	0	0	111.4	Y1401 H1402 T1405 L1409 Y1472	Y1401-E1407 CarbonylContact C-O 3.55Å; Y1401-E1407 WeakPolarHBondContact CA-O 3.38Å; H1402-E1407 HydrophobicContact CB-CB 4.27Å; H1402-E1407 PolarHBondContact N-O 3.35Å; T1405-E1407 PolarHBondContact O-N 3.29Å; T1405-E1407 VanDerWaalsContact OG1-CB 3.23Å; T1405-E1407 WeakPolarHBondContact OG1-CB 3.45Å; T1405-E1407 PolarHBondContact OG1-OE2 3.18Å; E1407-L1409 HydrophobicContact CG-CD2 4.41Å; E1407-Y1472 WeakPolarHBondContact OE2-CE2 3.16Å
1408	F	87.9	Confident	89.7	Confident	71 Å²	71	34 Å²	34	31%	0.311	18%	0.184	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	134.8	173.1	169.6	-94.8	0	0	0	110.2	N1369 Y1401 M1410 E1411	N1369-F1408 HydrophobicContact CB-CB 4.08Å; Y1401-F1408 HydrophobicContact CD1-CB 4.19Å; Y1401-F1408 HydrophobicContact CD2-CD2 4.49Å; Y1401-F1408 HydrophobicContact CE1-CB 3.79Å; Y1401-F1408 HydrophobicContact CE1-CD2 4.41Å; Y1401-F1408 AromaticContact CE2-CD2 3.87Å; Y1401-F1408 HydrophobicContact CE2-CD2 3.87Å; Y1401-F1408 AromaticContact CZ-CD2 3.84Å; F1408-M1410 WeakPolarHBondContact CE2-O 3.43Å; F1408-M1410 VanDerWaalsContact CZ-C 3.42Å; F1408-E1411 HydrophobicContact CE2-CB 4.07Å; F1408-E1411 HydrophobicContact CZ-CB 3.88Å
1409	L	86	Confident	89.7	Confident	27 Å²	27	35.7 Å²	35.7	14%	0.141	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	-40.5	-172	-63.1	-179.6	0	0	0	113.9	T1387 L1400 H1402 E1407 L1466 Y1472 I1475	T1387-L1409 HydrophobicContact CG2-CD1 4.33Å; L1400-L1409 HydrophobicContact CB-CB 4.3Å; L1400-L1409 HydrophobicContact CD2-CB 3.91Å; L1400-L1409 HydrophobicContact CD2-CD1 4.08Å; L1400-L1409 HydrophobicContact CG-CB 4.02Å; L1400-L1409 HydrophobicContact CG-CD1 4.15Å; L1400-L1409 PolarHBondContact O-N 3.41Å; H1402-L1409 HydrophobicContact CB-CD1 3.98Å; H1402-L1409 HydrophobicContact CB-CD2 4.33Å; H1402-L1409 HydrophobicContact CB-CG 4.27Å; E1407-L1409 HydrophobicContact CG-CD2 4.41Å; L1409-L1466 HydrophobicContact CD1-CD1 4.01Å; L1409-L1466 HydrophobicContact CD1-CD2 4.04Å; L1409-Y1472 HydrophobicContact CD2-CD2 3.87Å; L1409-Y1472 HydrophobicContact CD2-CG 4.06Å; L1409-I1475 HydrophobicContact CB-CD1 3.93Å; L1409-I1475 HydrophobicContact CD1-CD1 4.08Å; L1409-I1475 HydrophobicContact CD2-CD1 4.03Å; L1409-I1475 HydrophobicContact CG-CD1 4.24Å
1410	M	87.9	Confident	89.6	Confident	28 Å²	28	41 Å²	41	14%	0.138	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-169.3	172.2	175.8	61.3	173.1	56.8	0	0	111.1	L1400 F1408 I1412 I1475 P1478	L1400-M1410 HydrophobicContact CB-CG 3.57Å; L1400-M1410 HydrophobicContact CD2-CG 3.61Å; L1400-M1410 HydrophobicContact CD2-SD 4.02Å; L1400-M1410 HydrophobicContact CG-CG 4.21Å; L1400-M1410 PolarHBondContact N-O 3.23Å; F1408-M1410 WeakPolarHBondContact CE2-O 3.43Å; F1408-M1410 VanDerWaalsContact CZ-C 3.42Å; M1410-I1412 HydrophobicContact SD-CD1 4.05Å; M1410-I1412 HydrophobicContact SD-CG1 4.22Å; M1410-I1475 HydrophobicContact CE-CB 3.91Å; M1410-I1475 HydrophobicContact CE-CG2 3.46Å; M1410-I1475 VanDerWaalsContact CE-CG2 3.46Å; M1410-P1478 HydrophobicContact SD-CG 4.39Å
1411	E	89.3	Confident	89.4	Confident	62 Å²	62	43.3 Å²	43.3	29%	0.29	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	141.6	172	-173.7	159.9	73.9	0	0	110.4	R1397 I1398 S1399 F1408	R1397-E1411 IonicContact CZ-OE1 3.45Å; R1397-E1411 VanDerWaalsContact NH1-CD 3.28Å; R1397-E1411 IonicContact NH1-OE1 3.29Å; R1397-E1411 PolarHBondContact NH1-OE1 3.44Å; R1397-E1411 IonicContact NH1-OE2 3.06Å; R1397-E1411 IonicContact NH2-OE1 3.29Å; R1397-E1411 PolarHBondContact NH2-OE1 3.18Å; I1398-E1411 WeakPolarHBondContact O-CA 3.28Å; S1399-E1411 PolarHBondContact OG-OE2 2.7Å; F1408-E1411 HydrophobicContact CE2-CB 4.07Å; F1408-E1411 HydrophobicContact CZ-CB 3.88Å
1412	I	91.4	Very high	89.3	Confident	7 Å²	7	43.2 Å²	43.2	4%	0.036	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	125.1	-172.9	-50.4	179.4	0	0	0	108.8	W1389 R1397 I1398 M1410 L1414 V1461 P1478 L1480	W1389-I1412 HydrophobicContact CH2-CD1 4.44Å; W1389-I1412 HydrophobicContact CZ3-CD1 3.97Å; R1397-I1412 CarbonylContact C-O 3.58Å; R1397-I1412 VanDerWaalsContact CA-O 3.27Å; R1397-I1412 WeakPolarHBondContact CA-O 3.25Å; I1398-I1412 PolarHBondContact N-O 2.83Å; I1398-I1412 PolarHBondContact O-N 3.3Å; M1410-I1412 HydrophobicContact SD-CD1 4.05Å; M1410-I1412 HydrophobicContact SD-CG1 4.22Å; I1412-L1414 HydrophobicContact CG2-CD2 4.15Å; I1412-V1461 HydrophobicContact CD1-CG1 4.33Å; I1412-P1478 HydrophobicContact CD1-CG 3.38Å; I1412-L1480 HydrophobicContact CG2-CD1 4.01Å; I1412-L1480 HydrophobicContact CG2-CD2 4.23Å
1413	D	93.2	Very high	89.2	Confident	59 Å²	59	47.1 Å²	47.1	32%	0.316	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	126.4	167.9	-173.3	8.7	0	0	0	110.4	S1396 R1397 K1415	S1396-D1413 VanDerWaalsContact CB-OD1 3.27Å; S1396-D1413 WeakPolarHBondContact CB-OD1 3.35Å; S1396-D1413 PolarHBondContact OG-OD1 2.89Å; R1397-D1413 HydrophobicContact CG-CB 3.99Å; D1413-K1415 VanDerWaalsContact OD1-CB 3.26Å; D1413-K1415 WeakPolarHBondContact OD1-CB 3.42Å; D1413-K1415 PolarHBondContact OD1-N 2.7Å
1414	L	94.8	Very high	88.8	Confident	2 Å²	2	51.2 Å²	51.2	1%	0.01	27%	0.265	C	S	.	.			trans	-86.5	-11.2	175.9	-58.1	-170.1	0	0	0	113	S1396 I1398 I1412 I1417 V1418 I1439 A1451 V1459 L1480	S1396-L1414 WeakPolarHBondContact O-CB 3.26Å; S1396-L1414 PolarHBondContact O-N 2.81Å; I1398-L1414 HydrophobicContact CD1-CD1 3.77Å; I1398-L1414 HydrophobicContact CD1-CG 4.29Å; I1398-L1414 HydrophobicContact CG1-CD1 4.38Å; I1412-L1414 HydrophobicContact CG2-CD2 4.15Å; L1414-I1417 WeakPolarHBondContact O-CG2 3.2Å; L1414-I1417 PolarHBondContact O-N 3Å; L1414-V1418 WeakPolarHBondContact O-CG2 3.48Å; L1414-V1418 PolarHBondContact O-N 3.21Å; L1414-V1418 VanDerWaalsContact O-N 3.13Å; L1414-I1439 HydrophobicContact CD1-CG1 4.31Å; L1414-A1451 HydrophobicContact CD1-CB 3.76Å; L1414-V1459 HydrophobicContact CD1-CB 4.18Å; L1414-V1459 HydrophobicContact CD1-CG1 4.44Å; L1414-V1459 HydrophobicContact CD1-CG2 4.2Å; L1414-V1459 HydrophobicContact CD2-CG1 4.27Å; L1414-L1480 HydrophobicContact CD2-CD1 4.46Å; L1414-L1480 HydrophobicContact CD2-CD2 4.17Å
1415	K	95.2	Very high	88.5	Confident	67 Å²	67	47.3 Å²	47.3	29%	0.291	24%	0.241	S	C	.	.	H	α-helix	trans	-51.3	-47.1	-177.7	178.8	173.6	178.5	173.6	0	113.7	D1413 I1417 V1418 L1419 E1434 L1437	D1413-K1415 VanDerWaalsContact OD1-CB 3.26Å; D1413-K1415 WeakPolarHBondContact OD1-CB 3.42Å; D1413-K1415 PolarHBondContact OD1-N 2.7Å; K1415-I1417 PolarHBondContact O-N 3.22Å; K1415-V1418 PolarHBondContact O-N 3.5Å; K1415-L1419 HydrophobicContact CG-CD1 3.85Å; K1415-L1419 HydrophobicContact CG-CG 4.33Å; K1415-L1419 WeakPolarHBondContact O-CG 3.24Å; K1415-L1419 PolarHBondContact O-N 3.18Å; K1415-E1434 VanDerWaalsContact CE-CG 3.49Å; K1415-E1434 WeakPolarHBondContact CE-OE1 3.02Å; K1415-E1434 IonicContact NZ-OE1 3.48Å; K1415-E1434 PolarHBondContact NZ-OE1 3.34Å; K1415-L1437 HydrophobicContact CB-CD2 3.93Å; K1415-L1437 HydrophobicContact CG-CD2 3.98Å
1416	P	94.3	Very high	88.7	Confident	84 Å²	84	47.7 Å²	47.7	55%	0.545	24%	0.24	S	C	.	.	H	α-helix	trans	-63.1	-41	-177	-23.8	35.4	0	0	0	113.9	Q1420	P1416-Q1420 WeakPolarHBondContact O-CB 3.34Å; P1416-Q1420 PolarHBondContact O-N 2.78Å
1417	I	92.5	Very high	88.7	Confident	22 Å²	22	52.5 Å²	52.5	11%	0.113	26%	0.261	C	S	.	.	H	α-helix	trans	-77.5	-27.6	-178.5	-164.1	176.3	0	0	0	112.5	L1414 K1415 R1421 V1459 L1480 T1482	L1414-I1417 WeakPolarHBondContact O-CG2 3.2Å; L1414-I1417 PolarHBondContact O-N 3Å; K1415-I1417 PolarHBondContact O-N 3.22Å; I1417-R1421 PolarHBondContact O-N 2.87Å; I1417-V1459 HydrophobicContact CG2-CG1 4.23Å; I1417-L1480 HydrophobicContact CD1-CB 3.62Å; I1417-L1480 WeakPolarHBondContact CD1-O 3.34Å; I1417-L1480 HydrophobicContact CG2-CD1 4.45Å; I1417-T1482 HydrophobicContact CD1-CG2 4.27Å; I1417-T1482 HydrophobicContact CG1-CG2 3.92Å; I1417-T1482 HydrophobicContact CG2-CG2 4.48Å
1418	V	93.9	Very high	88.8	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-67.7	-47.8	170.8	174.2	0	0	0	0	110.3	L1414 K1415 Q1420 R1421 L1422 L1437 T1453 A1455 V1457 V1459	L1414-V1418 WeakPolarHBondContact O-CG2 3.48Å; L1414-V1418 PolarHBondContact O-N 3.21Å; L1414-V1418 VanDerWaalsContact O-N 3.13Å; K1415-V1418 PolarHBondContact O-N 3.5Å; V1418-Q1420 VanDerWaalsContact C-N 3.32Å; V1418-Q1420 PolarHBondContact O-N 3.44Å; V1418-R1421 WeakPolarHBondContact O-CA 3.1Å; V1418-R1421 WeakPolarHBondContact O-CB 3.41Å; V1418-R1421 PolarHBondContact O-N 2.95Å; V1418-L1422 HydrophobicContact CG1-CD1 3.95Å; V1418-L1422 HydrophobicContact CG1-CG 4.43Å; V1418-L1422 WeakPolarHBondContact O-CG 3.41Å; V1418-L1422 PolarHBondContact O-N 3.36Å; V1418-L1437 HydrophobicContact CB-CD2 4.05Å; V1418-L1437 HydrophobicContact CG1-CD1 3.94Å; V1418-L1437 HydrophobicContact CG1-CD2 4.02Å; V1418-L1437 HydrophobicContact CG2-CD2 4.47Å; V1418-T1453 HydrophobicContact CG2-CG2 4.12Å; V1418-A1455 HydrophobicContact CG1-CB 4.16Å; V1418-V1457 HydrophobicContact CG1-CB 4.26Å; V1418-V1457 HydrophobicContact CG1-CG2 4.2Å; V1418-V1457 HydrophobicContact CG2-CG1 4.47Å; V1418-V1459 HydrophobicContact CG2-CG2 4Å
1419	L	93.2	Very high	88.6	Confident	36 Å²	36	54.5 Å²	54.5	19%	0.188	28%	0.275	C	S	.	.	H	α-helix	trans	-63.9	-36.5	176.4	-64.1	176.6	0	0	0	112.3	K1415 R1421 L1422 Q1423 M1430 E1434	K1415-L1419 HydrophobicContact CG-CD1 3.85Å; K1415-L1419 HydrophobicContact CG-CG 4.33Å; K1415-L1419 WeakPolarHBondContact O-CG 3.24Å; K1415-L1419 PolarHBondContact O-N 3.18Å; L1419-R1421 PolarHBondContact O-N 3.48Å; L1419-R1421 VanDerWaalsContact O-N 3.14Å; L1419-L1422 CarbonylContact O-C 3.57Å; L1419-L1422 PolarHBondContact O-N 2.78Å; L1419-L1422 VanDerWaalsContact O-N 3.13Å; L1419-Q1423 PolarHBondContact O-N 3.49Å; L1419-M1430 HydrophobicContact CD2-CG 4.25Å; L1419-E1434 HydrophobicContact CD1-CG 4.02Å; L1419-E1434 HydrophobicContact CD2-CB 3.78Å; L1419-E1434 HydrophobicContact CD2-CG 3.84Å; L1419-E1434 HydrophobicContact CG-CG 4.49Å
1420	Q	90.1	Very high	88.8	Confident	120 Å²	120	55.3 Å²	55.3	56%	0.561	28%	0.279	S	S	*	.	H	α-helix	trans	-61.8	-18.3	171.2	-162.4	-170.3	19.9	0	0	113.5	P1416 V1418 Q1423	P1416-Q1420 WeakPolarHBondContact O-CB 3.34Å; P1416-Q1420 PolarHBondContact O-N 2.78Å; V1418-Q1420 VanDerWaalsContact C-N 3.32Å; V1418-Q1420 PolarHBondContact O-N 3.44Å; Q1420-Q1423 WeakPolarHBondContact O-CG 3.45Å
1421	R	88.4	Confident	88.8	Confident	48 Å²	48	60.3 Å²	60.3	18%	0.181	30%	0.296	C	S	.	.	H	α-helix	trans	-95.6	-25.7	173.7	-168.6	62.8	97.4	148.1	-1.9	113.2	I1417 V1418 L1419 Q1423 V1457 T1482 L1483 F1599	I1417-R1421 PolarHBondContact O-N 2.87Å; V1418-R1421 WeakPolarHBondContact O-CA 3.1Å; V1418-R1421 WeakPolarHBondContact O-CB 3.41Å; V1418-R1421 PolarHBondContact O-N 2.95Å; L1419-R1421 PolarHBondContact O-N 3.48Å; L1419-R1421 VanDerWaalsContact O-N 3.14Å; R1421-Q1423 VanDerWaalsContact C-N 3.35Å; R1421-V1457 HydrophobicContact CB-CG1 4.43Å; R1421-V1457 HydrophobicContact CG-CG1 4.35Å; R1421-T1482 HydrophobicContact CB-CG2 4.21Å; R1421-T1482 PolarHBondContact NE-OG1 3.23Å; R1421-T1482 PolarHBondContact NH2-O 2.84Å; R1421-T1482 PolarHBondContact NH2-OG1 2.83Å; R1421-L1483 PolarHBondContact NH2-O 2.71Å; R1421-F1599 HydrophobicContact CG-CB 3.67Å; R1421-F1599 HydrophobicContact CG-CD1 4.31Å; R1421-F1599 HydrophobicContact CG-CD2 4.47Å; R1421-F1599 HydrophobicContact CG-CG 3.94Å; R1421-F1599 PolarHBondContact NH1-O 2.92Å
1422	L	88.7	Confident	88.8	Confident	0 Å²	0	62.9 Å²	62.9	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-87.1	0.8	174.2	-60.9	174.8	0	0	0	113.9	V1418 L1419 D1424 C1425 M1430 K1433 A1455 V1457 F1599	V1418-L1422 HydrophobicContact CG1-CD1 3.95Å; V1418-L1422 HydrophobicContact CG1-CG 4.43Å; V1418-L1422 WeakPolarHBondContact O-CG 3.41Å; V1418-L1422 PolarHBondContact O-N 3.36Å; L1419-L1422 CarbonylContact O-C 3.57Å; L1419-L1422 PolarHBondContact O-N 2.78Å; L1419-L1422 VanDerWaalsContact O-N 3.13Å; L1422-D1424 PolarHBondContact O-N 3.11Å; L1422-C1425 WeakPolarHBondContact O-CB 3.38Å; L1422-C1425 PolarHBondContact O-N 3.04Å; L1422-M1430 HydrophobicContact CB-CG 4.29Å; L1422-K1433 HydrophobicContact CD1-CB 3.78Å; L1422-K1433 HydrophobicContact CD1-CD 4.07Å; L1422-K1433 HydrophobicContact CD2-CD 3.89Å; L1422-A1455 HydrophobicContact CD1-CB 4.1Å; L1422-V1457 HydrophobicContact CD2-CG2 3.97Å; L1422-V1457 HydrophobicContact CG-CG2 4.3Å; L1422-F1599 HydrophobicContact CD2-CD1 4.37Å; L1422-F1599 HydrophobicContact CD2-CE1 3.75Å
1423	Q	84.9	Confident	88.9	Confident	87 Å²	87	63.8 Å²	63.8	41%	0.407	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.9	-21.2	-178.6	62.2	154.8	72.1	0	0	115.5	L1419 Q1420 R1421	L1419-Q1423 PolarHBondContact O-N 3.49Å; Q1420-Q1423 WeakPolarHBondContact O-CG 3.45Å; R1421-Q1423 VanDerWaalsContact C-N 3.35Å
1424	D	77.9	Confident	88.9	Confident	91 Å²	91	63.9 Å²	63.9	49%	0.487	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102	2.2	-175.6	-56.7	-41.5	0	0	0	111.7	L1422	L1422-D1424 PolarHBondContact O-N 3.11Å
1425	C	79.6	Confident	88.7	Confident	19 Å²	19	68 Å²	68	13%	0.128	35%	0.345	C	S	.	.	S	Bend	trans	-87.4	159.8	172.3	-55.2	0	0	0	0	111.3	L1422 E1427	L1422-C1425 WeakPolarHBondContact O-CB 3.38Å; L1422-C1425 PolarHBondContact O-N 3.04Å; C1425-E1427 PolarHBondContact O-N 2.92Å
1426	D	85.1	Confident	88.6	Confident	84 Å²	84	67 Å²	67	45%	0.449	35%	0.345	S	S	.	.			trans	-56.6	139	172.7	-77.6	-29.1	0	0	0	112	I1428 I1429 M1430 C1615	D1426-I1428 PolarHBondContact O-N 3.38Å; D1426-I1428 VanDerWaalsContact O-N 3.08Å; D1426-I1429 HydrophobicContact CB-CB 4.48Å; D1426-I1429 HydrophobicContact CB-CD1 4.15Å; D1426-I1429 HydrophobicContact CB-CG1 4.23Å; D1426-I1429 WeakPolarHBondContact O-CA 3.36Å; D1426-I1429 WeakPolarHBondContact O-CB 3.35Å; D1426-I1429 PolarHBondContact O-N 2.86Å; D1426-M1430 PolarHBondContact O-N 2.99Å; D1426-C1615 VanDerWaalsContact CG-SG 3.51Å; D1426-C1615 PolarHBondContact OD1-SG 2.96Å
1427	E	84.9	Confident	88.7	Confident	109 Å²	109	63.8 Å²	63.8	51%	0.509	32%	0.324	S	S	.	.	H	α-helix	trans	-59	-30.3	-172	-155.3	-165.3	-156	0	0	113.3	C1425 M1430 R1431	C1425-E1427 PolarHBondContact O-N 2.92Å; E1427-M1430 HydrophobicContact CG-CE 4.19Å; E1427-R1431 WeakPolarHBondContact O-CB 3.48Å; E1427-R1431 WeakPolarHBondContact O-CG 3.34Å; E1427-R1431 PolarHBondContact O-N 3.11Å; E1427-R1431 IonicContact OE1-CZ 3.87Å; E1427-R1431 IonicContact OE1-NH1 2.68Å; E1427-R1431 IonicContact OE1-NH2 3.96Å; E1427-R1431 PolarHBondContact OE1-NH2 3.43Å; E1427-R1431 IonicContact OE2-CZ 2.81Å; E1427-R1431 IonicContact OE2-NH1 3.45Å; E1427-R1431 PolarHBondContact OE2-NH1 3.23Å; E1427-R1431 IonicContact OE2-NH2 2.7Å; E1427-R1431 PolarHBondContact OE2-NH2 2.96Å
1428	I	86	Confident	88.8	Confident	141 Å²	141	64.7 Å²	64.7	72%	0.723	33%	0.326	S	S	*	.	H	α-helix	trans	-68.8	-45.8	174.5	-59.5	174.8	0	0	0	110.7	D1426 R1431 H1432	D1426-I1428 PolarHBondContact O-N 3.38Å; D1426-I1428 VanDerWaalsContact O-N 3.08Å; I1428-R1431 PolarHBondContact O-N 3.19Å; I1428-H1432 WeakPolarHBondContact O-CB 3.38Å; I1428-H1432 PolarHBondContact O-N 2.98Å
1429	I	84.2	Confident	89	Confident	51 Å²	51	64.8 Å²	64.8	26%	0.262	33%	0.326	S	S	.	.	H	α-helix	trans	-66.7	-41.7	178.4	-61.2	176.5	0	0	0	109.8	D1426 H1432 K1433 C1616	D1426-I1429 HydrophobicContact CB-CB 4.48Å; D1426-I1429 HydrophobicContact CB-CD1 4.15Å; D1426-I1429 HydrophobicContact CB-CG1 4.23Å; D1426-I1429 WeakPolarHBondContact O-CA 3.36Å; D1426-I1429 WeakPolarHBondContact O-CB 3.35Å; D1426-I1429 PolarHBondContact O-N 2.86Å; I1429-H1432 PolarHBondContact O-N 3.26Å; I1429-K1433 HydrophobicContact CG2-CD 4.41Å; I1429-K1433 HydrophobicContact CG2-CG 4.47Å; I1429-K1433 WeakPolarHBondContact O-CB 3.5Å; I1429-K1433 PolarHBondContact O-N 2.86Å; I1429-C1616 HydrophobicContact CD1-CB 4.06Å
1430	M	88.8	Confident	89.2	Confident	44 Å²	44	64 Å²	64	22%	0.217	32%	0.323	C	S	.	.	H	α-helix	trans	-60.5	-49.2	175	178.7	168.7	48.9	0	0	111.4	L1419 L1422 D1426 E1427 H1432 K1433 E1434	L1419-M1430 HydrophobicContact CD2-CG 4.25Å; L1422-M1430 HydrophobicContact CB-CG 4.29Å; D1426-M1430 PolarHBondContact O-N 2.99Å; E1427-M1430 HydrophobicContact CG-CE 4.19Å; M1430-H1432 VanDerWaalsContact C-N 3.32Å; M1430-H1432 PolarHBondContact O-N 2.83Å; M1430-K1433 PolarHBondContact O-N 2.85Å; M1430-E1434 VanDerWaalsContact O-CB 3.24Å; M1430-E1434 WeakPolarHBondContact O-CB 3.44Å; M1430-E1434 PolarHBondContact O-N 3Å
1431	R	89.3	Confident	89.5	Confident	134 Å²	134	58.8 Å²	58.8	51%	0.506	30%	0.3	S	S	.	.	H	α-helix	trans	-62.1	-35.3	176.1	-76.8	-173.2	-175.4	104.7	9.1	113.1	E1427 I1428 E1434 A1435	E1427-R1431 WeakPolarHBondContact O-CB 3.48Å; E1427-R1431 WeakPolarHBondContact O-CG 3.34Å; E1427-R1431 PolarHBondContact O-N 3.11Å; E1427-R1431 IonicContact OE1-CZ 3.87Å; E1427-R1431 IonicContact OE1-NH1 2.68Å; E1427-R1431 IonicContact OE1-NH2 3.96Å; E1427-R1431 PolarHBondContact OE1-NH2 3.43Å; E1427-R1431 IonicContact OE2-CZ 2.81Å; E1427-R1431 IonicContact OE2-NH1 3.45Å; E1427-R1431 PolarHBondContact OE2-NH1 3.23Å; E1427-R1431 IonicContact OE2-NH2 2.7Å; E1427-R1431 PolarHBondContact OE2-NH2 2.96Å; I1428-R1431 PolarHBondContact O-N 3.19Å; R1431-E1434 WeakPolarHBondContact O-CB 3.45Å; R1431-E1434 PolarHBondContact O-N 2.82Å; R1431-A1435 WeakPolarHBondContact O-CB 3.41Å; R1431-A1435 PolarHBondContact O-N 3.24Å
1432	H	88.7	Confident	90	Very high	116 Å²	116	57.3 Å²	57.3	54%	0.537	30%	0.295	S	S	.	.	H	α-helix	trans	-69.8	-49.8	175.6	-179.4	69.9	0	0	0	112	I1428 I1429 M1430 E1434 A1435 C1436	I1428-H1432 WeakPolarHBondContact O-CB 3.38Å; I1428-H1432 PolarHBondContact O-N 2.98Å; I1429-H1432 PolarHBondContact O-N 3.26Å; M1430-H1432 VanDerWaalsContact C-N 3.32Å; M1430-H1432 PolarHBondContact O-N 2.83Å; H1432-E1434 PolarHBondContact O-N 2.81Å; H1432-A1435 PolarHBondContact O-N 2.79Å; H1432-C1436 PolarHBondContact O-N 3.06Å
1433	K	92.8	Very high	90.2	Very high	25 Å²	25	58.5 Å²	58.5	11%	0.109	30%	0.302	C	S	.	.	H	α-helix	trans	-59.4	-28.3	172.8	-77.2	-168.6	172.3	-158.6	0	111.9	L1422 I1429 M1430 L1437 A1455 I1488 E1597	L1422-K1433 HydrophobicContact CD1-CB 3.78Å; L1422-K1433 HydrophobicContact CD1-CD 4.07Å; L1422-K1433 HydrophobicContact CD2-CD 3.89Å; I1429-K1433 HydrophobicContact CG2-CD 4.41Å; I1429-K1433 HydrophobicContact CG2-CG 4.47Å; I1429-K1433 WeakPolarHBondContact O-CB 3.5Å; I1429-K1433 PolarHBondContact O-N 2.86Å; M1430-K1433 PolarHBondContact O-N 2.85Å; K1433-L1437 WeakPolarHBondContact O-CB 3.45Å; K1433-L1437 PolarHBondContact O-N 2.81Å; K1433-A1455 HydrophobicContact CB-CB 3.96Å; K1433-A1455 HydrophobicContact CD-CB 4.13Å; K1433-A1455 HydrophobicContact CG-CB 4.25Å; K1433-A1455 PolarHBondContact NZ-O 2.72Å; K1433-I1488 WeakPolarHBondContact CE-O 3.43Å; K1433-I1488 PolarHBondContact NZ-O 2.87Å; K1433-E1597 IonicContact NZ-OE1 3.22Å; K1433-E1597 IonicContact NZ-OE2 2.89Å; K1433-E1597 PolarHBondContact NZ-OE2 3.38Å
1434	E	92.9	Very high	90.5	Very high	61 Å²	61	55.8 Å²	55.8	29%	0.285	29%	0.292	S	S	.	.	H	α-helix	trans	-71.7	-51.2	173.3	-173.2	-178.6	165	0	0	113	K1415 L1419 M1430 R1431 H1432 C1436 L1437	K1415-E1434 VanDerWaalsContact CE-CG 3.49Å; K1415-E1434 WeakPolarHBondContact CE-OE1 3.02Å; K1415-E1434 IonicContact NZ-OE1 3.48Å; K1415-E1434 PolarHBondContact NZ-OE1 3.34Å; L1419-E1434 HydrophobicContact CD1-CG 4.02Å; L1419-E1434 HydrophobicContact CD2-CB 3.78Å; L1419-E1434 HydrophobicContact CD2-CG 3.84Å; L1419-E1434 HydrophobicContact CG-CG 4.49Å; M1430-E1434 VanDerWaalsContact O-CB 3.24Å; M1430-E1434 WeakPolarHBondContact O-CB 3.44Å; M1430-E1434 PolarHBondContact O-N 3Å; R1431-E1434 WeakPolarHBondContact O-CB 3.45Å; R1431-E1434 PolarHBondContact O-N 2.82Å; H1432-E1434 PolarHBondContact O-N 2.81Å; E1434-C1436 VanDerWaalsContact C-N 3.27Å; E1434-C1436 PolarHBondContact O-N 3.11Å; E1434-L1437 WeakPolarHBondContact O-CB 3.32Å; E1434-L1437 PolarHBondContact O-N 3.27Å; E1434-L1437 VanDerWaalsContact O-N 3.08Å
1435	A	91.6	Very high	91	Very high	90 Å²	90	51.6 Å²	51.6	74%	0.744	27%	0.269	S	S	*	.	H	α-helix	trans	-62.2	-36.9	-176.4	0	0	0	0	0	112	R1431 H1432 L1437	R1431-A1435 WeakPolarHBondContact O-CB 3.41Å; R1431-A1435 PolarHBondContact O-N 3.24Å; H1432-A1435 PolarHBondContact O-N 2.79Å; A1435-L1437 VanDerWaalsContact C-N 3.34Å
1436	C	92.3	Very high	91	Very high	45 Å²	45	53.6 Å²	53.6	30%	0.304	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.2	11.7	176.8	-61.6	0	0	0	0	113.5	H1432 E1434 R1438 S1454	H1432-C1436 PolarHBondContact O-N 3.06Å; E1434-C1436 VanDerWaalsContact C-N 3.27Å; E1434-C1436 PolarHBondContact O-N 3.11Å; C1436-R1438 PolarHBondContact O-N 2.93Å; C1436-S1454 WeakPolarHBondContact O-CB 3.46Å; C1436-S1454 PolarHBondContact O-OG 2.85Å
1437	L	96.3	Very high	90.7	Very high	17 Å²	17	51.5 Å²	51.5	9%	0.089	27%	0.265	C	S	.	.			trans	-72.4	113.6	-170.7	-173.5	60.1	0	0	0	113.4	K1415 V1418 K1433 E1434 A1435 T1453 S1454 A1455	K1415-L1437 HydrophobicContact CB-CD2 3.93Å; K1415-L1437 HydrophobicContact CG-CD2 3.98Å; V1418-L1437 HydrophobicContact CB-CD2 4.05Å; V1418-L1437 HydrophobicContact CG1-CD1 3.94Å; V1418-L1437 HydrophobicContact CG1-CD2 4.02Å; V1418-L1437 HydrophobicContact CG2-CD2 4.47Å; K1433-L1437 WeakPolarHBondContact O-CB 3.45Å; K1433-L1437 PolarHBondContact O-N 2.81Å; E1434-L1437 WeakPolarHBondContact O-CB 3.32Å; E1434-L1437 PolarHBondContact O-N 3.27Å; E1434-L1437 VanDerWaalsContact O-N 3.08Å; A1435-L1437 VanDerWaalsContact C-N 3.34Å; L1437-T1453 HydrophobicContact CD1-CG2 4.32Å; L1437-S1454 WeakPolarHBondContact CA-OG 3.22Å; L1437-A1455 HydrophobicContact CD1-CB 3.88Å
1438	R	96.3	Very high	90.9	Very high	41 Å²	41	47.1 Å²	47.1	16%	0.155	25%	0.245	C	C	.	.			trans	-139	157.4	175.2	53.5	172.4	167.1	-105.5	-7.3	111	E316 N1394 S1395 C1436 T1440 T1453 S1454	E316-R1438 IonicContact OE1-CZ 2.75Å; E316-R1438 VanDerWaalsContact OE1-CZ 3.22Å; E316-R1438 IonicContact OE1-NH1 3.62Å; E316-R1438 PolarHBondContact OE1-NH1 3Å; E316-R1438 IonicContact OE1-NH2 2.83Å; E316-R1438 PolarHBondContact OE1-NH2 2.8Å; N1394-R1438 PolarHBondContact OD1-NH1 2.96Å; S1395-R1438 CarbonylContact O-C 3.55Å; S1395-R1438 WeakPolarHBondContact O-CA 3.04Å; C1436-R1438 PolarHBondContact O-N 2.93Å; R1438-T1440 HydrophobicContact CG-CG2 3.92Å; R1438-T1453 CarbonylContact O-C 3.57Å; R1438-T1453 VanDerWaalsContact O-CA 3.3Å; R1438-T1453 WeakPolarHBondContact O-CA 3.26Å; R1438-S1454 WeakPolarHBondContact CG-OG 3.36Å; R1438-S1454 PolarHBondContact N-OG 3.43Å; R1438-S1454 PolarHBondContact O-N 3.27Å; R1438-S1454 PolarHBondContact O-OG 2.68Å
1439	I	97.5	Very high	91.3	Very high	1 Å²	1	40.4 Å²	40.4	1%	0.005	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	133.6	168.1	-60.2	144.6	0	0	0	108.4	L1380 A1391 S1395 R1397 I1398 L1414 L1442 A1451	L1380-I1439 HydrophobicContact CD1-CG2 3.9Å; A1391-I1439 HydrophobicContact CB-CB 4.13Å; A1391-I1439 HydrophobicContact CB-CD1 3.8Å; A1391-I1439 HydrophobicContact CB-CG2 4.07Å; S1395-I1439 PolarHBondContact O-N 3.03Å; R1397-I1439 WeakPolarHBondContact O-CD1 3.44Å; I1398-I1439 HydrophobicContact CD1-CD1 4.23Å; I1398-I1439 HydrophobicContact CG1-CD1 3.41Å; I1398-I1439 VanDerWaalsContact CG1-CD1 3.41Å; I1398-I1439 HydrophobicContact CG1-CG1 4.34Å; L1414-I1439 HydrophobicContact CD1-CG1 4.31Å; I1439-L1442 HydrophobicContact CG2-CD2 3.75Å; I1439-L1442 HydrophobicContact CG2-CG 4.01Å; I1439-A1451 HydrophobicContact CG2-CB 4.45Å
1440	T	97.2	Very high	91.9	Very high	20 Å²	20	38 Å²	38	12%	0.123	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	-23.7	-166.4	56.9	0	0	0	0	113.3	R1438 G1452 T1453 Q1490 V1491	R1438-T1440 HydrophobicContact CG-CG2 3.92Å; T1440-G1452 PolarHBondContact N-O 2.82Å; T1440-G1452 VanDerWaalsContact OG1-C 3.3Å; T1440-G1452 PolarHBondContact OG1-O 3.45Å; T1440-T1453 PolarHBondContact OG1-N 2.76Å; T1440-Q1490 HydrophobicContact CG2-CG 3.74Å; T1440-V1491 VanDerWaalsContact CB-O 3.32Å; T1440-V1491 WeakPolarHBondContact CB-O 3.45Å; T1440-V1491 PolarHBondContact OG1-O 3.41Å
1441	C	97.1	Very high	92.3	Very high	11 Å²	11	35.9 Å²	35.9	7%	0.074	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	147.9	166.7	51	0	0	0	0	111	A1451 G1452	C1441-A1451 WeakPolarHBondContact O-CA 3.38Å; C1441-G1452 PolarHBondContact O-N 2.67Å
1442	L	97	Very high	92.7	Very high	17 Å²	17	29.5 Å²	29.5	9%	0.089	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	140.6	175.7	-68.7	179.4	0	0	0	110	L1380 A1382 A1391 I1398 I1439 L1449 W1450 A1451	L1380-L1442 HydrophobicContact CB-CD1 3.94Å; L1380-L1442 HydrophobicContact CB-CG 4.18Å; L1380-L1442 HydrophobicContact CD1-CG 4.28Å; A1382-L1442 HydrophobicContact CB-CB 3.93Å; A1391-L1442 HydrophobicContact CB-CD1 4.07Å; I1398-L1442 HydrophobicContact CD1-CD2 3.82Å; I1439-L1442 HydrophobicContact CG2-CD2 3.75Å; I1439-L1442 HydrophobicContact CG2-CG 4.01Å; L1442-L1449 HydrophobicContact CD2-CD1 4.46Å; L1442-L1449 HydrophobicContact CD2-CD2 4.39Å; L1442-W1450 WeakPolarHBondContact CA-O 3.28Å; L1442-A1451 HydrophobicContact CD2-CB 3.64Å
1443	T	94.6	Very high	93.1	Very high	24 Å²	24	24 Å²	24	15%	0.147	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	167.6	166.6	-164	0	0	0	0	111.4	W1450 L1494 T1496	T1443-W1450 HydrophobicContact CG2-CB 3.95Å; T1443-W1450 PolarHBondContact N-O 3.48Å; T1443-W1450 PolarHBondContact O-N 3.33Å; T1443-L1494 HydrophobicContact CG2-CB 3.62Å; T1443-L1494 HydrophobicContact CG2-CD1 4.38Å; T1443-T1496 HydrophobicContact CG2-CG2 3.72Å
1444	V	91.5	Very high	93.3	Very high	30 Å²	30	23.7 Å²	23.7	18%	0.182	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	129.1	174.6	172.1	0	0	0	0	109.8	A1382 L1448 L1449 I1463	A1382-V1444 HydrophobicContact CB-CG2 4.28Å; V1444-L1448 WeakPolarHBondContact CA-O 3.42Å; V1444-L1449 HydrophobicContact CG2-CD1 3.84Å; V1444-I1463 HydrophobicContact CB-CD1 4.43Å; V1444-I1463 HydrophobicContact CG1-CD1 3.59Å; V1444-I1463 HydrophobicContact CG2-CD1 3.93Å
1445	C	87.7	Confident	93.4	Very high	3 Å²	3	20.9 Å²	20.9	2%	0.02	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	123	173.3	-173.1	0	0	0	0	109.7	D1447 L1448 T1496 V1589	C1445-D1447 VanDerWaalsContact C-N 3.34Å; C1445-D1447 PolarHBondContact O-N 2.87Å; C1445-L1448 PolarHBondContact N-O 3.05Å; C1445-L1448 PolarHBondContact O-N 3.39Å; C1445-T1496 HydrophobicContact CB-CG2 3.91Å; C1445-V1589 HydrophobicContact CB-CG2 3.67Å
1446	K	78.3	Confident	93.5	Very high	62 Å²	62	16.6 Å²	16.6	27%	0.27	9%	0.091	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.4	-88.8	-171.6	-62.3	-179.4	170	173.7	0	112.9	T1585 M1587 V1632 K1633	K1446-T1585 PolarHBondContact NZ-O 2.75Å; K1446-M1587 HydrophobicContact CD-SD 4.12Å; K1446-M1587 VanDerWaalsContact CE-SD 3.58Å; K1446-M1587 HydrophobicContact CG-CE 4.34Å; K1446-M1587 HydrophobicContact CG-CG 4.48Å; K1446-M1587 HydrophobicContact CG-SD 3.36Å; K1446-M1587 WeakPolarHBondContact CG-SD 3.43Å; K1446-V1632 HydrophobicContact CD-CG1 4.28Å; K1446-V1632 PolarHBondContact NZ-O 3.1Å; K1446-K1633 WeakPolarHBondContact CD-OXT 3.43Å; K1446-K1633 PolarHBondContact NZ-OXT 3.24Å
1447	D	80.5	Confident	93.6	Very high	40 Å²	40	14.4 Å²	14.4	21%	0.214	8%	0.076	C	C	.	.	T	Hydrogen-bonded Turn	trans	-131.3	1.7	-170	-107.2	38.2	0	0	0	112	R895 K1385 C1445 I1463	R895-D1447 IonicContact CZ-OD2 2.74Å; R895-D1447 IonicContact NH1-OD2 3.87Å; R895-D1447 PolarHBondContact NH1-OD2 3.46Å; R895-D1447 IonicContact NH2-OD2 2.67Å; K1385-D1447 WeakPolarHBondContact CE-OD1 3.45Å; K1385-D1447 WeakPolarHBondContact CE-OD2 3.45Å; K1385-D1447 IonicContact NZ-OD1 2.83Å; K1385-D1447 PolarHBondContact NZ-OD1 3.41Å; K1385-D1447 IonicContact NZ-OD2 3.71Å; K1385-D1447 PolarHBondContact NZ-OD2 3.2Å; C1445-D1447 VanDerWaalsContact C-N 3.34Å; C1445-D1447 PolarHBondContact O-N 2.87Å; D1447-I1463 WeakPolarHBondContact O-CB 3.26Å; D1447-I1463 WeakPolarHBondContact O-CG1 3.39Å; D1447-I1463 PolarHBondContact O-N 3.33Å
1448	L	89	Confident	93.6	Very high	16 Å²	16	13.6 Å²	13.6	8%	0.084	7%	0.072	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	131.9	-177.5	-58.6	177.4	0	0	0	109.8	V1444 C1445 V1461 A1462	V1444-L1448 WeakPolarHBondContact CA-O 3.42Å; C1445-L1448 PolarHBondContact N-O 3.05Å; C1445-L1448 PolarHBondContact O-N 3.39Å; L1448-V1461 WeakPolarHBondContact CA-O 3.28Å; L1448-A1462 HydrophobicContact CD2-CB 4.39Å
1449	L	93.9	Very high	93.6	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	-78.9	137.9	157.1	178.1	81.9	0	0	0	107.7	A1382 W1389 I1398 L1442 V1444 T1460 V1461 I1463	A1382-L1449 HydrophobicContact CB-CD1 3.83Å; W1389-L1449 HydrophobicContact CB-CD1 3.94Å; W1389-L1449 HydrophobicContact CB-CD2 4.1Å; W1389-L1449 HydrophobicContact CD2-CD1 4.4Å; W1389-L1449 HydrophobicContact CD2-CD2 3.62Å; W1389-L1449 HydrophobicContact CD2-CG 4.42Å; W1389-L1449 HydrophobicContact CE3-CD2 3.67Å; W1389-L1449 HydrophobicContact CG-CD1 3.85Å; W1389-L1449 HydrophobicContact CG-CD2 3.85Å; W1389-L1449 HydrophobicContact CG-CG 4.37Å; W1389-L1449 HydrophobicContact CZ3-CD2 4.23Å; I1398-L1449 HydrophobicContact CD1-CD2 3.88Å; I1398-L1449 HydrophobicContact CG2-CD2 4.3Å; L1442-L1449 HydrophobicContact CD2-CD1 4.46Å; L1442-L1449 HydrophobicContact CD2-CD2 4.39Å; V1444-L1449 HydrophobicContact CG2-CD1 3.84Å; L1449-T1460 CarbonylContact O-C 3.54Å; L1449-T1460 WeakPolarHBondContact O-CA 3.49Å; L1449-V1461 HydrophobicContact CB-CB 4.24Å; L1449-V1461 HydrophobicContact CD2-CG2 4.41Å; L1449-V1461 PolarHBondContact N-O 3Å; L1449-V1461 PolarHBondContact O-N 3.43Å; L1449-I1463 HydrophobicContact CB-CG1 4.27Å
1450	W	96.1	Very high	93.4	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	-114.9	132.7	174.5	-72.6	57	0	0	0	109	A897 L1442 T1443 I1458 T1460 L1483 L1494 V1589 W1630 V1632	A897-W1450 HydrophobicContact CB-CH2 3.4Å; A897-W1450 HydrophobicContact CB-CZ2 3.56Å; A897-W1450 HydrophobicContact CB-CZ3 4.47Å; L1442-W1450 WeakPolarHBondContact CA-O 3.28Å; T1443-W1450 HydrophobicContact CG2-CB 3.95Å; T1443-W1450 PolarHBondContact N-O 3.48Å; T1443-W1450 PolarHBondContact O-N 3.33Å; W1450-I1458 HydrophobicContact CE3-CG2 3.9Å; W1450-I1458 HydrophobicContact CZ3-CG2 4.3Å; W1450-T1460 HydrophobicContact CD2-CG2 3.62Å; W1450-T1460 HydrophobicContact CE3-CG2 4.12Å; W1450-T1460 HydrophobicContact CG-CG2 3.88Å; W1450-T1460 HydrophobicContact CZ2-CG2 4.09Å; W1450-L1483 HydrophobicContact CE3-CD1 4.17Å; W1450-L1483 HydrophobicContact CH2-CD1 3.91Å; W1450-L1483 HydrophobicContact CZ3-CD1 3.5Å; W1450-L1483 VanDerWaalsContact CZ3-CD1 3.5Å; W1450-L1494 HydrophobicContact CB-CD1 3.95Å; W1450-L1494 HydrophobicContact CE3-CD2 4.13Å; W1450-V1589 HydrophobicContact CD2-CB 4.44Å; W1450-V1589 HydrophobicContact CD2-CG1 3.99Å; W1450-V1589 HydrophobicContact CD2-CG2 4.28Å; W1450-V1589 HydrophobicContact CE3-CB 4.23Å; W1450-V1589 HydrophobicContact CE3-CG1 3.63Å; W1450-V1589 HydrophobicContact CH2-CB 3.73Å; W1450-V1589 HydrophobicContact CH2-CG1 4.06Å; W1450-V1589 HydrophobicContact CH2-CG2 3.99Å; W1450-V1589 HydrophobicContact CZ2-CB 4Å; W1450-V1589 HydrophobicContact CZ2-CG1 4.42Å; W1450-V1589 HydrophobicContact CZ2-CG2 3.72Å; W1450-V1589 HydrophobicContact CZ3-CB 3.85Å; W1450-V1589 HydrophobicContact CZ3-CG1 3.66Å; W1450-V1589 HydrophobicContact CZ3-CG2 4.41Å; W1450-W1630 HydrophobicContact CH2-CB 3.72Å; W1450-W1630 HydrophobicContact CH2-CD2 4.32Å; W1450-W1630 AromaticContact CH2-CG 3.87Å; W1450-W1630 HydrophobicContact CH2-CG 3.87Å; W1450-W1630 HydrophobicContact CZ3-CB 4.26Å; W1450-W1630 HydrophobicContact CZ3-CD2 4.3Å; W1450-W1630 AromaticContact CZ3-CG 3.94Å; W1450-W1630 HydrophobicContact CZ3-CG 3.94Å; W1450-V1632 HydrophobicContact CH2-CG2 4.19Å; W1450-V1632 HydrophobicContact CZ2-CG2 3.57Å
1451	A	97.4	Very high	93.1	Very high	0 Å²	0	11 Å²	11	0%	0	6%	0.06	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	121.1	178	0	0	0	0	0	110.5	I1398 L1414 I1439 C1441 L1442 V1459	I1398-A1451 HydrophobicContact CD1-CB 4.05Å; L1414-A1451 HydrophobicContact CD1-CB 3.76Å; I1439-A1451 HydrophobicContact CG2-CB 4.45Å; C1441-A1451 WeakPolarHBondContact O-CA 3.38Å; L1442-A1451 HydrophobicContact CD2-CB 3.64Å; A1451-V1459 PolarHBondContact N-O 3.02Å; A1451-V1459 PolarHBondContact O-N 3.31Å
1452	G	97.3	Very high	92.7	Very high	0 Å²	0	12 Å²	12	0%	0	7%	0.07	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	148.4	166.1	0	0	0	0	0	110.5	T1440 C1441	T1440-G1452 PolarHBondContact N-O 2.82Å; T1440-G1452 VanDerWaalsContact OG1-C 3.3Å; T1440-G1452 PolarHBondContact OG1-O 3.45Å; C1441-G1452 PolarHBondContact O-N 2.67Å
1453	T	97.8	Very high	92.1	Very high	2 Å²	2	11.6 Å²	11.6	1%	0.012	7%	0.067	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	161.6	-178.6	66.3	0	0	0	0	112.6	V1418 L1437 R1438 T1440 A1455 G1456 V1457 V1491	V1418-T1453 HydrophobicContact CG2-CG2 4.12Å; L1437-T1453 HydrophobicContact CD1-CG2 4.32Å; R1438-T1453 CarbonylContact O-C 3.57Å; R1438-T1453 VanDerWaalsContact O-CA 3.3Å; R1438-T1453 WeakPolarHBondContact O-CA 3.26Å; T1440-T1453 PolarHBondContact OG1-N 2.76Å; T1453-A1455 PolarHBondContact O-N 2.77Å; T1453-G1456 PolarHBondContact O-N 3.26Å; T1453-G1456 VanDerWaalsContact O-N 3.16Å; T1453-V1457 PolarHBondContact N-O 3.34Å; T1453-V1457 PolarHBondContact OG1-N 3.09Å; T1453-V1457 PolarHBondContact OG1-O 3.08Å; T1453-V1491 PolarHBondContact O-N 2.84Å
1454	S	96.6	Very high	91.3	Very high	18 Å²	18	11.4 Å²	11.4	13%	0.126	7%	0.067	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-27.4	171.6	48.5	0	0	0	0	113.3	C1436 L1437 R1438 G1456 Q1490	C1436-S1454 WeakPolarHBondContact O-CB 3.46Å; C1436-S1454 PolarHBondContact O-OG 2.85Å; L1437-S1454 WeakPolarHBondContact CA-OG 3.22Å; R1438-S1454 WeakPolarHBondContact CG-OG 3.36Å; R1438-S1454 PolarHBondContact N-OG 3.43Å; R1438-S1454 PolarHBondContact O-N 3.27Å; R1438-S1454 PolarHBondContact O-OG 2.68Å; S1454-G1456 PolarHBondContact O-N 3.06Å; S1454-Q1490 WeakPolarHBondContact O-CA 3.3Å; S1454-Q1490 PolarHBondContact O-N 3.37Å
1455	A	94.5	Very high	90.4	Very high	1 Å²	1	18.5 Å²	18.5	1%	0.008	10%	0.095	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.5	0	174.8	0	0	0	0	0	114.2	V1418 L1422 K1433 L1437 T1453 V1457	V1418-A1455 HydrophobicContact CG1-CB 4.16Å; L1422-A1455 HydrophobicContact CD1-CB 4.1Å; K1433-A1455 HydrophobicContact CB-CB 3.96Å; K1433-A1455 HydrophobicContact CD-CB 4.13Å; K1433-A1455 HydrophobicContact CG-CB 4.25Å; K1433-A1455 PolarHBondContact NZ-O 2.72Å; L1437-A1455 HydrophobicContact CD1-CB 3.88Å; T1453-A1455 PolarHBondContact O-N 2.77Å; A1455-V1457 PolarHBondContact O-N 3.26Å
1456	G	93.8	Very high	89.5	Confident	0 Å²	0	19.8 Å²	19.8	0%	0	10%	0.102	C	C	.	.	S	Bend	trans	82.8	-14.3	178.4	0	0	0	0	0	115.4	T1453 S1454 G1486 H1487 G1489 V1491	T1453-G1456 PolarHBondContact O-N 3.26Å; T1453-G1456 VanDerWaalsContact O-N 3.16Å; S1454-G1456 PolarHBondContact O-N 3.06Å; G1456-G1486 WeakPolarHBondContact O-CA 3.37Å; G1456-H1487 VanDerWaalsContact CA-O 3.28Å; G1456-H1487 WeakPolarHBondContact CA-O 3.3Å; G1456-H1487 PolarHBondContact O-N 3.14Å; G1456-G1489 WeakPolarHBondContact CA-O 3.5Å; G1456-V1491 WeakPolarHBondContact O-CG2 3.28Å
1457	V	95.3	Very high	88.4	Confident	0 Å²	0	19.3 Å²	19.3	0%	0	11%	0.114	C	C	.	.			trans	-68.8	137.3	175.1	-178.7	0	0	0	0	110.8	V1418 R1421 L1422 T1453 A1455 T1482 F1599	V1418-V1457 HydrophobicContact CG1-CB 4.26Å; V1418-V1457 HydrophobicContact CG1-CG2 4.2Å; V1418-V1457 HydrophobicContact CG2-CG1 4.47Å; R1421-V1457 HydrophobicContact CB-CG1 4.43Å; R1421-V1457 HydrophobicContact CG-CG1 4.35Å; L1422-V1457 HydrophobicContact CD2-CG2 3.97Å; L1422-V1457 HydrophobicContact CG-CG2 4.3Å; T1453-V1457 PolarHBondContact N-O 3.34Å; T1453-V1457 PolarHBondContact OG1-N 3.09Å; T1453-V1457 PolarHBondContact OG1-O 3.08Å; A1455-V1457 PolarHBondContact O-N 3.26Å; V1457-T1482 HydrophobicContact CG1-CG2 3.65Å; V1457-F1599 HydrophobicContact CG2-CE1 4.11Å; V1457-F1599 HydrophobicContact CG2-CE2 4.13Å; V1457-F1599 HydrophobicContact CG2-CZ 3.79Å
1458	I	96.4	Very high	87	Confident	0 Å²	0	24.1 Å²	24.1	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	130.9	173.9	-57.8	167.8	0	0	0	109.2	W1450 T1482 L1483 V1491 S1591 W1630	W1450-I1458 HydrophobicContact CE3-CG2 3.9Å; W1450-I1458 HydrophobicContact CZ3-CG2 4.3Å; I1458-T1482 WeakPolarHBondContact O-CA 3.31Å; I1458-L1483 HydrophobicContact CB-CB 4.5Å; I1458-L1483 HydrophobicContact CB-CD1 4Å; I1458-L1483 HydrophobicContact CB-CG 4.23Å; I1458-L1483 HydrophobicContact CG2-CD1 3.61Å; I1458-L1483 HydrophobicContact CG2-CG 4.11Å; I1458-L1483 PolarHBondContact O-N 3.42Å; I1458-V1491 HydrophobicContact CG1-CG2 4.01Å; I1458-S1591 WeakPolarHBondContact CD1-OG 3.41Å; I1458-W1630 HydrophobicContact CD1-CZ2 3.96Å
1459	V	95.4	Very high	85.1	Confident	0 Å²	0	25 Å²	25	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	136.4	179.3	-167.8	0	0	0	0	110.1	L1414 I1417 V1418 A1451 E1481 T1482	L1414-V1459 HydrophobicContact CD1-CB 4.18Å; L1414-V1459 HydrophobicContact CD1-CG1 4.44Å; L1414-V1459 HydrophobicContact CD1-CG2 4.2Å; L1414-V1459 HydrophobicContact CD2-CG1 4.27Å; I1417-V1459 HydrophobicContact CG2-CG1 4.23Å; V1418-V1459 HydrophobicContact CG2-CG2 4Å; A1451-V1459 PolarHBondContact N-O 3.02Å; A1451-V1459 PolarHBondContact O-N 3.31Å; V1459-E1481 CarbonylContact C-O 3.59Å; V1459-E1481 WeakPolarHBondContact CA-O 3.4Å; V1459-T1482 HydrophobicContact CG2-CG2 4.05Å
1460	T	94.2	Very high	82.8	Confident	5 Å²	5	31.2 Å²	31.2	3%	0.031	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	136.6	171.3	48.5	0	0	0	0	111.3	L1449 W1450 E1481 L1483	L1449-T1460 CarbonylContact O-C 3.54Å; L1449-T1460 WeakPolarHBondContact O-CA 3.49Å; W1450-T1460 HydrophobicContact CD2-CG2 3.62Å; W1450-T1460 HydrophobicContact CE3-CG2 4.12Å; W1450-T1460 HydrophobicContact CG-CG2 3.88Å; W1450-T1460 HydrophobicContact CZ2-CG2 4.09Å; T1460-E1481 PolarHBondContact N-O 3.32Å; T1460-E1481 PolarHBondContact O-N 3.1Å; T1460-E1481 PolarHBondContact OG1-O 3.16Å; T1460-L1483 HydrophobicContact CG2-CD2 4.11Å
1461	V	91.6	Very high	80.4	Confident	1 Å²	1	35.4 Å²	35.4	1%	0.006	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	124.8	-176.2	-172.6	0	0	0	0	109.7	W1389 I1412 L1448 L1449 I1463 P1478 L1480	W1389-V1461 HydrophobicContact CH2-CG1 3.97Å; W1389-V1461 HydrophobicContact CZ3-CG1 4.38Å; I1412-V1461 HydrophobicContact CD1-CG1 4.33Å; L1448-V1461 WeakPolarHBondContact CA-O 3.28Å; L1449-V1461 HydrophobicContact CB-CB 4.24Å; L1449-V1461 HydrophobicContact CD2-CG2 4.41Å; L1449-V1461 PolarHBondContact N-O 3Å; L1449-V1461 PolarHBondContact O-N 3.43Å; V1461-I1463 PolarHBondContact O-N 2.83Å; V1461-P1478 HydrophobicContact CG1-CB 3.78Å; V1461-P1478 HydrophobicContact CG1-CG 3.52Å; V1461-L1480 HydrophobicContact CB-CD2 4.04Å; V1461-L1480 HydrophobicContact CG1-CD2 3.7Å; V1461-L1480 HydrophobicContact CG2-CD2 3.52Å
1462	A	87.5	Confident	78.5	Confident	34 Å²	34	37.9 Å²	37.9	28%	0.281	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	114.1	179.9	0	0	0	0	0	111.7	L1448 P1464 P1478 Q1479	L1448-A1462 HydrophobicContact CD2-CB 4.39Å; A1462-P1464 WeakPolarHBondContact O-CD 3.48Å; A1462-P1478 WeakPolarHBondContact O-CB 3.35Å; A1462-Q1479 PolarHBondContact N-O 2.71Å; A1462-Q1479 VanDerWaalsContact N-O 3.09Å
1463	I	84.9	Confident	76.2	Confident	7 Å²	7	45.3 Å²	45.3	4%	0.036	27%	0.269	C	S	.	.			trans	-67.6	118.3	-174.1	-59.5	174.1	0	0	0	110.3	K1385 T1387 W1389 V1444 D1447 L1449 V1461	K1385-I1463 HydrophobicContact CD-CB 4.43Å; K1385-I1463 HydrophobicContact CD-CG2 3.93Å; K1385-I1463 PolarHBondContact NZ-O 3.03Å; T1387-I1463 WeakPolarHBondContact OG1-CG2 3.27Å; W1389-I1463 HydrophobicContact CZ2-CB 4.34Å; W1389-I1463 HydrophobicContact CZ2-CG1 4.02Å; W1389-I1463 HydrophobicContact CZ2-CG2 4.21Å; V1444-I1463 HydrophobicContact CB-CD1 4.43Å; V1444-I1463 HydrophobicContact CG1-CD1 3.59Å; V1444-I1463 HydrophobicContact CG2-CD1 3.93Å; D1447-I1463 WeakPolarHBondContact O-CB 3.26Å; D1447-I1463 WeakPolarHBondContact O-CG1 3.39Å; D1447-I1463 PolarHBondContact O-N 3.33Å; L1449-I1463 HydrophobicContact CB-CG1 4.27Å; V1461-I1463 PolarHBondContact O-N 2.83Å
1464	P	78.5	Confident	74.1	Confident	20 Å²	20	52.4 Å²	52.4	13%	0.13	31%	0.307	C	S	.	.			trans	-65	153.3	-172.5	26.7	-33.9	0	0	0	112.1	L1400 A1462 I1475	L1400-P1464 HydrophobicContact CD2-CG 4.06Å; A1462-P1464 WeakPolarHBondContact O-CD 3.48Å; P1464-I1475 HydrophobicContact CB-CG2 3.75Å; P1464-I1475 HydrophobicContact CG-CG2 4.01Å
1465	K	72.5	Confident	72.8	Confident	180 Å²	180	53.5 Å²	53.5	78%	0.783	31%	0.31	S	S	*	.			trans	-91	104.7	176.5	-67	177.9	-177.7	172.8	0	109.2
1466	L	67.6	Low	71.6	Confident	29 Å²	29	61.9 Å²	61.9	15%	0.152	35%	0.347	C	S	.	.			trans	-67.6	131.9	170	-58.4	-178.4	0	0	0	109.9	Q1386 T1387 L1409 Y1472 I1475	Q1386-L1466 HydrophobicContact CB-CD1 4.31Å; T1387-L1466 HydrophobicContact CG2-CD1 3.82Å; T1387-L1466 HydrophobicContact CG2-CG 4.26Å; L1409-L1466 HydrophobicContact CD1-CD1 4.01Å; L1409-L1466 HydrophobicContact CD1-CD2 4.04Å; L1466-Y1472 HydrophobicContact CB-CE1 4.24Å; L1466-Y1472 HydrophobicContact CD1-CE1 4.44Å; L1466-Y1472 HydrophobicContact CD2-CD1 4.27Å; L1466-I1475 HydrophobicContact CD2-CD1 3.47Å; L1466-I1475 VanDerWaalsContact CD2-CD1 3.47Å; L1466-I1475 HydrophobicContact CD2-CG1 3.86Å
1467	G	55.7	Low	70.7	Confident	52 Å²	52	68.7 Å²	68.7	54%	0.536	38%	0.379	S	S	.	.			trans	-77.8	155	171.6	0	0	0	0	0	111.1	G1469	G1467-G1469 PolarHBondContact O-N 3.07Å
1468	T	51.9	Low	70	Confident	142 Å²	142	69.3 Å²	69.3	87%	0.871	38%	0.383	S	S	*	.	S	Bend	trans	-82.5	37.9	179.5	62.4	0	0	0	0	112.9
1469	G	48.5	Very low	69	Low	34 Å²	34	74 Å²	74	35%	0.351	41%	0.405	S	S	.	.	S	Bend	trans	-101.5	162.3	178.9	0	0	0	0	0	111.9	G1467 T1471	G1467-G1469 PolarHBondContact O-N 3.07Å; G1469-T1471 VanDerWaalsContact C-N 3.3Å; G1469-T1471 PolarHBondContact O-N 2.93Å
1470	P	44.6	Very low	68.7	Low	131 Å²	131	76.1 Å²	76.1	85%	0.851	42%	0.416	S	S	*	.	S	Bend	trans	-79.8	-5.9	179.9	33.8	-36.5	0	0	0	114.3
1471	T	46.4	Very low	68.3	Low	87 Å²	87	79.8 Å²	79.8	53%	0.534	43%	0.433	S	S	.	.			trans	-127.2	126.9	176.9	49.2	0	0	0	0	110.7	G1469 E1473	G1469-T1471 VanDerWaalsContact C-N 3.3Å; G1469-T1471 PolarHBondContact O-N 2.93Å; T1471-E1473 WeakPolarHBondContact CB-OE2 3.44Å
1472	Y	57.8	Low	68.3	Low	52 Å²	52	80.9 Å²	80.9	20%	0.204	44%	0.439	C	S	.	.			trans	-94.5	17.2	-178.8	-63.2	-62.9	0	0	0	113.7	H1402 E1407 L1409 L1466 N1474 I1475	H1402-Y1472 PolarHBondContact CE1-OH 3.32Å; H1402-Y1472 VanDerWaalsContact CE1-OH 3.3Å; H1402-Y1472 PolarHBondContact NE2-OH 3.43Å; E1407-Y1472 WeakPolarHBondContact OE2-CE2 3.16Å; L1409-Y1472 HydrophobicContact CD2-CD2 3.87Å; L1409-Y1472 HydrophobicContact CD2-CG 4.06Å; L1466-Y1472 HydrophobicContact CB-CE1 4.24Å; L1466-Y1472 HydrophobicContact CD1-CE1 4.44Å; L1466-Y1472 HydrophobicContact CD2-CD1 4.27Å; Y1472-N1474 PolarHBondContact O-N 3.16Å; Y1472-I1475 WeakPolarHBondContact O-CG1 3.28Å; Y1472-I1475 PolarHBondContact O-N 2.64Å
1473	E	49.7	Very low	68.4	Low	156 Å²	156	79.8 Å²	79.8	73%	0.729	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	4.8	-163.7	-62.8	166	143.4	0	0	116.2	T1471	T1471-E1473 WeakPolarHBondContact CB-OE2 3.44Å
1474	N	53.2	Low	68.4	Low	152 Å²	152	81.6 Å²	81.6	81%	0.813	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-141.1	33.8	-175.9	-80	-83.2	0	0	0	113.8	Y1472 K1476	Y1472-N1474 PolarHBondContact O-N 3.16Å; N1474-K1476 PolarHBondContact O-N 2.88Å; N1474-K1476 VanDerWaalsContact O-N 3.11Å
1475	I	67.8	Low	68.9	Low	40 Å²	40	83.5 Å²	83.5	21%	0.205	45%	0.447	C	S	.	.			trans	-70.2	107.4	171.1	-52.9	162.8	0	0	0	109.2	L1409 M1410 P1464 L1466 Y1472	L1409-I1475 HydrophobicContact CB-CD1 3.93Å; L1409-I1475 HydrophobicContact CD1-CD1 4.08Å; L1409-I1475 HydrophobicContact CD2-CD1 4.03Å; L1409-I1475 HydrophobicContact CG-CD1 4.24Å; M1410-I1475 HydrophobicContact CE-CB 3.91Å; M1410-I1475 HydrophobicContact CE-CG2 3.46Å; M1410-I1475 VanDerWaalsContact CE-CG2 3.46Å; P1464-I1475 HydrophobicContact CB-CG2 3.75Å; P1464-I1475 HydrophobicContact CG-CG2 4.01Å; L1466-I1475 HydrophobicContact CD2-CD1 3.47Å; L1466-I1475 VanDerWaalsContact CD2-CD1 3.47Å; L1466-I1475 HydrophobicContact CD2-CG1 3.86Å; Y1472-I1475 WeakPolarHBondContact O-CG1 3.28Å; Y1472-I1475 PolarHBondContact O-N 2.64Å
1476	K	69.5	Low	69.9	Low	178 Å²	178	74.9 Å²	74.9	77%	0.774	41%	0.409	S	S	*	.	P	Polyproline II helix	trans	-57.6	139.6	171.7	-67.8	-167.5	175.4	-167.2	0	110.8	N1474	N1474-K1476 PolarHBondContact O-N 2.88Å; N1474-K1476 VanDerWaalsContact O-N 3.11Å
1477	Q	75	Confident	71.1	Confident	143 Å²	143	73.5 Å²	73.5	67%	0.668	40%	0.402	S	S	*	.	P	Polyproline II helix	trans	-53.7	130.7	171	-171.7	178.2	7.8	0	0	109.7
1478	P	80.6	Confident	72.7	Confident	13 Å²	13	73.9 Å²	73.9	8%	0.084	39%	0.391	C	S	.	.	P	Polyproline II helix	trans	-72.5	152.4	-177.5	30.8	-36.9	0	0	0	111.5	W1389 M1410 I1412 V1461 A1462	W1389-P1478 HydrophobicContact CH2-CG 4.39Å; M1410-P1478 HydrophobicContact SD-CG 4.39Å; I1412-P1478 HydrophobicContact CD1-CG 3.38Å; V1461-P1478 HydrophobicContact CG1-CB 3.78Å; V1461-P1478 HydrophobicContact CG1-CG 3.52Å; A1462-P1478 WeakPolarHBondContact O-CB 3.35Å
1479	Q	76.9	Confident	74.5	Confident	98 Å²	98	67.7 Å²	67.7	46%	0.458	36%	0.355	S	S	.	.	P	Polyproline II helix	trans	-68.1	137.5	172.7	-70.3	178.8	-47.4	0	0	110.3	A1462	A1462-Q1479 PolarHBondContact N-O 2.71Å; A1462-Q1479 VanDerWaalsContact N-O 3.09Å
1480	L	88.1	Confident	76.7	Confident	44 Å²	44	68.2 Å²	68.2	23%	0.23	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	130.2	179.5	-56.6	176.2	0	0	0	108.4	I1412 L1414 I1417 V1461	I1412-L1480 HydrophobicContact CG2-CD1 4.01Å; I1412-L1480 HydrophobicContact CG2-CD2 4.23Å; L1414-L1480 HydrophobicContact CD2-CD1 4.46Å; L1414-L1480 HydrophobicContact CD2-CD2 4.17Å; I1417-L1480 HydrophobicContact CD1-CB 3.62Å; I1417-L1480 WeakPolarHBondContact CD1-O 3.34Å; I1417-L1480 HydrophobicContact CG2-CD1 4.45Å; V1461-L1480 HydrophobicContact CB-CD2 4.04Å; V1461-L1480 HydrophobicContact CG1-CD2 3.7Å; V1461-L1480 HydrophobicContact CG2-CD2 3.52Å
1481	E	86.7	Confident	79.1	Confident	83 Å²	83	62 Å²	62	39%	0.388	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	137.2	172.4	-63.1	-169.8	153.8	0	0	109.5	V1459 T1460	V1459-E1481 CarbonylContact C-O 3.59Å; V1459-E1481 WeakPolarHBondContact CA-O 3.4Å; T1460-E1481 PolarHBondContact N-O 3.32Å; T1460-E1481 PolarHBondContact O-N 3.1Å; T1460-E1481 PolarHBondContact OG1-O 3.16Å
1482	T	90.4	Very high	81.5	Confident	23 Å²	23	60 Å²	60	14%	0.141	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	143.4	165.8	43.5	0	0	0	0	109.7	I1417 R1421 V1457 I1458 V1459	I1417-T1482 HydrophobicContact CD1-CG2 4.27Å; I1417-T1482 HydrophobicContact CG1-CG2 3.92Å; I1417-T1482 HydrophobicContact CG2-CG2 4.48Å; R1421-T1482 HydrophobicContact CB-CG2 4.21Å; R1421-T1482 PolarHBondContact NE-OG1 3.23Å; R1421-T1482 PolarHBondContact NH2-O 2.84Å; R1421-T1482 PolarHBondContact NH2-OG1 2.83Å; V1457-T1482 HydrophobicContact CG1-CG2 3.65Å; I1458-T1482 WeakPolarHBondContact O-CA 3.31Å; V1459-T1482 HydrophobicContact CG2-CG2 4.05Å
1483	L	90.1	Very high	83.3	Confident	11 Å²	11	58 Å²	58	6%	0.058	28%	0.284	C	S	.	.			trans	-77.4	159.2	177.2	-53	-172.3	0	0	0	111.6	A897 R1421 W1450 I1458 T1460 Y1485 W1630	A897-L1483 HydrophobicContact CB-CD1 4.2Å; A897-L1483 HydrophobicContact CB-CD2 3.85Å; R1421-L1483 PolarHBondContact NH2-O 2.71Å; W1450-L1483 HydrophobicContact CE3-CD1 4.17Å; W1450-L1483 HydrophobicContact CH2-CD1 3.91Å; W1450-L1483 HydrophobicContact CZ3-CD1 3.5Å; W1450-L1483 VanDerWaalsContact CZ3-CD1 3.5Å; I1458-L1483 HydrophobicContact CB-CB 4.5Å; I1458-L1483 HydrophobicContact CB-CD1 4Å; I1458-L1483 HydrophobicContact CB-CG 4.23Å; I1458-L1483 HydrophobicContact CG2-CD1 3.61Å; I1458-L1483 HydrophobicContact CG2-CG 4.11Å; I1458-L1483 PolarHBondContact O-N 3.42Å; T1460-L1483 HydrophobicContact CG2-CD2 4.11Å; L1483-Y1485 VanDerWaalsContact C-N 3.35Å; L1483-W1630 HydrophobicContact CB-CH2 3.54Å; L1483-W1630 HydrophobicContact CB-CZ2 4.29Å; L1483-W1630 HydrophobicContact CB-CZ3 3.81Å; L1483-W1630 HydrophobicContact CD1-CD2 3.94Å; L1483-W1630 HydrophobicContact CD1-CE3 3.81Å; L1483-W1630 HydrophobicContact CD1-CH2 3.69Å; L1483-W1630 HydrophobicContact CD1-CZ2 3.83Å; L1483-W1630 HydrophobicContact CD1-CZ3 3.68Å; L1483-W1630 HydrophobicContact CG-CH2 4.24Å; L1483-W1630 HydrophobicContact CG-CZ3 4.26Å
1484	S	84.8	Confident	85.6	Confident	46 Å²	46	51.4 Å²	51.4	32%	0.322	25%	0.253	S	S	.	.	S	Bend	trans	-76	-22.7	-179	60.7	0	0	0	0	113.8	F1599	S1484-F1599 PolarHBondContact O-N 3.28Å
1485	Y	89.9	Confident	87.5	Confident	59 Å²	59	44.8 Å²	44.8	23%	0.231	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	153	173.5	-60.1	-89.5	0	0	0	109.9	F899 L1483 E1597 E1598 W1630	F899-Y1485 HydrophobicContact CB-CD2 3.57Å; F899-Y1485 HydrophobicContact CB-CE2 3.83Å; F899-Y1485 AromaticContact CD1-CD2 3.7Å; F899-Y1485 HydrophobicContact CD1-CD2 3.7Å; F899-Y1485 AromaticContact CD1-CE2 3.47Å; F899-Y1485 HydrophobicContact CD1-CE2 3.47Å; F899-Y1485 VanDerWaalsContact CD1-CE2 3.47Å; F899-Y1485 HydrophobicContact CD1-CG 4.4Å; F899-Y1485 AromaticContact CD2-CD2 3.81Å; F899-Y1485 HydrophobicContact CD2-CD2 3.81Å; F899-Y1485 HydrophobicContact CD2-CE2 4.44Å; F899-Y1485 HydrophobicContact CD2-CG 4.1Å; F899-Y1485 HydrophobicContact CE1-CD2 4.32Å; F899-Y1485 HydrophobicContact CE1-CE1 4.5Å; F899-Y1485 HydrophobicContact CE1-CE2 4.12Å; F899-Y1485 HydrophobicContact CE2-CD2 4.42Å; F899-Y1485 HydrophobicContact CE2-CG 4.35Å; F899-Y1485 AromaticContact CG-CD2 3.4Å; F899-Y1485 HydrophobicContact CG-CD2 3.4Å; F899-Y1485 VanDerWaalsContact CG-CD2 3.4Å; F899-Y1485 AromaticContact CG-CE2 3.66Å; F899-Y1485 HydrophobicContact CG-CE2 3.66Å; F899-Y1485 HydrophobicContact CG-CG 4.12Å; L1483-Y1485 VanDerWaalsContact C-N 3.35Å; Y1485-E1597 CarbonylContact C-O 3.59Å; Y1485-E1597 VanDerWaalsContact CA-O 3.28Å; Y1485-E1597 WeakPolarHBondContact CA-O 3.09Å; Y1485-E1598 HydrophobicContact CD1-CB 3.75Å; Y1485-E1598 HydrophobicContact CD1-CG 3.82Å; Y1485-E1598 HydrophobicContact CE1-CB 3.58Å; Y1485-E1598 HydrophobicContact CE1-CG 3.4Å; Y1485-E1598 WeakPolarHBondContact CE1-OE2 3.41Å; Y1485-E1598 VanDerWaalsContact OH-CD 3.28Å; Y1485-E1598 PolarHBondContact OH-OE2 3.22Å; Y1485-W1630 HydrophobicContact CD2-CH2 4.42Å; Y1485-W1630 VanDerWaalsContact O-CH2 3.3Å; Y1485-W1630 WeakPolarHBondContact O-CH2 3.49Å; Y1485-W1630 WeakPolarHBondContact O-CZ2 3.24Å
1486	G	91.6	Very high	88.6	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.5	-159.8	167.6	0	0	0	0	0	110.3	G1456 R1596 E1597 L1628	G1456-G1486 WeakPolarHBondContact O-CA 3.37Å; G1486-R1596 CarbonylContact O-C 3.58Å; G1486-R1596 WeakPolarHBondContact O-CA 3.06Å; G1486-E1597 PolarHBondContact N-O 3.48Å; G1486-E1597 PolarHBondContact O-N 2.91Å; G1486-L1628 WeakPolarHBondContact O-CD1 3.49Å
1487	H	93.3	Very high	89.3	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	18%	0.179	C	C	.	.			trans	-97.1	159.7	175	-65.3	-75	0	0	0	110.1	G1456 G1489 S1591 G1593 G1595 Y1626	G1456-H1487 VanDerWaalsContact CA-O 3.28Å; G1456-H1487 WeakPolarHBondContact CA-O 3.3Å; G1456-H1487 PolarHBondContact O-N 3.14Å; H1487-G1489 VanDerWaalsContact CB-O 3.27Å; H1487-G1489 WeakPolarHBondContact CB-O 3.36Å; H1487-S1591 PolarHBondContact NE2-OG 3.4Å; H1487-G1593 PolarHBondContact CE1-N 2.78Å; H1487-G1593 WeakPolarHBondContact ND1-CA 3.38Å; H1487-G1593 PolarHBondContact ND1-N 2.96Å; H1487-G1595 PolarHBondContact ND1-O 2.59Å; H1487-Y1626 PolarHBondContact CE1-O 2.78Å; H1487-Y1626 VanDerWaalsContact CE1-O 3.23Å
1488	I	89.7	Confident	89.1	Confident	60 Å²	60	30 Å²	30	31%	0.308	15%	0.153	S	C	.	.	S	Bend	trans	-76.6	-46.2	175.3	-65.1	174.1	0	0	0	108.9	K1433 E1594 E1597 D1622	K1433-I1488 WeakPolarHBondContact CE-O 3.43Å; K1433-I1488 PolarHBondContact NZ-O 2.87Å; I1488-E1594 PolarHBondContact N-O 2.84Å; I1488-E1597 HydrophobicContact CG1-CB 3.89Å; I1488-E1597 HydrophobicContact CG1-CG 4.42Å; I1488-D1622 HydrophobicContact CD1-CB 3.69Å
1489	G	89.5	Confident	88	Confident	11 Å²	11	32.8 Å²	32.8	11%	0.113	17%	0.168	C	C	.	.	S	Bend	trans	-93.8	-169.3	169.1	0	0	0	0	0	113.3	G1456 H1487 E1594	G1456-G1489 WeakPolarHBondContact CA-O 3.5Å; H1487-G1489 VanDerWaalsContact CB-O 3.27Å; H1487-G1489 WeakPolarHBondContact CB-O 3.36Å; G1489-E1594 PolarHBondContact N-O 3.01Å
1490	Q	94	Very high	86.7	Confident	46 Å²	46	28.6 Å²	28.6	22%	0.215	15%	0.148	C	C	.	.			trans	-56.3	135.3	-176	168.4	166.2	-39.5	0	0	113.6	T1440 S1454 R1492	T1440-Q1490 HydrophobicContact CG2-CG 3.74Å; S1454-Q1490 WeakPolarHBondContact O-CA 3.3Å; S1454-Q1490 PolarHBondContact O-N 3.37Å; Q1490-R1492 PolarHBondContact O-N 2.87Å
1491	V	96.7	Very high	84.3	Confident	0 Å²	0	29.8 Å²	29.8	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	117	165.7	-165.4	0	0	0	0	108.6	T1440 T1453 G1456 I1458	T1440-V1491 VanDerWaalsContact CB-O 3.32Å; T1440-V1491 WeakPolarHBondContact CB-O 3.45Å; T1440-V1491 PolarHBondContact OG1-O 3.41Å; T1453-V1491 PolarHBondContact O-N 2.84Å; G1456-V1491 WeakPolarHBondContact O-CG2 3.28Å; I1458-V1491 HydrophobicContact CG1-CG2 4.01Å
1492	R	95.3	Very high	81.8	Confident	45 Å²	45	29.8 Å²	29.8	17%	0.17	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	-34.9	-173.3	-60.6	-70	-81.5	-170.5	-10.6	112.9	D315 L914 Q1490 G1592	D315-R1492 IonicContact OD2-CZ 3.74Å; D315-R1492 IonicContact OD2-NH1 3.83Å; D315-R1492 PolarHBondContact OD2-NH1 3.17Å; D315-R1492 IonicContact OD2-NH2 3.35Å; D315-R1492 PolarHBondContact OD2-NH2 2.93Å; L914-R1492 HydrophobicContact CB-CB 4.44Å; L914-R1492 WeakPolarHBondContact O-CB 3.46Å; L914-R1492 VanDerWaalsContact O-CG 3.24Å; L914-R1492 WeakPolarHBondContact O-CG 3.48Å; L914-R1492 PolarHBondContact O-NE 3.19Å; Q1490-R1492 PolarHBondContact O-N 2.87Å; R1492-G1592 PolarHBondContact N-O 3.4Å
1493	F	96.9	Very high	79.1	Confident	11 Å²	11	35.5 Å²	35.5	5%	0.048	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	162.4	174.7	63.8	-104.1	0	0	0	113.4	L914 A917 I935 V1495 I1590 S1591 G1592 V1627	L914-F1493 HydrophobicContact CB-CE1 4.07Å; L914-F1493 HydrophobicContact CD1-CE1 3.97Å; L914-F1493 HydrophobicContact CD1-CZ 4.36Å; A917-F1493 HydrophobicContact CB-CD1 3.97Å; A917-F1493 HydrophobicContact CB-CD2 3.7Å; A917-F1493 HydrophobicContact CB-CE1 3.9Å; A917-F1493 HydrophobicContact CB-CE2 3.64Å; A917-F1493 HydrophobicContact CB-CG 3.87Å; A917-F1493 HydrophobicContact CB-CZ 3.74Å; I935-F1493 HydrophobicContact CD1-CZ 4.16Å; I935-F1493 HydrophobicContact CG1-CZ 4.13Å; I935-F1493 HydrophobicContact CG2-CE1 3.71Å; I935-F1493 HydrophobicContact CG2-CZ 3.8Å; F1493-V1495 HydrophobicContact CD2-CG2 4.02Å; F1493-V1495 HydrophobicContact CE2-CG2 4.47Å; F1493-I1590 HydrophobicContact CE2-CG2 4.22Å; F1493-S1591 WeakPolarHBondContact O-CA 2.93Å; F1493-G1592 PolarHBondContact N-O 3.12Å; F1493-G1592 PolarHBondContact O-N 3.3Å; F1493-V1627 HydrophobicContact CZ-CG2 4.41Å
1494	L	97	Very high	76.3	Confident	16 Å²	16	43.4 Å²	43.4	8%	0.084	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	123.4	167.8	-76.1	164.1	0	0	0	109.6	T1443 W1450 V1589 I1590	T1443-L1494 HydrophobicContact CG2-CB 3.62Å; T1443-L1494 HydrophobicContact CG2-CD1 4.38Å; W1450-L1494 HydrophobicContact CB-CD1 3.95Å; W1450-L1494 HydrophobicContact CE3-CD2 4.13Å; L1494-V1589 HydrophobicContact CD2-CG1 3.99Å; L1494-I1590 CarbonylContact C-O 3.58Å; L1494-I1590 VanDerWaalsContact CA-O 3.29Å; L1494-I1590 WeakPolarHBondContact CA-O 3.31Å
1495	V	94.1	Very high	73.5	Confident	14 Å²	14	47.1 Å²	47.1	9%	0.085	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	142.6	178.6	176.2	0	0	0	0	110.1	A917 M919 V933 F1493 L1497 V1589 I1590	A917-V1495 HydrophobicContact CB-CG2 3.67Å; M919-V1495 HydrophobicContact CB-CG1 4.25Å; V933-V1495 HydrophobicContact CG1-CG1 4.33Å; F1493-V1495 HydrophobicContact CD2-CG2 4.02Å; F1493-V1495 HydrophobicContact CE2-CG2 4.47Å; V1495-L1497 HydrophobicContact CG1-CD2 4.29Å; V1495-V1589 CarbonylContact O-C 3.55Å; V1495-V1589 WeakPolarHBondContact O-CA 3.18Å; V1495-I1590 HydrophobicContact CB-CB 4.46Å; V1495-I1590 PolarHBondContact N-O 2.85Å; V1495-I1590 PolarHBondContact O-N 3.21Å
1496	T	90.7	Very high	70.6	Confident	26 Å²	26	49.7 Å²	49.7	16%	0.16	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	136.7	-179.3	55.3	0	0	0	0	111.3	T1443 C1445 V1589	T1443-T1496 HydrophobicContact CG2-CG2 3.72Å; C1445-T1496 HydrophobicContact CB-CG2 3.91Å; T1496-V1589 HydrophobicContact CG2-CG2 4.19Å
1497	L	84.7	Confident	67.6	Low	1 Å²	1	57 Å²	57	1%	0.005	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	125.7	178.3	-50.1	-172.2	0	0	0	111.1	M919 C931 V933 V950 V1495 M1587 K1588 I1590	M919-L1497 HydrophobicContact CB-CD2 4.02Å; M919-L1497 HydrophobicContact CG-CD2 3.77Å; M919-L1497 HydrophobicContact SD-CB 4.24Å; M919-L1497 HydrophobicContact SD-CD2 3.45Å; M919-L1497 WeakPolarHBondContact SD-CD2 3.47Å; M919-L1497 HydrophobicContact SD-CG 4.43Å; C931-L1497 HydrophobicContact CB-CD1 4.12Å; V933-L1497 HydrophobicContact CG2-CD2 3.71Å; V950-L1497 HydrophobicContact CB-CD1 4.05Å; V950-L1497 HydrophobicContact CG1-CD1 3.98Å; V950-L1497 HydrophobicContact CG2-CD1 4.13Å; V1495-L1497 HydrophobicContact CG1-CD2 4.29Å; L1497-M1587 WeakPolarHBondContact O-CA 3.19Å; L1497-M1587 WeakPolarHBondContact O-CB 3.24Å; L1497-K1588 HydrophobicContact CB-CB 4.19Å; L1497-K1588 HydrophobicContact CD1-CB 4.05Å; L1497-K1588 HydrophobicContact CG-CB 4.24Å; L1497-K1588 PolarHBondContact N-O 2.87Å; L1497-K1588 PolarHBondContact O-N 2.99Å; L1497-I1590 HydrophobicContact CD1-CD1 4.08Å; L1497-I1590 HydrophobicContact CD2-CD1 4.33Å; L1497-I1590 HydrophobicContact CG-CD1 4.29Å
1498	D	70.8	Confident	64.4	Low	22 Å²	22	66.3 Å²	66.3	12%	0.118	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	150.3	170.7	-73.6	-40.6	0	0	0	111.2	S994 S997 R998 M1587	S994-D1498 WeakPolarHBondContact CB-OD2 3.5Å; S994-D1498 PolarHBondContact OG-OD2 2.81Å; S997-D1498 WeakPolarHBondContact CB-OD1 3.35Å; S997-D1498 PolarHBondContact OG-OD1 3.15Å; R998-D1498 IonicContact NE-OD2 3.24Å; R998-D1498 PolarHBondContact NE-OD2 2.83Å; D1498-M1587 WeakPolarHBondContact OD1-CE 3.37Å
1499	N	57.7	Low	61.5	Low	73 Å²	73	68.8 Å²	68.8	39%	0.39	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	52.1	88.4	166.3	-78	-1.9	0	0	0	117.8
1500	I	48	Very low	58.7	Low	9 Å²	9	77.7 Å²	77.7	5%	0.046	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	120.2	158.9	-64.4	147.9	0	0	0	108.6	H951 D1502 K1586 K1588	H951-I1500 WeakPolarHBondContact CE1-CG2 3.38Å; H951-I1500 WeakPolarHBondContact NE2-CD1 3.26Å; H951-I1500 WeakPolarHBondContact NE2-CG1 3.45Å; I1500-D1502 WeakPolarHBondContact CG2-OD1 3.35Å; I1500-K1586 HydrophobicContact CB-CB 4.31Å; I1500-K1586 PolarHBondContact N-O 2.99Å; I1500-K1588 HydrophobicContact CD1-CB 4.02Å; I1500-K1588 HydrophobicContact CD1-CD 3.57Å; I1500-K1588 HydrophobicContact CD1-CG 3.57Å
1501	A	37.4	Very low	55.5	Low	70 Å²	70	81.1 Å²	81.1	58%	0.579	43%	0.434	S	S	*	.			trans	-109.6	82.1	178.5	0	0	0	0	0	110.5	D1503	A1501-D1503 PolarHBondContact O-N 3.19Å; A1501-D1503 VanDerWaalsContact O-N 3.09Å
1502	D	35.9	Very low	52.3	Low	83 Å²	83	90.5 Å²	90.5	44%	0.444	48%	0.478	S	S	.	.			trans	-75.5	93.1	174.3	-61.6	-31.8	0	0	0	110.2	I1500 E1504 K1586	I1500-D1502 WeakPolarHBondContact CG2-OD1 3.35Å; D1502-E1504 PolarHBondContact O-N 3.05Å; D1502-K1586 VanDerWaalsContact OD2-CD 3.26Å; D1502-K1586 WeakPolarHBondContact OD2-CD 3.25Å; D1502-K1586 WeakPolarHBondContact OD2-CE 3.5Å; D1502-K1586 IonicContact OD2-NZ 2.75Å; D1502-K1586 PolarHBondContact OD2-NZ 3.32Å
1503	D	32.6	Very low	49	Very low	143 Å²	143	97.1 Å²	97.1	77%	0.765	51%	0.508	S	S	*	.			trans	-91	67.4	-179.2	-158.5	10.6	0	0	0	112.3	A1501 N1505	A1501-D1503 PolarHBondContact O-N 3.19Å; A1501-D1503 VanDerWaalsContact O-N 3.09Å; D1503-N1505 PolarHBondContact O-N 3.25Å
1504	E	31.1	Very low	45.7	Very low	177 Å²	177	103.3 Å²	103.3	83%	0.827	55%	0.547	S	S	*	.			trans	-73.5	71.7	172.8	-74.8	-152.6	137.9	0	0	112.1	D1502	D1502-E1504 PolarHBondContact O-N 3.05Å
1505	N	26.7	Very low	42.3	Very low	124 Å²	124	110 Å²	110	66%	0.663	58%	0.583	S	S	*	*			trans	-148.5	73.8	166.7	-99.1	-57.7	0	0	0	113.5	D1503 I1507	D1503-N1505 PolarHBondContact O-N 3.25Å; N1505-I1507 VanDerWaalsContact C-N 3.35Å; N1505-I1507 PolarHBondContact O-N 2.78Å
1506	P	28.9	Very low	39.2	Very low	112 Å²	112	115.9 Å²	115.9	73%	0.727	62%	0.619	S	S	*	*			trans	-73.5	83.1	175.2	30.9	-35.1	0	0	0	111.8	K1508	P1506-K1508 PolarHBondContact O-N 2.84Å
1507	I	29.7	Very low	36.1	Very low	153 Å²	153	120.1 Å²	120.1	79%	0.785	65%	0.65	S	S	*	*			trans	-66.8	102.9	176	-60.8	-179.8	0	0	0	110	N1505 S1509	N1505-I1507 VanDerWaalsContact C-N 3.35Å; N1505-I1507 PolarHBondContact O-N 2.78Å; I1507-S1509 PolarHBondContact O-N 2.89Å; I1507-S1509 VanDerWaalsContact O-N 3.11Å
1508	K	24.4	Very low	33.5	Very low	196 Å²	196	125.9 Å²	125.9	85%	0.852	69%	0.69	S	S	*	*			trans	-73.9	94.8	178.5	-67.4	172.1	-177.8	170.3	0	111.8	P1506	P1506-K1508 PolarHBondContact O-N 2.84Å
1509	S	30.3	Very low	31.4	Very low	113 Å²	113	133 Å²	133	79%	0.79	72%	0.723	S	S	*	*			trans	-84.1	153.1	157.6	62.1	0	0	0	0	110.6	I1507	I1507-S1509 PolarHBondContact O-N 2.89Å; I1507-S1509 VanDerWaalsContact O-N 3.11Å
1510	K	30.9	Very low	29.9	Very low	198 Å²	198	134.4 Å²	134.4	86%	0.861	75%	0.745	S	S	*	*			trans	-97.7	123.9	-171.8	-73.2	179.9	179.4	174.8	0	112.5
1511	T	26.6	Very low	28.8	Very low	118 Å²	118	140.3 Å²	140.3	72%	0.724	78%	0.775	S	S	*	*			trans	47.1	108.3	130.5	-45.5	0	0	0	0	118.5
1512	E	29.4	Very low	28.2	Very low	196 Å²	196	147.9 Å²	147.9	92%	0.916	79%	0.79	S	S	*	*				-146.9	165.4	125.7	-125.3	167.5	-148.4	0	0	110.9
1513	K	25.5	Very low	27.7	Very low	184 Å²	184	149.4 Å²	149.4	80%	0.8	80%	0.797	S	S	*	*			trans	-114.9	122.2	-161.4	-63.7	177.8	-179.5	177.7	0	113.6
1514	T	28.3	Very low	27.4	Very low	142 Å²	142	147.7 Å²	147.7	87%	0.871	80%	0.796	S	S	*	*			trans	-141.7	139.5	152.5	41.6	0	0	0	0	110.1
1515	N	24.6	Very low	27.2	Very low	157 Å²	157	145.5 Å²	145.5	84%	0.84	79%	0.79	S	S	*	*			trans	-90.8	126.8	-176.6	-62	-16.7	0	0	0	111.1
1516	T	29.9	Very low	27.1	Very low	136 Å²	136	144.7 Å²	144.7	83%	0.834	79%	0.794	S	S	*	*			trans	-159.7	148.2	145.8	16.5	0	0	0	0	109.6
1517	S	25.9	Very low	27.1	Very low	115 Å²	115	142.7 Å²	142.7	80%	0.804	79%	0.787	S	S	*	*			trans	-72.2	133.4	-176.8	50.3	0	0	0	0	113.2
1518	S	28.5	Very low	27	Very low	123 Å²	123	142.8 Å²	142.8	86%	0.86	79%	0.787	S	S	*	*			trans	-108.6	97.1	169.3	-59.7	0	0	0	0	110.5
1519	Q	27.2	Very low	27	Very low	172 Å²	172	139.9 Å²	139.9	80%	0.804	79%	0.786	S	S	*	*			trans	-69	140.7	156.7	-73.4	174	-35.4	0	0	108.4	I1521	Q1519-I1521 PolarHBondContact O-N 2.95Å
1520	A	26.4	Very low	26.9	Very low	102 Å²	102	139.3 Å²	139.3	84%	0.843	78%	0.78	S	S	*	*			trans	-71.4	100.5	171.9	0	0	0	0	0	109.2	Y1522	A1520-Y1522 PolarHBondContact O-N 2.84Å
1521	I	24.8	Very low	26.9	Very low	132 Å²	132	139.2 Å²	139.2	68%	0.677	78%	0.78	S	S	*	*			trans	-75.4	117.9	-176.2	-50.5	179.5	0	0	0	109.4	Q1519 I1523	Q1519-I1521 PolarHBondContact O-N 2.95Å; I1521-I1523 VanDerWaalsContact C-N 3.29Å; I1521-I1523 HydrophobicContact CB-CG1 3.94Å; I1521-I1523 HydrophobicContact CG2-CG1 3.61Å; I1521-I1523 PolarHBondContact O-N 2.91Å
1522	Y	24.9	Very low	26.9	Very low	230 Å²	230	138.4 Å²	138.4	90%	0.902	78%	0.779	S	S	*	*			trans	-66.8	88.1	161.2	-92.5	-96.6	0	0	0	109.2	A1520 S1524	A1520-Y1522 PolarHBondContact O-N 2.84Å; Y1522-S1524 PolarHBondContact O-N 3.32Å
1523	I	26.1	Very low	26.9	Very low	114 Å²	114	137 Å²	137	59%	0.585	78%	0.778	S	S	*	*			trans	-79.5	90.7	179.1	-55.1	-179.8	0	0	0	109.8	I1521 N1525	I1521-I1523 VanDerWaalsContact C-N 3.29Å; I1521-I1523 HydrophobicContact CB-CG1 3.94Å; I1521-I1523 HydrophobicContact CG2-CG1 3.61Å; I1521-I1523 PolarHBondContact O-N 2.91Å; I1523-N1525 VanDerWaalsContact C-N 3.29Å; I1523-N1525 HydrophobicContact CG2-CB 3.79Å; I1523-N1525 PolarHBondContact O-N 3.31Å
1524	S	24.8	Very low	26.9	Very low	108 Å²	108	137.7 Å²	137.7	76%	0.755	78%	0.781	S	S	*	*			trans	-64.1	89.5	158.2	54.6	0	0	0	0	109	Y1522 S1526	Y1522-S1524 PolarHBondContact O-N 3.32Å; S1524-S1526 VanDerWaalsContact C-N 3.31Å; S1524-S1526 PolarHBondContact O-N 3.47Å
1525	N	28.3	Very low	27	Very low	131 Å²	131	137.7 Å²	137.7	70%	0.701	78%	0.78	S	S	*	*			trans	-83.3	69	-161.3	-143.3	-6.2	0	0	0	113.9	I1523 A1527	I1523-N1525 VanDerWaalsContact C-N 3.29Å; I1523-N1525 HydrophobicContact CG2-CB 3.79Å; I1523-N1525 PolarHBondContact O-N 3.31Å; N1525-A1527 PolarHBondContact O-N 2.86Å
1526	S	24.2	Very low	27.1	Very low	107 Å²	107	136.6 Å²	136.6	75%	0.748	78%	0.78	S	S	*	*			trans	-87.5	77.9	165.9	57.7	0	0	0	0	110.7	S1524	S1524-S1526 VanDerWaalsContact C-N 3.31Å; S1524-S1526 PolarHBondContact O-N 3.47Å
1527	A	28.8	Very low	27	Very low	70 Å²	70	135.6 Å²	135.6	58%	0.579	78%	0.778	S	S	*	*			trans	-133.7	118.5	169.6	0	0	0	0	0	108.4	N1525	N1525-A1527 PolarHBondContact O-N 2.86Å
1528	I	27.4	Very low	27.3	Very low	154 Å²	154	135.4 Å²	135.4	79%	0.79	78%	0.777	S	S	*	*				68.4	121.5	64.3	-59.3	174.1	0	0	0	111.6
1529	T	24.9	Very low	27.3	Very low	135 Å²	135	138 Å²	138	83%	0.828	78%	0.781	S	S	*	*			trans	-68.3	132.9	-172.2	49	0	0	0	0	114
1530	P	28.1	Very low	27.5	Very low	102 Å²	102	133.2 Å²	133.2	66%	0.662	78%	0.778	S	S	*	*			trans	-107.5	143.7	167.6	38.3	-30.5	0	0	0	112.8
1531	F	29.9	Very low	27.7	Very low	195 Å²	195	135.1 Å²	135.1	86%	0.855	77%	0.774	S	S	*	*			trans	57.2	107.7	173.7	-53.6	-78.1	0	0	0	116.5
1532	S	27.4	Very low	27.9	Very low	102 Å²	102	137.2 Å²	137.2	71%	0.713	78%	0.781	S	S	*	*			cis	79.8	83.5	42	90.5	0	0	0	0	115.1
1533	D	29	Very low	28.2	Very low	165 Å²	165	130 Å²	130	88%	0.882	77%	0.769	S	S	*	*			trans	-105.2	123.4	153.9	-100.7	-43	0	0	0	109.7
1534	K	26.2	Very low	28.4	Very low	199 Å²	199	131.3 Å²	131.3	87%	0.865	78%	0.778	S	S	*	*			trans	-95	112.3	168.2	-80.3	-177.2	176.1	179.5	0	108.7
1535	V	28.8	Very low	28.7	Very low	142 Å²	142	132 Å²	132	86%	0.861	78%	0.777	S	S	*	*			trans	-132.3	126.6	152.9	-174.7	0	0	0	0	108.6
1536	T	27.1	Very low	28.9	Very low	135 Å²	135	130.9 Å²	130.9	83%	0.828	78%	0.78	S	S	*	*			trans	-102.7	136.1	-173.7	47.5	0	0	0	0	112
1537	S	28.3	Very low	29.3	Very low	115 Å²	115	130.2 Å²	130.2	80%	0.804	78%	0.775	S	S	*	*			trans	-143	141.6	162.2	53	0	0	0	0	109.1
1538	S	31.6	Very low	29.5	Very low	111 Å²	111	134.8 Å²	134.8	78%	0.776	78%	0.784	S	S	*	*			cis	-162.4	135.5	-8	47.3	0	0	0	0	110.5
1539	D	29.8	Very low	29.8	Very low	176 Å²	176	133.9 Å²	133.9	94%	0.941	78%	0.78	S	S	*	*			trans	-147.4	141.8	159.4	-111.4	-34	0	0	0	107.3
1540	G	31.1	Very low	30	Very low	73 Å²	73	133.5 Å²	133.5	75%	0.753	78%	0.777	S	S	*	*			trans	108.1	69.3	178.2	0	0	0	0	0	116.7
1541	N	29.7	Very low	30.2	Very low	141 Å²	141	133.2 Å²	133.2	75%	0.754	78%	0.778	S	S	*	*			trans	13.5	149.5	146.1	-83.5	14.5	0	0	0	123.9
1542	E	29.2	Very low	30.1	Very low	176 Å²	176	128.5 Å²	128.5	82%	0.822	77%	0.769	S	S	*	*			trans	92.8	144.6	140.9	-82.8	164.7	-131.3	0	0	122.5
1543	A	31.6	Very low	30.1	Very low	79 Å²	79	128.1 Å²	128.1	65%	0.653	77%	0.766	S	S	*	*			trans	75.2	91	157.8	0	0	0	0	0	121.8
1544	N	30.9	Very low	30	Very low	142 Å²	142	130.9 Å²	130.9	76%	0.759	76%	0.764	S	S	*	*				87.4	130.5	121.5	-62.1	-22.2	0	0	0	123.2
1545	T	30.8	Very low	30.1	Very low	121 Å²	121	127.6 Å²	127.6	74%	0.742	76%	0.761	S	S	*	*			trans	59.9	102	141.5	54.5	0	0	0	0	118.5
1546	S	31.5	Very low	30	Very low	109 Å²	109	125.1 Å²	125.1	76%	0.762	75%	0.75	S	S	*	*				98.2	140.9	86.8	68.9	0	0	0	0	112.4
1547	S	32.7	Very low	30	Very low	92 Å²	92	125.7 Å²	125.7	64%	0.643	75%	0.748	S	S	*	*			cis	-174.7	151.2	3.2	37.3	0	0	0	0	112.1
1548	H	34.3	Very low	30	Very low	167 Å²	167	127.5 Å²	127.5	77%	0.773	75%	0.748	S	S	*	*			trans	70.4	142.4	145	-79.1	-133.5	0	0	0	118.4
1549	L	33.5	Very low	29.8	Very low	135 Å²	135	126.6 Å²	126.6	71%	0.707	74%	0.742	S	S	*	*			cis	-142.2	150.2	-4.3	-84.5	136.7	0	0	0	107.1
1550	V	29	Very low	29.7	Very low	126 Å²	126	126.8 Å²	126.8	76%	0.764	74%	0.737	S	S	*	*				69.3	134.4	52.3	176.6	0	0	0	0	111.7
1551	S	31.7	Very low	29.5	Very low	96 Å²	96	129 Å²	129	67%	0.671	74%	0.741	S	S	*	*			cis	-132.6	168.9	12.4	59.3	0	0	0	0	112.3
1552	S	28.5	Very low	29.5	Very low	97 Å²	97	126.2 Å²	126.2	68%	0.678	75%	0.745	S	S	*	*			cis	61.4	144	43.6	31.3	0	0	0	0	115.7
1553	S	28	Very low	29.5	Very low	93 Å²	93	126.6 Å²	126.6	65%	0.65	75%	0.747	S	S	*	*			cis	-178.4	161.1	-10.5	52.5	0	0	0	0	113.9
1554	R	26.5	Very low	29.3	Very low	223 Å²	223	130.7 Å²	130.7	84%	0.842	76%	0.757	S	S	*	*			trans	72	144.8	144.4	-78.6	168.9	178.9	-177	-0.2	122.3
1555	T	27.1	Very low	29.1	Very low	131 Å²	131	127.9 Å²	127.9	80%	0.804	75%	0.749	S	S	*	*			trans	63.8	149	146.3	47.2	0	0	0	0	119.7
1556	S	27.5	Very low	28.9	Very low	89 Å²	89	131.8 Å²	131.8	62%	0.622	75%	0.75	S	S	*	*			cis	-170.7	154.6	-8.8	44.2	0	0	0	0	112.1
1557	D	26.1	Very low	28.7	Very low	148 Å²	148	129.3 Å²	129.3	79%	0.791	73%	0.726	S	S	*	*			trans	66.7	162.8	150.5	-57.1	-26.1	0	0	0	123.2
1558	L	29.8	Very low	28.6	Very low	153 Å²	153	133.5 Å²	133.5	80%	0.801	74%	0.735	S	S	*	*			trans	70.7	87.8	166.1	-93.9	69	0	0	0	121.2
1559	S	26.7	Very low	28.2	Very low	92 Å²	92	133 Å²	133	64%	0.643	73%	0.731	S	S	*	*				60.3	131	111.9	69.1	0	0	0	0	123.6
1560	Q	28.2	Very low	28	Very low	179 Å²	179	132.3 Å²	132.3	84%	0.836	74%	0.737	S	S	*	*			trans	79.9	107.8	140.8	-74.8	-179	0.2	0	0	121.7
1561	S	27	Very low	27.9	Very low	120 Å²	120	129.9 Å²	129.9	84%	0.839	74%	0.737	S	S	*	*			trans	60.8	121.9	132.8	63.8	0	0	0	0	121.7
1562	G	30	Very low	27.7	Very low	82 Å²	82	130.9 Å²	130.9	85%	0.845	75%	0.745	S	S	*	*			trans	174.5	120.7	160.4	0	0	0	0	0	111
1563	Q	27.9	Very low	27.6	Very low	185 Å²	185	134.3 Å²	134.3	86%	0.864	74%	0.743	S	S	*	*			trans	-92.8	141.9	179.1	-63.5	168.3	-41.4	0	0	110.7
1564	L	27.2	Very low	27.5	Very low	164 Å²	164	141.8 Å²	141.8	86%	0.859	76%	0.757	S	S	*	*				171.6	137.9	118.4	-90.8	158.7	0	0	0	114.3
1565	S	27	Very low	27.6	Very low	83 Å²	83	135.9 Å²	135.9	58%	0.58	75%	0.75	S	S	*	*			trans	-4.4	130.9	166.2	-49.1	0	0	0	0	122
1566	R	27.2	Very low	27.5	Very low	204 Å²	204	134.9 Å²	134.9	77%	0.77	75%	0.748	S	S	*	*				-172.7	153	100.1	-104.1	-176.7	145.7	152.5	-3.7	115.7
1567	H	26.7	Very low	27.6	Very low	56 Å²	56	137.7 Å²	137.7	26%	0.259	75%	0.754	S	S	.	*			trans	11.5	127.1	160.2	-46.1	-44.7	0	0	0	121.1	D122 S123	D122-H1567 VanDerWaalsContact CG-ND1 3.35Å; D122-H1567 IonicContact OD1-CE1 3.23Å; D122-H1567 IonicContact OD1-CG 3.3Å; D122-H1567 VanDerWaalsContact OD1-CG 3.31Å; D122-H1567 IonicContact OD1-ND1 2.7Å; D122-H1567 PolarHBondContact OD1-ND1 2.89Å; D122-H1567 IonicContact OD2-CD2 2.69Å; D122-H1567 PolarHBondContact OD2-CD2 3.26Å; D122-H1567 IonicContact OD2-CE1 2.83Å; D122-H1567 IonicContact OD2-CG 2.63Å; D122-H1567 IonicContact OD2-ND1 3.31Å; D122-H1567 IonicContact OD2-NE2 2.64Å; S123-H1567 PolarHBondContact N-ND1 3.43Å; S123-H1567 PolarHBondContact O-ND1 3.32Å; S123-H1567 PolarHBondContact OG-ND1 3.45Å
1568	H	30.5	Very low	27.6	Very low	181 Å²	181	137 Å²	137	84%	0.838	75%	0.75	S	S	*	*			trans	-150.3	118.8	154.2	-96.8	-69.2	0	0	0	112.8
1569	F	25.7	Very low	27.3	Very low	157 Å²	157	136.2 Å²	136.2	69%	0.689	76%	0.755	S	S	*	*			trans	-70.5	149.7	167.1	-87	-119.6	0	0	0	111.4
1570	S	29.3	Very low	27.3	Very low	120 Å²	120	136.6 Å²	136.6	84%	0.839	76%	0.756	S	S	*	*			trans	-130.7	86.6	163.9	61.4	0	0	0	0	112.8	S1572	S1570-S1572 PolarHBondContact O-N 2.88Å
1571	G	26.7	Very low	27.1	Very low	74 Å²	74	133.8 Å²	133.8	76%	0.763	75%	0.752	S	S	*	*			trans	-76.3	106.3	169.6	0	0	0	0	0	111.3
1572	S	27.6	Very low	27.1	Very low	118 Å²	118	134.2 Å²	134.2	83%	0.825	75%	0.749	S	S	*	*			trans	-79.4	129.5	173.6	-154.8	0	0	0	0	110.7	S1570	S1570-S1572 PolarHBondContact O-N 2.88Å
1573	R	27.1	Very low	27.1	Very low	168 Å²	168	136.7 Å²	136.7	63%	0.634	74%	0.742	S	S	*	*			trans	-71.6	129.7	-162.2	-59.7	176.6	-175	174.4	2.1	112.1	S1575	R1573-S1575 PolarHBondContact O-N 2.91Å
1574	R	26.8	Very low	27.4	Very low	251 Å²	251	134.7 Å²	134.7	95%	0.947	74%	0.737	S	S	*	*			trans	-63.9	113.1	157.8	-91.5	-175.2	169.6	178.7	-3.1	108.4	S1576	R1574-S1576 PolarHBondContact O-N 2.79Å
1575	S	27.9	Very low	28.4	Very low	99 Å²	99	129.4 Å²	129.4	69%	0.692	71%	0.711	S	S	*	*			trans	-65.5	118.9	159.6	51.3	0	0	0	0	108.8	R1573 I1577	R1573-S1575 PolarHBondContact O-N 2.91Å; S1575-I1577 PolarHBondContact O-N 2.93Å
1576	S	25.9	Very low	30.1	Very low	110 Å²	110	128.9 Å²	128.9	77%	0.769	70%	0.699	S	S	*	*			trans	-70.7	93.9	177.1	49.3	0	0	0	0	110.7	R1574	R1574-S1576 PolarHBondContact O-N 2.79Å
1577	I	29.2	Very low	32.5	Very low	147 Å²	147	120.1 Å²	120.1	75%	0.754	67%	0.667	S	S	*	*			trans	-96.7	130.9	160.6	-60.8	176.9	0	0	0	106.5	S1575 P1579	S1575-I1577 PolarHBondContact O-N 2.93Å; I1577-P1579 WeakPolarHBondContact O-CD 3.47Å
1578	N	25	Very low	35.4	Very low	133 Å²	133	118 Å²	118	71%	0.711	66%	0.657	S	S	*	*			trans	-60.6	124.2	-171.2	-67.2	-30.5	0	0	0	111.8	C1580	N1578-C1580 PolarHBondContact O-N 2.86Å
1579	P	24.6	Very low	38.2	Very low	138 Å²	138	109.4 Å²	109.4	90%	0.896	62%	0.617	S	S	*	*	S	Bend	trans	-79.2	55.3	172.8	35	-35.9	0	0	0	110.7	I1577	I1577-P1579 WeakPolarHBondContact O-CD 3.47Å
1580	C	25.5	Very low	41.5	Very low	99 Å²	99	101.9 Å²	101.9	67%	0.669	58%	0.584	S	S	*	*			trans	-146.5	44.1	-179.7	-154.2	0	0	0	0	112.1	N1578	N1578-C1580 PolarHBondContact O-N 2.86Å
1581	T	23.7	Very low	44.7	Very low	121 Å²	121	96.2 Å²	96.2	74%	0.742	54%	0.544	S	S	*	.			trans	-150.9	75.8	162.9	-40.8	0	0	0	0	108.3	I1583	T1581-I1583 VanDerWaalsContact C-N 3.29Å; T1581-I1583 HydrophobicContact CG2-CG1 4.44Å; T1581-I1583 PolarHBondContact O-N 2.99Å
1582	T	27.7	Very low	48	Very low	128 Å²	128	92.7 Å²	92.7	79%	0.785	51%	0.508	S	S	*	.			trans	-70.9	91.5	169.3	-52.8	0	0	0	0	107.5	N1584	T1582-N1584 PolarHBondContact O-N 2.83Å; T1582-N1584 VanDerWaalsContact O-N 3.12Å
1583	I	29.3	Very low	51.1	Low	134 Å²	134	87.1 Å²	87.1	69%	0.687	47%	0.469	S	S	*	.			trans	-56.7	120.4	171	-58.7	176.4	0	0	0	106.4	T1581 T1585	T1581-I1583 VanDerWaalsContact C-N 3.29Å; T1581-I1583 HydrophobicContact CG2-CG1 4.44Å; T1581-I1583 PolarHBondContact O-N 2.99Å; I1583-T1585 HydrophobicContact CG2-CG2 4.03Å; I1583-T1585 PolarHBondContact O-N 3.38Å
1584	N	35.8	Very low	54	Low	143 Å²	143	80.6 Å²	80.6	77%	0.765	45%	0.446	S	S	*	.			trans	-81.8	64.6	-166.1	-136.6	-7.5	0	0	0	109.8	T1582 K1586	T1582-N1584 PolarHBondContact O-N 2.83Å; T1582-N1584 VanDerWaalsContact O-N 3.12Å; N1584-K1586 PolarHBondContact O-N 3.46Å
1585	T	47.7	Very low	56.9	Low	53 Å²	53	68.6 Å²	68.6	33%	0.325	40%	0.401	S	S	.	.			trans	-66.1	98.4	-173.6	48	0	0	0	0	110.6	K1446 I1583 M1587	K1446-T1585 PolarHBondContact NZ-O 2.75Å; I1583-T1585 HydrophobicContact CG2-CG2 4.03Å; I1583-T1585 PolarHBondContact O-N 3.38Å; T1585-M1587 PolarHBondContact O-N 2.73Å
1586	K	62.7	Low	59.8	Low	72 Å²	72	70 Å²	70	31%	0.313	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.2	126	164	-62	-178.8	-168.9	176.9	0	107	I1500 D1502 N1584	I1500-K1586 HydrophobicContact CB-CB 4.31Å; I1500-K1586 PolarHBondContact N-O 2.99Å; D1502-K1586 VanDerWaalsContact OD2-CD 3.26Å; D1502-K1586 WeakPolarHBondContact OD2-CD 3.25Å; D1502-K1586 WeakPolarHBondContact OD2-CE 3.5Å; D1502-K1586 IonicContact OD2-NZ 2.75Å; D1502-K1586 PolarHBondContact OD2-NZ 3.32Å; N1584-K1586 PolarHBondContact O-N 3.46Å
1587	M	78.1	Confident	62.6	Low	21 Å²	21	66.5 Å²	66.5	10%	0.103	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	153.8	163	-73.2	179.4	176.7	0	0	107.4	S997 K1446 L1497 D1498 T1585 V1632	S997-M1587 WeakPolarHBondContact OG-CE 3.35Å; K1446-M1587 HydrophobicContact CD-SD 4.12Å; K1446-M1587 VanDerWaalsContact CE-SD 3.58Å; K1446-M1587 HydrophobicContact CG-CE 4.34Å; K1446-M1587 HydrophobicContact CG-CG 4.48Å; K1446-M1587 HydrophobicContact CG-SD 3.36Å; K1446-M1587 WeakPolarHBondContact CG-SD 3.43Å; L1497-M1587 WeakPolarHBondContact O-CA 3.19Å; L1497-M1587 WeakPolarHBondContact O-CB 3.24Å; D1498-M1587 WeakPolarHBondContact OD1-CE 3.37Å; T1585-M1587 PolarHBondContact O-N 2.73Å; M1587-V1632 PolarHBondContact N-O 3.45Å; M1587-V1632 PolarHBondContact O-N 2.89Å
1588	K	87	Confident	65.2	Low	11 Å²	11	64.4 Å²	64.4	5%	0.048	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	148.7	171.5	-81	179.1	177.2	178.5	0	111	N900 V950 H951 L1497 I1500 I1629 W1630 D1631	N900-K1588 WeakPolarHBondContact ND2-CE 3.44Å; V950-K1588 HydrophobicContact CG1-CD 3.75Å; H951-K1588 PolarHBondContact CE1-NZ 3.49Å; H951-K1588 WeakPolarHBondContact NE2-CE 3.31Å; H951-K1588 PolarHBondContact NE2-NZ 2.73Å; L1497-K1588 HydrophobicContact CB-CB 4.19Å; L1497-K1588 HydrophobicContact CD1-CB 4.05Å; L1497-K1588 HydrophobicContact CG-CB 4.24Å; L1497-K1588 PolarHBondContact N-O 2.87Å; L1497-K1588 PolarHBondContact O-N 2.99Å; I1500-K1588 HydrophobicContact CD1-CB 4.02Å; I1500-K1588 HydrophobicContact CD1-CD 3.57Å; I1500-K1588 HydrophobicContact CD1-CG 3.57Å; K1588-I1629 HydrophobicContact CD-CG2 3.75Å; K1588-I1629 HydrophobicContact CG-CG2 4.35Å; K1588-W1630 CarbonylContact C-O 3.59Å; K1588-W1630 WeakPolarHBondContact CA-O 3.41Å; K1588-D1631 WeakPolarHBondContact CE-OD1 3.15Å
1589	V	90	Very high	67.7	Low	0 Å²	0	58.7 Å²	58.7	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	145	165	-176.8	0	0	0	0	108	C1445 W1450 L1494 V1495 T1496 W1630 V1632	C1445-V1589 HydrophobicContact CB-CG2 3.67Å; W1450-V1589 HydrophobicContact CD2-CB 4.44Å; W1450-V1589 HydrophobicContact CD2-CG1 3.99Å; W1450-V1589 HydrophobicContact CD2-CG2 4.28Å; W1450-V1589 HydrophobicContact CE3-CB 4.23Å; W1450-V1589 HydrophobicContact CE3-CG1 3.63Å; W1450-V1589 HydrophobicContact CH2-CB 3.73Å; W1450-V1589 HydrophobicContact CH2-CG1 4.06Å; W1450-V1589 HydrophobicContact CH2-CG2 3.99Å; W1450-V1589 HydrophobicContact CZ2-CB 4Å; W1450-V1589 HydrophobicContact CZ2-CG1 4.42Å; W1450-V1589 HydrophobicContact CZ2-CG2 3.72Å; W1450-V1589 HydrophobicContact CZ3-CB 3.85Å; W1450-V1589 HydrophobicContact CZ3-CG1 3.66Å; W1450-V1589 HydrophobicContact CZ3-CG2 4.41Å; L1494-V1589 HydrophobicContact CD2-CG1 3.99Å; V1495-V1589 CarbonylContact O-C 3.55Å; V1495-V1589 WeakPolarHBondContact O-CA 3.18Å; T1496-V1589 HydrophobicContact CG2-CG2 4.19Å; V1589-W1630 HydrophobicContact CB-CB 4.3Å; V1589-W1630 PolarHBondContact N-O 3.49Å; V1589-W1630 PolarHBondContact O-N 3.14Å; V1589-V1632 HydrophobicContact CB-CG2 4.44Å; V1589-V1632 HydrophobicContact CG2-CG2 3.68Å
1590	I	94.3	Very high	69.4	Low	0 Å²	0	54.5 Å²	54.5	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	123.6	-179.7	-55.1	-179.3	0	0	0	107.9	V933 V950 F1493 L1494 V1495 L1497 V1627 L1628	V933-I1590 HydrophobicContact CB-CD1 4.49Å; V933-I1590 HydrophobicContact CG1-CD1 4.5Å; V933-I1590 HydrophobicContact CG2-CD1 3.81Å; V950-I1590 HydrophobicContact CG2-CD1 3.86Å; F1493-I1590 HydrophobicContact CE2-CG2 4.22Å; L1494-I1590 CarbonylContact C-O 3.58Å; L1494-I1590 VanDerWaalsContact CA-O 3.29Å; L1494-I1590 WeakPolarHBondContact CA-O 3.31Å; V1495-I1590 HydrophobicContact CB-CB 4.46Å; V1495-I1590 PolarHBondContact N-O 2.85Å; V1495-I1590 PolarHBondContact O-N 3.21Å; L1497-I1590 HydrophobicContact CD1-CD1 4.08Å; L1497-I1590 HydrophobicContact CD2-CD1 4.33Å; L1497-I1590 HydrophobicContact CG-CD1 4.29Å; I1590-V1627 HydrophobicContact CG2-CG1 3.2Å; I1590-L1628 WeakPolarHBondContact CA-O 3.13Å
1591	S	96.2	Very high	70.4	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	145.4	167.3	66.9	0	0	0	0	110.5	I1458 H1487 F1493 V1627 L1628	I1458-S1591 WeakPolarHBondContact CD1-OG 3.41Å; H1487-S1591 PolarHBondContact NE2-OG 3.4Å; F1493-S1591 WeakPolarHBondContact O-CA 2.93Å; S1591-V1627 CarbonylContact O-C 3.57Å; S1591-V1627 VanDerWaalsContact O-CA 3.26Å; S1591-V1627 WeakPolarHBondContact O-CA 3.32Å; S1591-L1628 PolarHBondContact N-O 3.07Å; S1591-L1628 PolarHBondContact O-N 3.42Å; S1591-L1628 WeakPolarHBondContact OG-CB 3.41Å
1592	G	95.5	Very high	71.1	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	142	171.9	0	0	0	0	0	111.6	R1492 F1493 Y1626	R1492-G1592 PolarHBondContact N-O 3.4Å; F1493-G1592 PolarHBondContact N-O 3.12Å; F1493-G1592 PolarHBondContact O-N 3.3Å; G1592-Y1626 WeakPolarHBondContact CA-O 3.5Å
1593	G	93.4	Very high	71.3	Confident	1 Å²	1	57.3 Å²	57.3	1%	0.01	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-174.7	-171	-179.4	0	0	0	0	0	112.8	H1487 Y1626	H1487-G1593 PolarHBondContact CE1-N 2.78Å; H1487-G1593 WeakPolarHBondContact ND1-CA 3.38Å; H1487-G1593 PolarHBondContact ND1-N 2.96Å; G1593-Y1626 PolarHBondContact N-O 2.84Å; G1593-Y1626 PolarHBondContact O-N 3.12Å
1594	E	89.1	Confident	71.2	Confident	31 Å²	31	58.9 Å²	58.9	15%	0.145	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	126.7	178	177.4	162.2	-127.1	0	0	110.6	R907 I1488 G1489	R907-E1594 IonicContact CZ-OE1 3.36Å; R907-E1594 IonicContact NH1-OE1 3.85Å; R907-E1594 PolarHBondContact NH1-OE1 2.99Å; R907-E1594 VanDerWaalsContact NH2-CD 3.32Å; R907-E1594 IonicContact NH2-OE1 2.78Å; R907-E1594 PolarHBondContact NH2-OE1 2.71Å; I1488-E1594 PolarHBondContact N-O 2.84Å; G1489-E1594 PolarHBondContact N-O 3.01Å
1595	G	86.6	Confident	71	Confident	0 Å²	0	58.1 Å²	58.1	0%	0	29%	0.288	C	S	.	.	S	Bend	trans	64.1	-177.6	-175.1	0	0	0	0	0	114.7	H1487 D1622 D1624	H1487-G1595 PolarHBondContact ND1-O 2.59Å; G1595-D1622 WeakPolarHBondContact CA-O 3.46Å; G1595-D1624 PolarHBondContact N-O 3.34Å
1596	R	88	Confident	70.2	Confident	129 Å²	129	61.2 Å²	61.2	49%	0.487	31%	0.307	S	S	.	.			trans	-135.8	134.2	170.5	65.6	-176.4	-176.4	178.8	-0.7	109.2	G1486 Y1626 L1628	G1486-R1596 CarbonylContact O-C 3.58Å; G1486-R1596 WeakPolarHBondContact O-CA 3.06Å; R1596-Y1626 HydrophobicContact CB-CG 4.37Å; R1596-L1628 HydrophobicContact CB-CD2 4.1Å
1597	E	85	Confident	68.7	Low	35 Å²	35	66 Å²	66	16%	0.164	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	130.1	-176.8	-159.9	171.2	173	0	0	109	K1433 Y1485 G1486 I1488 F1599	K1433-E1597 IonicContact NZ-OE1 3.22Å; K1433-E1597 IonicContact NZ-OE2 2.89Å; K1433-E1597 PolarHBondContact NZ-OE2 3.38Å; Y1485-E1597 CarbonylContact C-O 3.59Å; Y1485-E1597 VanDerWaalsContact CA-O 3.28Å; Y1485-E1597 WeakPolarHBondContact CA-O 3.09Å; G1486-E1597 PolarHBondContact N-O 3.48Å; G1486-E1597 PolarHBondContact O-N 2.91Å; I1488-E1597 HydrophobicContact CG1-CB 3.89Å; I1488-E1597 HydrophobicContact CG1-CG 4.42Å; E1597-F1599 HydrophobicContact CB-CE1 4.19Å; E1597-F1599 HydrophobicContact CB-CE2 3.88Å; E1597-F1599 HydrophobicContact CB-CZ 3.65Å; E1597-F1599 HydrophobicContact CG-CD1 4.18Å; E1597-F1599 HydrophobicContact CG-CE1 3.63Å; E1597-F1599 HydrophobicContact CG-CE2 4.2Å; E1597-F1599 HydrophobicContact CG-CZ 3.64Å; E1597-F1599 VanDerWaalsContact OE1-CE1 3.29Å; E1597-F1599 WeakPolarHBondContact OE1-CE1 3.4Å; E1597-F1599 WeakPolarHBondContact OE2-CE1 3.21Å; E1597-F1599 VanDerWaalsContact OE2-CZ 3.3Å; E1597-F1599 WeakPolarHBondContact OE2-CZ 3.46Å
1598	E	85.3	Confident	66.2	Low	104 Å²	104	68.9 Å²	68.9	49%	0.486	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	109.3	172.8	-170.8	-178	137.6	0	0	110	Y1485 S1600	Y1485-E1598 HydrophobicContact CD1-CB 3.75Å; Y1485-E1598 HydrophobicContact CD1-CG 3.82Å; Y1485-E1598 HydrophobicContact CE1-CB 3.58Å; Y1485-E1598 HydrophobicContact CE1-CG 3.4Å; Y1485-E1598 WeakPolarHBondContact CE1-OE2 3.41Å; Y1485-E1598 VanDerWaalsContact OH-CD 3.28Å; Y1485-E1598 PolarHBondContact OH-OE2 3.22Å; E1598-S1600 VanDerWaalsContact C-N 3.28Å; E1598-S1600 PolarHBondContact O-N 3Å; E1598-S1600 WeakPolarHBondContact OE1-CB 3.42Å; E1598-S1600 PolarHBondContact OE1-OG 3.46Å
1599	F	77.3	Confident	63.7	Low	13 Å²	13	75.7 Å²	75.7	6%	0.057	41%	0.406	C	S	.	.			trans	-92.3	40.9	-178	-51.4	-86	0	0	0	112	R1421 L1422 V1457 S1484 E1597	R1421-F1599 HydrophobicContact CG-CB 3.67Å; R1421-F1599 HydrophobicContact CG-CD1 4.31Å; R1421-F1599 HydrophobicContact CG-CD2 4.47Å; R1421-F1599 HydrophobicContact CG-CG 3.94Å; R1421-F1599 PolarHBondContact NH1-O 2.92Å; L1422-F1599 HydrophobicContact CD2-CD1 4.37Å; L1422-F1599 HydrophobicContact CD2-CE1 3.75Å; V1457-F1599 HydrophobicContact CG2-CE1 4.11Å; V1457-F1599 HydrophobicContact CG2-CE2 4.13Å; V1457-F1599 HydrophobicContact CG2-CZ 3.79Å; S1484-F1599 PolarHBondContact O-N 3.28Å; E1597-F1599 HydrophobicContact CB-CE1 4.19Å; E1597-F1599 HydrophobicContact CB-CE2 3.88Å; E1597-F1599 HydrophobicContact CB-CZ 3.65Å; E1597-F1599 HydrophobicContact CG-CD1 4.18Å; E1597-F1599 HydrophobicContact CG-CE1 3.63Å; E1597-F1599 HydrophobicContact CG-CE2 4.2Å; E1597-F1599 HydrophobicContact CG-CZ 3.64Å; E1597-F1599 VanDerWaalsContact OE1-CE1 3.29Å; E1597-F1599 WeakPolarHBondContact OE1-CE1 3.4Å; E1597-F1599 WeakPolarHBondContact OE2-CE1 3.21Å; E1597-F1599 VanDerWaalsContact OE2-CZ 3.3Å; E1597-F1599 WeakPolarHBondContact OE2-CZ 3.46Å
1600	S	60	Low	60.8	Low	49 Å²	49	85.4 Å²	85.4	34%	0.343	44%	0.444	S	S	.	.			trans	-82.4	128.5	-174.8	64.5	0	0	0	0	112.3	E1598 K1602	E1598-S1600 VanDerWaalsContact C-N 3.28Å; E1598-S1600 PolarHBondContact O-N 3Å; E1598-S1600 WeakPolarHBondContact OE1-CB 3.42Å; E1598-S1600 PolarHBondContact OE1-OG 3.46Å; S1600-K1602 PolarHBondContact O-N 3.24Å; S1600-K1602 VanDerWaalsContact O-N 3.12Å
1601	K	46.9	Very low	57.6	Low	112 Å²	112	91.4 Å²	91.4	49%	0.487	48%	0.476	S	S	.	.			trans	-69.4	110.4	174.1	-71.6	-166.4	170	-170.6	0	109.3	D1603	K1601-D1603 PolarHBondContact O-N 2.77Å
1602	K	38.5	Very low	54.5	Low	148 Å²	148	99.3 Å²	99.3	64%	0.643	52%	0.518	S	S	*	.			trans	-66.1	103	172.8	-69.6	173.3	-178.8	167.1	0	109	S1600 L1604	S1600-K1602 PolarHBondContact O-N 3.24Å; S1600-K1602 VanDerWaalsContact O-N 3.12Å; K1602-L1604 VanDerWaalsContact C-N 3.33Å; K1602-L1604 PolarHBondContact O-N 2.89Å
1603	D	30.1	Very low	51.4	Low	147 Å²	147	105.9 Å²	105.9	79%	0.786	55%	0.554	S	S	*	*			trans	-62.8	90	174.4	-92.9	-31	0	0	0	110.4	K1601 T1605	K1601-D1603 PolarHBondContact O-N 2.77Å; D1603-T1605 PolarHBondContact O-N 2.89Å
1604	L	28.9	Very low	48.4	Very low	167 Å²	167	111 Å²	111	87%	0.874	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.2	61.2	-163.2	-153.6	80.2	0	0	0	113.5	K1602	K1602-L1604 VanDerWaalsContact C-N 3.33Å; K1602-L1604 PolarHBondContact O-N 2.89Å
1605	T	30.1	Very low	45.5	Very low	127 Å²	127	111.7 Å²	111.7	78%	0.779	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	-131.6	-12.8	-175.6	58.3	0	0	0	0	115	D1603	D1603-T1605 PolarHBondContact O-N 2.89Å
1606	T	30.7	Very low	42.8	Very low	118 Å²	118	113.9 Å²	113.9	72%	0.724	60%	0.603	S	S	*	*	S	Bend	trans	-135.1	139.6	-177.9	-48.8	0	0	0	0	110.6
1607	L	31.7	Very low	40	Very low	173 Å²	173	112 Å²	112	91%	0.906	61%	0.605	S	S	*	*			trans	63.6	85	-174.6	-63.1	167.5	0	0	0	114.9
1608	G	26.4	Very low	37.8	Very low	82 Å²	82	115.6 Å²	115.6	85%	0.845	63%	0.625	S	S	*	*			trans	-93.8	102.7	167	0	0	0	0	0	112.1
1609	I	33.4	Very low	35.3	Very low	153 Å²	153	112.1 Å²	112.1	79%	0.785	62%	0.617	S	S	*	*			trans	-157.5	137.2	161.8	-99.7	151.4	0	0	0	105.7
1610	Y	28.6	Very low	33.5	Very low	204 Å²	204	119.3 Å²	119.3	80%	0.8	66%	0.656	S	S	*	*	S	Bend	trans	1.5	131.7	164.2	-58.9	-95.1	0	0	0	117.9
1611	D	28	Very low	33.1	Very low	126 Å²	126	123.5 Å²	123.5	67%	0.674	68%	0.675	S	S	*	*			cis	-137.7	154.8	29.4	-80	-56	0	0	0	116
1612	N	30.5	Very low	33.6	Very low	166 Å²	166	120.5 Å²	120.5	89%	0.888	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.4	6.1	176.3	-78.5	5.1	0	0	0	114.3
1613	N	30.6	Very low	35	Very low	139 Å²	139	116.7 Å²	116.7	74%	0.743	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.4	12.1	-176.2	-77.6	17.7	0	0	0	113.7	C1615	N1613-C1615 VanDerWaalsContact C-N 3.29Å; N1613-C1615 PolarHBondContact O-N 3.37Å
1614	L	30	Very low	37.5	Very low	107 Å²	107	110.9 Å²	110.9	56%	0.56	63%	0.625	S	S	*	*			trans	-94	42.7	179.1	-136.1	88.5	0	0	0	113.3	T1617	L1614-T1617 HydrophobicContact CD1-CG2 3.48Å; L1614-T1617 VanDerWaalsContact CD1-CG2 3.48Å; L1614-T1617 HydrophobicContact CG-CG2 4.01Å
1615	C	28	Very low	40.5	Very low	47 Å²	47	103 Å²	103	32%	0.318	58%	0.584	S	S	.	*	S	Bend	trans	-89.9	130	153.7	-171.8	0	0	0	0	106.7	D1426 N1613 T1617	D1426-C1615 VanDerWaalsContact CG-SG 3.51Å; D1426-C1615 PolarHBondContact OD1-SG 2.96Å; N1613-C1615 VanDerWaalsContact C-N 3.29Å; N1613-C1615 PolarHBondContact O-N 3.37Å; C1615-T1617 VanDerWaalsContact C-N 3.33Å; C1615-T1617 PolarHBondContact O-N 3.23Å; C1615-T1617 VanDerWaalsContact O-N 3.11Å
1616	C	30.5	Very low	43.5	Very low	46 Å²	46	97.9 Å²	97.9	31%	0.311	55%	0.55	S	S	.	*	S	Bend	trans	41.6	51.7	173.8	-62.7	0	0	0	0	115.2	I1429 I1618	I1429-C1616 HydrophobicContact CD1-CB 4.06Å; C1616-I1618 PolarHBondContact O-N 3.03Å
1617	T	30.5	Very low	46.5	Very low	88 Å²	88	92.2 Å²	92.2	54%	0.54	52%	0.516	S	S	.	.			trans	-67.6	89.6	162.4	46.1	0	0	0	0	108.9	L1614 C1615 G1619	L1614-T1617 HydrophobicContact CD1-CG2 3.48Å; L1614-T1617 VanDerWaalsContact CD1-CG2 3.48Å; L1614-T1617 HydrophobicContact CG-CG2 4.01Å; C1615-T1617 VanDerWaalsContact C-N 3.33Å; C1615-T1617 PolarHBondContact O-N 3.23Å; C1615-T1617 VanDerWaalsContact O-N 3.11Å; T1617-G1619 PolarHBondContact O-N 3.04Å
1618	I	38.1	Very low	49.5	Very low	111 Å²	111	84 Å²	84	57%	0.569	47%	0.473	S	S	*	.			trans	-58.3	103.4	165.1	-59.3	133.4	0	0	0	106.4	Y308 C1616	Y308-I1618 VanDerWaalsContact OH-CD1 3.24Å; Y308-I1618 WeakPolarHBondContact OH-CD1 3.46Å; C1616-I1618 PolarHBondContact O-N 3.03Å
1619	G	33.2	Very low	52.7	Low	32 Å²	32	80.1 Å²	80.1	33%	0.33	43%	0.433	S	S	.	.			trans	-74.4	142.2	163.9	0	0	0	0	0	108.6	T1617 D1621 D1622	T1617-G1619 PolarHBondContact O-N 3.04Å; G1619-D1621 PolarHBondContact O-N 2.72Å; G1619-D1622 PolarHBondContact N-OD2 2.84Å; G1619-D1622 WeakPolarHBondContact O-CB 3.43Å; G1619-D1622 PolarHBondContact O-N 3.4Å
1620	D	39.5	Very low	55.4	Low	163 Å²	163	72.9 Å²	72.9	87%	0.872	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-21.8	-178.4	-64.1	-69.7	0	0	0	112.9
1621	D	51.2	Low	58.2	Low	137 Å²	137	64.1 Å²	64.1	73%	0.733	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.2	-12.8	175.1	-64	-43.8	0	0	0	115	G1619 S1623 D1624	G1619-D1621 PolarHBondContact O-N 2.72Å; D1621-S1623 PolarHBondContact O-N 2.94Å; D1621-D1624 PolarHBondContact O-N 2.65Å
1622	D	57.3	Low	60.7	Low	49 Å²	49	58.3 Å²	58.3	26%	0.262	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-11	-168.4	-83.4	-37.6	0	0	0	114.6	I1488 G1595 G1619 D1624	I1488-D1622 HydrophobicContact CD1-CB 3.69Å; G1595-D1622 WeakPolarHBondContact CA-O 3.46Å; G1619-D1622 PolarHBondContact N-OD2 2.84Å; G1619-D1622 WeakPolarHBondContact O-CB 3.43Å; G1619-D1622 PolarHBondContact O-N 3.4Å; D1622-D1624 VanDerWaalsContact C-N 3.31Å; D1622-D1624 PolarHBondContact O-N 2.86Å
1623	S	67.2	Low	62.5	Low	69 Å²	69	58.6 Å²	58.6	48%	0.483	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77	-8.6	-178.6	74.6	0	0	0	0	114.9	R907 D1621	R907-S1623 PolarHBondContact NE-O 3.14Å; R907-S1623 PolarHBondContact NH1-O 3.26Å; R907-S1623 PolarHBondContact NH2-O 3.27Å; D1621-S1623 PolarHBondContact O-N 2.94Å
1624	D	83.9	Confident	64.1	Low	24 Å²	24	54.6 Å²	54.6	13%	0.128	30%	0.304	C	S	.	.	S	Bend	trans	-72	163.3	-170.4	-141	-10.1	0	0	0	113.7	Q904 R907 G1595 D1621 D1622 Y1626	Q904-D1624 HydrophobicContact CG-CB 4.43Å; Q904-D1624 PolarHBondContact NE2-OD2 2.9Å; R907-D1624 WeakPolarHBondContact CB-OD1 3.33Å; R907-D1624 WeakPolarHBondContact CG-OD1 3.48Å; R907-D1624 PolarHBondContact N-OD1 3.43Å; G1595-D1624 PolarHBondContact N-O 3.34Å; D1621-D1624 PolarHBondContact O-N 2.65Å; D1622-D1624 VanDerWaalsContact C-N 3.31Å; D1622-D1624 PolarHBondContact O-N 2.86Å; D1624-Y1626 HydrophobicContact CB-CE2 4.09Å; D1624-Y1626 WeakPolarHBondContact O-CD2 3.46Å
1625	N	91.1	Very high	65.9	Low	2 Å²	2	51.8 Å²	51.8	1%	0.011	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	127.7	177.2	-67	-40	0	0	0	110.6	I905 R907 I912 L914	I905-N1625 HydrophobicContact CB-CB 4.41Å; I905-N1625 PolarHBondContact N-O 3.33Å; I905-N1625 WeakPolarHBondContact O-CB 3.49Å; R907-N1625 WeakPolarHBondContact CG-ND2 3.45Å; R907-N1625 PolarHBondContact NE-ND2 2.93Å; R907-N1625 PolarHBondContact NE-OD1 3.12Å; R907-N1625 VanDerWaalsContact NE-OD1 3.16Å; R907-N1625 PolarHBondContact NH2-OD1 3.37Å; I912-N1625 PolarHBondContact O-ND2 2.85Å; I912-N1625 PolarHBondContact O-OD1 3.26Å; L914-N1625 HydrophobicContact CD1-CB 4.3Å; L914-N1625 HydrophobicContact CD2-CB 3.99Å; L914-N1625 HydrophobicContact CG-CB 3.94Å
1626	Y	92.6	Very high	68	Low	19 Å²	19	52.1 Å²	52.1	8%	0.075	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	151.9	-179.9	-82	-88.9	0	0	0	112.8	A902 Q904 H1487 G1592 G1593 R1596 D1624	A902-Y1626 HydrophobicContact CB-CD1 4.38Å; Q904-Y1626 HydrophobicContact CB-CD1 4.19Å; Q904-Y1626 HydrophobicContact CB-CE1 3.73Å; Q904-Y1626 HydrophobicContact CG-CE1 4.19Å; Q904-Y1626 HydrophobicContact CG-CE2 4.48Å; H1487-Y1626 PolarHBondContact CE1-O 2.78Å; H1487-Y1626 VanDerWaalsContact CE1-O 3.23Å; G1592-Y1626 WeakPolarHBondContact CA-O 3.5Å; G1593-Y1626 PolarHBondContact N-O 2.84Å; G1593-Y1626 PolarHBondContact O-N 3.12Å; R1596-Y1626 HydrophobicContact CB-CG 4.37Å; D1624-Y1626 HydrophobicContact CB-CE2 4.09Å; D1624-Y1626 WeakPolarHBondContact O-CD2 3.46Å
1627	V	94.4	Very high	70.2	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	119.1	174.2	174.4	0	0	0	0	109.3	A902 V903 I905 L914 I935 L948 F1493 I1590 S1591	A902-V1627 CarbonylContact C-O 3.6Å; A902-V1627 WeakPolarHBondContact CA-O 3.34Å; V903-V1627 PolarHBondContact N-O 3.03Å; V903-V1627 PolarHBondContact O-N 2.82Å; I905-V1627 HydrophobicContact CD1-CG2 3.47Å; I905-V1627 VanDerWaalsContact CD1-CG2 3.47Å; I905-V1627 HydrophobicContact CG1-CG2 4.01Å; L914-V1627 HydrophobicContact CD1-CG2 4.12Å; I935-V1627 HydrophobicContact CD1-CG2 4.07Å; L948-V1627 HydrophobicContact CD2-CG1 3.86Å; F1493-V1627 HydrophobicContact CZ-CG2 4.41Å; I1590-V1627 HydrophobicContact CG2-CG1 3.2Å; S1591-V1627 CarbonylContact O-C 3.57Å; S1591-V1627 VanDerWaalsContact O-CA 3.26Å; S1591-V1627 WeakPolarHBondContact O-CA 3.32Å
1628	L	94.5	Very high	72.7	Confident	1 Å²	1	50.2 Å²	50.2	1%	0.005	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	130.5	-179.9	-44.7	176.4	0	0	0	109.7	F899 A902 G1486 I1590 S1591 R1596 W1630	F899-L1628 HydrophobicContact CE2-CB 4.15Å; F899-L1628 HydrophobicContact CE2-CD2 4.18Å; A902-L1628 HydrophobicContact CB-CD2 3.57Å; G1486-L1628 WeakPolarHBondContact O-CD1 3.49Å; I1590-L1628 WeakPolarHBondContact CA-O 3.13Å; S1591-L1628 PolarHBondContact N-O 3.07Å; S1591-L1628 PolarHBondContact O-N 3.42Å; S1591-L1628 WeakPolarHBondContact OG-CB 3.41Å; R1596-L1628 HydrophobicContact CB-CD2 4.1Å; L1628-W1630 HydrophobicContact CB-CZ2 4.32Å; L1628-W1630 HydrophobicContact CD1-CZ2 4.11Å
1629	I	93	Very high	75	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	131.5	-176.8	-58.2	175.5	0	0	0	109	N900 E901 V903 V950 P954 K1588	N900-I1629 WeakPolarHBondContact CA-O 3.16Å; N900-I1629 HydrophobicContact CB-CG2 4.28Å; N900-I1629 VanDerWaalsContact CB-O 3.31Å; N900-I1629 WeakPolarHBondContact CB-O 3.47Å; N900-I1629 PolarHBondContact N-O 3.13Å; E901-I1629 PolarHBondContact N-O 2.96Å; E901-I1629 PolarHBondContact O-N 3Å; V903-I1629 HydrophobicContact CG2-CD1 3.92Å; V950-I1629 HydrophobicContact CG1-CD1 4.35Å; V950-I1629 HydrophobicContact CG1-CG2 4.43Å; P954-I1629 HydrophobicContact CB-CD1 3.72Å; P954-I1629 HydrophobicContact CG-CD1 3.53Å; K1588-I1629 HydrophobicContact CD-CG2 3.75Å; K1588-I1629 HydrophobicContact CG-CG2 4.35Å
1630	W	91.6	Very high	78	Confident	1 Å²	1	47.1 Å²	47.1	0%	0.004	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	125.1	-171.3	-56.1	89.1	0	0	0	111	A897 K898 F899 W1450 I1458 L1483 Y1485 K1588 V1589 L1628	A897-W1630 HydrophobicContact CB-CE3 4.19Å; K898-W1630 CarbonylContact O-C 3.44Å; K898-W1630 WeakPolarHBondContact O-CA 3.17Å; F899-W1630 HydrophobicContact CB-CE3 3.99Å; F899-W1630 HydrophobicContact CB-CH2 4.39Å; F899-W1630 HydrophobicContact CB-CZ3 3.74Å; F899-W1630 HydrophobicContact CD2-CE3 4.46Å; F899-W1630 HydrophobicContact CD2-CH2 4.26Å; F899-W1630 HydrophobicContact CD2-CZ2 4.36Å; F899-W1630 HydrophobicContact CD2-CZ3 4.3Å; W1450-W1630 HydrophobicContact CH2-CB 3.72Å; W1450-W1630 HydrophobicContact CH2-CD2 4.32Å; W1450-W1630 AromaticContact CH2-CG 3.87Å; W1450-W1630 HydrophobicContact CH2-CG 3.87Å; W1450-W1630 HydrophobicContact CZ3-CB 4.26Å; W1450-W1630 HydrophobicContact CZ3-CD2 4.3Å; W1450-W1630 AromaticContact CZ3-CG 3.94Å; W1450-W1630 HydrophobicContact CZ3-CG 3.94Å; I1458-W1630 HydrophobicContact CD1-CZ2 3.96Å; L1483-W1630 HydrophobicContact CB-CH2 3.54Å; L1483-W1630 HydrophobicContact CB-CZ2 4.29Å; L1483-W1630 HydrophobicContact CB-CZ3 3.81Å; L1483-W1630 HydrophobicContact CD1-CD2 3.94Å; L1483-W1630 HydrophobicContact CD1-CE3 3.81Å; L1483-W1630 HydrophobicContact CD1-CH2 3.69Å; L1483-W1630 HydrophobicContact CD1-CZ2 3.83Å; L1483-W1630 HydrophobicContact CD1-CZ3 3.68Å; L1483-W1630 HydrophobicContact CG-CH2 4.24Å; L1483-W1630 HydrophobicContact CG-CZ3 4.26Å; Y1485-W1630 HydrophobicContact CD2-CH2 4.42Å; Y1485-W1630 VanDerWaalsContact O-CH2 3.3Å; Y1485-W1630 WeakPolarHBondContact O-CH2 3.49Å; Y1485-W1630 WeakPolarHBondContact O-CZ2 3.24Å; K1588-W1630 CarbonylContact C-O 3.59Å; K1588-W1630 WeakPolarHBondContact CA-O 3.41Å; V1589-W1630 HydrophobicContact CB-CB 4.3Å; V1589-W1630 PolarHBondContact N-O 3.49Å; V1589-W1630 PolarHBondContact O-N 3.14Å; L1628-W1630 HydrophobicContact CB-CZ2 4.32Å; L1628-W1630 HydrophobicContact CD1-CZ2 4.11Å
1631	D	86.4	Confident	80.9	Confident	20 Å²	20	38.2 Å²	38.2	11%	0.107	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83	128.6	170.5	-64.8	-20	0	0	0	110.1	K898 N900 K1588	K898-D1631 HydrophobicContact CB-CB 4.44Å; K898-D1631 PolarHBondContact N-O 3.38Å; K898-D1631 PolarHBondContact O-N 2.94Å; N900-D1631 VanDerWaalsContact ND2-CG 3.32Å; N900-D1631 PolarHBondContact ND2-OD1 3.31Å; N900-D1631 PolarHBondContact ND2-OD2 3.11Å; K1588-D1631 WeakPolarHBondContact CE-OD1 3.15Å
1632	V	81.2	Confident	83.4	Confident	3 Å²	3	30 Å²	30	2%	0.018	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	123.5	178.8	-168.8	0	0	0	0	110.4	K1446 W1450 M1587 V1589	K1446-V1632 HydrophobicContact CD-CG1 4.28Å; K1446-V1632 PolarHBondContact NZ-O 3.1Å; W1450-V1632 HydrophobicContact CH2-CG2 4.19Å; W1450-V1632 HydrophobicContact CZ2-CG2 3.57Å; M1587-V1632 PolarHBondContact N-O 3.45Å; M1587-V1632 PolarHBondContact O-N 2.89Å; V1589-V1632 HydrophobicContact CB-CG2 4.44Å; V1589-V1632 HydrophobicContact CG2-CG2 3.68Å
1633	K	67.7	Low	85.8	Confident	172 Å²	172	28.3 Å²	28.3	75%	0.748	14%	0.143	S	C	*	.			trans	-102.5	0	-178.7	-67.3	-172.4	176.6	-175.4	0	111.8	K1446	K1446-K1633 WeakPolarHBondContact CD-OXT 3.43Å; K1446-K1633 PolarHBondContact NZ-OXT 3.24Å

Retrieved 1,633 of 1,633 residues in 1391.9 ms (Link to these results)

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