A0A077Z2L6_TRITR Loading...

Regulating synaptic membrane exocytosis 2

AlphaFold DB , UniProt , Accession A0A077Z2L6, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 1,437 aa.

						>A0A077Z2L6_TRITR|A0A077Z2L6
MTDVMPDLSHLTEEERQIIERVLQRQKVEESQEQELKHFEQKFAMSVVTPCMFDIDGIQGQKSSFCSFSGYSFRKYEKQLRDIEKQIEERMEVARKLVGTMDDAICQICQKTKFADGIGHKCYYCQLRSCARCGGRLQIKVKADQVKPGNLPTKDKSPTGSATQQKTIWSCSLCQQRQQILAKTGKWFYSGDKDRASSEEPPLLPAESPGATAALDRPVTPVQRGQEGLKADQRQQEAKKDAINDQGRLEDEEKRTAGSVVSSEQKVPSPRDARHDLSASPANNDRWTSKGTNALQRRQSLQDRRYTVTNEQSDRDTRTDQAREQRRESGAKSVTRKTSKERRGSVAPDTVSPVSQNATVHQKAHIGKVKNAKELEGTQRRRHRSPSAAGSSESGADQLHYTALARGRPEKYREDRSDQIRSLKEMSGEYRPPDGSTLPFTRDRMQPSSHYGQTSRRRSRPLIVNSTKERSLSSSDEDLPSTSECQSYEDMESESYSDRGELGRSLHSAVEPNAHITSGRQLPLQWQSSPDGTYIYRRVVLHRHAGTSLGLKVVGGRSTPTGRLGAFITKVKRGSVADITGRLVPGDEVLEWNGQSLQNASFDEVCNAINQSKFSNRIDLVVARSVVQPSLAQNEYPFSLPGFAPELQTAVMAGSSISLPTIASTIAGGTIGGQTPIVMITAPLSEVLQLKQQQQQLSIPSVGASRSKGQIFGQISISILYIPEARQLMVNLLEAVDLPPRADGTARNPYVKMFLLPDRSEKSRRQSKTMAETCHPVWHQTMLYRDVSEMDIEQKIIEITVWDYDQYSSNDFLGEVLVDLSNVELDGTTAWYTLIDMDEETALRKKLRQTRAHFAASSYSTTGSLTTYCSQEDVRPESNIAHPVMKPSMFATQARRRRYEANYGGRLMHHIRSGYRSDSGLAMQPAAGRPYYEQPQQARGYDSEELEERGFEPEAHRLSGYYSDYGEHQRSSQAYQHQQQQQQQQRTGWRQWQGSETMERRAMIPLELRPSSPTEESGNETSSPSHPNLRHLPRPPSKPITERTEKMPPLNTDRSRPLNRDMDLRRFVDQSLLNRYTSGKTAAAEQRGRLRNRANFISGDYLSDESETSASLPSAHCEQPADQSQKFRDDRLKGFALESFVAPELTDVPSCRDGSPEEEALSAQLDAQENISAHSRSIADDQFNQPEGSEAAFFETSMEGGAYKSAPSNSVDSMTTAEKRKKSLMNRLIPGRSNASQSMNGMCFVVTSDEVGVPPNLSPQTSFDITKQSSRESTDSNESSLVPKVQEQGSIGEFVEGLGPGQVVGRQAIASPCLGEIFLTISERNGNLEVKVVRAKHLARRTGSKFYPSPYVKVYLCNEKSVVAKAKTGLAARTPEPRFDQLLIFTEPYQNRLLQVTVVGDYGRMERKSLIGVAMIKLGHLDLSKSVEGWYKLYQNG
					

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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	37.3	Very low	68.7	Low	247 Å²	247	109.4 Å²	109.4	100%	1.217	60%	0.599	S	S	*	*				0	144.6	0	-71.4	163.6	171.8	0	0	107.6
2	T	45	Very low	70.1	Confident	125 Å²	125	106.8 Å²	106.8	77%	0.767	59%	0.589	S	S	*	*			trans	-70.8	146.9	175.7	35	0	0	0	0	110.8	V4	T2-V4 PolarHBondContact O-N 2.92Å
3	D	53.5	Low	71.2	Confident	126 Å²	126	106.8 Å²	106.8	67%	0.674	58%	0.582	S	S	*	*			trans	-77.8	71.7	179.7	-173.4	25.4	0	0	0	110.3	M5 K27	D3-M5 PolarHBondContact O-N 3.26Å; D3-K27 IonicContact OD2-NZ 3.92Å; D3-K27 PolarHBondContact OD2-NZ 3.2Å
4	V	68.9	Low	72.1	Confident	113 Å²	113	110.4 Å²	110.4	69%	0.685	59%	0.593	S	S	*	*			trans	-75.8	111.6	-179	-179.9	0	0	0	0	108.9	T2	T2-V4 PolarHBondContact O-N 2.92Å
5	M	71.8	Confident	73	Confident	114 Å²	114	109.2 Å²	109.2	56%	0.562	58%	0.582	S	S	*	*			trans	-54.9	133	173.3	-127.6	-174.8	77.4	0	0	109.9	D3 L8	D3-M5 PolarHBondContact O-N 3.26Å; M5-L8 HydrophobicContact CE-CD1 4.37Å
6	P	76.8	Confident	73.8	Confident	71 Å²	71	108.7 Å²	108.7	46%	0.461	57%	0.57	S	S	.	*			trans	-61.7	141.1	174.2	26.6	-34.6	0	0	0	109.9	L8 L23	P6-L8 HydrophobicContact CG-CD2 4.25Å; P6-L8 WeakPolarHBondContact O-CG 3.48Å; P6-L8 PolarHBondContact O-N 3.37Å; P6-L8 VanDerWaalsContact O-N 3.1Å; P6-L23 HydrophobicContact CG-CD1 4.03Å
7	D	79.5	Confident	74.4	Confident	109 Å²	109	106.7 Å²	106.7	58%	0.583	56%	0.557	S	S	*	*			trans	-70.5	109.5	178.7	-180	23.1	0	0	0	111.1	S9 H10	D7-S9 VanDerWaalsContact C-N 3.35Å; D7-S9 WeakPolarHBondContact OD1-CB 3.34Å; D7-S9 PolarHBondContact OD1-N 2.69Å; D7-S9 PolarHBondContact OD1-OG 2.73Å; D7-S9 VanDerWaalsContact OD1-OG 3.13Å; D7-S9 PolarHBondContact OD2-OG 2.92Å; D7-H10 PolarHBondContact O-CE1 3.09Å; D7-H10 PolarHBondContact O-ND1 2.92Å
8	L	81.2	Confident	75	Confident	14 Å²	14	106.6 Å²	106.6	7%	0.073	56%	0.555	C	S	.	*			trans	-91.2	7.9	178.6	-52.8	-177.4	0	0	0	113.1	M5 P6 H10 L11 R16 I19 E20	M5-L8 HydrophobicContact CE-CD1 4.37Å; P6-L8 HydrophobicContact CG-CD2 4.25Å; P6-L8 WeakPolarHBondContact O-CG 3.48Å; P6-L8 PolarHBondContact O-N 3.37Å; P6-L8 VanDerWaalsContact O-N 3.1Å; L8-H10 PolarHBondContact O-N 3.18Å; L8-L11 HydrophobicContact CB-CD1 4.07Å; L8-L11 HydrophobicContact CD2-CD1 3.75Å; L8-L11 HydrophobicContact CG-CD1 4.47Å; L8-L11 PolarHBondContact O-N 3.3Å; L8-L11 VanDerWaalsContact O-N 3.15Å; L8-R16 HydrophobicContact CB-CG 4Å; L8-R16 HydrophobicContact CD1-CG 4.01Å; L8-I19 HydrophobicContact CD1-CB 4.33Å; L8-I19 HydrophobicContact CD1-CG2 3.89Å; L8-I19 HydrophobicContact CD2-CG2 3.75Å; L8-E20 HydrophobicContact CD1-CG 3.69Å
9	S	80	Confident	75.5	Confident	93 Å²	93	103.9 Å²	103.9	65%	0.65	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.3	-23.1	-178.6	69	0	0	0	0	115	D7	D7-S9 VanDerWaalsContact C-N 3.35Å; D7-S9 WeakPolarHBondContact OD1-CB 3.34Å; D7-S9 PolarHBondContact OD1-N 2.69Å; D7-S9 PolarHBondContact OD1-OG 2.73Å; D7-S9 VanDerWaalsContact OD1-OG 3.13Å; D7-S9 PolarHBondContact OD2-OG 2.92Å
10	H	82	Confident	76	Confident	144 Å²	144	101.1 Å²	101.1	67%	0.667	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.8	-1.2	-176.5	66.9	-86.2	0	0	0	114.4	D7 L8	D7-H10 PolarHBondContact O-CE1 3.09Å; D7-H10 PolarHBondContact O-ND1 2.92Å; L8-H10 PolarHBondContact O-N 3.18Å
11	L	79.9	Confident	76.5	Confident	47 Å²	47	103.5 Å²	103.5	25%	0.246	53%	0.528	C	S	.	.	S	Bend	trans	-105.4	156.5	-176.9	-70.6	146	0	0	0	111.1	L8 E15 I19	L8-L11 HydrophobicContact CB-CD1 4.07Å; L8-L11 HydrophobicContact CD2-CD1 3.75Å; L8-L11 HydrophobicContact CG-CD1 4.47Å; L8-L11 PolarHBondContact O-N 3.3Å; L8-L11 VanDerWaalsContact O-N 3.15Å; L11-E15 HydrophobicContact CB-CB 4.15Å; L11-E15 HydrophobicContact CD2-CB 3.97Å; L11-I19 HydrophobicContact CD1-CD1 3.58Å; L11-I19 HydrophobicContact CD2-CD1 3.92Å; L11-I19 HydrophobicContact CG-CD1 4.35Å
12	T	85.3	Confident	78.8	Confident	79 Å²	79	95.3 Å²	95.3	49%	0.485	49%	0.491	S	S	.	.			trans	-67.7	155.4	169.7	62.7	0	0	0	0	110.8	E14 E15 R16	T12-E14 PolarHBondContact O-N 3.34Å; T12-E14 VanDerWaalsContact O-N 3.17Å; T12-E15 WeakPolarHBondContact CB-OE2 3.41Å; T12-E15 WeakPolarHBondContact CG2-OE2 3.36Å; T12-E15 PolarHBondContact N-OE2 3.23Å; T12-E15 PolarHBondContact O-N 3.08Å; T12-E15 VanDerWaalsContact OG1-CD 3.24Å; T12-E15 VanDerWaalsContact OG1-CG 3.27Å; T12-E15 WeakPolarHBondContact OG1-CG 3.32Å; T12-E15 PolarHBondContact OG1-N 3.16Å; T12-E15 PolarHBondContact OG1-OE2 3.41Å; T12-R16 WeakPolarHBondContact O-CB 3.3Å; T12-R16 PolarHBondContact O-N 2.86Å
13	E	84	Confident	80.7	Confident	107 Å²	107	92.1 Å²	92.1	50%	0.5	47%	0.469	S	S	.	.	H	α-helix	trans	-56.3	-33.8	-179.9	-179.9	57	-155	0	0	112.8	Q17	E13-Q17 WeakPolarHBondContact O-CB 3.44Å; E13-Q17 WeakPolarHBondContact O-CG 3.41Å; E13-Q17 PolarHBondContact O-N 3.44Å; E13-Q17 PolarHBondContact OE1-NE2 3.33Å
14	E	84.1	Confident	82.2	Confident	156 Å²	156	92.2 Å²	92.2	73%	0.729	47%	0.466	S	S	*	.	H	α-helix	trans	-68	-47.3	174.5	-62.8	-172.9	171.6	0	0	112.1	T12 R16 Q17 I18	T12-E14 PolarHBondContact O-N 3.34Å; T12-E14 VanDerWaalsContact O-N 3.17Å; E14-R16 VanDerWaalsContact C-N 3.35Å; E14-Q17 PolarHBondContact O-N 3.26Å; E14-I18 WeakPolarHBondContact O-CD1 3.39Å; E14-I18 VanDerWaalsContact O-CG1 3.24Å; E14-I18 WeakPolarHBondContact O-CG1 3.34Å; E14-I18 PolarHBondContact O-N 3.09Å
15	E	86.3	Confident	83	Confident	93 Å²	93	95 Å²	95	44%	0.435	46%	0.464	S	S	.	.	H	α-helix	trans	-63.6	-41.5	176.4	-69.5	165.3	134.3	0	0	111.3	L11 T12 I18 I19	L11-E15 HydrophobicContact CB-CB 4.15Å; L11-E15 HydrophobicContact CD2-CB 3.97Å; T12-E15 WeakPolarHBondContact CB-OE2 3.41Å; T12-E15 WeakPolarHBondContact CG2-OE2 3.36Å; T12-E15 PolarHBondContact N-OE2 3.23Å; T12-E15 PolarHBondContact O-N 3.08Å; T12-E15 VanDerWaalsContact OG1-CD 3.24Å; T12-E15 VanDerWaalsContact OG1-CG 3.27Å; T12-E15 WeakPolarHBondContact OG1-CG 3.32Å; T12-E15 PolarHBondContact OG1-N 3.16Å; T12-E15 PolarHBondContact OG1-OE2 3.41Å; E15-I18 PolarHBondContact O-N 2.73Å; E15-I19 WeakPolarHBondContact O-CB 3.34Å; E15-I19 WeakPolarHBondContact O-CD1 3.24Å; E15-I19 VanDerWaalsContact O-CG1 3.31Å; E15-I19 WeakPolarHBondContact O-CG1 3.38Å; E15-I19 PolarHBondContact O-N 3.36Å
16	R	85.2	Confident	83.6	Confident	101 Å²	101	94 Å²	94	38%	0.381	46%	0.458	S	S	.	.	H	α-helix	trans	-57.7	-52.9	174.4	178.8	-177.3	171.8	-175.7	-3.2	111	L8 T12 E14 I18 I19 E20	L8-R16 HydrophobicContact CB-CG 4Å; L8-R16 HydrophobicContact CD1-CG 4.01Å; T12-R16 WeakPolarHBondContact O-CB 3.3Å; T12-R16 PolarHBondContact O-N 2.86Å; E14-R16 VanDerWaalsContact C-N 3.35Å; R16-I18 VanDerWaalsContact C-N 3.27Å; R16-I18 PolarHBondContact O-N 3.34Å; R16-I19 PolarHBondContact O-N 3.03Å; R16-I19 VanDerWaalsContact O-N 3.13Å; R16-E20 HydrophobicContact CG-CG 4.37Å; R16-E20 IonicContact CZ-OE1 3.73Å; R16-E20 VanDerWaalsContact CZ-OE1 3.24Å; R16-E20 IonicContact NE-OE1 2.68Å; R16-E20 PolarHBondContact NE-OE1 3.34Å; R16-E20 IonicContact NH2-OE1 3.74Å; R16-E20 PolarHBondContact NH2-OE1 2.66Å; R16-E20 WeakPolarHBondContact O-CG 3.48Å; R16-E20 PolarHBondContact O-N 2.78Å
17	Q	84.7	Confident	84	Confident	75 Å²	75	96.4 Å²	96.4	35%	0.35	46%	0.461	S	S	.	.	H	α-helix	trans	-63.4	-32	178.2	-74.8	-174.3	31.2	0	0	113	E13 E14 R21	E13-Q17 WeakPolarHBondContact O-CB 3.44Å; E13-Q17 WeakPolarHBondContact O-CG 3.41Å; E13-Q17 PolarHBondContact O-N 3.44Å; E13-Q17 PolarHBondContact OE1-NE2 3.33Å; E14-Q17 PolarHBondContact O-N 3.26Å; Q17-R21 WeakPolarHBondContact O-CB 3.46Å; Q17-R21 WeakPolarHBondContact O-CG 3.29Å; Q17-R21 PolarHBondContact O-N 3.3Å; Q17-R21 VanDerWaalsContact O-N 3.12Å
18	I	84.5	Confident	84.3	Confident	104 Å²	104	95.2 Å²	95.2	53%	0.533	46%	0.457	S	S	.	.	H	α-helix	trans	-65.4	-46.7	172.7	-70.9	163.5	0	0	0	110.1	E14 E15 R16 R21 V22	E14-I18 WeakPolarHBondContact O-CD1 3.39Å; E14-I18 VanDerWaalsContact O-CG1 3.24Å; E14-I18 WeakPolarHBondContact O-CG1 3.34Å; E14-I18 PolarHBondContact O-N 3.09Å; E15-I18 PolarHBondContact O-N 2.73Å; R16-I18 VanDerWaalsContact C-N 3.27Å; R16-I18 PolarHBondContact O-N 3.34Å; I18-R21 PolarHBondContact O-N 3.02Å; I18-V22 WeakPolarHBondContact O-CG2 3.38Å; I18-V22 PolarHBondContact O-N 3.17Å
19	I	83.8	Confident	84.4	Confident	56 Å²	56	99.1 Å²	99.1	29%	0.287	48%	0.475	S	S	.	.	H	α-helix	trans	-68.8	-42.4	-178.9	-69.4	161.4	0	0	0	111.3	L8 L11 E15 R16 R21 V22 L23	L8-I19 HydrophobicContact CD1-CB 4.33Å; L8-I19 HydrophobicContact CD1-CG2 3.89Å; L8-I19 HydrophobicContact CD2-CG2 3.75Å; L11-I19 HydrophobicContact CD1-CD1 3.58Å; L11-I19 HydrophobicContact CD2-CD1 3.92Å; L11-I19 HydrophobicContact CG-CD1 4.35Å; E15-I19 WeakPolarHBondContact O-CB 3.34Å; E15-I19 WeakPolarHBondContact O-CD1 3.24Å; E15-I19 VanDerWaalsContact O-CG1 3.31Å; E15-I19 WeakPolarHBondContact O-CG1 3.38Å; E15-I19 PolarHBondContact O-N 3.36Å; R16-I19 PolarHBondContact O-N 3.03Å; R16-I19 VanDerWaalsContact O-N 3.13Å; I19-R21 VanDerWaalsContact C-N 3.34Å; I19-R21 PolarHBondContact O-N 3.42Å; I19-V22 PolarHBondContact O-N 2.56Å; I19-V22 VanDerWaalsContact O-N 3.13Å; I19-L23 HydrophobicContact CG2-CD1 3.85Å; I19-L23 HydrophobicContact CG2-CG 4.32Å; I19-L23 WeakPolarHBondContact O-CB 3.34Å; I19-L23 WeakPolarHBondContact O-CG 3.45Å; I19-L23 PolarHBondContact O-N 3.43Å
20	E	86.7	Confident	84.5	Confident	47 Å²	47	99.1 Å²	99.1	22%	0.22	47%	0.465	C	S	.	.	H	α-helix	trans	-59.5	-42.1	173.6	-73.3	-177.2	179.8	0	0	111.8	L8 R16 V22 L23 Q24	L8-E20 HydrophobicContact CD1-CG 3.69Å; R16-E20 HydrophobicContact CG-CG 4.37Å; R16-E20 IonicContact CZ-OE1 3.73Å; R16-E20 VanDerWaalsContact CZ-OE1 3.24Å; R16-E20 IonicContact NE-OE1 2.68Å; R16-E20 PolarHBondContact NE-OE1 3.34Å; R16-E20 IonicContact NH2-OE1 3.74Å; R16-E20 PolarHBondContact NH2-OE1 2.66Å; R16-E20 WeakPolarHBondContact O-CG 3.48Å; R16-E20 PolarHBondContact O-N 2.78Å; E20-V22 PolarHBondContact O-N 3.28Å; E20-L23 PolarHBondContact O-N 3Å; E20-Q24 WeakPolarHBondContact O-CB 3.35Å; E20-Q24 VanDerWaalsContact O-CG 3.25Å; E20-Q24 WeakPolarHBondContact O-CG 3.44Å; E20-Q24 PolarHBondContact O-N 2.96Å
21	R	85.9	Confident	84.5	Confident	153 Å²	153	95 Å²	95	58%	0.577	45%	0.453	S	S	*	.	H	α-helix	trans	-67.1	-32.9	174.5	-71.3	174.3	-155.8	169.4	11.8	113	Q17 I18 I19 R25	Q17-R21 WeakPolarHBondContact O-CB 3.46Å; Q17-R21 WeakPolarHBondContact O-CG 3.29Å; Q17-R21 PolarHBondContact O-N 3.3Å; Q17-R21 VanDerWaalsContact O-N 3.12Å; I18-R21 PolarHBondContact O-N 3.02Å; I19-R21 VanDerWaalsContact C-N 3.34Å; I19-R21 PolarHBondContact O-N 3.42Å; R21-R25 VanDerWaalsContact O-CB 3.25Å; R21-R25 WeakPolarHBondContact O-CB 3.37Å; R21-R25 PolarHBondContact O-N 3.18Å; R21-R25 VanDerWaalsContact O-N 3.09Å
22	V	86.6	Confident	84.6	Confident	74 Å²	74	98.2 Å²	98.2	45%	0.448	47%	0.466	S	S	.	.	H	α-helix	trans	-70.3	-45.1	174.6	169	0	0	0	0	110.6	I18 I19 E20 R25 Q26	I18-V22 WeakPolarHBondContact O-CG2 3.38Å; I18-V22 PolarHBondContact O-N 3.17Å; I19-V22 PolarHBondContact O-N 2.56Å; I19-V22 VanDerWaalsContact O-N 3.13Å; E20-V22 PolarHBondContact O-N 3.28Å; V22-R25 WeakPolarHBondContact O-CB 3.32Å; V22-R25 PolarHBondContact O-N 3.5Å; V22-Q26 WeakPolarHBondContact O-CG 3.26Å; V22-Q26 PolarHBondContact O-N 3.11Å
23	L	85	Confident	84.4	Confident	59 Å²	59	97.6 Å²	97.6	31%	0.309	46%	0.458	S	S	.	.	H	α-helix	trans	-61.6	-47.7	175.8	-73.2	167.3	0	0	0	111.8	P6 I19 E20 R25 Q26 K27	P6-L23 HydrophobicContact CG-CD1 4.03Å; I19-L23 HydrophobicContact CG2-CD1 3.85Å; I19-L23 HydrophobicContact CG2-CG 4.32Å; I19-L23 WeakPolarHBondContact O-CB 3.34Å; I19-L23 WeakPolarHBondContact O-CG 3.45Å; I19-L23 PolarHBondContact O-N 3.43Å; E20-L23 PolarHBondContact O-N 3Å; L23-R25 VanDerWaalsContact C-N 3.26Å; L23-R25 PolarHBondContact O-N 3.18Å; L23-Q26 PolarHBondContact O-N 3.21Å; L23-K27 WeakPolarHBondContact O-CB 3.44Å; L23-K27 PolarHBondContact O-N 2.99Å
24	Q	83.7	Confident	84.1	Confident	128 Å²	128	98.7 Å²	98.7	60%	0.598	46%	0.463	S	S	*	.	H	α-helix	trans	-56.6	-41.5	173.6	-76	174.4	4.9	0	0	111.6	E20 K27 V28	E20-Q24 WeakPolarHBondContact O-CB 3.35Å; E20-Q24 VanDerWaalsContact O-CG 3.25Å; E20-Q24 WeakPolarHBondContact O-CG 3.44Å; E20-Q24 PolarHBondContact O-N 2.96Å; Q24-K27 PolarHBondContact O-N 2.9Å; Q24-V28 WeakPolarHBondContact O-CG2 3.34Å; Q24-V28 PolarHBondContact O-N 2.74Å
25	R	85.2	Confident	83.9	Confident	170 Å²	170	97.5 Å²	97.5	64%	0.642	46%	0.457	S	S	*	.	H	α-helix	trans	-68.6	-42.4	178.6	-174.1	176.7	-173.4	134.5	13.2	112.6	R21 V22 L23 V28 E29	R21-R25 VanDerWaalsContact O-CB 3.25Å; R21-R25 WeakPolarHBondContact O-CB 3.37Å; R21-R25 PolarHBondContact O-N 3.18Å; R21-R25 VanDerWaalsContact O-N 3.09Å; V22-R25 WeakPolarHBondContact O-CB 3.32Å; V22-R25 PolarHBondContact O-N 3.5Å; L23-R25 VanDerWaalsContact C-N 3.26Å; L23-R25 PolarHBondContact O-N 3.18Å; R25-V28 PolarHBondContact O-N 2.93Å; R25-E29 HydrophobicContact CG-CG 4.48Å; R25-E29 WeakPolarHBondContact CG-OE1 3.2Å; R25-E29 IonicContact CZ-OE1 3.87Å; R25-E29 IonicContact NE-OE1 3.4Å; R25-E29 PolarHBondContact NE-OE1 3.18Å; R25-E29 IonicContact NH2-OE1 2.74Å; R25-E29 WeakPolarHBondContact O-CB 3.48Å; R25-E29 WeakPolarHBondContact O-CG 3.5Å; R25-E29 PolarHBondContact O-N 3.45Å
26	Q	84.6	Confident	83.4	Confident	93 Å²	93	98.2 Å²	98.2	44%	0.435	46%	0.463	S	S	.	.	H	α-helix	trans	-59.6	-48	172.9	-74.7	-177.2	-100.9	0	0	110.5	V22 L23 V28 E29 E30	V22-Q26 WeakPolarHBondContact O-CG 3.26Å; V22-Q26 PolarHBondContact O-N 3.11Å; L23-Q26 PolarHBondContact O-N 3.21Å; Q26-V28 VanDerWaalsContact C-N 3.29Å; Q26-V28 PolarHBondContact O-N 3.49Å; Q26-E29 CarbonylContact O-C 3.57Å; Q26-E29 PolarHBondContact O-N 3.24Å; Q26-E29 VanDerWaalsContact O-N 3.08Å; Q26-E30 WeakPolarHBondContact O-CB 3.34Å; Q26-E30 WeakPolarHBondContact O-CG 3.23Å; Q26-E30 PolarHBondContact O-N 3.42Å
27	K	86.2	Confident	83	Confident	123 Å²	123	95.4 Å²	95.4	54%	0.535	45%	0.454	S	S	.	.	H	α-helix	trans	-60.2	-35	178.7	-167.5	161.1	-177.3	167.7	0	113.3	D3 L23 Q24 S31	D3-K27 IonicContact OD2-NZ 3.92Å; D3-K27 PolarHBondContact OD2-NZ 3.2Å; L23-K27 WeakPolarHBondContact O-CB 3.44Å; L23-K27 PolarHBondContact O-N 2.99Å; Q24-K27 PolarHBondContact O-N 2.9Å; K27-S31 WeakPolarHBondContact O-CB 3.44Å; K27-S31 PolarHBondContact O-N 3.06Å
28	V	85.1	Confident	82.5	Confident	83 Å²	83	96.4 Å²	96.4	50%	0.503	46%	0.459	S	S	.	.	H	α-helix	trans	-72.1	-42.2	172.3	169.9	0	0	0	0	112.4	Q24 R25 Q26 Q32	Q24-V28 WeakPolarHBondContact O-CG2 3.34Å; Q24-V28 PolarHBondContact O-N 2.74Å; R25-V28 PolarHBondContact O-N 2.93Å; Q26-V28 VanDerWaalsContact C-N 3.29Å; Q26-V28 PolarHBondContact O-N 3.49Å; V28-Q32 WeakPolarHBondContact O-CG 3.45Å; V28-Q32 PolarHBondContact O-N 3.23Å; V28-Q32 VanDerWaalsContact O-N 3.11Å
29	E	83	Confident	81.8	Confident	96 Å²	96	97.5 Å²	97.5	45%	0.449	46%	0.46	S	S	.	.	H	α-helix	trans	-68.3	-36.6	178.2	-70.7	178.7	-162.9	0	0	111.1	R25 Q26 E33	R25-E29 HydrophobicContact CG-CG 4.48Å; R25-E29 WeakPolarHBondContact CG-OE1 3.2Å; R25-E29 IonicContact CZ-OE1 3.87Å; R25-E29 IonicContact NE-OE1 3.4Å; R25-E29 PolarHBondContact NE-OE1 3.18Å; R25-E29 IonicContact NH2-OE1 2.74Å; R25-E29 WeakPolarHBondContact O-CB 3.48Å; R25-E29 WeakPolarHBondContact O-CG 3.5Å; R25-E29 PolarHBondContact O-N 3.45Å; Q26-E29 CarbonylContact O-C 3.57Å; Q26-E29 PolarHBondContact O-N 3.24Å; Q26-E29 VanDerWaalsContact O-N 3.08Å; E29-E33 PolarHBondContact O-N 2.92Å
30	E	82.7	Confident	81.1	Confident	94 Å²	94	100.8 Å²	100.8	44%	0.439	47%	0.474	S	S	.	.	H	α-helix	trans	-70.3	-41.8	173.6	-73.5	168.9	-173.6	0	0	112.8	Q26 Q32 E33 Q34	Q26-E30 WeakPolarHBondContact O-CB 3.34Å; Q26-E30 WeakPolarHBondContact O-CG 3.23Å; Q26-E30 PolarHBondContact O-N 3.42Å; E30-Q32 VanDerWaalsContact C-N 3.28Å; E30-Q32 PolarHBondContact O-N 2.83Å; E30-E33 PolarHBondContact O-N 3.18Å; E30-E33 VanDerWaalsContact O-N 3.14Å; E30-Q34 WeakPolarHBondContact O-CG 3.38Å; E30-Q34 PolarHBondContact O-N 2.95Å
31	S	81.9	Confident	80.2	Confident	58 Å²	58	103.2 Å²	103.2	41%	0.406	49%	0.485	S	S	.	.	H	α-helix	trans	-60.8	-38.5	174	-172.5	0	0	0	0	111.5	K27 Q34 E35	K27-S31 WeakPolarHBondContact O-CB 3.44Å; K27-S31 PolarHBondContact O-N 3.06Å; S31-Q34 PolarHBondContact O-N 2.78Å; S31-E35 WeakPolarHBondContact O-CG 3.43Å; S31-E35 PolarHBondContact O-N 3.04Å
32	Q	82.2	Confident	79.4	Confident	113 Å²	113	102.1 Å²	102.1	53%	0.528	49%	0.485	S	S	.	.	H	α-helix	trans	-70.3	-33.8	174.4	-72.5	176.9	24.5	0	0	112.4	V28 E30 L36	V28-Q32 WeakPolarHBondContact O-CG 3.45Å; V28-Q32 PolarHBondContact O-N 3.23Å; V28-Q32 VanDerWaalsContact O-N 3.11Å; E30-Q32 VanDerWaalsContact C-N 3.28Å; E30-Q32 PolarHBondContact O-N 2.83Å; Q32-L36 WeakPolarHBondContact O-CD1 3.33Å; Q32-L36 WeakPolarHBondContact O-CG 3.17Å; Q32-L36 PolarHBondContact O-N 3.14Å; Q32-L36 VanDerWaalsContact O-N 3.17Å
33	E	81.2	Confident	77.7	Confident	66 Å²	66	103 Å²	103	31%	0.308	48%	0.483	S	S	.	.	H	α-helix	trans	-66.7	-42	170.9	-153.8	-176.2	124.6	0	0	110.7	E29 E30 L36 K37 T1215	E29-E33 PolarHBondContact O-N 2.92Å; E30-E33 PolarHBondContact O-N 3.18Å; E30-E33 VanDerWaalsContact O-N 3.14Å; E33-L36 PolarHBondContact O-N 2.87Å; E33-K37 VanDerWaalsContact O-CG 3.24Å; E33-K37 WeakPolarHBondContact O-CG 3.43Å; E33-K37 PolarHBondContact O-N 3.37Å; E33-K37 WeakPolarHBondContact OE1-CE 3.38Å; E33-K37 IonicContact OE1-NZ 3.83Å; E33-K37 PolarHBondContact OE1-NZ 3.18Å; E33-T1215 WeakPolarHBondContact OE1-CB 3.31Å; E33-T1215 PolarHBondContact OE1-OG1 3.34Å
34	Q	78.2	Confident	76.4	Confident	131 Å²	131	102.9 Å²	102.9	61%	0.612	49%	0.49	S	S	*	.	H	α-helix	trans	-64.1	-41.4	176.4	-72.8	-176.9	5.2	0	0	113.3	E30 S31 L36 K37 H38	E30-Q34 WeakPolarHBondContact O-CG 3.38Å; E30-Q34 PolarHBondContact O-N 2.95Å; S31-Q34 PolarHBondContact O-N 2.78Å; Q34-L36 VanDerWaalsContact C-N 3.32Å; Q34-L36 PolarHBondContact O-N 3.06Å; Q34-K37 PolarHBondContact O-N 3.31Å; Q34-H38 WeakPolarHBondContact O-CB 3.36Å; Q34-H38 PolarHBondContact O-N 3.15Å
35	E	79.6	Confident	74.8	Confident	131 Å²	131	103.3 Å²	103.3	61%	0.612	49%	0.494	S	S	*	.	H	α-helix	trans	-59.5	-42.6	172.7	-77.5	-177	165.9	0	0	111.7	S31 F39	S31-E35 WeakPolarHBondContact O-CG 3.43Å; S31-E35 PolarHBondContact O-N 3.04Å; E35-F39 VanDerWaalsContact O-CB 3.31Å; E35-F39 WeakPolarHBondContact O-CB 3.3Å; E35-F39 PolarHBondContact O-N 3.34Å
36	L	76	Confident	73.1	Confident	107 Å²	107	99.3 Å²	99.3	56%	0.56	49%	0.492	S	S	*	.	H	α-helix	trans	-65.1	-45.7	175.3	-74.3	166.6	0	0	0	111.8	Q32 E33 Q34 H38 F39 E40	Q32-L36 WeakPolarHBondContact O-CD1 3.33Å; Q32-L36 WeakPolarHBondContact O-CG 3.17Å; Q32-L36 PolarHBondContact O-N 3.14Å; Q32-L36 VanDerWaalsContact O-N 3.17Å; E33-L36 PolarHBondContact O-N 2.87Å; Q34-L36 VanDerWaalsContact C-N 3.32Å; Q34-L36 PolarHBondContact O-N 3.06Å; L36-H38 PolarHBondContact O-N 3.18Å; L36-F39 PolarHBondContact O-N 2.83Å; L36-E40 WeakPolarHBondContact O-CB 3.29Å; L36-E40 WeakPolarHBondContact O-CG 3.47Å; L36-E40 PolarHBondContact O-N 3.05Å
37	K	75.3	Confident	71.2	Confident	42 Å²	42	99.7 Å²	99.7	18%	0.183	50%	0.5	C	S	.	.	H	α-helix	trans	-56.2	-50	175.6	-72.3	175.9	-170.9	-166.2	0	111.5	E33 Q34 F39 E40 Q41 M1214 T1215	E33-K37 VanDerWaalsContact O-CG 3.24Å; E33-K37 WeakPolarHBondContact O-CG 3.43Å; E33-K37 PolarHBondContact O-N 3.37Å; E33-K37 WeakPolarHBondContact OE1-CE 3.38Å; E33-K37 IonicContact OE1-NZ 3.83Å; E33-K37 PolarHBondContact OE1-NZ 3.18Å; Q34-K37 PolarHBondContact O-N 3.31Å; K37-F39 PolarHBondContact O-N 2.84Å; K37-E40 PolarHBondContact O-N 3.01Å; K37-Q41 WeakPolarHBondContact O-CB 3.15Å; K37-Q41 PolarHBondContact O-N 2.97Å; K37-M1214 HydrophobicContact CB-CE 4Å; K37-M1214 HydrophobicContact CB-SD 3.59Å; K37-M1214 VanDerWaalsContact CB-SD 3.59Å; K37-M1214 HydrophobicContact CD-CB 3.74Å; K37-M1214 HydrophobicContact CD-CG 4.26Å; K37-M1214 HydrophobicContact CD-SD 3.95Å; K37-M1214 HydrophobicContact CG-CB 4.19Å; K37-M1214 HydrophobicContact CG-CE 4Å; K37-M1214 HydrophobicContact CG-CG 4.15Å; K37-M1214 HydrophobicContact CG-SD 3.51Å; K37-M1214 VanDerWaalsContact CG-SD 3.51Å; K37-M1214 PolarHBondContact NZ-O 2.86Å; K37-T1215 WeakPolarHBondContact CE-OG1 3.34Å; K37-T1215 PolarHBondContact NZ-O 2.97Å; K37-T1215 PolarHBondContact NZ-OG1 2.97Å
38	H	75.2	Confident	69.2	Low	97 Å²	97	99.5 Å²	99.5	45%	0.449	51%	0.509	S	S	.	.	H	α-helix	trans	-67.8	-33.8	-179.5	174.8	-139.1	0	0	0	112.5	Q34 L36 K42	Q34-H38 WeakPolarHBondContact O-CB 3.36Å; Q34-H38 PolarHBondContact O-N 3.15Å; L36-H38 PolarHBondContact O-N 3.18Å; H38-K42 WeakPolarHBondContact NE2-CE 3.4Å; H38-K42 PolarHBondContact NE2-NZ 3.06Å; H38-K42 WeakPolarHBondContact O-CB 3.1Å; H38-K42 PolarHBondContact O-N 2.87Å
39	F	68.9	Low	67.1	Low	126 Å²	126	100.6 Å²	100.6	55%	0.553	52%	0.516	S	S	*	.	H	α-helix	trans	-68.6	-43.5	172.1	-169.8	-88.9	0	0	0	111.9	E35 L36 K37 F43	E35-F39 VanDerWaalsContact O-CB 3.31Å; E35-F39 WeakPolarHBondContact O-CB 3.3Å; E35-F39 PolarHBondContact O-N 3.34Å; L36-F39 PolarHBondContact O-N 2.83Å; K37-F39 PolarHBondContact O-N 2.84Å; F39-F43 WeakPolarHBondContact O-CB 3.22Å; F39-F43 PolarHBondContact O-N 3.11Å
40	E	70.4	Confident	64.7	Low	125 Å²	125	101.9 Å²	101.9	58%	0.584	53%	0.533	S	S	*	.	H	α-helix	trans	-63.8	-39.3	173.9	-73.8	-175.5	164.9	0	0	111.8	L36 K37 F43 A44 M1214	L36-E40 WeakPolarHBondContact O-CB 3.29Å; L36-E40 WeakPolarHBondContact O-CG 3.47Å; L36-E40 PolarHBondContact O-N 3.05Å; K37-E40 PolarHBondContact O-N 3.01Å; E40-F43 PolarHBondContact O-N 3.05Å; E40-A44 WeakPolarHBondContact O-CB 3.29Å; E40-A44 PolarHBondContact O-N 2.87Å; E40-M1214 HydrophobicContact CB-CE 4.42Å
41	Q	67.2	Low	62.5	Low	99 Å²	99	102.7 Å²	102.7	46%	0.463	55%	0.547	S	S	.	.	H	α-helix	trans	-67.6	-45.3	177.3	-167	175.1	25.9	0	0	112	K37 F43 A44 M45	K37-Q41 WeakPolarHBondContact O-CB 3.15Å; K37-Q41 PolarHBondContact O-N 2.97Å; Q41-F43 VanDerWaalsContact C-N 3.27Å; Q41-F43 PolarHBondContact O-N 2.77Å; Q41-A44 PolarHBondContact O-N 2.73Å; Q41-M45 HydrophobicContact CG-SD 4.44Å; Q41-M45 WeakPolarHBondContact O-CG 3.49Å; Q41-M45 PolarHBondContact O-N 2.83Å
42	K	68.4	Low	60.1	Low	130 Å²	130	108.1 Å²	108.1	57%	0.565	57%	0.569	S	S	*	*	H	α-helix	trans	-60.4	-37.3	172.2	-82.4	-176.6	166.8	172.3	0	112.3	H38 S46	H38-K42 WeakPolarHBondContact NE2-CE 3.4Å; H38-K42 PolarHBondContact NE2-NZ 3.06Å; H38-K42 WeakPolarHBondContact O-CB 3.1Å; H38-K42 PolarHBondContact O-N 2.87Å; K42-S46 PolarHBondContact O-N 3.19Å
43	F	52	Low	57.9	Low	92 Å²	92	112.1 Å²	112.1	40%	0.404	59%	0.585	S	S	.	*	H	α-helix	trans	-70.5	-34.4	176.1	-166.6	-98.2	0	0	0	112.9	F39 E40 Q41 V47 F68	F39-F43 WeakPolarHBondContact O-CB 3.22Å; F39-F43 PolarHBondContact O-N 3.11Å; E40-F43 PolarHBondContact O-N 3.05Å; Q41-F43 VanDerWaalsContact C-N 3.27Å; Q41-F43 PolarHBondContact O-N 2.77Å; F43-V47 HydrophobicContact CE1-CG2 4.32Å; F43-V47 HydrophobicContact CZ-CG2 4.34Å; F43-V47 WeakPolarHBondContact O-CG2 3.31Å; F43-F68 HydrophobicContact CD2-CE2 4.33Å; F43-F68 HydrophobicContact CE1-CE2 4.09Å; F43-F68 AromaticContact CE1-CZ 3.94Å; F43-F68 HydrophobicContact CE1-CZ 3.94Å; F43-F68 HydrophobicContact CE2-CD2 4.07Å; F43-F68 AromaticContact CE2-CE2 3.36Å; F43-F68 HydrophobicContact CE2-CE2 3.36Å; F43-F68 HydrophobicContact CE2-CZ 4.01Å; F43-F68 HydrophobicContact CZ-CD2 4.18Å; F43-F68 HydrophobicContact CZ-CE1 4.39Å; F43-F68 AromaticContact CZ-CE2 3.21Å; F43-F68 HydrophobicContact CZ-CE2 3.21Å; F43-F68 AromaticContact CZ-CZ 3.34Å; F43-F68 HydrophobicContact CZ-CZ 3.34Å
44	A	57.5	Low	55.5	Low	56 Å²	56	116.5 Å²	116.5	46%	0.463	61%	0.61	S	S	.	*	H	α-helix	trans	-67	-44.9	172.4	0	0	0	0	0	111.6	E40 Q41 S46 V47	E40-A44 WeakPolarHBondContact O-CB 3.29Å; E40-A44 PolarHBondContact O-N 2.87Å; Q41-A44 PolarHBondContact O-N 2.73Å; A44-S46 PolarHBondContact O-N 2.79Å; A44-V47 PolarHBondContact O-N 2.98Å
45	M	49.8	Very low	53.6	Low	138 Å²	138	118.2 Å²	118.2	68%	0.68	62%	0.622	S	S	*	*	H	α-helix	trans	-64.2	-36	-178.6	-69.9	179.2	77.9	0	0	113.1	Q41 V47 V48	Q41-M45 HydrophobicContact CG-SD 4.44Å; Q41-M45 WeakPolarHBondContact O-CG 3.49Å; Q41-M45 PolarHBondContact O-N 2.83Å; M45-V47 PolarHBondContact O-N 3.45Å; M45-V48 PolarHBondContact O-N 2.98Å
46	S	49.1	Very low	51.2	Low	86 Å²	86	119.7 Å²	119.7	60%	0.601	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.8	4.7	178.8	85.5	0	0	0	0	114.8	K42 A44	K42-S46 PolarHBondContact O-N 3.19Å; A44-S46 PolarHBondContact O-N 2.79Å
47	V	46.1	Very low	49	Very low	100 Å²	100	117.6 Å²	117.6	61%	0.606	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.4	-9.4	178.4	176.8	0	0	0	0	111.5	F43 A44 M45	F43-V47 HydrophobicContact CE1-CG2 4.32Å; F43-V47 HydrophobicContact CZ-CG2 4.34Å; F43-V47 WeakPolarHBondContact O-CG2 3.31Å; A44-V47 PolarHBondContact O-N 2.98Å; M45-V47 PolarHBondContact O-N 3.45Å
48	V	43.8	Very low	47.1	Very low	119 Å²	119	123.9 Å²	123.9	72%	0.721	67%	0.672	S	S	*	*			trans	-105.2	66.5	179	-171.2	0	0	0	0	110.5	M45	M45-V48 PolarHBondContact O-N 2.98Å
49	T	40.3	Very low	45	Very low	107 Å²	107	128.3 Å²	128.3	66%	0.656	69%	0.693	S	S	*	*			trans	-128.4	107.9	165.9	-49.5	0	0	0	0	108.6	C51	T49-C51 PolarHBondContact O-N 2.86Å
50	P	33.7	Very low	43.1	Very low	123 Å²	123	125.8 Å²	125.8	80%	0.799	70%	0.702	S	S	*	*			trans	-85.6	92.3	-171.2	32.7	-34	0	0	0	112	M52	P50-M52 PolarHBondContact O-N 3.08Å
51	C	35.4	Very low	41.2	Very low	110 Å²	110	128.9 Å²	128.9	74%	0.743	72%	0.717	S	S	*	*			trans	-87.2	85.8	172.6	-61.7	0	0	0	0	111.3	T49 F53	T49-C51 PolarHBondContact O-N 2.86Å; C51-F53 PolarHBondContact O-N 3.16Å
52	M	31.5	Very low	39.6	Very low	173 Å²	173	134.5 Å²	134.5	85%	0.852	74%	0.74	S	S	*	*			trans	-70	107.6	152.2	-81.7	173.4	52.4	0	0	108.4	P50	P50-M52 PolarHBondContact O-N 3.08Å
53	F	35.7	Very low	37.7	Very low	197 Å²	197	133.1 Å²	133.1	86%	0.864	75%	0.747	S	S	*	*			trans	-155.7	118.8	155.1	-79.9	-64.6	0	0	0	109	C51	C51-F53 PolarHBondContact O-N 3.16Å
54	D	30.9	Very low	36.7	Very low	158 Å²	158	134.1 Å²	134.1	85%	0.845	77%	0.765	S	S	*	*			trans	-72.1	144.6	156.8	-61.5	-75.9	0	0	0	109
55	I	39.3	Very low	35.4	Very low	166 Å²	166	141.7 Å²	141.7	85%	0.851	79%	0.788	S	S	*	*			trans	-175.2	136.8	150.5	-101.2	153.4	0	0	0	108.4
56	D	29.3	Very low	34.5	Very low	162 Å²	162	140.1 Å²	140.1	87%	0.866	79%	0.789	S	S	*	*			trans	-75.6	145.3	177.3	-79.9	-68.7	0	0	0	113.1
57	G	28.6	Very low	33.7	Very low	64 Å²	64	140.7 Å²	140.7	66%	0.66	79%	0.793	S	S	*	*			trans	75.5	115.8	154	0	0	0	0	0	117.8
58	I	36	Very low	33.4	Very low	174 Å²	174	143.6 Å²	143.6	89%	0.892	80%	0.798	S	S	*	*				-167.6	149.8	118.4	-100	154.1	0	0	0	109.8
59	Q	30.7	Very low	33.5	Very low	190 Å²	190	142 Å²	142	89%	0.888	79%	0.792	S	S	*	*			trans	-84.9	140.7	-175.8	-61.7	175.1	-2.4	0	0	112.3
60	G	28.8	Very low	33.6	Very low	72 Å²	72	138.1 Å²	138.1	74%	0.742	77%	0.774	S	S	*	*			trans	90.8	72.8	140.4	0	0	0	0	0	119.5
61	Q	31.3	Very low	34.3	Very low	190 Å²	190	140.1 Å²	140.1	89%	0.888	77%	0.767	S	S	*	*			trans	-124.2	104.8	146.7	-73.9	-160.6	-2.5	0	0	111.9
62	K	32.5	Very low	35.6	Very low	217 Å²	217	138.1 Å²	138.1	94%	0.943	75%	0.753	S	S	*	*			trans	-96.9	61.1	177	-74.1	-174.8	176.6	176	0	112.6
63	S	30.3	Very low	37.5	Very low	102 Å²	102	134 Å²	134	71%	0.713	73%	0.731	S	S	*	*	S	Bend	trans	-167.1	96.7	169.1	50	0	0	0	0	114.5
64	S	31.1	Very low	39.5	Very low	113 Å²	113	133 Å²	133	79%	0.79	72%	0.721	S	S	*	*	S	Bend	trans	174.4	-28.4	157.4	51.6	0	0	0	0	113.1	C66	S64-C66 PolarHBondContact O-N 3.01Å
65	F	30.2	Very low	41.9	Very low	214 Å²	214	132.2 Å²	132.2	94%	0.939	71%	0.711	S	S	*	*			trans	-74.5	47	-168	-148.7	-93.2	0	0	0	115.3
66	C	29.1	Very low	44.1	Very low	106 Å²	106	127.2 Å²	127.2	72%	0.716	68%	0.681	S	S	*	*			trans	-148.8	72.1	176.4	-162	0	0	0	0	112.8	S64	S64-C66 PolarHBondContact O-N 3.01Å
67	S	34.1	Very low	46.7	Very low	98 Å²	98	121.7 Å²	121.7	69%	0.685	65%	0.651	S	S	*	*	S	Bend	trans	-134.1	-31.6	170.3	-68.7	0	0	0	0	113.5	S69 G70	S67-S69 PolarHBondContact O-N 2.8Å; S67-G70 PolarHBondContact O-N 2.89Å
68	F	38.2	Very low	49.6	Very low	161 Å²	161	124.7 Å²	124.7	71%	0.706	65%	0.646	S	S	*	*	H	α-helix	trans	-72.2	-28.4	-169.9	-164	-123.2	0	0	0	114.7	F43	F43-F68 HydrophobicContact CD2-CE2 4.33Å; F43-F68 HydrophobicContact CE1-CE2 4.09Å; F43-F68 AromaticContact CE1-CZ 3.94Å; F43-F68 HydrophobicContact CE1-CZ 3.94Å; F43-F68 HydrophobicContact CE2-CD2 4.07Å; F43-F68 AromaticContact CE2-CE2 3.36Å; F43-F68 HydrophobicContact CE2-CE2 3.36Å; F43-F68 HydrophobicContact CE2-CZ 4.01Å; F43-F68 HydrophobicContact CZ-CD2 4.18Å; F43-F68 HydrophobicContact CZ-CE1 4.39Å; F43-F68 AromaticContact CZ-CE2 3.21Å; F43-F68 HydrophobicContact CZ-CE2 3.21Å; F43-F68 AromaticContact CZ-CZ 3.34Å; F43-F68 HydrophobicContact CZ-CZ 3.34Å
69	S	46.1	Very low	52.2	Low	84 Å²	84	119.9 Å²	119.9	59%	0.587	62%	0.619	S	S	*	*	H	α-helix	trans	-72.1	-26.1	177.6	54.7	0	0	0	0	113.8	S67 Y71 F73	S67-S69 PolarHBondContact O-N 2.8Å; S69-Y71 PolarHBondContact O-N 3.06Å; S69-F73 PolarHBondContact O-N 2.8Å
70	G	43.8	Very low	55	Low	27 Å²	27	111.3 Å²	111.3	28%	0.278	58%	0.58	S	S	.	*	H	α-helix	trans	-67.4	-36.3	-168.8	0	0	0	0	0	114.9	S67 R74	S67-G70 PolarHBondContact O-N 2.89Å; G70-R74 WeakPolarHBondContact O-CB 3.43Å; G70-R74 VanDerWaalsContact O-CG 3.27Å; G70-R74 WeakPolarHBondContact O-CG 3.15Å; G70-R74 PolarHBondContact O-N 3.12Å
71	Y	47.5	Very low	58	Low	165 Å²	165	114.4 Å²	114.4	65%	0.647	57%	0.569	S	S	*	*	H	α-helix	trans	-68.2	-45.2	-175.3	-96.4	-89.1	0	0	0	113.1	S69 K75	S69-Y71 PolarHBondContact O-N 3.06Å; Y71-K75 PolarHBondContact O-N 3.41Å
72	S	62.4	Low	60.9	Low	67 Å²	67	109 Å²	109	47%	0.469	55%	0.546	S	S	.	.	H	α-helix	trans	-66.2	-40.5	178.1	-166.1	0	0	0	0	111.3	K75 Y76	S72-K75 PolarHBondContact O-N 3.08Å; S72-Y76 VanDerWaalsContact O-CD2 3.23Å; S72-Y76 WeakPolarHBondContact O-CD2 3.41Å; S72-Y76 PolarHBondContact O-N 2.88Å; S72-Y76 VanDerWaalsContact O-N 3.16Å
73	F	72	Confident	63.7	Low	88 Å²	88	98.8 Å²	98.8	39%	0.386	50%	0.501	S	S	.	.	H	α-helix	trans	-62.2	-51.3	176.8	-169.8	-99.9	0	0	0	112.2	S69 K75 Y76 E77	S69-F73 PolarHBondContact O-N 2.8Å; F73-K75 PolarHBondContact O-N 2.8Å; F73-Y76 PolarHBondContact O-N 2.67Å; F73-Y76 VanDerWaalsContact O-N 3.13Å; F73-E77 HydrophobicContact CD1-CG 4.07Å; F73-E77 HydrophobicContact CE1-CG 3.81Å; F73-E77 VanDerWaalsContact CE1-OE1 3.23Å; F73-E77 WeakPolarHBondContact CE1-OE1 3.34Å; F73-E77 HydrophobicContact CZ-CG 4.17Å; F73-E77 WeakPolarHBondContact CZ-OE1 3.42Å; F73-E77 PolarHBondContact O-N 3.24Å
74	R	76.4	Confident	66.6	Low	174 Å²	174	97 Å²	97	66%	0.657	48%	0.482	S	S	*	.	H	α-helix	trans	-55.6	-37.5	176.6	-74.6	173.8	179	-172.1	0.8	112.6	G70 K78	G70-R74 WeakPolarHBondContact O-CB 3.43Å; G70-R74 VanDerWaalsContact O-CG 3.27Å; G70-R74 WeakPolarHBondContact O-CG 3.15Å; G70-R74 PolarHBondContact O-N 3.12Å; R74-K78 PolarHBondContact O-N 2.84Å; R74-K78 VanDerWaalsContact O-N 3.08Å
75	K	82.9	Confident	69.6	Low	143 Å²	143	97.3 Å²	97.3	62%	0.622	47%	0.469	S	S	*	.	H	α-helix	trans	-64.9	-46.1	177.1	-169.9	171.4	-174.4	169	0	111.9	Y71 S72 F73 Q79	Y71-K75 PolarHBondContact O-N 3.41Å; S72-K75 PolarHBondContact O-N 3.08Å; F73-K75 PolarHBondContact O-N 2.8Å; K75-Q79 WeakPolarHBondContact O-CG 3.29Å; K75-Q79 PolarHBondContact O-N 2.88Å
76	Y	84.7	Confident	72.6	Confident	60 Å²	60	91.1 Å²	91.1	24%	0.235	44%	0.443	C	S	.	.	H	α-helix	trans	-69.5	-37.2	176.8	-71	-55.2	0	0	0	113	S72 F73 K78 Q79 L80 I180 K183 T184	S72-Y76 VanDerWaalsContact O-CD2 3.23Å; S72-Y76 WeakPolarHBondContact O-CD2 3.41Å; S72-Y76 PolarHBondContact O-N 2.88Å; S72-Y76 VanDerWaalsContact O-N 3.16Å; F73-Y76 PolarHBondContact O-N 2.67Å; F73-Y76 VanDerWaalsContact O-N 3.13Å; Y76-K78 PolarHBondContact O-N 3.44Å; Y76-Q79 PolarHBondContact O-N 2.97Å; Y76-L80 PolarHBondContact O-N 2.88Å; Y76-I180 HydrophobicContact CD1-CG2 3.87Å; Y76-I180 HydrophobicContact CG-CG2 4.25Å; Y76-K183 HydrophobicContact CE1-CD 3.79Å; Y76-T184 HydrophobicContact CD2-CG2 4.42Å; Y76-T184 HydrophobicContact CG-CG2 4.15Å
77	E	84.9	Confident	75.6	Confident	47 Å²	47	86.5 Å²	86.5	22%	0.22	41%	0.411	C	S	.	.	H	α-helix	trans	-65.9	-36.3	175.9	-70.4	-155.1	138.9	0	0	113.2	F73 L80 R81 K186	F73-E77 HydrophobicContact CD1-CG 4.07Å; F73-E77 HydrophobicContact CE1-CG 3.81Å; F73-E77 VanDerWaalsContact CE1-OE1 3.23Å; F73-E77 WeakPolarHBondContact CE1-OE1 3.34Å; F73-E77 HydrophobicContact CZ-CG 4.17Å; F73-E77 WeakPolarHBondContact CZ-OE1 3.42Å; F73-E77 PolarHBondContact O-N 3.24Å; E77-L80 PolarHBondContact O-N 2.93Å; E77-R81 PolarHBondContact O-N 2.9Å; E77-R81 VanDerWaalsContact O-N 3.17Å; E77-R81 IonicContact OE2-NH1 2.86Å; E77-K186 IonicContact OE1-NZ 2.63Å; E77-K186 PolarHBondContact OE1-NZ 3.44Å
78	K	88.8	Confident	78.4	Confident	127 Å²	127	87.7 Å²	87.7	55%	0.552	41%	0.406	S	S	*	.	H	α-helix	trans	-61.3	-47.6	170.9	-172.7	178.2	176.9	178.9	0	110.5	R74 Y76 L80 R81 D82	R74-K78 PolarHBondContact O-N 2.84Å; R74-K78 VanDerWaalsContact O-N 3.08Å; Y76-K78 PolarHBondContact O-N 3.44Å; K78-L80 VanDerWaalsContact C-N 3.3Å; K78-L80 PolarHBondContact O-N 3.41Å; K78-R81 PolarHBondContact O-N 3.3Å; K78-D82 PolarHBondContact O-N 3.23Å
79	Q	89.7	Confident	81	Confident	73 Å²	73	84.3 Å²	84.3	34%	0.341	39%	0.392	S	S	.	.	H	α-helix	trans	-62.6	-31.8	178.3	-69	178.9	-7.8	0	0	113.7	K75 Y76 I83 I180	K75-Q79 WeakPolarHBondContact O-CG 3.29Å; K75-Q79 PolarHBondContact O-N 2.88Å; Y76-Q79 PolarHBondContact O-N 2.97Å; Q79-I83 VanDerWaalsContact O-CD1 3.28Å; Q79-I83 WeakPolarHBondContact O-CD1 3.48Å; Q79-I83 WeakPolarHBondContact O-CG1 3.21Å; Q79-I83 PolarHBondContact O-N 3.42Å; Q79-I180 HydrophobicContact CB-CD1 3.84Å
80	L	90.6	Very high	83.2	Confident	10 Å²	10	83.6 Å²	83.6	5%	0.052	38%	0.377	C	S	.	.	H	α-helix	trans	-64.8	-51.4	172.1	-75.9	170.3	0	0	0	111.1	Y76 E77 K78 D82 I83 E84 R177 I180 L181 T184	Y76-L80 PolarHBondContact O-N 2.88Å; E77-L80 PolarHBondContact O-N 2.93Å; K78-L80 VanDerWaalsContact C-N 3.3Å; K78-L80 PolarHBondContact O-N 3.41Å; L80-D82 VanDerWaalsContact C-N 3.3Å; L80-D82 PolarHBondContact O-N 2.92Å; L80-I83 PolarHBondContact O-N 2.96Å; L80-I83 VanDerWaalsContact O-N 3.1Å; L80-E84 WeakPolarHBondContact O-CB 3.1Å; L80-E84 VanDerWaalsContact O-CG 3.31Å; L80-E84 WeakPolarHBondContact O-CG 3.46Å; L80-E84 PolarHBondContact O-N 3.31Å; L80-R177 HydrophobicContact CD2-CG 4.24Å; L80-I180 HydrophobicContact CD1-CG2 4.2Å; L80-I180 HydrophobicContact CD2-CB 3.88Å; L80-I180 HydrophobicContact CD2-CG2 3.81Å; L80-I180 HydrophobicContact CG-CB 4.31Å; L80-I180 HydrophobicContact CG-CG2 3.67Å; L80-L181 HydrophobicContact CD1-CD2 4.07Å; L80-L181 HydrophobicContact CD2-CD2 3.97Å; L80-L181 HydrophobicContact CD2-CG 3.89Å; L80-T184 HydrophobicContact CD1-CG2 4.4Å
81	R	90.4	Very high	85.4	Confident	137 Å²	137	85.4 Å²	85.4	52%	0.517	38%	0.379	S	S	.	.	H	α-helix	trans	-57.7	-42.2	176.9	-69.2	-174.8	-68.5	-94.8	3	112.2	E77 K78 I83 E84 K85	E77-R81 PolarHBondContact O-N 2.9Å; E77-R81 VanDerWaalsContact O-N 3.17Å; E77-R81 IonicContact OE2-NH1 2.86Å; K78-R81 PolarHBondContact O-N 3.3Å; R81-I83 VanDerWaalsContact C-N 3.3Å; R81-I83 PolarHBondContact O-N 2.71Å; R81-E84 PolarHBondContact O-N 2.83Å; R81-K85 WeakPolarHBondContact O-CB 3.32Å; R81-K85 PolarHBondContact O-N 3.12Å
82	D	92.4	Very high	87.4	Confident	75 Å²	75	80.5 Å²	80.5	40%	0.401	36%	0.362	S	S	.	.	H	α-helix	trans	-63.4	-32.5	178.3	-65	-23.7	0	0	0	112.5	K78 L80 Q86	K78-D82 PolarHBondContact O-N 3.23Å; L80-D82 VanDerWaalsContact C-N 3.3Å; L80-D82 PolarHBondContact O-N 2.92Å; D82-Q86 WeakPolarHBondContact O-CG 3.33Å; D82-Q86 PolarHBondContact O-N 2.81Å; D82-Q86 PolarHBondContact O-NE2 3.38Å
83	I	92.1	Very high	88.6	Confident	3 Å²	3	80.1 Å²	80.1	2%	0.015	36%	0.356	C	S	.	.	H	α-helix	trans	-82	-38	176.5	-67	162.3	0	0	0	111.4	Q79 L80 R81 Q86 I87 Q176 R177 I180	Q79-I83 VanDerWaalsContact O-CD1 3.28Å; Q79-I83 WeakPolarHBondContact O-CD1 3.48Å; Q79-I83 WeakPolarHBondContact O-CG1 3.21Å; Q79-I83 PolarHBondContact O-N 3.42Å; L80-I83 PolarHBondContact O-N 2.96Å; L80-I83 VanDerWaalsContact O-N 3.1Å; R81-I83 VanDerWaalsContact C-N 3.3Å; R81-I83 PolarHBondContact O-N 2.71Å; I83-Q86 WeakPolarHBondContact O-CB 3.28Å; I83-Q86 PolarHBondContact O-N 3.45Å; I83-I87 HydrophobicContact CG2-CD1 4Å; I83-I87 HydrophobicContact CG2-CG1 4.49Å; I83-I87 WeakPolarHBondContact O-CG1 3.07Å; I83-I87 PolarHBondContact O-N 3.32Å; I83-Q176 HydrophobicContact CD1-CB 4.22Å; I83-Q176 HydrophobicContact CD1-CG 3.75Å; I83-R177 HydrophobicContact CG2-CB 3.96Å; I83-I180 HydrophobicContact CD1-CD1 3.51Å
84	E	91.4	Very high	89.3	Confident	64 Å²	64	76.4 Å²	76.4	30%	0.299	34%	0.342	S	S	.	.	H	α-helix	trans	-63.7	-45.3	178.9	-74.5	166.8	166.5	0	0	110.6	L80 R81 Q86 I87 E88 R177	L80-E84 WeakPolarHBondContact O-CB 3.1Å; L80-E84 VanDerWaalsContact O-CG 3.31Å; L80-E84 WeakPolarHBondContact O-CG 3.46Å; L80-E84 PolarHBondContact O-N 3.31Å; R81-E84 PolarHBondContact O-N 2.83Å; E84-Q86 VanDerWaalsContact C-N 3.33Å; E84-Q86 PolarHBondContact O-N 2.83Å; E84-I87 PolarHBondContact O-N 2.97Å; E84-I87 VanDerWaalsContact O-N 3.08Å; E84-E88 PolarHBondContact O-N 2.85Å; E84-R177 IonicContact OE1-CZ 2.82Å; E84-R177 IonicContact OE1-NE 3.72Å; E84-R177 PolarHBondContact OE1-NE 2.91Å; E84-R177 IonicContact OE1-NH2 3.68Å; E84-R177 PolarHBondContact OE1-NH2 2.89Å
85	K	94.1	Very high	89.7	Confident	120 Å²	120	75.7 Å²	75.7	52%	0.522	34%	0.339	S	S	.	.	H	α-helix	trans	-57.4	-42.3	170.5	-171.2	173	-172.3	-76.7	0	112.5	R81 I87 E88 E89	R81-K85 WeakPolarHBondContact O-CB 3.32Å; R81-K85 PolarHBondContact O-N 3.12Å; K85-I87 VanDerWaalsContact C-N 3.33Å; K85-I87 PolarHBondContact O-N 3.2Å; K85-E88 PolarHBondContact O-N 3.27Å; K85-E89 HydrophobicContact CG-CG 4.48Å; K85-E89 IonicContact NZ-OE1 2.91Å; K85-E89 PolarHBondContact NZ-OE1 2.97Å; K85-E89 WeakPolarHBondContact O-CB 3.33Å; K85-E89 VanDerWaalsContact O-CG 3.29Å; K85-E89 WeakPolarHBondContact O-CG 3.02Å; K85-E89 PolarHBondContact O-N 2.78Å
86	Q	92.8	Very high	89.7	Confident	85 Å²	85	75.8 Å²	75.8	40%	0.397	34%	0.339	S	S	.	.	H	α-helix	trans	-65.8	-30.9	175.5	-81.5	170.9	73.1	0	0	113.5	D82 I83 E84 R90 L173	D82-Q86 WeakPolarHBondContact O-CG 3.33Å; D82-Q86 PolarHBondContact O-N 2.81Å; D82-Q86 PolarHBondContact O-NE2 3.38Å; I83-Q86 WeakPolarHBondContact O-CB 3.28Å; I83-Q86 PolarHBondContact O-N 3.45Å; E84-Q86 VanDerWaalsContact C-N 3.33Å; E84-Q86 PolarHBondContact O-N 2.83Å; Q86-R90 WeakPolarHBondContact O-CB 3.37Å; Q86-R90 WeakPolarHBondContact O-CG 2.94Å; Q86-R90 PolarHBondContact O-N 2.81Å; Q86-L173 HydrophobicContact CB-CD1 4.38Å; Q86-L173 HydrophobicContact CB-CD2 4.37Å
87	I	92.9	Very high	89.3	Confident	9 Å²	9	74.9 Å²	74.9	5%	0.046	34%	0.339	C	S	.	.	H	α-helix	trans	-72.4	-43.5	174.2	-67.4	165	0	0	0	109.5	I83 E84 K85 R90 M91 C125 L173	I83-I87 HydrophobicContact CG2-CD1 4Å; I83-I87 HydrophobicContact CG2-CG1 4.49Å; I83-I87 WeakPolarHBondContact O-CG1 3.07Å; I83-I87 PolarHBondContact O-N 3.32Å; E84-I87 PolarHBondContact O-N 2.97Å; E84-I87 VanDerWaalsContact O-N 3.08Å; K85-I87 VanDerWaalsContact C-N 3.33Å; K85-I87 PolarHBondContact O-N 3.2Å; I87-R90 PolarHBondContact O-N 2.82Å; I87-M91 HydrophobicContact CG2-CE 4.13Å; I87-M91 HydrophobicContact CG2-CG 4.43Å; I87-M91 HydrophobicContact CG2-SD 4.22Å; I87-M91 WeakPolarHBondContact O-CG 3.2Å; I87-M91 PolarHBondContact O-N 3.14Å; I87-C125 HydrophobicContact CG2-CB 3.72Å; I87-L173 HydrophobicContact CD1-CB 4.18Å; I87-L173 HydrophobicContact CG1-CB 3.72Å; I87-L173 HydrophobicContact CG1-CD1 4.06Å
88	E	92.4	Very high	88.7	Confident	122 Å²	122	77.5 Å²	77.5	57%	0.57	36%	0.357	S	S	*	.	H	α-helix	trans	-62.4	-49.1	177.6	-174.7	169.8	-141.8	0	0	112.9	E84 K85 R90 M91 E92	E84-E88 PolarHBondContact O-N 2.85Å; K85-E88 PolarHBondContact O-N 3.27Å; E88-R90 PolarHBondContact O-N 3.17Å; E88-M91 PolarHBondContact O-N 3.1Å; E88-M91 VanDerWaalsContact O-N 3.13Å; E88-E92 WeakPolarHBondContact O-CB 3.46Å; E88-E92 PolarHBondContact O-N 3.19Å
89	E	92.7	Very high	87.8	Confident	91 Å²	91	75 Å²	75	43%	0.425	37%	0.368	S	S	.	.	H	α-helix	trans	-54.6	-38.1	173.4	-74.5	170.5	176.7	0	0	112.1	K85 V93	K85-E89 HydrophobicContact CG-CG 4.48Å; K85-E89 IonicContact NZ-OE1 2.91Å; K85-E89 PolarHBondContact NZ-OE1 2.97Å; K85-E89 WeakPolarHBondContact O-CB 3.33Å; K85-E89 VanDerWaalsContact O-CG 3.29Å; K85-E89 WeakPolarHBondContact O-CG 3.02Å; K85-E89 PolarHBondContact O-N 2.78Å; E89-V93 WeakPolarHBondContact O-CG2 3.43Å; E89-V93 PolarHBondContact O-N 2.78Å
90	R	91.9	Very high	87	Confident	68 Å²	68	74.6 Å²	74.6	26%	0.257	37%	0.37	S	S	.	.	H	α-helix	trans	-75.6	-35.8	179.3	-68.9	-81.9	172.6	-173.5	-10.5	112.6	Q86 I87 E88 A94 Q107 I108 L127 L173	Q86-R90 WeakPolarHBondContact O-CB 3.37Å; Q86-R90 WeakPolarHBondContact O-CG 2.94Å; Q86-R90 PolarHBondContact O-N 2.81Å; I87-R90 PolarHBondContact O-N 2.82Å; E88-R90 PolarHBondContact O-N 3.17Å; R90-A94 VanDerWaalsContact O-CB 3.31Å; R90-A94 WeakPolarHBondContact O-CB 3.37Å; R90-A94 PolarHBondContact O-N 3.16Å; R90-Q107 WeakPolarHBondContact CD-O 3.39Å; R90-Q107 PolarHBondContact NH1-O 2.98Å; R90-I108 PolarHBondContact NH1-O 2.93Å; R90-L127 HydrophobicContact CB-CD1 3.61Å; R90-L173 HydrophobicContact CG-CD1 4.12Å
91	M	90.5	Very high	85.7	Confident	65 Å²	65	81.8 Å²	81.8	32%	0.32	41%	0.406	S	S	.	.	H	α-helix	trans	-66.3	-39.2	171	-69.9	-172.9	-52.3	0	0	111.3	I87 E88 A94 R95 C125 L127	I87-M91 HydrophobicContact CG2-CE 4.13Å; I87-M91 HydrophobicContact CG2-CG 4.43Å; I87-M91 HydrophobicContact CG2-SD 4.22Å; I87-M91 WeakPolarHBondContact O-CG 3.2Å; I87-M91 PolarHBondContact O-N 3.14Å; E88-M91 PolarHBondContact O-N 3.1Å; E88-M91 VanDerWaalsContact O-N 3.13Å; M91-A94 PolarHBondContact O-N 3.46Å; M91-R95 WeakPolarHBondContact O-CG 3.45Å; M91-R95 PolarHBondContact O-N 2.89Å; M91-C125 HydrophobicContact SD-CB 4.27Å; M91-L127 HydrophobicContact CG-CD1 4.15Å; M91-L127 HydrophobicContact CG-CD2 4.07Å; M91-L127 HydrophobicContact CG-CG 4.03Å
92	E	90	Very high	84.6	Confident	63 Å²	63	79.3 Å²	79.3	29%	0.294	40%	0.403	S	S	.	.	H	α-helix	trans	-68.8	-41.4	178	179.1	56.7	-167.2	0	0	112.7	E88 A94 R95 K96	E88-E92 WeakPolarHBondContact O-CB 3.46Å; E88-E92 PolarHBondContact O-N 3.19Å; E92-A94 VanDerWaalsContact C-N 3.34Å; E92-R95 PolarHBondContact O-N 2.78Å; E92-R95 IonicContact OE2-CZ 3.49Å; E92-R95 VanDerWaalsContact OE2-CZ 3.22Å; E92-R95 IonicContact OE2-NE 3.43Å; E92-R95 PolarHBondContact OE2-NE 3.36Å; E92-R95 IonicContact OE2-NH2 2.73Å; E92-R95 PolarHBondContact OE2-NH2 3.46Å; E92-K96 PolarHBondContact O-N 2.88Å; E92-K96 VanDerWaalsContact O-N 3.14Å; E92-K96 WeakPolarHBondContact OE1-CE 3.23Å; E92-K96 IonicContact OE1-NZ 2.77Å; E92-K96 PolarHBondContact OE1-NZ 2.74Å
93	V	87.5	Confident	83.7	Confident	58 Å²	58	77.5 Å²	77.5	35%	0.352	39%	0.393	S	S	.	.	H	α-helix	trans	-66.4	-37.5	171.5	175.3	0	0	0	0	111.1	E89 K96 L97	E89-V93 WeakPolarHBondContact O-CG2 3.43Å; E89-V93 PolarHBondContact O-N 2.78Å; V93-K96 PolarHBondContact O-N 3.04Å; V93-L97 HydrophobicContact CG1-CD1 4.01Å; V93-L97 HydrophobicContact CG1-CG 4.45Å; V93-L97 WeakPolarHBondContact O-CG 3.24Å; V93-L97 PolarHBondContact O-N 3.46Å
94	A	86.2	Confident	83.1	Confident	10 Å²	10	78.5 Å²	78.5	8%	0.083	40%	0.402	C	S	.	.	H	α-helix	trans	-61.1	-45.4	173.5	0	0	0	0	0	112	R90 M91 E92 K96 L97 V98 Q107 L127	R90-A94 VanDerWaalsContact O-CB 3.31Å; R90-A94 WeakPolarHBondContact O-CB 3.37Å; R90-A94 PolarHBondContact O-N 3.16Å; M91-A94 PolarHBondContact O-N 3.46Å; E92-A94 VanDerWaalsContact C-N 3.34Å; A94-K96 VanDerWaalsContact C-N 3.26Å; A94-K96 PolarHBondContact O-N 3.34Å; A94-L97 PolarHBondContact O-N 3.28Å; A94-L97 VanDerWaalsContact O-N 3.1Å; A94-V98 WeakPolarHBondContact O-CG2 3.33Å; A94-V98 PolarHBondContact O-N 3.11Å; A94-Q107 HydrophobicContact CB-CB 4.36Å; A94-Q107 HydrophobicContact CB-CG 4Å; A94-L127 HydrophobicContact CB-CD2 3.54Å
95	R	85.7	Confident	82.9	Confident	159 Å²	159	77.1 Å²	77.1	60%	0.6	40%	0.396	S	S	*	.	H	α-helix	trans	-55.8	-39.4	175	-77.1	-168.3	-69	-128.7	3.9	112.5	M91 E92 L97 V98	M91-R95 WeakPolarHBondContact O-CG 3.45Å; M91-R95 PolarHBondContact O-N 2.89Å; E92-R95 PolarHBondContact O-N 2.78Å; E92-R95 IonicContact OE2-CZ 3.49Å; E92-R95 VanDerWaalsContact OE2-CZ 3.22Å; E92-R95 IonicContact OE2-NE 3.43Å; E92-R95 PolarHBondContact OE2-NE 3.36Å; E92-R95 IonicContact OE2-NH2 2.73Å; E92-R95 PolarHBondContact OE2-NH2 3.46Å; R95-L97 VanDerWaalsContact C-N 3.31Å; R95-L97 PolarHBondContact O-N 2.65Å; R95-V98 WeakPolarHBondContact O-CG2 3.26Å
96	K	83.2	Confident	82.8	Confident	145 Å²	145	71.4 Å²	71.4	63%	0.63	37%	0.371	S	S	*	.	H	α-helix	trans	-74	-15.2	179.3	-78.9	166	167.8	147.2	0	115	E92 V93 A94	E92-K96 PolarHBondContact O-N 2.88Å; E92-K96 VanDerWaalsContact O-N 3.14Å; E92-K96 WeakPolarHBondContact OE1-CE 3.23Å; E92-K96 IonicContact OE1-NZ 2.77Å; E92-K96 PolarHBondContact OE1-NZ 2.74Å; V93-K96 PolarHBondContact O-N 3.04Å; A94-K96 VanDerWaalsContact C-N 3.26Å; A94-K96 PolarHBondContact O-N 3.34Å
97	L	75.2	Confident	82.7	Confident	41 Å²	41	68.3 Å²	68.3	22%	0.215	36%	0.357	C	S	.	.	H	α-helix	trans	-101.3	-5.8	178.6	-63.2	176.4	0	0	0	113	V93 A94 R95 G99 T100 D102 D103	V93-L97 HydrophobicContact CG1-CD1 4.01Å; V93-L97 HydrophobicContact CG1-CG 4.45Å; V93-L97 WeakPolarHBondContact O-CG 3.24Å; V93-L97 PolarHBondContact O-N 3.46Å; A94-L97 PolarHBondContact O-N 3.28Å; A94-L97 VanDerWaalsContact O-N 3.1Å; R95-L97 VanDerWaalsContact C-N 3.31Å; R95-L97 PolarHBondContact O-N 2.65Å; L97-G99 PolarHBondContact O-N 3.29Å; L97-T100 WeakPolarHBondContact O-CB 3.4Å; L97-T100 PolarHBondContact O-N 3.28Å; L97-T100 PolarHBondContact O-OG1 2.85Å; L97-D102 HydrophobicContact CD1-CB 4.27Å; L97-D102 HydrophobicContact CD2-CB 4.03Å; L97-D103 WeakPolarHBondContact O-CB 3.13Å
98	V	72.4	Confident	82.6	Confident	102 Å²	102	68.7 Å²	68.7	62%	0.618	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.7	123.2	-180	177.7	0	0	0	0	110.6	A94 R95 T100 D103	A94-V98 WeakPolarHBondContact O-CG2 3.33Å; A94-V98 PolarHBondContact O-N 3.11Å; R95-V98 WeakPolarHBondContact O-CG2 3.26Å; V98-T100 VanDerWaalsContact C-N 3.34Å; V98-D103 WeakPolarHBondContact CA-OD2 3.42Å
99	G	70.3	Confident	82.5	Confident	75 Å²	75	64.3 Å²	64.3	77%	0.773	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.9	2.9	-179.1	0	0	0	0	0	115.7	L97 D103	L97-G99 PolarHBondContact O-N 3.29Å; G99-D103 PolarHBondContact N-OD2 3.22Å
100	T	72.7	Confident	82.2	Confident	64 Å²	64	64.1 Å²	64.1	39%	0.393	34%	0.34	S	S	.	.	S	Bend	trans	-93.8	163.8	172.5	70.4	0	0	0	0	111.3	L97 V98 D102 D103	L97-T100 WeakPolarHBondContact O-CB 3.4Å; L97-T100 PolarHBondContact O-N 3.28Å; L97-T100 PolarHBondContact O-OG1 2.85Å; V98-T100 VanDerWaalsContact C-N 3.34Å; T100-D102 PolarHBondContact O-N 2.77Å; T100-D102 VanDerWaalsContact O-N 3.11Å; T100-D102 PolarHBondContact OG1-N 2.88Å; T100-D103 WeakPolarHBondContact O-CB 3.24Å; T100-D103 PolarHBondContact O-N 2.93Å; T100-D103 VanDerWaalsContact O-N 3.11Å
101	M	62.8	Low	82	Confident	162 Å²	162	69.8 Å²	69.8	80%	0.798	37%	0.367	S	S	*	.	G	3₁₀ helix	trans	-61.2	-17.8	172	-76.3	-163	-74.9	0	0	113.9
102	D	68.1	Low	81.9	Confident	85 Å²	85	69.2 Å²	69.2	46%	0.455	37%	0.367	S	S	.	.	G	3₁₀ helix	trans	-85	-9.8	178.6	-68.8	-31.2	0	0	0	113.2	L97 T100 A104 I105	L97-D102 HydrophobicContact CD1-CB 4.27Å; L97-D102 HydrophobicContact CD2-CB 4.03Å; T100-D102 PolarHBondContact O-N 2.77Å; T100-D102 VanDerWaalsContact O-N 3.11Å; T100-D102 PolarHBondContact OG1-N 2.88Å; D102-A104 PolarHBondContact O-N 3.07Å; D102-I105 HydrophobicContact CB-CD1 4.01Å; D102-I105 VanDerWaalsContact O-CB 3.24Å; D102-I105 WeakPolarHBondContact O-CB 3.27Å; D102-I105 WeakPolarHBondContact O-CG1 3.38Å; D102-I105 PolarHBondContact O-N 3.1Å; D102-I105 VanDerWaalsContact OD1-CD1 3.25Å; D102-I105 WeakPolarHBondContact OD1-CD1 3.11Å
103	D	72.2	Confident	81.7	Confident	36 Å²	36	72.8 Å²	72.8	19%	0.193	38%	0.382	C	S	.	.	G	3₁₀ helix	trans	-65.2	-23.5	173.5	-151.5	10	0	0	0	111.9	L97 V98 G99 T100 I105 Q107	L97-D103 WeakPolarHBondContact O-CB 3.13Å; V98-D103 WeakPolarHBondContact CA-OD2 3.42Å; G99-D103 PolarHBondContact N-OD2 3.22Å; T100-D103 WeakPolarHBondContact O-CB 3.24Å; T100-D103 PolarHBondContact O-N 2.93Å; T100-D103 VanDerWaalsContact O-N 3.11Å; D103-I105 PolarHBondContact O-N 2.83Å; D103-Q107 PolarHBondContact OD1-NE2 2.84Å
104	A	80.6	Confident	81.6	Confident	24 Å²	24	71.1 Å²	71.1	20%	0.198	37%	0.37	C	S	.	.	G	3₁₀ helix	trans	-75	8.6	169.9	0	0	0	0	0	113.7	D102 K113 F114	D102-A104 PolarHBondContact O-N 3.07Å; A104-K113 HydrophobicContact CB-CG 4.3Å; A104-K113 CarbonylContact O-C 3.56Å; A104-K113 WeakPolarHBondContact O-CA 3.3Å; A104-K113 WeakPolarHBondContact O-CG 3.39Å; A104-F114 WeakPolarHBondContact O-CD2 3.13Å; A104-F114 PolarHBondContact O-N 3.13Å
105	I	86.6	Confident	81	Confident	35 Å²	35	75.5 Å²	75.5	18%	0.179	41%	0.406	C	S	.	.	B	Isolated β-bridge	trans	-106.9	146	179.2	-54.3	177.5	0	0	0	110.7	D102 D103 Q107 K113 F114	D102-I105 HydrophobicContact CB-CD1 4.01Å; D102-I105 VanDerWaalsContact O-CB 3.24Å; D102-I105 WeakPolarHBondContact O-CB 3.27Å; D102-I105 WeakPolarHBondContact O-CG1 3.38Å; D102-I105 PolarHBondContact O-N 3.1Å; D102-I105 VanDerWaalsContact OD1-CD1 3.25Å; D102-I105 WeakPolarHBondContact OD1-CD1 3.11Å; D103-I105 PolarHBondContact O-N 2.83Å; I105-Q107 PolarHBondContact O-N 2.92Å; I105-K113 HydrophobicContact CG1-CB 4.43Å; I105-K113 HydrophobicContact CG1-CG 4.34Å; I105-F114 VanDerWaalsContact C-CE2 3.46Å
106	C	92.6	Very high	80.4	Confident	0 Å²	0	74.5 Å²	74.5	0%	0	41%	0.412	C	S	.	.			trans	-59.3	105	175.1	177	0	0	0	0	112.3	I108 C109 Q110 T112 F114 C130	C106-I108 PolarHBondContact O-N 2.91Å; C106-C109 PolarHBondContact O-N 2.62Å; C106-Q110 WeakPolarHBondContact O-CA 3.21Å; C106-Q110 PolarHBondContact O-N 3.39Å; C106-T112 WeakPolarHBondContact CB-O 3.48Å; C106-T112 PolarHBondContact N-O 2.96Å; C106-F114 VanDerWaalsContact CA-CZ 3.41Å; C106-F114 HydrophobicContact CB-CE1 4.13Å; C106-F114 HydrophobicContact CB-CE2 4.36Å; C106-F114 HydrophobicContact CB-CZ 3.65Å; C106-C130 HydrophobicContact CB-CB 4.16Å; C106-C130 PolarHBondContact SG-N 2.94Å
107	Q	89.9	Confident	79.8	Confident	21 Å²	21	68.9 Å²	68.9	10%	0.098	40%	0.396	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-22.9	-175.6	-64.7	163.9	-12.4	0	0	112.9	R90 A94 D103 I105 L127 R128	R90-Q107 WeakPolarHBondContact CD-O 3.39Å; R90-Q107 PolarHBondContact NH1-O 2.98Å; A94-Q107 HydrophobicContact CB-CB 4.36Å; A94-Q107 HydrophobicContact CB-CG 4Å; D103-Q107 PolarHBondContact OD1-NE2 2.84Å; I105-Q107 PolarHBondContact O-N 2.92Å; Q107-L127 HydrophobicContact CB-CD2 4.09Å; Q107-R128 HydrophobicContact CG-CB 4.46Å; Q107-R128 PolarHBondContact N-O 3.25Å; Q107-R128 VanDerWaalsContact N-O 3.09Å
108	I	91.4	Very high	79.6	Confident	16 Å²	16	73 Å²	73	8%	0.082	42%	0.417	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-30.7	176.5	-53.4	-63.7	0	0	0	113.9	R90 C106 L127 C133 C171 L173	R90-I108 PolarHBondContact NH1-O 2.93Å; C106-I108 PolarHBondContact O-N 2.91Å; I108-L127 HydrophobicContact CD1-CB 4.02Å; I108-L127 HydrophobicContact CD1-CD1 3.65Å; I108-L127 HydrophobicContact CD1-CG 4.49Å; I108-C133 HydrophobicContact CB-CB 3.94Å; I108-C133 HydrophobicContact CG2-CB 3.82Å; I108-C171 HydrophobicContact CD1-CB 3.83Å; I108-C171 HydrophobicContact CG1-CB 3.96Å; I108-L173 HydrophobicContact CD1-CD1 4.4Å
109	C	90.4	Very high	80.2	Confident	30 Å²	30	68.2 Å²	68.2	20%	0.203	39%	0.389	C	S	.	.	T	Hydrogen-bonded Turn	trans	-127.9	-16.8	-174.2	72.3	0	0	0	0	116.1	C106 K111 C133	C106-C109 PolarHBondContact O-N 2.62Å; C109-K111 WeakPolarHBondContact O-CG 3.27Å; C109-K111 PolarHBondContact O-N 2.86Å; C109-K111 VanDerWaalsContact O-N 3.12Å; C109-C133 VanDerWaalsContact CB-SG 3.54Å
110	Q	86.8	Confident	81.1	Confident	87 Å²	87	69.1 Å²	69.1	41%	0.407	37%	0.372	S	S	.	.	S	Bend	trans	53	27	-177.6	-67.9	147.4	-36.6	0	0	114.2	C106	C106-Q110 WeakPolarHBondContact O-CA 3.21Å; C106-Q110 PolarHBondContact O-N 3.39Å
111	K	87.3	Confident	82	Confident	187 Å²	187	72.1 Å²	72.1	81%	0.813	38%	0.38	S	S	*	.			trans	-130.8	5.3	-173.8	-73.2	176.7	-174.5	-168	0	114.5	C109	C109-K111 WeakPolarHBondContact O-CG 3.27Å; C109-K111 PolarHBondContact O-N 2.86Å; C109-K111 VanDerWaalsContact O-N 3.12Å
112	T	87.5	Confident	83.5	Confident	54 Å²	54	64.5 Å²	64.5	33%	0.331	34%	0.343	S	S	.	.			trans	-141.1	107.1	-178	-53.9	0	0	0	0	107.9	C106 C130	C106-T112 WeakPolarHBondContact CB-O 3.48Å; C106-T112 PolarHBondContact N-O 2.96Å; T112-C130 HydrophobicContact CG2-CB 3.84Å
113	K	87.1	Confident	84.6	Confident	138 Å²	138	66.3 Å²	66.3	60%	0.6	34%	0.344	S	S	*	.	B	Isolated β-bridge	trans	-72.5	141.8	166.3	-163.3	172.6	-176.1	175.4	0	108.4	A104 I105	A104-K113 HydrophobicContact CB-CG 4.3Å; A104-K113 CarbonylContact O-C 3.56Å; A104-K113 WeakPolarHBondContact O-CA 3.3Å; A104-K113 WeakPolarHBondContact O-CG 3.39Å; I105-K113 HydrophobicContact CG1-CB 4.43Å; I105-K113 HydrophobicContact CG1-CG 4.34Å
114	F	85.4	Confident	85.6	Confident	23 Å²	23	66.7 Å²	66.7	10%	0.101	34%	0.343	C	S	.	.			trans	-82.6	132	174.1	-56	-63.3	0	0	0	108.8	A104 I105 C106 G117 G119 R128 C130	A104-F114 WeakPolarHBondContact O-CD2 3.13Å; A104-F114 PolarHBondContact O-N 3.13Å; I105-F114 VanDerWaalsContact C-CE2 3.46Å; C106-F114 VanDerWaalsContact CA-CZ 3.41Å; C106-F114 HydrophobicContact CB-CE1 4.13Å; C106-F114 HydrophobicContact CB-CE2 4.36Å; C106-F114 HydrophobicContact CB-CZ 3.65Å; F114-G117 PolarHBondContact O-N 2.86Å; F114-G119 VanDerWaalsContact CD1-CA 3.46Å; F114-R128 HydrophobicContact CE2-CB 3.87Å; F114-R128 HydrophobicContact CZ-CB 4.07Å; F114-C130 HydrophobicContact CE1-CB 3.96Å
115	A	73.7	Confident	86.1	Confident	102 Å²	102	66.2 Å²	66.2	84%	0.843	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-48.8	176.2	0	0	0	0	0	110.3	G117	A115-G117 PolarHBondContact O-N 2.95Å
116	D	71.5	Confident	86.3	Confident	137 Å²	137	71.8 Å²	71.8	73%	0.733	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.9	5.7	-177.9	-20.2	-71.1	0	0	0	112.7	I118	D116-I118 PolarHBondContact O-N 3.19Å
117	G	70.4	Confident	86.2	Confident	28 Å²	28	72 Å²	72	29%	0.289	37%	0.365	S	S	.	.	S	Bend	trans	65.7	-29.5	-168.5	0	0	0	0	0	115.3	F114 A115 G119	F114-G117 PolarHBondContact O-N 2.86Å; A115-G117 PolarHBondContact O-N 2.95Å; G117-G119 PolarHBondContact O-N 3.23Å; G117-G119 VanDerWaalsContact O-N 3.13Å
118	I	72.7	Confident	86.3	Confident	126 Å²	126	73.7 Å²	73.7	65%	0.646	37%	0.37	S	S	*	.			trans	-91.5	76.8	-169.1	-56.6	172.4	0	0	0	111.1	D116	D116-I118 PolarHBondContact O-N 3.19Å
119	G	83.6	Confident	86.4	Confident	3 Å²	3	72.9 Å²	72.9	3%	0.031	37%	0.366	C	S	.	.			trans	-61.2	142.3	168.6	0	0	0	0	0	113.6	F114 G117 K121 R128	F114-G119 VanDerWaalsContact CD1-CA 3.46Å; G117-G119 PolarHBondContact O-N 3.23Å; G117-G119 VanDerWaalsContact O-N 3.13Å; G119-K121 PolarHBondContact O-N 2.98Å; G119-R128 PolarHBondContact O-NH1 3.48Å
120	H	89.8	Confident	86.5	Confident	93 Å²	93	72 Å²	72	43%	0.431	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.1	115.4	-178.4	-57.9	-48.9	0	0	0	111.9	S129 W169	H120-S129 PolarHBondContact N-O 3.35Å; H120-S129 PolarHBondContact O-N 3.48Å; H120-S129 PolarHBondContact O-OG 2.99Å; H120-W169 HydrophobicContact CB-CD2 3.72Å; H120-W169 HydrophobicContact CB-CE3 4.4Å; H120-W169 HydrophobicContact CB-CG 3.81Å; H120-W169 HydrophobicContact CB-CZ2 4.15Å; H120-W169 AromaticContact CD2-CE2 3.74Å; H120-W169 AromaticContact CD2-CE3 3.96Å; H120-W169 AromaticContact CD2-CH2 3.42Å; H120-W169 VanDerWaalsContact CD2-CH2 3.42Å; H120-W169 WeakPolarHBondContact CD2-CH2 3.3Å; H120-W169 AromaticContact CD2-CZ2 3.47Å; H120-W169 VanDerWaalsContact CD2-CZ2 3.47Å; H120-W169 WeakPolarHBondContact CD2-CZ2 3.44Å; H120-W169 AromaticContact CD2-CZ3 3.67Å; H120-W169 AromaticContact CG-CE2 3.97Å
121	K	91.3	Very high	86.6	Confident	127 Å²	127	71.9 Å²	71.9	55%	0.552	37%	0.374	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.3	134.2	176.2	-64.6	-176.1	178.6	-178.1	0	110.6	G119 Q126 R128	G119-K121 PolarHBondContact O-N 2.98Å; K121-Q126 WeakPolarHBondContact CB-O 3.42Å; K121-R128 HydrophobicContact CG-CG 4.44Å
122	C	94	Very high	86.7	Confident	3 Å²	3	74.1 Å²	74.1	2%	0.02	38%	0.377	C	S	.	.			trans	-74	129	172.7	178.7	0	0	0	0	111.2	Y124 C125 Q126 L127 C171	C122-Y124 PolarHBondContact O-N 2.8Å; C122-Y124 PolarHBondContact SG-N 2.87Å; C122-C125 PolarHBondContact O-N 2.86Å; C122-Q126 WeakPolarHBondContact O-CA 3.19Å; C122-Q126 PolarHBondContact O-N 3.04Å; C122-L127 PolarHBondContact N-O 3.46Å; C122-C171 HydrophobicContact CB-CB 3.98Å; C122-C171 PolarHBondContact SG-N 3.46Å
123	Y	93	Very high	87	Confident	123 Å²	123	72.4 Å²	72.4	48%	0.482	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-32.6	177.3	-179.3	-104.2	0	0	0	114	I139 I168 W169	Y123-I139 HydrophobicContact CE1-CD1 4.45Å; Y123-I168 HydrophobicContact CD1-CB 4.5Å; Y123-I168 HydrophobicContact CD1-CD1 3.52Å; Y123-I168 HydrophobicContact CD1-CG2 4.39Å; Y123-I168 HydrophobicContact CD2-CB 4.38Å; Y123-I168 HydrophobicContact CD2-CG2 3.94Å; Y123-I168 HydrophobicContact CE1-CD1 4.18Å; Y123-I168 HydrophobicContact CE2-CG2 4.22Å; Y123-I168 HydrophobicContact CG-CB 4.08Å; Y123-I168 HydrophobicContact CG-CD1 3.9Å; Y123-I168 HydrophobicContact CG-CG2 4.04Å; Y123-W169 WeakPolarHBondContact CB-O 3.14Å; Y123-W169 PolarHBondContact N-O 3.49Å
124	Y	92.3	Very high	87.1	Confident	44 Å²	44	66.4 Å²	66.4	17%	0.173	34%	0.344	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.3	-23.5	-174.4	-60.3	-66	0	0	0	115.5	C122 I168 S170 C174 Q178 F188	C122-Y124 PolarHBondContact O-N 2.8Å; C122-Y124 PolarHBondContact SG-N 2.87Å; Y124-I168 HydrophobicContact CE2-CD1 4.01Å; Y124-S170 WeakPolarHBondContact CD2-OG 3.49Å; Y124-C174 HydrophobicContact CD2-CB 3.82Å; Y124-C174 HydrophobicContact CG-CB 4.31Å; Y124-Q178 VanDerWaalsContact CE1-NE2 3.26Å; Y124-Q178 HydrophobicContact CE2-CG 4.24Å; Y124-Q178 VanDerWaalsContact CZ-NE2 3.29Å; Y124-Q178 PolarHBondContact OH-NE2 3.39Å; Y124-F188 AromaticContact CD1-CD1 3.64Å; Y124-F188 HydrophobicContact CD1-CD1 3.64Å; Y124-F188 AromaticContact CD1-CE1 3.76Å; Y124-F188 HydrophobicContact CD1-CE1 3.76Å; Y124-F188 HydrophobicContact CE1-CD1 4.15Å; Y124-F188 HydrophobicContact CG-CD1 4.38Å; Y124-F188 HydrophobicContact CG-CE1 4.26Å
125	C	91.1	Very high	87.4	Confident	13 Å²	13	66.1 Å²	66.1	9%	0.088	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	-139.7	9.2	-176.3	72.7	0	0	0	0	114	I87 M91 C122 L127	I87-C125 HydrophobicContact CG2-CB 3.72Å; M91-C125 HydrophobicContact SD-CB 4.27Å; C122-C125 PolarHBondContact O-N 2.86Å; C125-L127 PolarHBondContact O-N 2.88Å
126	Q	90.7	Very high	88.2	Confident	152 Å²	152	70.7 Å²	70.7	71%	0.71	34%	0.343	S	S	*	.			trans	60.2	-16.4	178.2	-50.8	-166.1	39.7	0	0	117.3	K121 C122	K121-Q126 WeakPolarHBondContact CB-O 3.42Å; C122-Q126 WeakPolarHBondContact O-CA 3.19Å; C122-Q126 PolarHBondContact O-N 3.04Å
127	L	91.3	Very high	88.9	Confident	5 Å²	5	66.9 Å²	66.9	3%	0.026	32%	0.323	C	S	.	.			trans	-49.9	136.1	178.7	-69.3	177.3	0	0	0	113.9	R90 M91 A94 Q107 I108 C122 C125	R90-L127 HydrophobicContact CB-CD1 3.61Å; M91-L127 HydrophobicContact CG-CD1 4.15Å; M91-L127 HydrophobicContact CG-CD2 4.07Å; M91-L127 HydrophobicContact CG-CG 4.03Å; A94-L127 HydrophobicContact CB-CD2 3.54Å; Q107-L127 HydrophobicContact CB-CD2 4.09Å; I108-L127 HydrophobicContact CD1-CB 4.02Å; I108-L127 HydrophobicContact CD1-CD1 3.65Å; I108-L127 HydrophobicContact CD1-CG 4.49Å; C122-L127 PolarHBondContact N-O 3.46Å; C125-L127 PolarHBondContact O-N 2.88Å
128	R	91.2	Very high	89.5	Confident	56 Å²	56	72.1 Å²	72.1	21%	0.211	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	125.6	176.2	-62.7	-174.6	-177.8	-90.3	17.1	111.2	Q107 F114 G119 K121	Q107-R128 HydrophobicContact CG-CB 4.46Å; Q107-R128 PolarHBondContact N-O 3.25Å; Q107-R128 VanDerWaalsContact N-O 3.09Å; F114-R128 HydrophobicContact CE2-CB 3.87Å; F114-R128 HydrophobicContact CZ-CB 4.07Å; G119-R128 PolarHBondContact O-NH1 3.48Å; K121-R128 HydrophobicContact CG-CG 4.44Å
129	S	92.4	Very high	89.6	Confident	0 Å²	0	68 Å²	68	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	138.6	-174.9	54.6	0	0	0	0	112.4	H120 W169	H120-S129 PolarHBondContact N-O 3.35Å; H120-S129 PolarHBondContact O-N 3.48Å; H120-S129 PolarHBondContact O-OG 2.99Å; S129-W169 PolarHBondContact OG-NE1 2.82Å
130	C	92.4	Very high	89	Confident	12 Å²	12	74.4 Å²	74.4	8%	0.081	35%	0.346	C	S	.	.			trans	-78.7	165.4	171.6	67.3	0	0	0	0	111	C106 T112 F114 R132 C133 G134	C106-C130 HydrophobicContact CB-CB 4.16Å; C106-C130 PolarHBondContact SG-N 2.94Å; T112-C130 HydrophobicContact CG2-CB 3.84Å; F114-C130 HydrophobicContact CE1-CB 3.96Å; C130-R132 PolarHBondContact O-N 3.04Å; C130-C133 CarbonylContact O-C 3.6Å; C130-C133 PolarHBondContact O-N 3.31Å; C130-G134 PolarHBondContact O-N 3.39Å; C130-G134 VanDerWaalsContact O-N 3.14Å
131	A	89.5	Confident	87.7	Confident	83 Å²	83	71.4 Å²	71.4	69%	0.686	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-8.8	179.5	0	0	0	0	0	115.3	W169	A131-W169 HydrophobicContact CB-CH2 4.36Å
132	R	90.9	Very high	85.7	Confident	235 Å²	235	72 Å²	72	89%	0.887	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.9	-11.6	173.9	-155.8	177.4	-171.3	179.5	4.3	113.7	C130	C130-R132 PolarHBondContact O-N 3.04Å
133	C	92	Very high	83.7	Confident	17 Å²	17	74.5 Å²	74.5	12%	0.115	36%	0.358	C	S	.	.	T	Hydrogen-bonded Turn	trans	-125.6	8.1	-174.3	-63.1	0	0	0	0	113.2	I108 C109 C130 C171 S172	I108-C133 HydrophobicContact CB-CB 3.94Å; I108-C133 HydrophobicContact CG2-CB 3.82Å; C109-C133 VanDerWaalsContact CB-SG 3.54Å; C130-C133 CarbonylContact O-C 3.6Å; C130-C133 PolarHBondContact O-N 3.31Å; C133-C171 CarbonylContact O-C 3.5Å; C133-C171 WeakPolarHBondContact O-CA 3.27Å; C133-S172 PolarHBondContact O-N 3.32Å; C133-S172 PolarHBondContact O-OG 2.83Å
134	G	90.9	Very high	81.9	Confident	12 Å²	12	75 Å²	75	12%	0.124	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.2	-179.2	170.2	0	0	0	0	0	110.2	C130 S170	C130-G134 PolarHBondContact O-N 3.39Å; C130-G134 VanDerWaalsContact O-N 3.14Å; G134-S170 CarbonylContact C-O 3.57Å; G134-S170 WeakPolarHBondContact CA-O 3.41Å
135	G	90.3	Very high	79.5	Confident	18 Å²	18	79.7 Å²	79.7	19%	0.186	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-168.3	168.9	177.9	0	0	0	0	0	112.6	S170	G135-S170 PolarHBondContact N-O 3.32Å; G135-S170 PolarHBondContact O-N 3.04Å
136	R	91.3	Very high	77.3	Confident	197 Å²	197	82.9 Å²	82.9	74%	0.743	41%	0.411	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.8	132.1	176.1	-65.3	178.6	-178.2	171.5	-0.3	110.2	T167 I168 W169	R136-T167 HydrophobicContact CB-CG2 3.85Å; R136-T167 HydrophobicContact CG-CG2 4.14Å; R136-I168 CarbonylContact C-O 3.59Å; R136-I168 WeakPolarHBondContact CA-O 3.42Å; R136-W169 HydrophobicContact CG-CE3 3.74Å; R136-W169 HydrophobicContact CG-CZ3 3.89Å
137	L	85.4	Confident	74.7	Confident	58 Å²	58	83.6 Å²	83.6	30%	0.304	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	140.9	170.5	-58.2	178.2	0	0	0	108.8	T167 I168 S170 Q175	L137-T167 CarbonylContact O-C 3.5Å; L137-T167 WeakPolarHBondContact O-CA 3.17Å; L137-I168 HydrophobicContact CB-CG1 4.09Å; L137-I168 PolarHBondContact N-O 2.9Å; L137-I168 PolarHBondContact O-N 2.91Å; L137-S170 VanDerWaalsContact CD1-CB 3.48Å; L137-Q175 HydrophobicContact CD1-CG 4.38Å
138	Q	82.4	Confident	71.9	Confident	138 Å²	138	89.6 Å²	89.6	65%	0.645	45%	0.451	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.5	126.3	169.1	-69.7	179	-19.9	0	0	109.5
139	I	75.5	Confident	69.1	Low	40 Å²	40	90.4 Å²	90.4	21%	0.205	48%	0.477	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	142.5	171.2	57.4	166.8	0	0	0	109.8	Y123 V141 Q165 K166 I168	Y123-I139 HydrophobicContact CE1-CD1 4.45Å; I139-V141 HydrophobicContact CD1-CG2 3.74Å; I139-V141 HydrophobicContact CG1-CG2 3.83Å; I139-Q165 WeakPolarHBondContact O-CA 3.38Å; I139-K166 HydrophobicContact CG1-CB 4.2Å; I139-K166 WeakPolarHBondContact CG1-O 3.38Å; I139-K166 PolarHBondContact N-O 2.91Å; I139-K166 PolarHBondContact O-N 2.95Å; I139-I168 HydrophobicContact CD1-CD1 4.11Å; I139-I168 HydrophobicContact CD1-CG1 4.36Å; I139-I168 HydrophobicContact CD1-CG2 3.73Å; I139-I168 HydrophobicContact CG1-CD1 4.4Å; I139-I168 HydrophobicContact CG1-CG1 4.27Å; I139-I168 HydrophobicContact CG1-CG2 4.04Å; I139-I168 HydrophobicContact CG2-CD1 3.87Å; I139-I168 HydrophobicContact CG2-CG1 4.18Å
140	K	70.3	Confident	66.2	Low	137 Å²	137	98.3 Å²	98.3	60%	0.596	52%	0.519	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.3	122.7	169.4	-64.5	-174.2	-179.9	-174.9	0	107.7	Q165	K140-Q165 HydrophobicContact CG-CG 4.49Å
141	V	62.5	Low	63.5	Low	29 Å²	29	104.7 Å²	104.7	18%	0.176	55%	0.551	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-117.7	142.1	-179	-163	0	0	0	0	108.7	I139 Q145 Q164 K166	I139-V141 HydrophobicContact CD1-CG2 3.74Å; I139-V141 HydrophobicContact CG1-CG2 3.83Å; V141-Q145 HydrophobicContact CG1-CB 4.07Å; V141-Q164 PolarHBondContact N-O 3.1Å; V141-Q164 PolarHBondContact O-N 2.96Å; V141-Q164 VanDerWaalsContact O-N 3.13Å; V141-K166 HydrophobicContact CG2-CB 3.79Å
142	K	50.7	Low	60.9	Low	140 Å²	140	106.8 Å²	106.8	61%	0.609	56%	0.558	S	S	*	*			trans	-74.4	146.5	168	-70.8	-171.4	173.5	-170.6	0	109.6	D144 Q145	K142-D144 PolarHBondContact O-N 2.82Å; K142-Q145 PolarHBondContact O-N 2.66Å
143	A	52	Low	58.2	Low	56 Å²	56	100.7 Å²	100.7	46%	0.463	55%	0.547	S	S	.	.	G	3₁₀ helix	trans	-56.7	-39	179.1	0	0	0	0	0	112.3	Q145 V146	A143-Q145 PolarHBondContact O-N 2.89Å; A143-V146 WeakPolarHBondContact O-CB 3.48Å; A143-V146 WeakPolarHBondContact O-CG2 3.42Å; A143-V146 PolarHBondContact O-N 3.27Å; A143-V146 VanDerWaalsContact O-N 3.16Å
144	D	53.8	Low	55.8	Low	132 Å²	132	109.2 Å²	109.2	71%	0.706	58%	0.582	S	S	*	*	G	3₁₀ helix	trans	-61.7	-3	-179	-19.8	-50.5	0	0	0	115.2	K142	K142-D144 PolarHBondContact O-N 2.82Å
145	Q	43.8	Very low	53.1	Low	143 Å²	143	115.3 Å²	115.3	67%	0.668	61%	0.612	S	S	*	*	G	3₁₀ helix	trans	-113.1	21.1	-179.3	-73.5	-83	-48.5	0	0	112.2	V141 K142 A143	V141-Q145 HydrophobicContact CG1-CB 4.07Å; K142-Q145 PolarHBondContact O-N 2.66Å; A143-Q145 PolarHBondContact O-N 2.89Å
146	V	44.2	Very low	50.8	Low	80 Å²	80	124.1 Å²	124.1	49%	0.485	65%	0.645	S	S	.	*	S	Bend	trans	-110.6	124.4	178.4	-177.1	0	0	0	0	109.6	A143	A143-V146 WeakPolarHBondContact O-CB 3.48Å; A143-V146 WeakPolarHBondContact O-CG2 3.42Å; A143-V146 PolarHBondContact O-N 3.27Å; A143-V146 VanDerWaalsContact O-N 3.16Å
147	K	36.2	Very low	48.3	Very low	167 Å²	167	119.9 Å²	119.9	73%	0.726	65%	0.646	S	S	*	*			trans	-63.7	137.7	174.9	-71.2	-166.3	170.8	-159.4	0	110.9
148	P	32.2	Very low	46	Very low	132 Å²	132	123.4 Å²	123.4	86%	0.857	67%	0.672	S	S	*	*	S	Bend	trans	-63.3	149.4	163.5	30.1	-34.4	0	0	0	109.6
149	G	31.6	Very low	43.6	Very low	73 Å²	73	123.4 Å²	123.4	75%	0.753	68%	0.682	S	S	*	*	S	Bend	trans	132.9	8.4	178.9	0	0	0	0	0	116.7
150	N	32.6	Very low	41.7	Very low	165 Å²	165	125.2 Å²	125.2	88%	0.882	71%	0.71	S	S	*	*			trans	-162.1	100.9	162.2	-114.1	-46.2	0	0	0	110.9
151	L	35.3	Very low	40.3	Very low	146 Å²	146	124.5 Å²	124.5	76%	0.764	72%	0.723	S	S	*	*			trans	-162.8	128	177	-160.2	90.4	0	0	0	110.7	T153	L151-T153 HydrophobicContact CD2-CG2 4.4Å
152	P	35.6	Very low	39.4	Very low	127 Å²	127	126.7 Å²	126.7	83%	0.825	74%	0.743	S	S	*	*			trans	-88.2	144	156.1	32.4	-27.9	0	0	0	110.5
153	T	33.7	Very low	39.4	Very low	108 Å²	108	124.2 Å²	124.2	66%	0.663	74%	0.74	S	S	*	*			trans	-101.1	148	-168.9	46.5	0	0	0	0	114.1	L151	L151-T153 HydrophobicContact CD2-CG2 4.4Å
154	K	41.7	Very low	39.5	Very low	195 Å²	195	127.6 Å²	127.6	85%	0.848	75%	0.747	S	S	*	*			trans	179	90.5	134.1	-99.8	168.3	-178.6	177.1	0	113.5
155	D	34	Very low	40.1	Very low	140 Å²	140	127.4 Å²	127.4	75%	0.749	74%	0.741	S	S	*	*			trans	27.2	112.3	136.1	-41.5	-57	0	0	0	120.4
156	K	43.1	Very low	41.9	Very low	204 Å²	204	126 Å²	126	89%	0.887	73%	0.733	S	S	*	*				-149.4	119.2	129.6	-67.3	-156.7	178.2	-174	0	111
157	S	38.5	Very low	43.8	Very low	108 Å²	108	126 Å²	126	76%	0.755	73%	0.733	S	S	*	*			trans	27.7	131	165.9	48.8	0	0	0	0	122.1
158	P	35.8	Very low	46.4	Very low	131 Å²	131	118.6 Å²	118.6	85%	0.851	70%	0.701	S	S	*	*			trans	-92.2	105.6	-178.1	35.3	-33.4	0	0	0	114.6
159	T	33.3	Very low	49.2	Very low	139 Å²	139	114.2 Å²	114.2	85%	0.853	67%	0.668	S	S	*	*			trans	-143.9	122.1	162.5	43.2	0	0	0	0	112.6
160	G	35.6	Very low	52.2	Low	78 Å²	78	110.7 Å²	110.7	80%	0.804	63%	0.632	S	S	*	*	S	Bend	trans	98.6	138.4	172.7	0	0	0	0	0	115.7	A162	G160-A162 PolarHBondContact O-N 2.78Å
161	S	39.8	Very low	55.2	Low	122 Å²	122	102.9 Å²	102.9	85%	0.853	59%	0.59	S	S	*	*			trans	-81.3	98	-171.6	48.1	0	0	0	0	113.8	T163	S161-T163 PolarHBondContact O-N 3.49Å
162	A	44.3	Very low	58	Low	74 Å²	74	98.2 Å²	98.2	61%	0.612	57%	0.57	S	S	*	*			trans	-76	108.2	176.7	0	0	0	0	0	112.6	G160 Q164	G160-A162 PolarHBondContact O-N 2.78Å; A162-Q164 PolarHBondContact O-N 3.3Å
163	T	50.2	Low	60.8	Low	88 Å²	88	93.1 Å²	93.1	54%	0.54	54%	0.535	S	S	.	.			trans	-82.6	111.9	169.2	59	0	0	0	0	110.9	S161	S161-T163 PolarHBondContact O-N 3.49Å
164	Q	55.1	Low	63.7	Low	128 Å²	128	88.1 Å²	88.1	60%	0.598	51%	0.505	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.1	141.4	176.7	-67	-173.9	-2.5	0	0	111.6	V141 A162	V141-Q164 PolarHBondContact N-O 3.1Å; V141-Q164 PolarHBondContact O-N 2.96Å; V141-Q164 VanDerWaalsContact O-N 3.13Å; A162-Q164 PolarHBondContact O-N 3.3Å
165	Q	66.5	Low	66.1	Low	127 Å²	127	82.1 Å²	82.1	59%	0.593	48%	0.48	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.5	106.5	169.4	-74	-175.9	-45.3	0	0	110	I139 K140	I139-Q165 WeakPolarHBondContact O-CA 3.38Å; K140-Q165 HydrophobicContact CG-CG 4.49Å
166	K	80.1	Confident	68.9	Low	114 Å²	114	79.3 Å²	79.3	50%	0.496	46%	0.462	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	127.6	175.5	-166.7	164.7	-172.9	163.9	0	110	I139 V141 I168	I139-K166 HydrophobicContact CG1-CB 4.2Å; I139-K166 WeakPolarHBondContact CG1-O 3.38Å; I139-K166 PolarHBondContact N-O 2.91Å; I139-K166 PolarHBondContact O-N 2.95Å; V141-K166 HydrophobicContact CG2-CB 3.79Å; K166-I168 HydrophobicContact CG-CG2 4.46Å
167	T	84.6	Confident	71.2	Confident	80 Å²	80	72.1 Å²	72.1	49%	0.491	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	120.8	171.4	-60.9	0	0	0	0	109.2	R136 L137	R136-T167 HydrophobicContact CB-CG2 3.85Å; R136-T167 HydrophobicContact CG-CG2 4.14Å; L137-T167 CarbonylContact O-C 3.5Å; L137-T167 WeakPolarHBondContact O-CA 3.17Å
168	I	89.9	Confident	73.6	Confident	11 Å²	11	68.7 Å²	68.7	6%	0.056	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	160.2	176.2	60	161.1	0	0	0	110.8	Y123 Y124 R136 L137 I139 K166	Y123-I168 HydrophobicContact CD1-CB 4.5Å; Y123-I168 HydrophobicContact CD1-CD1 3.52Å; Y123-I168 HydrophobicContact CD1-CG2 4.39Å; Y123-I168 HydrophobicContact CD2-CB 4.38Å; Y123-I168 HydrophobicContact CD2-CG2 3.94Å; Y123-I168 HydrophobicContact CE1-CD1 4.18Å; Y123-I168 HydrophobicContact CE2-CG2 4.22Å; Y123-I168 HydrophobicContact CG-CB 4.08Å; Y123-I168 HydrophobicContact CG-CD1 3.9Å; Y123-I168 HydrophobicContact CG-CG2 4.04Å; Y124-I168 HydrophobicContact CE2-CD1 4.01Å; R136-I168 CarbonylContact C-O 3.59Å; R136-I168 WeakPolarHBondContact CA-O 3.42Å; L137-I168 HydrophobicContact CB-CG1 4.09Å; L137-I168 PolarHBondContact N-O 2.9Å; L137-I168 PolarHBondContact O-N 2.91Å; I139-I168 HydrophobicContact CD1-CD1 4.11Å; I139-I168 HydrophobicContact CD1-CG1 4.36Å; I139-I168 HydrophobicContact CD1-CG2 3.73Å; I139-I168 HydrophobicContact CG1-CD1 4.4Å; I139-I168 HydrophobicContact CG1-CG1 4.27Å; I139-I168 HydrophobicContact CG1-CG2 4.04Å; I139-I168 HydrophobicContact CG2-CD1 3.87Å; I139-I168 HydrophobicContact CG2-CG1 4.18Å; K166-I168 HydrophobicContact CG-CG2 4.46Å
169	W	92.1	Very high	76.1	Confident	40 Å²	40	67.7 Å²	67.7	15%	0.152	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	134.5	170.6	-170.8	-89.5	0	0	0	111.1	H120 Y123 S129 A131 R136	H120-W169 HydrophobicContact CB-CD2 3.72Å; H120-W169 HydrophobicContact CB-CE3 4.4Å; H120-W169 HydrophobicContact CB-CG 3.81Å; H120-W169 HydrophobicContact CB-CZ2 4.15Å; H120-W169 AromaticContact CD2-CE2 3.74Å; H120-W169 AromaticContact CD2-CE3 3.96Å; H120-W169 AromaticContact CD2-CH2 3.42Å; H120-W169 VanDerWaalsContact CD2-CH2 3.42Å; H120-W169 WeakPolarHBondContact CD2-CH2 3.3Å; H120-W169 AromaticContact CD2-CZ2 3.47Å; H120-W169 VanDerWaalsContact CD2-CZ2 3.47Å; H120-W169 WeakPolarHBondContact CD2-CZ2 3.44Å; H120-W169 AromaticContact CD2-CZ3 3.67Å; H120-W169 AromaticContact CG-CE2 3.97Å; Y123-W169 WeakPolarHBondContact CB-O 3.14Å; Y123-W169 PolarHBondContact N-O 3.49Å; S129-W169 PolarHBondContact OG-NE1 2.82Å; A131-W169 HydrophobicContact CB-CH2 4.36Å; R136-W169 HydrophobicContact CG-CE3 3.74Å; R136-W169 HydrophobicContact CG-CZ3 3.89Å
170	S	94	Very high	78.6	Confident	0 Å²	0	61.6 Å²	61.6	0%	0	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	133.7	179.9	-174.8	0	0	0	0	111.9	Y124 G134 G135 L137 Q175	Y124-S170 WeakPolarHBondContact CD2-OG 3.49Å; G134-S170 CarbonylContact C-O 3.57Å; G134-S170 WeakPolarHBondContact CA-O 3.41Å; G135-S170 PolarHBondContact N-O 3.32Å; G135-S170 PolarHBondContact O-N 3.04Å; L137-S170 VanDerWaalsContact CD1-CB 3.48Å; S170-Q175 PolarHBondContact O-NE2 2.87Å
171	C	95	Very high	80.9	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	159.9	176.4	77.1	0	0	0	0	112	I108 C122 C133 L173 C174 Q175	I108-C171 HydrophobicContact CD1-CB 3.83Å; I108-C171 HydrophobicContact CG1-CB 3.96Å; C122-C171 HydrophobicContact CB-CB 3.98Å; C122-C171 PolarHBondContact SG-N 3.46Å; C133-C171 CarbonylContact O-C 3.5Å; C133-C171 WeakPolarHBondContact O-CA 3.27Å; C171-L173 PolarHBondContact O-N 3.01Å; C171-C174 PolarHBondContact O-N 2.88Å; C171-C174 VanDerWaalsContact O-N 3.17Å; C171-Q175 WeakPolarHBondContact O-CG 3.24Å; C171-Q175 PolarHBondContact O-N 2.86Å
172	S	94.4	Very high	82.9	Confident	49 Å²	49	55.5 Å²	55.5	34%	0.343	30%	0.295	S	S	.	.	H	α-helix	trans	-60.6	-29.5	-176.8	55.9	0	0	0	0	114.2	C133 Q176	C133-S172 PolarHBondContact O-N 3.32Å; C133-S172 PolarHBondContact O-OG 2.83Å; S172-Q176 WeakPolarHBondContact O-CB 3.33Å; S172-Q176 PolarHBondContact O-N 2.61Å; S172-Q176 VanDerWaalsContact O-N 3.08Å
173	L	94.5	Very high	84.5	Confident	19 Å²	19	57.8 Å²	57.8	10%	0.099	29%	0.291	C	S	.	.	H	α-helix	trans	-69.4	-47.6	175.4	-64.8	176.4	0	0	0	111.2	Q86 I87 R90 I108 C171 Q176 R177	Q86-L173 HydrophobicContact CB-CD1 4.38Å; Q86-L173 HydrophobicContact CB-CD2 4.37Å; I87-L173 HydrophobicContact CD1-CB 4.18Å; I87-L173 HydrophobicContact CG1-CB 3.72Å; I87-L173 HydrophobicContact CG1-CD1 4.06Å; R90-L173 HydrophobicContact CG-CD1 4.12Å; I108-L173 HydrophobicContact CD1-CD1 4.4Å; C171-L173 PolarHBondContact O-N 3.01Å; L173-Q176 PolarHBondContact O-N 2.81Å; L173-Q176 VanDerWaalsContact O-N 3.17Å; L173-R177 PolarHBondContact O-N 2.85Å
174	C	94.4	Very high	85.7	Confident	4 Å²	4	54.7 Å²	54.7	3%	0.027	27%	0.272	C	S	.	.	H	α-helix	trans	-67.5	-35.5	177	-63.8	0	0	0	0	112.5	Y124 C171 Q176 R177 Q178	Y124-C174 HydrophobicContact CD2-CB 3.82Å; Y124-C174 HydrophobicContact CG-CB 4.31Å; C171-C174 PolarHBondContact O-N 2.88Å; C171-C174 VanDerWaalsContact O-N 3.17Å; C174-Q176 VanDerWaalsContact C-N 3.32Å; C174-Q176 PolarHBondContact O-N 3.03Å; C174-R177 PolarHBondContact O-N 2.81Å; C174-Q178 WeakPolarHBondContact O-CB 3.42Å; C174-Q178 VanDerWaalsContact O-CG 3.26Å; C174-Q178 WeakPolarHBondContact O-CG 3.43Å; C174-Q178 PolarHBondContact O-N 2.87Å
175	Q	92.6	Very high	86.4	Confident	69 Å²	69	51.1 Å²	51.1	32%	0.322	27%	0.27	S	S	.	.	H	α-helix	trans	-58.5	-43.6	169.6	-69.3	176.5	20.8	0	0	111.5	L137 S170 C171 Q179	L137-Q175 HydrophobicContact CD1-CG 4.38Å; S170-Q175 PolarHBondContact O-NE2 2.87Å; C171-Q175 WeakPolarHBondContact O-CG 3.24Å; C171-Q175 PolarHBondContact O-N 2.86Å; Q175-Q179 WeakPolarHBondContact O-CB 3.41Å; Q175-Q179 PolarHBondContact O-N 2.85Å
176	Q	92.5	Very high	86.3	Confident	81 Å²	81	49.3 Å²	49.3	38%	0.379	26%	0.26	S	S	.	.	H	α-helix	trans	-69.5	-38.5	177.8	-163.2	175.9	-56	0	0	112.3	I83 S172 L173 C174 Q179 I180	I83-Q176 HydrophobicContact CD1-CB 4.22Å; I83-Q176 HydrophobicContact CD1-CG 3.75Å; S172-Q176 WeakPolarHBondContact O-CB 3.33Å; S172-Q176 PolarHBondContact O-N 2.61Å; S172-Q176 VanDerWaalsContact O-N 3.08Å; L173-Q176 PolarHBondContact O-N 2.81Å; L173-Q176 VanDerWaalsContact O-N 3.17Å; C174-Q176 VanDerWaalsContact C-N 3.32Å; C174-Q176 PolarHBondContact O-N 3.03Å; Q176-Q179 PolarHBondContact O-N 3.06Å; Q176-I180 PolarHBondContact O-N 2.84Å; Q176-I180 VanDerWaalsContact O-N 3.15Å
177	R	91.6	Very high	85.2	Confident	53 Å²	53	52.5 Å²	52.5	20%	0.2	27%	0.269	C	S	.	.	H	α-helix	trans	-58.9	-51.8	172.9	-166.7	-177.6	-177.9	-167.1	4.1	110.6	L80 I83 E84 L173 C174 Q179 I180 L181 F188	L80-R177 HydrophobicContact CD2-CG 4.24Å; I83-R177 HydrophobicContact CG2-CB 3.96Å; E84-R177 IonicContact OE1-CZ 2.82Å; E84-R177 IonicContact OE1-NE 3.72Å; E84-R177 PolarHBondContact OE1-NE 2.91Å; E84-R177 IonicContact OE1-NH2 3.68Å; E84-R177 PolarHBondContact OE1-NH2 2.89Å; L173-R177 PolarHBondContact O-N 2.85Å; C174-R177 PolarHBondContact O-N 2.81Å; R177-Q179 VanDerWaalsContact C-N 3.29Å; R177-Q179 PolarHBondContact O-N 2.81Å; R177-I180 PolarHBondContact O-N 2.91Å; R177-I180 VanDerWaalsContact O-N 3.15Å; R177-L181 HydrophobicContact CG-CD1 4.03Å; R177-L181 HydrophobicContact CG-CG 4.41Å; R177-L181 WeakPolarHBondContact O-CB 3.47Å; R177-L181 VanDerWaalsContact O-CG 3.31Å; R177-L181 WeakPolarHBondContact O-CG 3.33Å; R177-L181 PolarHBondContact O-N 3.44Å; R177-F188 VanDerWaalsContact NH1-CZ 3.29Å
178	Q	88.3	Confident	83.4	Confident	36 Å²	36	51 Å²	51	17%	0.168	26%	0.256	C	S	.	.	H	α-helix	trans	-58.1	-38.8	176.2	-69.6	-70.5	7.7	0	0	112.2	Y124 C174 I180 L181 A182	Y124-Q178 VanDerWaalsContact CE1-NE2 3.26Å; Y124-Q178 HydrophobicContact CE2-CG 4.24Å; Y124-Q178 VanDerWaalsContact CZ-NE2 3.29Å; Y124-Q178 PolarHBondContact OH-NE2 3.39Å; C174-Q178 WeakPolarHBondContact O-CB 3.42Å; C174-Q178 VanDerWaalsContact O-CG 3.26Å; C174-Q178 WeakPolarHBondContact O-CG 3.43Å; C174-Q178 PolarHBondContact O-N 2.87Å; Q178-I180 VanDerWaalsContact C-N 3.34Å; Q178-I180 PolarHBondContact O-N 2.78Å; Q178-L181 PolarHBondContact O-N 3.32Å; Q178-A182 WeakPolarHBondContact O-CB 3.47Å; Q178-A182 PolarHBondContact O-N 3.31Å
179	Q	88.4	Confident	81.3	Confident	109 Å²	109	60.4 Å²	60.4	51%	0.509	29%	0.292	S	S	.	.	H	α-helix	trans	-66.9	-29.9	178.3	-168.4	176	36	0	0	113.6	Q175 Q176 R177 K183	Q175-Q179 WeakPolarHBondContact O-CB 3.41Å; Q175-Q179 PolarHBondContact O-N 2.85Å; Q176-Q179 PolarHBondContact O-N 3.06Å; R177-Q179 VanDerWaalsContact C-N 3.29Å; R177-Q179 PolarHBondContact O-N 2.81Å; Q179-K183 WeakPolarHBondContact O-CG 3.45Å
180	I	86.6	Confident	78.9	Confident	11 Å²	11	61.3 Å²	61.3	6%	0.056	31%	0.305	C	S	.	.	H	α-helix	trans	-88.3	-34.8	176.3	-62.5	165.6	0	0	0	111.4	Y76 Q79 L80 I83 Q176 R177 Q178 K183 T184	Y76-I180 HydrophobicContact CD1-CG2 3.87Å; Y76-I180 HydrophobicContact CG-CG2 4.25Å; Q79-I180 HydrophobicContact CB-CD1 3.84Å; L80-I180 HydrophobicContact CD1-CG2 4.2Å; L80-I180 HydrophobicContact CD2-CB 3.88Å; L80-I180 HydrophobicContact CD2-CG2 3.81Å; L80-I180 HydrophobicContact CG-CB 4.31Å; L80-I180 HydrophobicContact CG-CG2 3.67Å; I83-I180 HydrophobicContact CD1-CD1 3.51Å; Q176-I180 PolarHBondContact O-N 2.84Å; Q176-I180 VanDerWaalsContact O-N 3.15Å; R177-I180 PolarHBondContact O-N 2.91Å; R177-I180 VanDerWaalsContact O-N 3.15Å; Q178-I180 VanDerWaalsContact C-N 3.34Å; Q178-I180 PolarHBondContact O-N 2.78Å; I180-K183 CarbonylContact O-C 3.58Å; I180-K183 WeakPolarHBondContact O-CB 3.43Å; I180-K183 PolarHBondContact O-N 2.76Å; I180-K183 VanDerWaalsContact O-N 3.08Å; I180-T184 HydrophobicContact CG2-CG2 4.31Å; I180-T184 WeakPolarHBondContact O-CG2 3.49Å; I180-T184 PolarHBondContact O-N 2.77Å; I180-T184 PolarHBondContact O-OG1 3.15Å
181	L	85.1	Confident	75.9	Confident	13 Å²	13	64.3 Å²	64.3	7%	0.068	34%	0.336	C	S	.	.	H	α-helix	trans	-54.2	-52.9	168.7	-77.1	179.2	0	0	0	110.8	L80 R177 Q178 K183 T184 G185 K186 F188	L80-L181 HydrophobicContact CD1-CD2 4.07Å; L80-L181 HydrophobicContact CD2-CD2 3.97Å; L80-L181 HydrophobicContact CD2-CG 3.89Å; R177-L181 HydrophobicContact CG-CD1 4.03Å; R177-L181 HydrophobicContact CG-CG 4.41Å; R177-L181 WeakPolarHBondContact O-CB 3.47Å; R177-L181 VanDerWaalsContact O-CG 3.31Å; R177-L181 WeakPolarHBondContact O-CG 3.33Å; R177-L181 PolarHBondContact O-N 3.44Å; Q178-L181 PolarHBondContact O-N 3.32Å; L181-K183 PolarHBondContact O-N 3.47Å; L181-K183 VanDerWaalsContact O-N 3.1Å; L181-T184 WeakPolarHBondContact CA-OG1 3.34Å; L181-T184 CarbonylContact O-C 3.5Å; L181-T184 PolarHBondContact O-N 3.18Å; L181-T184 PolarHBondContact O-OG1 2.73Å; L181-G185 PolarHBondContact O-N 2.81Å; L181-K186 CarbonylContact C-O 3.46Å; L181-K186 WeakPolarHBondContact CA-O 3.39Å; L181-K186 VanDerWaalsContact CB-O 3.23Å; L181-K186 WeakPolarHBondContact CB-O 3.4Å; L181-K186 HydrophobicContact CD2-CB 3.75Å; L181-K186 PolarHBondContact O-N 3.24Å; L181-F188 HydrophobicContact CD1-CB 3.71Å; L181-F188 HydrophobicContact CD1-CD2 4.5Å; L181-F188 HydrophobicContact CD1-CG 4.4Å
182	A	81.5	Confident	72.9	Confident	59 Å²	59	70.9 Å²	70.9	49%	0.488	37%	0.371	S	S	.	.	H	α-helix	trans	-58.5	-26	174.6	0	0	0	0	0	114.6	Q178	Q178-A182 WeakPolarHBondContact O-CB 3.47Å; Q178-A182 PolarHBondContact O-N 3.31Å
183	K	77.1	Confident	69.9	Low	122 Å²	122	77.8 Å²	77.8	53%	0.53	40%	0.395	S	S	.	.	H	α-helix	trans	-82.1	-20.7	173.1	-76	177.7	169.4	-160.1	0	114.3	Y76 Q179 I180 L181	Y76-K183 HydrophobicContact CE1-CD 3.79Å; Q179-K183 WeakPolarHBondContact O-CG 3.45Å; I180-K183 CarbonylContact O-C 3.58Å; I180-K183 WeakPolarHBondContact O-CB 3.43Å; I180-K183 PolarHBondContact O-N 2.76Å; I180-K183 VanDerWaalsContact O-N 3.08Å; L181-K183 PolarHBondContact O-N 3.47Å; L181-K183 VanDerWaalsContact O-N 3.1Å
184	T	76.1	Confident	66.8	Low	23 Å²	23	83.9 Å²	83.9	14%	0.141	43%	0.427	C	S	.	.	H	α-helix	trans	-101.9	-1.8	-179.3	52.3	0	0	0	0	112.9	Y76 L80 I180 L181 K186	Y76-T184 HydrophobicContact CD2-CG2 4.42Å; Y76-T184 HydrophobicContact CG-CG2 4.15Å; L80-T184 HydrophobicContact CD1-CG2 4.4Å; I180-T184 HydrophobicContact CG2-CG2 4.31Å; I180-T184 WeakPolarHBondContact O-CG2 3.49Å; I180-T184 PolarHBondContact O-N 2.77Å; I180-T184 PolarHBondContact O-OG1 3.15Å; L181-T184 WeakPolarHBondContact CA-OG1 3.34Å; L181-T184 CarbonylContact O-C 3.5Å; L181-T184 PolarHBondContact O-N 3.18Å; L181-T184 PolarHBondContact O-OG1 2.73Å; T184-K186 PolarHBondContact O-N 2.56Å
185	G	69.8	Low	63.7	Low	53 Å²	53	94.2 Å²	94.2	55%	0.546	47%	0.466	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.1	-8.1	-175.3	0	0	0	0	0	114.5	L181 W187	L181-G185 PolarHBondContact O-N 2.81Å; G185-W187 VanDerWaalsContact O-CD1 3.24Å
186	K	64.5	Low	60.6	Low	89 Å²	89	95.7 Å²	95.7	39%	0.387	49%	0.489	S	S	.	.			trans	-77	138.6	174	-59.3	-179.2	-175	-177.8	0	108.7	E77 L181 T184	E77-K186 IonicContact OE1-NZ 2.63Å; E77-K186 PolarHBondContact OE1-NZ 3.44Å; L181-K186 CarbonylContact C-O 3.46Å; L181-K186 WeakPolarHBondContact CA-O 3.39Å; L181-K186 VanDerWaalsContact CB-O 3.23Å; L181-K186 WeakPolarHBondContact CB-O 3.4Å; L181-K186 HydrophobicContact CD2-CB 3.75Å; L181-K186 PolarHBondContact O-N 3.24Å; T184-K186 PolarHBondContact O-N 2.56Å
187	W	55.4	Low	57.4	Low	181 Å²	181	96.6 Å²	96.6	69%	0.686	51%	0.505	S	S	*	.			trans	-118.8	150.9	179.4	-69.5	88.1	0	0	0	111.7	G185 Y189	G185-W187 VanDerWaalsContact O-CD1 3.24Å; W187-Y189 HydrophobicContact CB-CE2 4.47Å
188	F	48.5	Very low	54.4	Low	50 Å²	50	99.1 Å²	99.1	22%	0.219	53%	0.531	C	S	.	.			trans	-97	117.1	-178.8	-166.7	-121.7	0	0	0	112	Y124 R177 L181 S190	Y124-F188 AromaticContact CD1-CD1 3.64Å; Y124-F188 HydrophobicContact CD1-CD1 3.64Å; Y124-F188 AromaticContact CD1-CE1 3.76Å; Y124-F188 HydrophobicContact CD1-CE1 3.76Å; Y124-F188 HydrophobicContact CE1-CD1 4.15Å; Y124-F188 HydrophobicContact CG-CD1 4.38Å; Y124-F188 HydrophobicContact CG-CE1 4.26Å; R177-F188 VanDerWaalsContact NH1-CZ 3.29Å; L181-F188 HydrophobicContact CD1-CB 3.71Å; L181-F188 HydrophobicContact CD1-CD2 4.5Å; L181-F188 HydrophobicContact CD1-CG 4.4Å; F188-S190 WeakPolarHBondContact CE1-OG 3.47Å; F188-S190 WeakPolarHBondContact CZ-OG 3.36Å
189	Y	45.1	Very low	51.7	Low	207 Å²	207	107 Å²	107	81%	0.812	57%	0.567	S	S	*	*			trans	-100.6	135.2	164.8	-64.3	-93.6	0	0	0	108.8	W187	W187-Y189 HydrophobicContact CB-CE2 4.47Å
190	S	41.2	Very low	49	Very low	60 Å²	60	109.8 Å²	109.8	42%	0.42	58%	0.581	S	S	.	*			trans	-160.1	140.7	171.1	-82.7	0	0	0	0	110.4	F188	F188-S190 WeakPolarHBondContact CE1-OG 3.47Å; F188-S190 WeakPolarHBondContact CZ-OG 3.36Å
191	G	31.3	Very low	46.4	Very low	63 Å²	63	115.1 Å²	115.1	65%	0.649	62%	0.616	S	S	*	*	S	Bend	trans	102.3	78.9	-150.2	0	0	0	0	0	109
192	D	32.2	Very low	43.8	Very low	138 Å²	138	118.8 Å²	118.8	74%	0.738	64%	0.64	S	S	*	*	S	Bend	trans	167.4	-25.7	145.7	-87.4	-11.4	0	0	0	112.6
193	K	31.4	Very low	41.2	Very low	194 Å²	194	123.5 Å²	123.5	84%	0.843	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.1	-14.1	-169.9	-66.6	-158.3	170.1	-166.3	0	117.6
194	D	29.2	Very low	39.1	Very low	146 Å²	146	125 Å²	125	78%	0.781	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.4	33.7	-174.6	-51.1	-57.3	0	0	0	113.2
195	R	28.5	Very low	37.2	Very low	222 Å²	222	129.4 Å²	129.4	84%	0.838	70%	0.699	S	S	*	*	S	Bend	trans	-143.7	14.7	-179.2	-105.6	-168	-178.4	-125.7	-0	116.2
196	A	28.4	Very low	35.3	Very low	99 Å²	99	131.5 Å²	131.5	82%	0.818	71%	0.711	S	S	*	*	S	Bend	trans	-122.7	29.1	-178.7	0	0	0	0	0	112.6
197	S	26.3	Very low	33.6	Very low	101 Å²	101	136.2 Å²	136.2	71%	0.706	73%	0.734	S	S	*	*			trans	-146.4	48.9	-166.8	65.3	0	0	0	0	113.2
198	S	28.2	Very low	32.5	Very low	106 Å²	106	133.1 Å²	133.1	74%	0.741	74%	0.74	S	S	*	*	S	Bend	trans	-166.5	69.3	171.3	60.9	0	0	0	0	112.2
199	E	30.9	Very low	32	Very low	201 Å²	201	136.3 Å²	136.3	94%	0.939	77%	0.766	S	S	*	*			trans	174.4	123.6	151.2	-100	165.6	161.1	0	0	108.6
200	E	31.3	Very low	31.3	Very low	168 Å²	168	129.8 Å²	129.8	79%	0.785	76%	0.762	S	S	*	*			trans	-131.3	134	-178	179.2	-172.7	173.8	0	0	108.9
201	P	31.4	Very low	30.7	Very low	122 Å²	122	130.9 Å²	130.9	79%	0.792	77%	0.774	S	S	*	*			trans	-118.5	154.9	146.8	-1.3	23.1	0	0	0	112.6
202	P	31.3	Very low	30.7	Very low	90 Å²	90	134.2 Å²	134.2	58%	0.584	78%	0.782	S	S	*	*			trans	-114.4	150.7	-149.2	4.9	19.5	0	0	0	116
203	L	27.8	Very low	30.6	Very low	158 Å²	158	132 Å²	132	83%	0.827	78%	0.783	S	S	*	*			trans	66.5	162.8	153.8	-53.8	165.8	0	0	0	116.1
204	L	31.5	Very low	30.4	Very low	154 Å²	154	127 Å²	127	81%	0.806	78%	0.778	S	S	*	*			cis	-132.6	166.6	8.5	-83	171.5	0	0	0	111.7
205	P	38	Very low	30.5	Very low	116 Å²	116	127.5 Å²	127.5	75%	0.753	78%	0.78	S	S	*	*			trans	-99.8	145.8	178.9	37.4	-32.4	0	0	0	114.8
206	A	28.4	Very low	30.6	Very low	97 Å²	97	123.3 Å²	123.3	80%	0.802	77%	0.774	S	S	*	*			trans	-170.5	154.1	162.1	0	0	0	0	0	110.4
207	E	29.6	Very low	30.9	Very low	187 Å²	187	129 Å²	129	87%	0.874	77%	0.774	S	S	*	*			cis	-154.4	154.4	-33.6	-91.7	-157.5	132.8	0	0	106.7
208	S	31.1	Very low	31.4	Very low	116 Å²	116	128.9 Å²	128.9	81%	0.811	77%	0.771	S	S	*	*			trans	-152.2	96.1	174.5	52.7	0	0	0	0	115
209	P	39.2	Very low	31.6	Very low	117 Å²	117	130 Å²	130	76%	0.76	77%	0.774	S	S	*	*			trans	-67.4	156.8	144.6	33.6	-33.5	0	0	0	108.7
210	G	29.6	Very low	31.8	Very low	71 Å²	71	127.3 Å²	127.3	73%	0.732	77%	0.771	S	S	*	*			cis	93.1	128	29.3	0	0	0	0	0	109.2
211	A	29.9	Very low	32.1	Very low	82 Å²	82	124.2 Å²	124.2	68%	0.678	77%	0.765	S	S	*	*			cis	-162.5	-171.3	-4.1	0	0	0	0	0	109.7
212	T	29.5	Very low	31.9	Very low	133 Å²	133	123.7 Å²	123.7	82%	0.816	76%	0.76	S	S	*	*			trans	64.4	137.5	152.7	51.5	0	0	0	0	121.7
213	A	30.1	Very low	31.8	Very low	92 Å²	92	127.2 Å²	127.2	76%	0.76	77%	0.768	S	S	*	*			trans	72.3	105.4	138.3	0	0	0	0	0	120.9
214	A	29.2	Very low	31.6	Very low	88 Å²	88	129.9 Å²	129.9	73%	0.727	77%	0.767	S	S	*	*				82.2	138.4	112.9	0	0	0	0	0	121.4
215	L	31	Very low	31.4	Very low	158 Å²	158	125.8 Å²	125.8	83%	0.827	76%	0.762	S	S	*	*			trans	62.9	101.9	144.2	-68.3	168.1	0	0	0	119.9
216	D	30.8	Very low	30.9	Very low	133 Å²	133	128 Å²	128	71%	0.711	76%	0.762	S	S	*	*				79.2	127	110.8	-142	-4.4	0	0	0	119.9
217	R	33.8	Very low	30.9	Very low	218 Å²	218	130.8 Å²	130.8	82%	0.823	76%	0.759	S	S	*	*			trans	76.1	166.5	142.7	-108.3	170	160.3	-142.2	-7	118.2
218	P	37.5	Very low	30.8	Very low	100 Å²	100	125.2 Å²	125.2	65%	0.649	75%	0.752	S	S	*	*				-131.2	174.3	-95.7	44.4	-30.3	0	0	0	114.9
219	V	31.7	Very low	30.7	Very low	130 Å²	130	126.5 Å²	126.5	79%	0.788	75%	0.749	S	S	*	*			trans	36.7	107.1	146.3	179.3	0	0	0	0	117.5
220	T	34.5	Very low	30.3	Very low	143 Å²	143	129.4 Å²	129.4	88%	0.877	75%	0.749	S	S	*	*				-154.3	157.6	119.5	18.4	0	0	0	0	110.5
221	P	37.9	Very low	30.3	Very low	104 Å²	104	130 Å²	130	68%	0.675	75%	0.748	S	S	*	*			trans	-128.7	-168	-169.6	39.2	-20.1	0	0	0	114
222	V	27.7	Very low	30.4	Very low	111 Å²	111	131.7 Å²	131.7	67%	0.673	75%	0.745	S	S	*	*			trans	81.9	124.3	154.6	173.4	0	0	0	0	118.6
223	Q	28.1	Very low	30.7	Very low	163 Å²	163	131.5 Å²	131.5	76%	0.762	74%	0.735	S	S	*	*			trans	67.3	165.1	156.2	-73.8	167.6	37.5	0	0	118.6
224	R	25.3	Very low	30.9	Very low	214 Å²	214	135.4 Å²	135.4	81%	0.808	73%	0.73	S	S	*	*			cis	-174	130.9	-30.1	166.9	-169.2	-91.7	178.4	-8.5	107.6
225	G	27.2	Very low	31.2	Very low	68 Å²	68	138.3 Å²	138.3	70%	0.701	73%	0.729	S	S	*	*			trans	66.4	-177	-179.3	0	0	0	0	0	112.2
226	Q	27.1	Very low	31.3	Very low	162 Å²	162	136.2 Å²	136.2	76%	0.757	72%	0.715	S	S	*	*			cis	-150.3	-167.7	-12.5	-137	163.7	-66.9	0	0	107.6	G228	Q226-G228 PolarHBondContact O-N 3.46Å
227	E	27.6	Very low	31.4	Very low	156 Å²	156	136.4 Å²	136.4	73%	0.729	71%	0.711	S	S	*	*			trans	-4.2	117	165.4	-65	123	-130.7	0	0	116.8
228	G	28.1	Very low	31.5	Very low	70 Å²	70	130.1 Å²	130.1	72%	0.722	71%	0.706	S	S	*	*			cis	117.1	-169.3	19	0	0	0	0	0	110.2	Q226	Q226-G228 PolarHBondContact O-N 3.46Å
229	L	29.1	Very low	31.7	Very low	143 Å²	143	134.8 Å²	134.8	75%	0.749	72%	0.716	S	S	*	*			trans	50.6	116.5	162.2	-63.4	177.2	0	0	0	119.5
230	K	29.9	Very low	31.8	Very low	178 Å²	178	135.1 Å²	135.1	77%	0.774	71%	0.707	S	S	*	*			trans	74	113.4	141.9	-63.8	169.5	-178.9	174.6	0	115.7
231	A	30.4	Very low	31.7	Very low	84 Å²	84	135 Å²	135	69%	0.694	70%	0.701	S	S	*	*				78.6	170.2	78.4	0	0	0	0	0	110.7
232	D	32.8	Very low	31.4	Very low	117 Å²	117	134.4 Å²	134.4	63%	0.626	70%	0.704	S	S	*	*			cis	-126.5	124.7	7.1	-104.8	-51.3	0	0	0	110
233	Q	34.8	Very low	31.6	Very low	129 Å²	129	136.3 Å²	136.3	60%	0.603	71%	0.709	S	S	*	*				84.7	-160.7	104.2	-155.6	179.2	100.3	0	0	109.3
234	R	34.1	Very low	31.7	Very low	175 Å²	175	135 Å²	135	66%	0.66	71%	0.708	S	S	*	*			trans	58.2	117.2	146.2	-77	170.6	-162.2	-92.2	-13.7	116.5
235	Q	36.1	Very low	32	Very low	149 Å²	149	131 Å²	131	70%	0.696	70%	0.702	S	S	*	*			cis	-161.5	161.9	24.7	-61.3	-167.8	-8.3	0	0	109.4
236	Q	33.2	Very low	32.2	Very low	114 Å²	114	136.1 Å²	136.1	53%	0.533	71%	0.708	S	S	.	*			cis	-167.3	158.3	-15	-109.8	173.2	-41.7	0	0	109.6
237	E	33	Very low	32.3	Very low	137 Å²	137	130.9 Å²	130.9	64%	0.64	70%	0.698	S	S	*	*			trans	16.8	107.5	134.5	-53.5	154.4	-141	0	0	119.2
238	A	36.6	Very low	32.4	Very low	86 Å²	86	130.9 Å²	130.9	71%	0.711	69%	0.691	S	S	*	*				178.2	136.8	124.7	0	0	0	0	0	110.5
239	K	39.9	Very low	32.4	Very low	197 Å²	197	134.9 Å²	134.9	86%	0.857	70%	0.695	S	S	*	*			cis	-119.1	136.5	0.8	-67.9	179.5	-179	173.3	0	109.4
240	K	33.6	Very low	32.3	Very low	137 Å²	137	132.8 Å²	132.8	60%	0.596	68%	0.681	S	S	*	*			cis	79.4	127.1	47.9	-78.2	-168.8	166.8	-170.4	0	114.2
241	D	32.6	Very low	32.2	Very low	141 Å²	141	129.3 Å²	129.3	75%	0.754	67%	0.671	S	S	*	*			trans	59.8	84.5	137.2	-44.3	-16	0	0	0	117.8
242	A	32.9	Very low	32	Very low	91 Å²	91	132.9 Å²	132.9	75%	0.752	67%	0.674	S	S	*	*			trans	-151.1	104.6	141.5	0	0	0	0	0	112.5
243	I	32.3	Very low	31.8	Very low	151 Å²	151	131.1 Å²	131.1	77%	0.774	66%	0.662	S	S	*	*			trans	60.1	98.6	133	-59.7	168.7	0	0	0	116.6	D245	I243-D245 HydrophobicContact CG2-CB 4.27Å; I243-D245 PolarHBondContact O-N 2.8Å
244	N	30	Very low	31.8	Very low	136 Å²	136	132.2 Å²	132.2	73%	0.727	66%	0.664	S	S	*	*			trans	-42.1	118.1	135.9	158.5	87	0	0	0	110.3
245	D	31.7	Very low	31.6	Very low	130 Å²	130	132.7 Å²	132.7	70%	0.695	67%	0.666	S	S	*	*			trans	-129.1	115.8	155.3	-168.8	18.9	0	0	0	109.8	I243 G247	I243-D245 HydrophobicContact CG2-CB 4.27Å; I243-D245 PolarHBondContact O-N 2.8Å; D245-G247 PolarHBondContact O-N 3.1Å; D245-G247 PolarHBondContact OD1-N 2.97Å; D245-G247 WeakPolarHBondContact OD2-CA 3.39Å
246	Q	30.8	Very low	31.4	Very low	176 Å²	176	131.5 Å²	131.5	82%	0.822	67%	0.669	S	S	*	*			trans	-78.5	59	164.1	-68.8	-177	-49.1	0	0	107.9	R248	Q246-R248 VanDerWaalsContact C-N 3.34Å; Q246-R248 PolarHBondContact O-N 3.35Å
247	G	27.9	Very low	31.4	Very low	52 Å²	52	130.5 Å²	130.5	54%	0.536	68%	0.68	S	S	.	*			trans	-81.5	71.3	-166	0	0	0	0	0	113.2	D245 L249	D245-G247 PolarHBondContact O-N 3.1Å; D245-G247 PolarHBondContact OD1-N 2.97Å; D245-G247 WeakPolarHBondContact OD2-CA 3.39Å; G247-L249 PolarHBondContact O-N 2.8Å
248	R	31.2	Very low	31.3	Very low	155 Å²	155	127.6 Å²	127.6	59%	0.585	69%	0.687	S	S	*	*			trans	-37.7	121.9	162.5	-113	179.9	142.1	-138.9	-5	111.6	Q246 E250 D251	Q246-R248 VanDerWaalsContact C-N 3.34Å; Q246-R248 PolarHBondContact O-N 3.35Å; R248-E250 HydrophobicContact CB-CG 3.82Å; R248-E250 WeakPolarHBondContact CD-OE1 3.35Å; R248-E250 HydrophobicContact CG-CG 3.64Å; R248-E250 VanDerWaalsContact CZ-CG 3.46Å; R248-E250 IonicContact CZ-OE1 3.27Å; R248-E250 VanDerWaalsContact CZ-OE1 3.27Å; R248-E250 IonicContact NE-OE1 3.56Å; R248-E250 IonicContact NH1-OE1 2.65Å; R248-E250 PolarHBondContact NH1-OE1 3Å; R248-D251 IonicContact CZ-OD1 3.77Å; R248-D251 IonicContact CZ-OD2 3.52Å; R248-D251 IonicContact NE-OD1 3.99Å; R248-D251 IonicContact NH1-OD2 3.98Å; R248-D251 IonicContact NH2-OD1 2.88Å; R248-D251 PolarHBondContact NH2-OD1 2.94Å; R248-D251 IonicContact NH2-OD2 2.66Å; R248-D251 PolarHBondContact NH2-OD2 3.07Å
249	L	27.9	Very low	31.2	Very low	154 Å²	154	128.5 Å²	128.5	81%	0.806	69%	0.688	S	S	*	*				-122.7	104.7	106.4	-71	-177.4	0	0	0	106.3	G247	G247-L249 PolarHBondContact O-N 2.8Å
250	E	27	Very low	30.9	Very low	99 Å²	99	124.9 Å²	124.9	46%	0.463	68%	0.682	S	S	.	*				69.3	96.6	74.8	-67	178.4	-179.6	0	0	108.7	R248	R248-E250 HydrophobicContact CB-CG 3.82Å; R248-E250 WeakPolarHBondContact CD-OE1 3.35Å; R248-E250 HydrophobicContact CG-CG 3.64Å; R248-E250 VanDerWaalsContact CZ-CG 3.46Å; R248-E250 IonicContact CZ-OE1 3.27Å; R248-E250 VanDerWaalsContact CZ-OE1 3.27Å; R248-E250 IonicContact NE-OE1 3.56Å; R248-E250 IonicContact NH1-OE1 2.65Å; R248-E250 PolarHBondContact NH1-OE1 3Å
251	D	26.6	Very low	30.8	Very low	106 Å²	106	123.8 Å²	123.8	57%	0.567	69%	0.687	S	S	*	*				105.9	167.8	87.4	-79.6	-6.9	0	0	0	105.7	R248	R248-D251 IonicContact CZ-OD1 3.77Å; R248-D251 IonicContact CZ-OD2 3.52Å; R248-D251 IonicContact NE-OD1 3.99Å; R248-D251 IonicContact NH1-OD2 3.98Å; R248-D251 IonicContact NH2-OD1 2.88Å; R248-D251 PolarHBondContact NH2-OD1 2.94Å; R248-D251 IonicContact NH2-OD2 2.66Å; R248-D251 PolarHBondContact NH2-OD2 3.07Å
252	E	27.2	Very low	30.8	Very low	159 Å²	159	121.8 Å²	121.8	74%	0.743	68%	0.684	S	S	*	*			cis	-131.4	131.1	5.9	-154.7	170.9	155.3	0	0	111.3
253	E	29.6	Very low	30.7	Very low	80 Å²	80	121.3 Å²	121.3	37%	0.374	68%	0.675	S	S	.	*			trans	42.6	139.4	146.8	-60	-160.7	7.4	0	0	122.8	R255	E253-R255 IonicContact OE1-CZ 3.1Å; E253-R255 IonicContact OE1-NE 2.73Å; E253-R255 PolarHBondContact OE1-NE 2.96Å; E253-R255 IonicContact OE1-NH2 2.66Å; E253-R255 PolarHBondContact OE1-NH2 3.1Å; E253-R255 IonicContact OE2-NH2 3.78Å
254	K	33.1	Very low	30.5	Very low	152 Å²	152	121 Å²	121	66%	0.661	67%	0.671	S	S	*	*				30.2	123.4	95.6	-21.5	155.5	-160.7	158.5	0	113.3
255	R	31.5	Very low	30.5	Very low	185 Å²	185	120.9 Å²	120.9	70%	0.698	67%	0.666	S	S	*	*				-178.7	102.6	104.8	-93.9	144.9	-155.6	-99.9	10.7	109.2	E253	E253-R255 IonicContact OE1-CZ 3.1Å; E253-R255 IonicContact OE1-NE 2.73Å; E253-R255 PolarHBondContact OE1-NE 2.96Å; E253-R255 IonicContact OE1-NH2 2.66Å; E253-R255 PolarHBondContact OE1-NH2 3.1Å; E253-R255 IonicContact OE2-NH2 3.78Å
256	T	31.6	Very low	30.4	Very low	124 Å²	124	122.6 Å²	122.6	76%	0.761	67%	0.667	S	S	*	*				79.1	152	100	54.9	0	0	0	0	113.9	G258	T256-G258 PolarHBondContact O-N 3.11Å
257	A	31.8	Very low	30.7	Very low	93 Å²	93	120.3 Å²	120.3	77%	0.769	66%	0.664	S	S	*	*			trans	49.5	62.7	164.5	0	0	0	0	0	114.4
258	G	32.4	Very low	31.2	Very low	75 Å²	75	123.1 Å²	123.1	77%	0.773	67%	0.673	S	S	*	*			cis	79.4	-130.9	43.5	0	0	0	0	0	108.7	T256	T256-G258 PolarHBondContact O-N 3.11Å
259	S	32.9	Very low	31.5	Very low	105 Å²	105	120.6 Å²	120.6	73%	0.734	68%	0.68	S	S	*	*			trans	64.9	115.3	168.8	-86.6	0	0	0	0	119.2
260	V	33.5	Very low	32.1	Very low	122 Å²	122	118.5 Å²	118.5	74%	0.739	68%	0.675	S	S	*	*				88.3	95.1	122.5	172.8	0	0	0	0	117.7
261	V	33.1	Very low	32.3	Very low	113 Å²	113	123.9 Å²	123.9	69%	0.685	69%	0.691	S	S	*	*				82.9	110.3	124.3	172.1	0	0	0	0	117.3
262	S	31.6	Very low	32.6	Very low	100 Å²	100	125.4 Å²	125.4	70%	0.699	70%	0.699	S	S	*	*				39.8	158.8	105.1	-21.3	0	0	0	0	119
263	S	31.8	Very low	32.9	Very low	81 Å²	81	121.4 Å²	121.4	57%	0.566	69%	0.694	S	S	*	*			cis	-158.9	142.7	34.2	-114	0	0	0	0	113.8
264	E	28.2	Very low	32.9	Very low	145 Å²	145	127.7 Å²	127.7	68%	0.678	71%	0.714	S	S	*	*				57.9	117	126.9	-63.7	174.4	103.5	0	0	121.2
265	Q	28.5	Very low	33	Very low	133 Å²	133	126.8 Å²	126.8	62%	0.621	71%	0.712	S	S	*	*				82.9	129.7	117.3	-70.3	-177.9	42.3	0	0	121.1
266	K	29.5	Very low	32.9	Very low	166 Å²	166	123.5 Å²	123.5	72%	0.722	71%	0.708	S	S	*	*				76.7	99.4	120.3	-173.4	175.1	175.9	-173.4	0	117.4
267	V	37.5	Very low	33	Very low	127 Å²	127	124.6 Å²	124.6	77%	0.77	71%	0.708	S	S	*	*				48.9	122	75.6	-178.2	0	0	0	0	111.5
268	P	38.9	Very low	32.8	Very low	111 Å²	111	124.9 Å²	124.9	72%	0.721	71%	0.705	S	S	*	*			cis	-141.1	178.3	35.5	28	-2.9	0	0	0	117.5
269	S	37.3	Very low	33	Very low	103 Å²	103	125.8 Å²	125.8	72%	0.72	71%	0.705	S	S	*	*			trans	13.5	139.7	135.2	-149.7	0	0	0	0	119.2
270	P	41.4	Very low	32.9	Very low	110 Å²	110	126.3 Å²	126.3	71%	0.714	71%	0.709	S	S	*	*				-149.4	141.7	90.8	38.5	-21.4	0	0	0	118.2
271	R	31.1	Very low	33.3	Very low	211 Å²	211	126.3 Å²	126.3	80%	0.796	71%	0.711	S	S	*	*				62.5	162.4	127.7	-65.1	-172.2	-179.4	175.6	0.7	124.2
272	D	33.2	Very low	33.4	Very low	139 Å²	139	125.5 Å²	125.5	74%	0.743	72%	0.716	S	S	*	*			trans	74.2	90.5	145.6	-62	-27.6	0	0	0	122.4
273	A	31.8	Very low	33.4	Very low	75 Å²	75	127.2 Å²	127.2	62%	0.62	72%	0.717	S	S	*	*				91.5	108.6	99.9	0	0	0	0	0	122
274	R	30.9	Very low	33.5	Very low	211 Å²	211	129.6 Å²	129.6	80%	0.796	72%	0.724	S	S	*	*				65.3	166.2	121.6	-59.6	-178.2	-179.9	-166.8	0	121
275	H	34.2	Very low	33.6	Very low	134 Å²	134	127.7 Å²	127.7	62%	0.62	72%	0.719	S	S	*	*			trans	72.8	138.2	159.2	-60.2	-66.1	0	0	0	116
276	D	30.7	Very low	33.8	Very low	116 Å²	116	132.9 Å²	132.9	62%	0.62	73%	0.732	S	S	*	*			cis	-163.8	162.7	-8.9	-115.5	-7.6	0	0	0	112.8
277	L	33.1	Very low	33.8	Very low	146 Å²	146	131.6 Å²	131.6	76%	0.764	72%	0.723	S	S	*	*			trans	45.3	153.7	138.3	-59.1	169.2	0	0	0	121.4
278	S	28.2	Very low	33.7	Very low	99 Å²	99	131.9 Å²	131.9	69%	0.692	73%	0.725	S	S	*	*			cis	-174.3	-176.3	-16.4	58.8	0	0	0	0	109.5
279	A	35.9	Very low	33.4	Very low	94 Å²	94	131.9 Å²	131.9	78%	0.777	73%	0.728	S	S	*	*			trans	66.1	121.8	171.7	0	0	0	0	0	116.6
280	S	30.3	Very low	33.1	Very low	117 Å²	117	137.1 Å²	137.1	82%	0.818	74%	0.738	S	S	*	*			cis	78.8	153.2	28.3	-125.3	0	0	0	0	114.2
281	P	42.3	Very low	32.7	Very low	121 Å²	121	135.6 Å²	135.6	79%	0.786	74%	0.741	S	S	*	*				-139.4	163	-100.4	37.6	-18.1	0	0	0	117.8
282	A	35.9	Very low	32.8	Very low	96 Å²	96	131.5 Å²	131.5	79%	0.793	74%	0.74	S	S	*	*			trans	-161.9	145.8	156.8	0	0	0	0	0	109.4
283	N	30.9	Very low	32.8	Very low	136 Å²	136	132.4 Å²	132.4	73%	0.727	75%	0.745	S	S	*	*			cis	85.1	91.2	20.9	-165.8	71.3	0	0	0	116.4
284	N	33.8	Very low	32.7	Very low	131 Å²	131	132.9 Å²	132.9	70%	0.701	75%	0.749	S	S	*	*				176.5	130.1	128.2	-90.9	-12	0	0	0	114.3
285	D	31.4	Very low	32.7	Very low	106 Å²	106	129.8 Å²	129.8	57%	0.567	75%	0.747	S	S	*	*			trans	13.1	142.9	137.2	-48.6	-32.7	0	0	0	122.3
286	R	31.8	Very low	32.5	Very low	242 Å²	242	130.6 Å²	130.6	91%	0.913	75%	0.751	S	S	*	*				-166.4	147.5	97.4	-176.6	156	-79.5	-170.6	-5.4	113.4
287	W	29.4	Very low	32.4	Very low	139 Å²	139	135 Å²	135	53%	0.527	76%	0.759	S	S	.	*			trans	-80.9	168.6	-179.8	-48.8	-17.2	0	0	0	114.9	W992	W287-W992 HydrophobicContact CE3-CZ2 4.11Å; W287-W992 HydrophobicContact CH2-CD2 4.26Å; W287-W992 AromaticContact CH2-CE2 3.51Å; W287-W992 AromaticContact CH2-CH2 3.84Å; W287-W992 HydrophobicContact CH2-CH2 3.84Å; W287-W992 AromaticContact CH2-CZ2 3.29Å; W287-W992 HydrophobicContact CH2-CZ2 3.29Å; W287-W992 HydrophobicContact CH2-CZ3 4.49Å; W287-W992 AromaticContact CH2-NE1 3.83Å; W287-W992 AromaticContact CZ2-CE2 3.99Å; W287-W992 HydrophobicContact CZ2-CZ2 4.16Å; W287-W992 AromaticContact CZ2-NE1 3.81Å; W287-W992 AromaticContact CZ3-CE2 3.95Å; W287-W992 AromaticContact CZ3-CH2 3.78Å; W287-W992 HydrophobicContact CZ3-CH2 3.78Å; W287-W992 AromaticContact CZ3-CZ2 3.27Å; W287-W992 HydrophobicContact CZ3-CZ2 3.27Å
288	T	35.6	Very low	32.3	Very low	133 Å²	133	136.7 Å²	136.7	82%	0.816	76%	0.755	S	S	*	*				155	158	127.4	42.3	0	0	0	0	109.9
289	S	31.7	Very low	32.4	Very low	110 Å²	110	138.1 Å²	138.1	77%	0.769	75%	0.751	S	S	*	*			cis	-165.1	168.8	-26.7	-102.1	0	0	0	0	108.9
290	K	30.8	Very low	32.2	Very low	214 Å²	214	138.1 Å²	138.1	93%	0.93	75%	0.746	S	S	*	*			trans	-44.1	145.5	174.6	-55.1	164.3	-178.9	172.5	0	114.6
291	G	33.9	Very low	32.5	Very low	77 Å²	77	138.8 Å²	138.8	79%	0.794	74%	0.739	S	S	*	*			trans	-160.8	135.6	164.1	0	0	0	0	0	112.2
292	T	33.9	Very low	32.2	Very low	126 Å²	126	140.2 Å²	140.2	77%	0.773	74%	0.736	S	S	*	*			trans	-125.4	154	-175.2	49	0	0	0	0	113
293	N	32.9	Very low	32.2	Very low	158 Å²	158	140.5 Å²	140.5	85%	0.845	72%	0.724	S	S	*	*			trans	69.7	168	155.4	-70.2	-30.3	0	0	0	120.1
294	A	29.5	Very low	32.5	Very low	84 Å²	84	142.2 Å²	142.2	69%	0.694	72%	0.72	S	S	*	*			trans	83.8	89.5	155.5	0	0	0	0	0	119.9
295	L	29.9	Very low	32.6	Very low	146 Å²	146	143.9 Å²	143.9	76%	0.764	72%	0.716	S	S	*	*				62.1	125.9	112.4	-70.8	159.7	0	0	0	121.3
296	Q	31.5	Very low	33	Very low	151 Å²	151	148.5 Å²	148.5	71%	0.706	73%	0.727	S	S	*	*			trans	72.4	135.3	135.6	-72.1	-178.3	5.2	0	0	120.9
297	R	28.9	Very low	33.1	Very low	210 Å²	210	142.2 Å²	142.2	79%	0.792	72%	0.716	S	S	*	*			trans	70.4	148.4	155.8	-68.9	172.7	166.1	-178.9	-3	114
298	R	29.9	Very low	33.4	Very low	180 Å²	180	141.6 Å²	141.6	68%	0.679	73%	0.727	S	S	*	*			cis	-159.9	159.7	2.2	-132.6	170.1	165	-154.6	-6	110.2
299	Q	30.7	Very low	33.4	Very low	130 Å²	130	140.6 Å²	140.6	61%	0.607	72%	0.721	S	S	*	*			trans	48.8	107.3	140.7	-81.9	163.3	-26.7	0	0	118.4
300	S	31.9	Very low	33.4	Very low	94 Å²	94	141.1 Å²	141.1	66%	0.657	72%	0.715	S	S	*	*				77.3	139	91.5	70.8	0	0	0	0	113.9
301	L	36.6	Very low	33.3	Very low	131 Å²	131	137.1 Å²	137.1	69%	0.686	70%	0.7	S	S	*	*				-167.2	166	59.9	-89.2	170.3	0	0	0	112.2
302	Q	36.1	Very low	33.2	Very low	151 Å²	151	140.6 Å²	140.6	71%	0.706	70%	0.696	S	S	*	*			trans	69.1	149.5	144.2	-74.7	156.3	-15.8	0	0	119.1
303	D	36.3	Very low	32.9	Very low	101 Å²	101	139.3 Å²	139.3	54%	0.54	69%	0.692	S	S	.	*			cis	-152.2	166.2	-3.8	-131.1	-11.1	0	0	0	116.1
304	R	35.9	Very low	32.8	Very low	173 Å²	173	138.5 Å²	138.5	65%	0.653	69%	0.687	S	S	*	*			trans	7.2	157.7	151.4	-69.1	134.3	96.3	-169.9	5	120.5
305	R	36.4	Very low	32.8	Very low	166 Å²	166	144.4 Å²	144.4	63%	0.626	69%	0.692	S	S	*	*			cis	-164	164.9	4.6	-112.5	160.8	-173.6	-178.4	-3.6	105.8
306	Y	39.4	Very low	32.7	Very low	203 Å²	203	143.7 Å²	143.7	80%	0.796	69%	0.689	S	S	*	*				-150.7	-177.6	52.1	-93.8	-82.4	0	0	0	112.1
307	T	33.6	Very low	32.7	Very low	109 Å²	109	141.9 Å²	141.9	67%	0.669	69%	0.688	S	S	*	*			trans	-158.2	177.7	-153.7	44.2	0	0	0	0	111.3
308	V	36.2	Very low	32.7	Very low	127 Å²	127	141.3 Å²	141.3	77%	0.77	69%	0.686	S	S	*	*			trans	80.8	140	164.9	-171.6	0	0	0	0	113
309	T	36.1	Very low	32.6	Very low	112 Å²	112	136.6 Å²	136.6	69%	0.687	68%	0.677	S	S	*	*			cis	-143.6	160	11.5	-1.7	0	0	0	0	112
310	N	31.4	Very low	32.9	Very low	121 Å²	121	137.7 Å²	137.7	65%	0.647	69%	0.687	S	S	*	*				16.4	156.6	115.6	-58.3	30.6	0	0	0	119.5
311	E	29.6	Very low	32.8	Very low	129 Å²	129	139.3 Å²	139.3	60%	0.603	68%	0.684	S	S	*	*			cis	-171.4	174.8	-2.5	-118.5	177.1	123.5	0	0	111.8
312	Q	30.3	Very low	32.4	Very low	151 Å²	151	136.5 Å²	136.5	71%	0.706	68%	0.68	S	S	*	*			trans	61	174.3	143.5	-72.6	163.6	21	0	0	118.7
313	S	28.9	Very low	31.9	Very low	99 Å²	99	137.1 Å²	137.1	69%	0.692	68%	0.676	S	S	*	*			trans	45.1	129.8	158.4	60.9	0	0	0	0	118.6
314	D	29.4	Very low	31.5	Very low	140 Å²	140	140.2 Å²	140.2	75%	0.749	69%	0.687	S	S	*	*			cis	160.8	166.9	-4.9	-123.7	-54.5	0	0	0	103.1
315	R	29.4	Very low	31.3	Very low	209 Å²	209	134.6 Å²	134.6	79%	0.789	67%	0.668	S	S	*	*			trans	64.3	142	156.6	-74	-173.7	166.6	139.5	2.7	116.9
316	D	28.8	Very low	30.9	Very low	131 Å²	131	137.8 Å²	137.8	70%	0.701	68%	0.68	S	S	*	*				47.8	113.6	105.3	-40.9	-39.7	0	0	0	112.2
317	T	31	Very low	30.4	Very low	113 Å²	113	136.8 Å²	136.8	69%	0.693	68%	0.675	S	S	*	*			cis	-140.7	152.6	25.7	41.3	0	0	0	0	110.9
318	R	28.3	Very low	30.2	Very low	198 Å²	198	139.6 Å²	139.6	75%	0.747	68%	0.681	S	S	*	*				55.9	137	60.4	165.5	-160.9	-178	176.6	2.8	110.9
319	T	29.1	Very low	29.8	Very low	80 Å²	80	138.6 Å²	138.6	49%	0.491	68%	0.679	S	S	.	*			trans	58.6	121.5	179.5	30.4	0	0	0	0	114.2	Q321	T319-Q321 HydrophobicContact CG2-CB 3.93Å; T319-Q321 HydrophobicContact CG2-CG 4.02Å
320	D	35.8	Very low	29.4	Very low	153 Å²	153	136.2 Å²	136.2	82%	0.818	68%	0.677	S	S	*	*			cis	-111.3	115.4	15.5	-67.4	-36.7	0	0	0	110.1
321	Q	30.1	Very low	29.3	Very low	128 Å²	128	134.7 Å²	134.7	60%	0.598	68%	0.681	S	S	*	*			cis	48	149.3	40.5	-65.8	-164.1	8.9	0	0	114.7	T319	T319-Q321 HydrophobicContact CG2-CB 3.93Å; T319-Q321 HydrophobicContact CG2-CG 4.02Å
322	A	29.2	Very low	29.4	Very low	73 Å²	73	138.5 Å²	138.5	60%	0.603	70%	0.696	S	S	*	*			trans	68.1	110.8	145.7	0	0	0	0	0	117.6
323	R	25.5	Very low	29.4	Very low	164 Å²	164	136.1 Å²	136.1	62%	0.619	70%	0.696	S	S	*	*				65.8	84.6	76.9	-167.1	-136.8	-173.2	-150.6	9.1	108.7	Q325	R323-Q325 HydrophobicContact CB-CG 4.26Å; R323-Q325 VanDerWaalsContact CD-CG 3.49Å; R323-Q325 HydrophobicContact CG-CB 4.4Å; R323-Q325 HydrophobicContact CG-CG 3.54Å; R323-Q325 VanDerWaalsContact O-CG 3.25Å; R323-Q325 WeakPolarHBondContact O-CG 3.43Å; R323-Q325 PolarHBondContact O-NE2 3.12Å
324	E	28.2	Very low	29.6	Very low	165 Å²	165	136.5 Å²	136.5	77%	0.771	69%	0.693	S	S	*	*	S	Bend		-75	86.4	114.3	-156	64.1	-112.3	0	0	104.7
325	Q	31.7	Very low	29.8	Very low	56 Å²	56	135.9 Å²	135.9	26%	0.262	70%	0.695	S	S	.	*				55.6	109	80.4	-67.8	171.3	89.3	0	0	107.7	R323 R327	R323-Q325 HydrophobicContact CB-CG 4.26Å; R323-Q325 VanDerWaalsContact CD-CG 3.49Å; R323-Q325 HydrophobicContact CG-CB 4.4Å; R323-Q325 HydrophobicContact CG-CG 3.54Å; R323-Q325 VanDerWaalsContact O-CG 3.25Å; R323-Q325 WeakPolarHBondContact O-CG 3.43Å; R323-Q325 PolarHBondContact O-NE2 3.12Å; Q325-R327 HydrophobicContact CB-CG 4.47Å; Q325-R327 PolarHBondContact O-N 3.21Å
326	R	27.9	Very low	29.8	Very low	233 Å²	233	136 Å²	136	88%	0.879	70%	0.696	S	S	*	*			cis	50.7	26.1	47.3	-139.7	-174.7	-161.4	-137.9	5.6	113.3
327	R	27.2	Very low	30	Very low	181 Å²	181	138.5 Å²	138.5	68%	0.683	70%	0.7	S	S	*	*			trans	-129.3	132.9	147.5	-69.5	175.1	170.3	169.6	-4.9	103.5	Q325	Q325-R327 HydrophobicContact CB-CG 4.47Å; Q325-R327 PolarHBondContact O-N 3.21Å
328	E	29.7	Very low	30.1	Very low	169 Å²	169	138.4 Å²	138.4	79%	0.79	70%	0.699	S	S	*	*			cis	-130.8	136.6	3.5	-60.3	164.5	143.4	0	0	106.3
329	S	27.3	Very low	30.3	Very low	106 Å²	106	133.8 Å²	133.8	74%	0.741	70%	0.697	S	S	*	*			cis	60	93	23.5	82.2	0	0	0	0	114.5
330	G	29.5	Very low	30.5	Very low	61 Å²	61	137.6 Å²	137.6	63%	0.629	71%	0.707	S	S	*	*			trans	94.6	111.2	-164.4	0	0	0	0	0	108.6
331	A	28.9	Very low	30.5	Very low	90 Å²	90	134.9 Å²	134.9	74%	0.744	69%	0.689	S	S	*	*			cis	68.4	135.2	46.3	0	0	0	0	0	112.9
332	K	31.7	Very low	30.7	Very low	209 Å²	209	137.3 Å²	137.3	91%	0.909	69%	0.693	S	S	*	*			trans	72.5	149.3	179.2	-56.2	163.1	-174.2	176.9	0	112.9
333	S	30.4	Very low	30.9	Very low	100 Å²	100	143.2 Å²	143.2	70%	0.699	70%	0.7	S	S	*	*			cis	-159.2	149.3	-14	167.3	0	0	0	0	111.1
334	V	32.2	Very low	31.4	Very low	107 Å²	107	138.3 Å²	138.3	65%	0.648	70%	0.701	S	S	*	*			trans	7.7	117.4	147.4	-173.4	0	0	0	0	117.7	R336	V334-R336 HydrophobicContact CG1-CG 4.42Å
335	T	33.2	Very low	31.5	Very low	127 Å²	127	136.1 Å²	136.1	78%	0.779	70%	0.704	S	S	*	*				-159.3	127.4	114.7	28.6	0	0	0	0	108.3
336	R	29.7	Very low	31.7	Very low	213 Å²	213	140.1 Å²	140.1	80%	0.804	73%	0.731	S	S	*	*				53.9	94.4	69.1	-76.5	-180	165.1	-180	-3.6	110.3	V334	V334-R336 HydrophobicContact CG1-CG 4.42Å
337	K	33.3	Very low	32.3	Very low	183 Å²	183	133 Å²	133	80%	0.796	72%	0.723	S	S	*	*				173.9	160.9	79.5	-86	169.8	178.7	177	0	106.8
338	T	32.3	Very low	32.9	Very low	110 Å²	110	129.1 Å²	129.1	68%	0.675	72%	0.721	S	S	*	*			cis	-171.3	154	-5.4	21.2	0	0	0	0	108.6
339	S	32.9	Very low	33.1	Very low	101 Å²	101	127.6 Å²	127.6	71%	0.706	72%	0.718	S	S	*	*			trans	67.2	152.9	145.2	-64.9	0	0	0	0	118.2
340	K	34.7	Very low	33.3	Very low	161 Å²	161	127.7 Å²	127.7	70%	0.7	71%	0.714	S	S	*	*			cis	-162.3	141.9	-10.5	-121.8	176.4	161.2	-127.7	0	109
341	E	34.6	Very low	33.6	Very low	95 Å²	95	131.3 Å²	131.3	44%	0.444	72%	0.724	S	S	.	*			trans	61.9	160.5	146.6	-71.2	179.2	104.9	0	0	118.1	R343	E341-R343 IonicContact OE1-CZ 2.69Å; E341-R343 IonicContact OE1-NE 2.95Å; E341-R343 PolarHBondContact OE1-NE 2.66Å; E341-R343 IonicContact OE1-NH2 2.7Å; E341-R343 PolarHBondContact OE1-NH2 2.85Å
342	R	35.5	Very low	33.8	Very low	180 Å²	180	132.1 Å²	132.1	68%	0.679	72%	0.724	S	S	*	*			cis	-139.8	128.8	2	-126.5	145.2	-162.8	-114.2	2.8	108.4
343	R	33.1	Very low	34.3	Very low	196 Å²	196	127.4 Å²	127.4	74%	0.74	72%	0.715	S	S	*	*				58.6	135.8	104.1	-55.6	-176.8	-150.2	-150.5	2.2	114.5	E341	E341-R343 IonicContact OE1-CZ 2.69Å; E341-R343 IonicContact OE1-NE 2.95Å; E341-R343 PolarHBondContact OE1-NE 2.66Å; E341-R343 IonicContact OE1-NH2 2.7Å; E341-R343 PolarHBondContact OE1-NH2 2.85Å
344	G	34.6	Very low	34.3	Very low	62 Å²	62	128.8 Å²	128.8	64%	0.639	72%	0.719	S	S	*	*			cis	-154.2	164.2	0.9	0	0	0	0	0	110.4
345	S	31.3	Very low	34.3	Very low	119 Å²	119	128.5 Å²	128.5	83%	0.832	72%	0.721	S	S	*	*				67.9	130.7	66	-45.3	0	0	0	0	111.6
346	V	35.5	Very low	34.6	Very low	139 Å²	139	131.1 Å²	131.1	84%	0.842	73%	0.725	S	S	*	*			cis	-139.7	163	20	-154.2	0	0	0	0	111
347	A	40.6	Very low	34.8	Very low	84 Å²	84	128.6 Å²	128.6	69%	0.694	73%	0.727	S	S	*	*			trans	-85.7	-146.9	155.6	0	0	0	0	0	108.2
348	P	41.1	Very low	35	Very low	99 Å²	99	123.8 Å²	123.8	64%	0.643	72%	0.722	S	S	*	*			cis	-132.9	-159.5	-15.8	21.7	6.3	0	0	0	112.4
349	D	33.3	Very low	35.1	Very low	137 Å²	137	123.8 Å²	123.8	73%	0.733	72%	0.722	S	S	*	*			trans	76.2	157.9	149.8	-69	-45.6	0	0	0	120.4
350	T	31.1	Very low	35.3	Very low	109 Å²	109	124.8 Å²	124.8	67%	0.669	72%	0.724	S	S	*	*			cis	-175.6	176.8	-33.4	-89.8	0	0	0	0	105.4
351	V	36.4	Very low	35.4	Very low	136 Å²	136	124.4 Å²	124.4	82%	0.824	72%	0.724	S	S	*	*			trans	80.3	145.4	170.6	-151.7	0	0	0	0	117.3
352	S	33.3	Very low	35.2	Very low	107 Å²	107	128.6 Å²	128.6	75%	0.748	74%	0.743	S	S	*	*			trans	-88.6	-152.5	169	-49.1	0	0	0	0	109.8
353	P	40.6	Very low	35.2	Very low	111 Å²	111	129.4 Å²	129.4	72%	0.721	75%	0.752	S	S	*	*			cis	-140.1	-162.6	-14.3	43.6	-23.9	0	0	0	114.7
354	V	31.2	Very low	35	Very low	129 Å²	129	124 Å²	124	78%	0.782	75%	0.749	S	S	*	*			trans	70.4	110.9	148.9	169	0	0	0	0	121.8
355	S	32.7	Very low	34.8	Very low	100 Å²	100	128.9 Å²	128.9	70%	0.699	76%	0.755	S	S	*	*				44.7	126.3	130	-154.9	0	0	0	0	123.6
356	Q	39.4	Very low	34.8	Very low	182 Å²	182	130.5 Å²	130.5	85%	0.85	75%	0.753	S	S	*	*				-174.5	176.8	103.8	-96.1	-176.6	43.2	0	0	113
357	N	33.7	Very low	34.7	Very low	160 Å²	160	127 Å²	127	86%	0.856	74%	0.744	S	S	*	*			trans	-82.6	174.9	-172	-58.9	-54.7	0	0	0	112.7
358	A	36.5	Very low	34.2	Very low	83 Å²	83	132.6 Å²	132.6	69%	0.686	75%	0.753	S	S	*	*			cis	-157.1	173.6	20.7	0	0	0	0	0	114.9
359	T	35.2	Very low	34.1	Very low	109 Å²	109	133.3 Å²	133.3	67%	0.669	76%	0.756	S	S	*	*			trans	6.2	137.6	151.7	-16.6	0	0	0	0	117.2
360	V	36.3	Very low	34.2	Very low	123 Å²	123	136.1 Å²	136.1	75%	0.745	76%	0.761	S	S	*	*				-131	-124.4	53.6	-176.3	0	0	0	0	113.2
361	H	37.1	Very low	34.2	Very low	152 Å²	152	137.9 Å²	137.9	70%	0.704	77%	0.766	S	S	*	*			trans	-154	168	-150.6	-61.2	-22.7	0	0	0	109.6
362	Q	30.6	Very low	33.9	Very low	183 Å²	183	135.7 Å²	135.7	86%	0.855	76%	0.763	S	S	*	*			cis	-134.3	-164.4	-1.7	-146.5	-180	84.1	0	0	109.2
363	K	34.9	Very low	33.9	Very low	197 Å²	197	139.5 Å²	139.5	86%	0.857	77%	0.766	S	S	*	*			trans	-154.5	122.7	-178.3	-130.9	170.6	-168.1	170.6	0	116.7
364	A	30.5	Very low	33.4	Very low	83 Å²	83	140.2 Å²	140.2	69%	0.686	76%	0.76	S	S	*	*			trans	-90	161.1	156	0	0	0	0	0	110.6
365	H	30.3	Very low	33.3	Very low	165 Å²	165	140.4 Å²	140.4	76%	0.764	76%	0.756	S	S	*	*			trans	56.7	138.5	153.8	-90.7	-109	0	0	0	121.9
366	I	31.4	Very low	33.2	Very low	152 Å²	152	144.6 Å²	144.6	78%	0.779	76%	0.764	S	S	*	*			trans	65.7	107.4	144.3	-62.8	164.7	0	0	0	117.9
367	G	31.8	Very low	33	Very low	65 Å²	65	139.4 Å²	139.4	67%	0.67	76%	0.759	S	S	*	*				101.5	152.6	111.4	0	0	0	0	0	118.6
368	K	31.2	Very low	32.9	Very low	202 Å²	202	138.3 Å²	138.3	88%	0.878	76%	0.759	S	S	*	*				-157.5	108.3	118.8	-107	161.3	-173.9	179.8	0	111.8
369	V	39.1	Very low	32.7	Very low	114 Å²	114	141.5 Å²	141.5	69%	0.691	76%	0.759	S	S	*	*			trans	-57.5	142.9	152.2	174.6	0	0	0	0	108
370	K	34.8	Very low	32.4	Very low	197 Å²	197	145 Å²	145	86%	0.857	76%	0.76	S	S	*	*			trans	-120.9	109	157.8	-78.9	-168	173.4	-174.7	0	108.7
371	N	30.7	Very low	32.2	Very low	145 Å²	145	147.4 Å²	147.4	78%	0.775	76%	0.756	S	S	*	*			trans	-88.3	171.1	173.7	-85.8	-24.9	0	0	0	110.8
372	A	30.5	Very low	31.8	Very low	90 Å²	90	149.3 Å²	149.3	74%	0.744	76%	0.757	S	S	*	*			trans	60.4	111	152.8	0	0	0	0	0	118.1
373	K	32.8	Very low	31.7	Very low	188 Å²	188	148.9 Å²	148.9	82%	0.817	76%	0.755	S	S	*	*				-165.1	156.6	108.5	-86.5	-146.2	176.6	-123.1	0	108.4
374	E	29.6	Very low	31.4	Very low	126 Å²	126	150.9 Å²	150.9	59%	0.589	76%	0.757	S	S	*	*			cis	170.6	140	-28.6	-113.2	-173.2	118.4	0	0	104.7
375	L	30.7	Very low	31.7	Very low	133 Å²	133	151.9 Å²	151.9	70%	0.696	76%	0.759	S	S	*	*			trans	64.9	144.4	150	-93.4	66	0	0	0	123.8
376	E	29.1	Very low	31.8	Very low	188 Å²	188	149.7 Å²	149.7	88%	0.879	76%	0.759	S	S	*	*			trans	68.5	165.9	148.8	-68	-178.5	148	0	0	120.5
377	G	35.7	Very low	31.7	Very low	73 Å²	73	147.6 Å²	147.6	75%	0.753	76%	0.758	S	S	*	*			trans	123.9	14	170.6	0	0	0	0	0	118.2	Q379	G377-Q379 PolarHBondContact O-N 2.81Å; G377-Q379 VanDerWaalsContact O-N 3.08Å
378	T	32.6	Very low	31.5	Very low	137 Å²	137	149.5 Å²	149.5	84%	0.84	77%	0.768	S	S	*	*			trans	-66.3	107.7	169	36.7	0	0	0	0	111
379	Q	30.9	Very low	31.2	Very low	150 Å²	150	144.6 Å²	144.6	70%	0.701	77%	0.765	S	S	*	*			trans	-178	131.8	138.9	-103	172.8	81.9	0	0	115.9	G377	G377-Q379 PolarHBondContact O-N 2.81Å; G377-Q379 VanDerWaalsContact O-N 3.08Å
380	R	29.8	Very low	30.6	Very low	181 Å²	181	142 Å²	142	68%	0.683	76%	0.761	S	S	*	*			trans	67.2	122.6	131.8	-73.5	172.7	-175.6	-169.3	-0.9	122.4
381	R	31.5	Very low	30.2	Very low	174 Å²	174	138.7 Å²	138.7	66%	0.657	76%	0.762	S	S	*	*				87.2	116.9	120.1	-75.9	177.1	173.5	-168.8	-2	120.4
382	R	29.7	Very low	30	Very low	192 Å²	192	136.1 Å²	136.1	73%	0.725	76%	0.756	S	S	*	*				78.8	135.7	122.7	-68.4	178	176.7	-165.9	-4.3	119.7
383	H	27.9	Very low	29.9	Very low	175 Å²	175	140.2 Å²	140.2	81%	0.81	76%	0.759	S	S	*	*			trans	-5.2	126.2	146.6	-35.6	-103.4	0	0	0	117
384	R	28.3	Very low	29.6	Very low	239 Å²	239	136 Å²	136	90%	0.902	75%	0.754	S	S	*	*				-169.1	130.9	120.6	-112.3	179.8	180	-178.9	-1.7	113.9
385	S	36.8	Very low	29.7	Very low	103 Å²	103	133.9 Å²	133.9	72%	0.72	77%	0.766	S	S	*	*			trans	-67.8	167.4	140.3	-22.3	0	0	0	0	108.8
386	P	33.4	Very low	29.9	Very low	119 Å²	119	131.8 Å²	131.8	77%	0.773	77%	0.768	S	S	*	*			cis	-145.5	-154.6	25.8	44.5	-23.1	0	0	0	114.5
387	S	29.1	Very low	30	Very low	109 Å²	109	129 Å²	129	76%	0.762	76%	0.759	S	S	*	*			trans	-59.2	169.8	171.4	-33.4	0	0	0	0	116.3
388	A	26.7	Very low	30	Very low	105 Å²	105	132.7 Å²	132.7	87%	0.868	76%	0.756	S	S	*	*			trans	72	147	168.5	0	0	0	0	0	116
389	A	26.4	Very low	30	Very low	99 Å²	99	132.2 Å²	132.2	82%	0.818	75%	0.748	S	S	*	*			cis	-125.5	168	-2.4	0	0	0	0	0	108.8
390	G	25.7	Very low	30	Very low	59 Å²	59	131.7 Å²	131.7	61%	0.608	75%	0.745	S	S	*	*			cis	101	145.2	24.9	0	0	0	0	0	110.2
391	S	25.9	Very low	30.2	Very low	127 Å²	127	131.8 Å²	131.8	89%	0.888	75%	0.747	S	S	*	*			trans	61.8	152.8	-157.4	73.6	0	0	0	0	113.6
392	S	27.7	Very low	30.3	Very low	91 Å²	91	128.9 Å²	128.9	64%	0.636	75%	0.748	S	S	*	*			cis	-115.9	132.2	3.9	46.2	0	0	0	0	111.1
393	E	28.8	Very low	30.5	Very low	176 Å²	176	123.9 Å²	123.9	82%	0.822	75%	0.749	S	S	*	*				80.4	138.6	104	-68.4	177.4	109.9	0	0	113.8
394	S	26.2	Very low	30.7	Very low	101 Å²	101	123 Å²	123	71%	0.706	75%	0.749	S	S	*	*			cis	154	144.2	-24.6	49.3	0	0	0	0	106.7
395	G	31.1	Very low	30.8	Very low	81 Å²	81	115.8 Å²	115.8	84%	0.835	74%	0.741	S	S	*	*			trans	75.8	153.7	-175.5	0	0	0	0	0	112.3
396	A	34.6	Very low	30.5	Very low	89 Å²	89	123 Å²	123	74%	0.736	75%	0.752	S	S	*	*			cis	-113.6	139	-12.6	0	0	0	0	0	107.1
397	D	31.1	Very low	30.5	Very low	129 Å²	129	121.3 Å²	121.3	69%	0.69	76%	0.757	S	S	*	*				63.4	139.8	60.4	-172.4	41.9	0	0	0	112.4
398	Q	35.4	Very low	30.7	Very low	151 Å²	151	127.7 Å²	127.7	71%	0.706	76%	0.764	S	S	*	*			trans	69.2	144.8	179.6	-60.5	157	54.9	0	0	116.1
399	L	33.3	Very low	31.1	Very low	126 Å²	126	127.2 Å²	127.2	66%	0.66	75%	0.752	S	S	*	*			cis	-161.6	137.1	-9.7	-114.3	168.4	0	0	0	111
400	H	31.2	Very low	31.2	Very low	140 Å²	140	129.2 Å²	129.2	65%	0.648	74%	0.744	S	S	*	*			trans	60.5	167.4	150.5	-84.4	-152.2	0	0	0	119.1
401	Y	33.8	Very low	31.3	Very low	183 Å²	183	133.7 Å²	133.7	72%	0.718	75%	0.747	S	S	*	*			cis	-149.7	131.6	9.4	-125.9	-56.6	0	0	0	110.6
402	T	33.4	Very low	31.3	Very low	112 Å²	112	135.9 Å²	135.9	69%	0.687	74%	0.737	S	S	*	*			trans	49.9	157.2	152.6	41.4	0	0	0	0	121.5	L404	T402-L404 HydrophobicContact CG2-CD1 3.85Å; T402-L404 HydrophobicContact CG2-CG 4.38Å
403	A	34.8	Very low	31.3	Very low	88 Å²	88	139.3 Å²	139.3	73%	0.727	74%	0.736	S	S	*	*			cis	-138	133.7	11.8	0	0	0	0	0	109
404	L	30.9	Very low	31.3	Very low	155 Å²	155	136 Å²	136	81%	0.812	72%	0.72	S	S	*	*				82.5	149.8	67.1	-69.6	170.4	0	0	0	115.3	T402	T402-L404 HydrophobicContact CG2-CD1 3.85Å; T402-L404 HydrophobicContact CG2-CG 4.38Å
405	A	30.9	Very low	31.5	Very low	89 Å²	89	136.7 Å²	136.7	74%	0.736	72%	0.716	S	S	*	*			trans	74.3	95.7	179.7	0	0	0	0	0	116.1
406	R	30	Very low	31.4	Very low	254 Å²	254	140.7 Å²	140.7	96%	0.958	71%	0.706	S	S	*	*				77.5	102.3	70.8	-71.1	173.1	177.9	177.6	-0.6	113.4
407	G	33	Very low	31.3	Very low	84 Å²	84	141.2 Å²	141.2	87%	0.866	70%	0.704	S	S	*	*			trans	-169.7	50.9	-178.6	0	0	0	0	0	116.1
408	R	35	Very low	31.1	Very low	243 Å²	243	140.4 Å²	140.4	92%	0.917	70%	0.7	S	S	*	*			trans	-86.3	160.3	154	-124.2	-168.1	177.1	-166.1	1.5	106.8
409	P	34.5	Very low	31.2	Very low	94 Å²	94	142 Å²	142	61%	0.61	71%	0.708	S	S	*	*			cis	-139.7	-157.4	9.8	37.9	-14.8	0	0	0	113.6
410	E	28.3	Very low	30.9	Very low	141 Å²	141	140.8 Å²	140.8	66%	0.659	70%	0.701	S	S	*	*			trans	68.2	163.9	153.9	-71.2	-175.2	136.7	0	0	117.6
411	K	27.8	Very low	30.8	Very low	154 Å²	154	143.1 Å²	143.1	67%	0.67	70%	0.704	S	S	*	*			cis	-161.2	155.7	-34.3	-116.8	170.2	-172.4	163.7	0	106.8
412	Y	26.2	Very low	30.8	Very low	173 Å²	173	138.8 Å²	138.8	68%	0.678	70%	0.7	S	S	*	*			trans	67.6	142.9	160.7	-86.9	-142.9	0	0	0	114.3
413	R	27.6	Very low	30.8	Very low	162 Å²	162	140.2 Å²	140.2	61%	0.611	70%	0.703	S	S	*	*			cis	93.7	146	33.3	-176.1	-166.2	158	178.6	-6.5	111.3
414	E	27.8	Very low	30.9	Very low	107 Å²	107	142.7 Å²	142.7	50%	0.5	70%	0.697	S	S	.	*			trans	69.8	129.6	-176.2	-89.2	96.9	-150.6	0	0	113.1
415	D	31.1	Very low	31.2	Very low	115 Å²	115	141.9 Å²	141.9	62%	0.615	69%	0.689	S	S	*	*			cis	95.4	156.4	42.1	-178	41.8	0	0	0	111.5
416	R	28.6	Very low	31.4	Very low	165 Å²	165	143.5 Å²	143.5	62%	0.623	68%	0.683	S	S	*	*			trans	79.1	124.8	178.5	-47.9	-167.7	179.9	98.4	38.4	113.7
417	S	32.5	Very low	32	Very low	100 Å²	100	136.3 Å²	136.3	70%	0.699	67%	0.672	S	S	*	*			cis	62.4	58.9	11.2	-45.6	0	0	0	0	115.5
418	D	27.2	Very low	32.6	Very low	113 Å²	113	135.2 Å²	135.2	60%	0.604	66%	0.661	S	S	*	*			trans	-108.4	115.4	146.5	-66	-44.3	0	0	0	106.5	I420	D418-I420 HydrophobicContact CB-CB 4.14Å; D418-I420 HydrophobicContact CB-CD1 4.25Å; D418-I420 HydrophobicContact CB-CG1 3.96Å; D418-I420 WeakPolarHBondContact OD1-CD1 3.32Å; D418-I420 VanDerWaalsContact OD1-CG1 3.31Å; D418-I420 WeakPolarHBondContact OD1-CG1 3.36Å
419	Q	37.4	Very low	33.1	Very low	185 Å²	185	131.5 Å²	131.5	86%	0.864	65%	0.654	S	S	*	*			cis	56.4	33.7	5.3	-148.2	178.3	91.7	0	0	116.1
420	I	26.5	Very low	33.8	Very low	99 Å²	99	134.4 Å²	134.4	51%	0.508	65%	0.654	S	S	.	*			trans	-124.4	123.2	164.9	-74.2	-175.7	0	0	0	108.2	D418	D418-I420 HydrophobicContact CB-CB 4.14Å; D418-I420 HydrophobicContact CB-CD1 4.25Å; D418-I420 HydrophobicContact CB-CG1 3.96Å; D418-I420 WeakPolarHBondContact OD1-CD1 3.32Å; D418-I420 VanDerWaalsContact OD1-CG1 3.31Å; D418-I420 WeakPolarHBondContact OD1-CG1 3.36Å
421	R	30	Very low	34.3	Very low	189 Å²	189	137.1 Å²	137.1	71%	0.713	66%	0.658	S	S	*	*			cis	-161.7	179.1	-7.8	-133.5	172.5	-136.8	149.3	8.6	112
422	S	32.7	Very low	35.4	Very low	92 Å²	92	135 Å²	135	64%	0.643	66%	0.66	S	S	*	*			trans	85.2	109.9	155.8	-64.5	0	0	0	0	115.9
423	L	35	Very low	36.2	Very low	143 Å²	143	132.2 Å²	132.2	75%	0.749	66%	0.663	S	S	*	*				74.6	132.6	55.9	-65.2	167.9	0	0	0	110.4
424	K	36.5	Very low	37.1	Very low	140 Å²	140	132.2 Å²	132.2	61%	0.609	68%	0.675	S	S	*	*			cis	-176.6	-167.3	3.3	170.2	-156.8	160.2	-146.9	0	106.5
425	E	37.1	Very low	37.6	Very low	137 Å²	137	130.2 Å²	130.2	64%	0.64	68%	0.683	S	S	*	*			trans	98.2	131.7	146.9	-47.5	-155.7	149.7	0	0	117.1
426	M	35.6	Very low	37.6	Very low	124 Å²	124	129.9 Å²	129.9	61%	0.611	69%	0.69	S	S	*	*			cis	-150.2	129.4	-21	-113.7	-170.9	-53.3	0	0	106.7
427	S	42.7	Very low	37.8	Very low	103 Å²	103	127.9 Å²	127.9	72%	0.72	70%	0.696	S	S	*	*				57.4	139	97.2	80.6	0	0	0	0	115.9
428	G	45.1	Very low	37.8	Very low	61 Å²	61	129.7 Å²	129.7	63%	0.629	70%	0.697	S	S	*	*			trans	152.9	57.4	-169.9	0	0	0	0	0	108.4
429	E	45.4	Very low	38.2	Very low	165 Å²	165	129.8 Å²	129.8	77%	0.771	70%	0.704	S	S	*	*				81.5	147.9	93	-69.9	-173.6	124.7	0	0	111.4
430	Y	48.3	Very low	38.1	Very low	155 Å²	155	128.5 Å²	128.5	61%	0.608	70%	0.696	S	S	*	*			cis	-148.8	135.1	8.2	-145.7	-140.7	0	0	0	111.9
431	R	40.3	Very low	38.5	Very low	197 Å²	197	128 Å²	128	74%	0.743	70%	0.697	S	S	*	*			trans	65.4	160.7	134.2	-79.8	-163.2	178.4	160.1	-0	125
432	P	50	Low	38.9	Very low	110 Å²	110	128.9 Å²	128.9	71%	0.714	70%	0.701	S	S	*	*			trans	-115.2	-169.6	-172.5	45	-30.2	0	0	0	112.9
433	P	43.4	Very low	39.2	Very low	114 Å²	114	129.6 Å²	129.6	74%	0.74	70%	0.697	S	S	*	*				-146.6	-161	86.3	42.3	-24.8	0	0	0	113.7
434	D	47	Very low	39.6	Very low	162 Å²	162	131.5 Å²	131.5	87%	0.866	70%	0.695	S	S	*	*	S	Bend	trans	-71.8	-141.3	168.6	-61.5	-82	0	0	0	112.4
435	G	36.7	Very low	39.9	Very low	66 Å²	66	131.3 Å²	131.3	68%	0.68	70%	0.697	S	S	*	*	S	Bend	trans	-65.8	158.4	-170.2	0	0	0	0	0	116.5
436	S	30.9	Very low	40.1	Very low	107 Å²	107	132.5 Å²	132.5	75%	0.748	70%	0.703	S	S	*	*			trans	91.9	141.4	174.6	83.6	0	0	0	0	118
437	T	33.1	Very low	40	Very low	124 Å²	124	131.6 Å²	131.6	76%	0.761	71%	0.706	S	S	*	*			trans	77.5	113.3	155.2	-44.7	0	0	0	0	118.9
438	L	32.1	Very low	39.4	Very low	137 Å²	137	131.9 Å²	131.9	72%	0.717	71%	0.708	S	S	*	*				16.9	149.8	127.5	-72	175.9	0	0	0	119.9	F440	L438-F440 HydrophobicContact CD2-CD2 4.08Å
439	P	35.7	Very low	38.8	Very low	115 Å²	115	133.3 Å²	133.3	75%	0.747	71%	0.708	S	S	*	*			cis	-122.6	166.6	37.3	37.1	-18.7	0	0	0	113.5
440	F	36.9	Very low	38.2	Very low	159 Å²	159	133 Å²	133	70%	0.697	71%	0.707	S	S	*	*				39.9	126.9	73	-96.9	-108.7	0	0	0	112.8	L438	L438-F440 HydrophobicContact CD2-CD2 4.08Å
441	T	33.1	Very low	37.4	Very low	87 Å²	87	135.5 Å²	135.5	53%	0.534	72%	0.717	S	S	.	*			cis	-175.4	159.3	-18.5	21.4	0	0	0	0	105.4
442	R	39.5	Very low	37	Very low	209 Å²	209	128.7 Å²	128.7	79%	0.789	71%	0.707	S	S	*	*			trans	67.6	152.4	159	-69.8	166.7	168.4	110.6	-5	114.8
443	D	38.6	Very low	36.3	Very low	106 Å²	106	131.9 Å²	131.9	57%	0.567	71%	0.713	S	S	*	*	S	Bend	cis	-136	149	0.7	-120.7	-10.2	0	0	0	108.2
444	R	43.2	Very low	35.6	Very low	184 Å²	184	132.3 Å²	132.3	69%	0.694	71%	0.714	S	S	*	*			cis	-161.8	130.7	15.8	-162.2	153.6	177.2	153.6	-12.4	112.6
445	M	43.6	Very low	34.9	Very low	135 Å²	135	128.6 Å²	128.6	67%	0.665	70%	0.7	S	S	*	*			trans	57.5	143.5	150.6	-64.2	172.7	170.9	0	0	119.4
446	Q	41.1	Very low	34.7	Very low	163 Å²	163	135 Å²	135	76%	0.762	70%	0.704	S	S	*	*			cis	-153.4	160.7	-3.3	-120.5	160.1	-12.5	0	0	109.9
447	P	33.8	Very low	34.6	Very low	105 Å²	105	139.6 Å²	139.6	68%	0.682	71%	0.705	S	S	*	*			trans	-104.5	-172.8	-163.1	41.2	-35.7	0	0	0	114.5
448	S	29.3	Very low	34.4	Very low	109 Å²	109	144.7 Å²	144.7	76%	0.762	71%	0.71	S	S	*	*			trans	69.6	146.6	158.8	51.9	0	0	0	0	118
449	S	32	Very low	34.1	Very low	90 Å²	90	143 Å²	143	63%	0.629	71%	0.71	S	S	*	*			cis	-172.2	167.7	-7.4	44.4	0	0	0	0	111.6
450	H	33.6	Very low	33.8	Very low	159 Å²	159	149.2 Å²	149.2	74%	0.736	72%	0.718	S	S	*	*			trans	70.5	148	163.6	-66.5	-67.7	0	0	0	117.9
451	Y	32.4	Very low	33.8	Very low	208 Å²	208	146.9 Å²	146.9	82%	0.816	72%	0.719	S	S	*	*			cis	-151.2	153.4	1.1	-142.7	-74.6	0	0	0	111.3
452	G	31.4	Very low	33.4	Very low	53 Å²	53	149.8 Å²	149.8	55%	0.546	73%	0.731	S	S	.	*			trans	66	104.1	156.3	0	0	0	0	0	118.4
453	Q	34.1	Very low	32.9	Very low	177 Å²	177	146.5 Å²	146.5	83%	0.827	73%	0.727	S	S	*	*				57.3	115	70	-57.5	-178.5	-9.4	0	0	113.2
454	T	30.3	Very low	32.3	Very low	124 Å²	124	147 Å²	147	76%	0.761	73%	0.734	S	S	*	*				62.3	139.8	50.3	85.3	0	0	0	0	112.1
455	S	31.9	Very low	31.5	Very low	83 Å²	83	145.3 Å²	145.3	58%	0.58	74%	0.739	S	S	*	*			cis	-175.8	155.2	39.2	-139.8	0	0	0	0	111.9
456	R	32.6	Very low	30.8	Very low	201 Å²	201	143.5 Å²	143.5	76%	0.758	74%	0.739	S	S	*	*			trans	69.1	158.2	147.9	-67.4	162.8	-174.8	-163.9	-1.1	116.4
457	R	28.6	Very low	30.2	Very low	204 Å²	204	141.3 Å²	141.3	77%	0.77	74%	0.737	S	S	*	*			cis	-160.7	179.2	1.7	-127.8	166.3	-172.5	-168.8	-0.8	110.9
458	R	28.2	Very low	30.2	Very low	230 Å²	230	144.3 Å²	144.3	87%	0.868	74%	0.74	S	S	*	*			trans	77.6	90.8	162.1	-68.6	-178.4	-169.2	-136.5	4.3	120.2
459	S	26.4	Very low	30.4	Very low	103 Å²	103	144.6 Å²	144.6	72%	0.72	73%	0.729	S	S	*	*				51.5	139.8	109.1	66.6	0	0	0	0	123.9
460	R	29.1	Very low	30.4	Very low	244 Å²	244	150.2 Å²	150.2	92%	0.921	74%	0.736	S	S	*	*			trans	84.1	154.9	154.4	-84.1	-171.5	170.5	-152.1	-4.9	118.3
461	P	36.5	Very low	30.4	Very low	110 Å²	110	147.4 Å²	147.4	71%	0.714	73%	0.734	S	S	*	*			trans	-99.6	-173.5	-163	40.3	-36.2	0	0	0	113.7
462	L	26	Very low	30.4	Very low	148 Å²	148	144.5 Å²	144.5	78%	0.775	73%	0.732	S	S	*	*			trans	120.7	128.7	158.5	-63.7	176.7	0	0	0	115.7
463	I	27.8	Very low	30.4	Very low	140 Å²	140	146.8 Å²	146.8	72%	0.718	74%	0.74	S	S	*	*				60.2	108.7	129.7	-62.6	176.5	0	0	0	119.9
464	V	26.7	Very low	30.3	Very low	118 Å²	118	142.8 Å²	142.8	72%	0.715	73%	0.731	S	S	*	*			trans	76.2	131.5	137.8	171.9	0	0	0	0	121.1
465	N	27.1	Very low	30.6	Very low	147 Å²	147	141.6 Å²	141.6	79%	0.786	73%	0.728	S	S	*	*			trans	22.1	132.3	154.2	-50.7	-8.1	0	0	0	121.3
466	S	28.1	Very low	30.8	Very low	97 Å²	97	143.4 Å²	143.4	68%	0.678	73%	0.731	S	S	*	*				150.8	144.1	97.4	-159.6	0	0	0	0	113.8
467	T	29.5	Very low	31.1	Very low	117 Å²	117	140.2 Å²	140.2	72%	0.718	73%	0.725	S	S	*	*			trans	28.9	135.1	144.3	58.2	0	0	0	0	120
468	K	33.8	Very low	31.8	Very low	169 Å²	169	137.1 Å²	137.1	74%	0.735	72%	0.724	S	S	*	*			cis	171.5	171.3	41.7	-140.2	178	177.9	-104.6	0	110.6
469	E	32.4	Very low	32.2	Very low	114 Å²	114	131.6 Å²	131.6	53%	0.533	71%	0.711	S	S	.	*			trans	67.5	114.1	157.1	-62.2	-55.1	132.5	0	0	121.8
470	R	32.7	Very low	32.5	Very low	209 Å²	209	132.1 Å²	132.1	79%	0.789	71%	0.712	S	S	*	*			trans	68.8	145.4	139.9	-70.3	173.7	176.7	-123	-6	118.8
471	S	33.1	Very low	33.1	Very low	99 Å²	99	125.4 Å²	125.4	69%	0.692	70%	0.702	S	S	*	*			cis	-133	130.4	18	-72.6	0	0	0	0	115.4
472	L	32.4	Very low	32.8	Very low	148 Å²	148	125.5 Å²	125.5	78%	0.775	70%	0.701	S	S	*	*			trans	69.8	136.9	133.1	-61.4	173.7	0	0	0	123.3
473	S	31	Very low	33.2	Very low	101 Å²	101	123 Å²	123	71%	0.706	70%	0.696	S	S	*	*			trans	72.2	117	160.6	-69.8	0	0	0	0	118.5
474	S	31.9	Very low	33.2	Very low	92 Å²	92	124.3 Å²	124.3	64%	0.643	70%	0.699	S	S	*	*			cis	71.6	147.5	44.9	93	0	0	0	0	111.9
475	S	37.3	Very low	33.3	Very low	99 Å²	99	123.9 Å²	123.9	69%	0.692	70%	0.7	S	S	*	*			cis	-124.8	137.5	21	51.4	0	0	0	0	113.7
476	D	36.5	Very low	33.2	Very low	121 Å²	121	125.3 Å²	125.3	65%	0.647	70%	0.702	S	S	*	*				70.1	146.4	76.1	-36	-40.5	0	0	0	112.5
477	E	37.9	Very low	33.2	Very low	134 Å²	134	124.9 Å²	124.9	63%	0.626	70%	0.699	S	S	*	*			cis	-155.7	-168.6	-33.7	-100.6	-38.7	85	0	0	104.9	L479	E477-L479 WeakPolarHBondContact OE2-CD1 3.46Å; E477-L479 WeakPolarHBondContact OE2-CG 3.3Å
478	D	44	Very low	33.1	Very low	139 Å²	139	129 Å²	129	74%	0.743	70%	0.703	S	S	*	*			cis	-131.8	171.5	13.5	-82.2	-75.5	0	0	0	109.3
479	L	35.5	Very low	33	Very low	114 Å²	114	128.9 Å²	128.9	60%	0.597	71%	0.705	S	S	*	*			cis	75.5	151	30.8	-60.3	-177.3	0	0	0	114.8	E477	E477-L479 WeakPolarHBondContact OE2-CD1 3.46Å; E477-L479 WeakPolarHBondContact OE2-CG 3.3Å
480	P	33.6	Very low	33	Very low	115 Å²	115	130.9 Å²	130.9	75%	0.747	72%	0.719	S	S	*	*			cis	-101.4	151.7	5.2	38.2	-32	0	0	0	115.1
481	S	42.2	Very low	33.3	Very low	103 Å²	103	127.9 Å²	127.9	72%	0.72	72%	0.716	S	S	*	*			trans	-114.4	100.5	156.8	61.7	0	0	0	0	109.7
482	T	30.2	Very low	33.1	Very low	112 Å²	112	130.7 Å²	130.7	69%	0.687	72%	0.718	S	S	*	*			trans	-127.5	137.9	164.6	50.5	0	0	0	0	107.9
483	S	33.1	Very low	33	Very low	96 Å²	96	127.7 Å²	127.7	67%	0.671	71%	0.709	S	S	*	*			cis	84.3	66.4	23.7	91.1	0	0	0	0	115.8
484	E	29.5	Very low	33	Very low	166 Å²	166	130.9 Å²	130.9	78%	0.776	71%	0.713	S	S	*	*			trans	-140.4	138.2	149.2	-100.1	124.9	-157.8	0	0	106.7
485	C	27.3	Very low	33	Very low	109 Å²	109	130.7 Å²	130.7	74%	0.736	71%	0.712	S	S	*	*			cis	74.2	143.4	32.8	-58.6	0	0	0	0	113.8
486	Q	25.9	Very low	32.7	Very low	177 Å²	177	136.3 Å²	136.3	83%	0.827	72%	0.72	S	S	*	*			trans	69.3	125.5	-179.8	-56.2	166.7	15.9	0	0	113.5
487	S	27.7	Very low	32.3	Very low	88 Å²	88	133.8 Å²	133.8	62%	0.615	71%	0.711	S	S	*	*			cis	99.9	143.2	20.8	75.9	0	0	0	0	114.2
488	Y	27.9	Very low	32	Very low	205 Å²	205	135 Å²	135	80%	0.804	72%	0.722	S	S	*	*			trans	81.8	121.9	-179	-64.4	-83.7	0	0	0	116.4
489	E	30.8	Very low	31.4	Very low	165 Å²	165	138.8 Å²	138.8	77%	0.771	73%	0.726	S	S	*	*				15.2	131.6	119.6	-26.3	-76.6	76.9	0	0	115.4
490	D	31.9	Very low	31	Very low	157 Å²	157	137.3 Å²	137.3	84%	0.84	74%	0.738	S	S	*	*				-152	174.5	87.8	-135	-37.1	0	0	0	112.4
491	M	39.7	Very low	30.7	Very low	145 Å²	145	139.7 Å²	139.7	71%	0.714	74%	0.74	S	S	*	*			trans	-89.8	-170.8	-176	-168.5	169.5	64.3	0	0	111.2
492	E	29.9	Very low	30.1	Very low	158 Å²	158	142.3 Å²	142.3	74%	0.738	75%	0.745	S	S	*	*			trans	74	151.3	159.5	-58.7	-165.2	159.1	0	0	118.6
493	S	30.2	Very low	30	Very low	85 Å²	85	140.6 Å²	140.6	59%	0.594	75%	0.749	S	S	*	*			cis	-161.8	149.8	-33.3	-107.5	0	0	0	0	110.8
494	E	30.4	Very low	29.6	Very low	168 Å²	168	147.6 Å²	147.6	79%	0.785	76%	0.761	S	S	*	*			trans	58.9	156.4	140.3	-65	-174.7	174.2	0	0	123.3
495	S	31.8	Very low	29.7	Very low	89 Å²	89	144.8 Å²	144.8	62%	0.622	76%	0.76	S	S	*	*			trans	48.4	135.2	145.1	-57.6	0	0	0	0	120.5
496	Y	31	Very low	29.6	Very low	217 Å²	217	146.4 Å²	146.4	85%	0.851	76%	0.76	S	S	*	*			cis	-117.4	130.9	26.7	-101.8	-122.6	0	0	0	110.8
497	S	27.8	Very low	29.6	Very low	67 Å²	67	145.9 Å²	145.9	47%	0.469	76%	0.758	S	S	.	*				55.4	110.5	54.5	82	0	0	0	0	114.6
498	D	32.4	Very low	29.5	Very low	160 Å²	160	147.2 Å²	147.2	86%	0.856	77%	0.767	S	S	*	*			trans	-125	146.5	135.3	-164.6	6.2	0	0	0	108.5
499	R	30.1	Very low	29.5	Very low	219 Å²	219	141.3 Å²	141.3	83%	0.826	76%	0.76	S	S	*	*			trans	-117.3	82	-172.8	-65.4	170.5	88.1	155.7	2	108.3	E501	R499-E501 PolarHBondContact O-N 2.76Å
500	G	29	Very low	29.3	Very low	83 Å²	83	139.8 Å²	139.8	86%	0.856	76%	0.762	S	S	*	*			trans	-83.7	86.5	-178	0	0	0	0	0	113.3
501	E	27.2	Very low	29.6	Very low	165 Å²	165	139.4 Å²	139.4	77%	0.771	76%	0.755	S	S	*	*			trans	-67.4	156.5	-177.9	-71.3	-178	134	0	0	115.9	R499	R499-E501 PolarHBondContact O-N 2.76Å
502	L	28	Very low	29.4	Very low	158 Å²	158	137.5 Å²	137.5	83%	0.827	75%	0.753	S	S	*	*			trans	57.7	66	139.8	-64.3	168.1	0	0	0	121
503	G	27.7	Very low	29.4	Very low	76 Å²	76	135.7 Å²	135.7	78%	0.784	75%	0.749	S	S	*	*				73.6	-156.7	114.5	0	0	0	0	0	121
504	R	26.4	Very low	29.4	Very low	242 Å²	242	136 Å²	136	91%	0.913	76%	0.757	S	S	*	*			trans	57.3	89.4	-179.6	-61	-175.7	-172	-91	-3.7	117.6
505	S	30	Very low	29.5	Very low	108 Å²	108	135.3 Å²	135.3	76%	0.755	75%	0.753	S	S	*	*				38.6	150.1	106.6	-151.8	0	0	0	0	121.3
506	L	26.5	Very low	29.3	Very low	142 Å²	142	137.8 Å²	137.8	74%	0.743	76%	0.758	S	S	*	*			trans	87.2	112.9	163.7	-55	165	0	0	0	118.9
507	H	25.2	Very low	29.3	Very low	167 Å²	167	133 Å²	133	77%	0.773	75%	0.751	S	S	*	*				64.4	110	128.7	-73.4	90	0	0	0	123
508	S	25.7	Very low	29.4	Very low	116 Å²	116	135.6 Å²	135.6	81%	0.811	77%	0.77	S	S	*	*				92.5	160.7	114.2	-155.2	0	0	0	0	120.9
509	A	27.1	Very low	29.2	Very low	81 Å²	81	131.6 Å²	131.6	67%	0.669	77%	0.766	S	S	*	*			trans	82.3	108.7	158.6	0	0	0	0	0	121.4
510	V	27.7	Very low	29.1	Very low	132 Å²	132	131.9 Å²	131.9	80%	0.8	77%	0.767	S	S	*	*			trans	74	106.6	131.7	176.9	0	0	0	0	117.2
511	E	37.5	Very low	29	Very low	149 Å²	149	137.3 Å²	137.3	70%	0.696	77%	0.771	S	S	*	*				60.7	150.6	81	-80	-75.4	127.5	0	0	114.2	N513	E511-N513 PolarHBondContact OE2-N 3.5Å
512	P	36.6	Very low	29	Very low	105 Å²	105	135.8 Å²	135.8	68%	0.682	77%	0.767	S	S	*	*			cis	-141.5	161.5	28.8	41.7	-22.4	0	0	0	120.8
513	N	29.5	Very low	29.1	Very low	121 Å²	121	132.8 Å²	132.8	65%	0.647	76%	0.757	S	S	*	*			trans	51.3	127.4	142.6	-78.8	-55.2	0	0	0	122.5	E511	E511-N513 PolarHBondContact OE2-N 3.5Å
514	A	30	Very low	30	Very low	92 Å²	92	136 Å²	136	76%	0.76	76%	0.755	S	S	*	*				-165.5	95.9	103.7	0	0	0	0	0	114.4
515	H	31.6	Very low	31.3	Very low	153 Å²	153	130.8 Å²	130.8	71%	0.708	74%	0.741	S	S	*	*			trans	62.8	116.9	143.8	-68.5	-73.9	0	0	0	124.1
516	I	28.6	Very low	33.5	Very low	141 Å²	141	128.8 Å²	128.8	72%	0.723	72%	0.717	S	S	*	*				94.5	88.9	122.2	-71.6	173.6	0	0	0	119.6
517	T	30.5	Very low	35.8	Very low	115 Å²	115	127 Å²	127	71%	0.706	71%	0.705	S	S	*	*				104.2	107.3	112.5	-63	0	0	0	0	120.9
518	S	29.6	Very low	38.1	Very low	122 Å²	122	123 Å²	123	85%	0.853	70%	0.696	S	S	*	*			trans	64.8	106.7	144.3	-63.4	0	0	0	0	121
519	G	28.4	Very low	40.4	Very low	76 Å²	76	117.7 Å²	117.7	78%	0.784	66%	0.659	S	S	*	*			trans	-173.3	68.7	167.9	0	0	0	0	0	113.2	Q521	G519-Q521 PolarHBondContact O-N 2.79Å
520	R	27.6	Very low	42.4	Very low	225 Å²	225	120.2 Å²	120.2	85%	0.849	67%	0.669	S	S	*	*			trans	-25	116.4	-173.4	-68	-177.3	175.7	-154.1	-1.7	115.7	L522	R520-L522 VanDerWaalsContact C-N 3.34Å; R520-L522 HydrophobicContact CB-CD1 4.12Å; R520-L522 PolarHBondContact O-N 2.9Å
521	Q	28.2	Very low	44.4	Very low	198 Å²	198	118.7 Å²	118.7	93%	0.925	66%	0.656	S	S	*	*			trans	-69	91.3	159.5	-71.6	179.4	-12.4	0	0	109.3	G519	G519-Q521 PolarHBondContact O-N 2.79Å
522	L	25.7	Very low	46	Very low	132 Å²	132	113.6 Å²	113.6	69%	0.691	64%	0.644	S	S	*	*			trans	-74.8	157.8	164.3	-78.8	121.3	0	0	0	110.2	R520	R520-L522 VanDerWaalsContact C-N 3.34Å; R520-L522 HydrophobicContact CB-CD1 4.12Å; R520-L522 PolarHBondContact O-N 2.9Å
523	P	30.3	Very low	47.5	Very low	95 Å²	95	111.9 Å²	111.9	62%	0.617	63%	0.631	S	S	*	*			trans	-56.4	159	173.3	-22.9	33.8	0	0	0	112.1	Q525	P523-Q525 HydrophobicContact CB-CB 4.38Å; P523-Q525 PolarHBondContact O-N 2.83Å
524	L	47.3	Very low	49.8	Very low	144 Å²	144	109.9 Å²	109.9	75%	0.754	62%	0.615	S	S	*	*	S	Bend	trans	-73	55.4	173.1	-68.1	170.6	0	0	0	111.5
525	Q	54.7	Low	52.5	Low	133 Å²	133	107.6 Å²	107.6	62%	0.621	59%	0.59	S	S	*	*	P	Polyproline II helix	trans	-92.2	140.1	-172.7	-177.3	170.7	-8.4	0	0	110.9	P523	P523-Q525 HydrophobicContact CB-CB 4.38Å; P523-Q525 PolarHBondContact O-N 2.83Å
526	W	76.2	Confident	55.1	Low	65 Å²	65	103.3 Å²	103.3	25%	0.246	57%	0.568	C	S	.	*	P	Polyproline II helix	trans	-72.4	131.8	169.8	-68.9	94.4	0	0	0	110.2	I535 R537 R624	W526-I535 HydrophobicContact CB-CB 4.13Å; W526-I535 HydrophobicContact CB-CD1 4.1Å; W526-I535 HydrophobicContact CD2-CB 4.43Å; W526-I535 HydrophobicContact CD2-CD1 3.76Å; W526-I535 HydrophobicContact CD2-CG1 4.1Å; W526-I535 HydrophobicContact CE3-CB 3.9Å; W526-I535 HydrophobicContact CE3-CD1 3.85Å; W526-I535 HydrophobicContact CE3-CG1 3.64Å; W526-I535 HydrophobicContact CG-CD1 3.93Å; W526-I535 HydrophobicContact CZ3-CD1 4.42Å; W526-I535 HydrophobicContact CZ3-CG1 4.07Å; W526-I535 WeakPolarHBondContact CZ3-O 3.45Å; W526-R537 HydrophobicContact CD2-CB 4.34Å; W526-R537 HydrophobicContact CD2-CG 3.96Å; W526-R537 VanDerWaalsContact CE2-NE 3.34Å; W526-R537 HydrophobicContact CE3-CB 4.13Å; W526-R537 HydrophobicContact CE3-CG 3.67Å; W526-R537 HydrophobicContact CH2-CG 4.2Å; W526-R537 HydrophobicContact CZ2-CG 4.43Å; W526-R537 VanDerWaalsContact CZ2-NH2 3.31Å; W526-R537 HydrophobicContact CZ3-CG 3.8Å; W526-R624 HydrophobicContact CH2-CB 3.76Å; W526-R624 VanDerWaalsContact CZ2-CZ 3.4Å; W526-R624 HydrophobicContact CZ3-CB 3.78Å
527	Q	73.5	Confident	57.9	Low	104 Å²	104	97.5 Å²	97.5	49%	0.486	54%	0.537	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	136.5	173.2	-67.2	167.5	54	0	0	108.6	I535 Y536	Q527-I535 CarbonylContact O-C 3.44Å; Q527-I535 WeakPolarHBondContact O-CA 3.31Å; Q527-Y536 HydrophobicContact CB-CD1 4.35Å; Q527-Y536 HydrophobicContact CB-CD2 4.31Å; Q527-Y536 HydrophobicContact CB-CE1 3.83Å; Q527-Y536 HydrophobicContact CB-CE2 3.76Å; Q527-Y536 VanDerWaalsContact CB-CZ 3.48Å; Q527-Y536 HydrophobicContact CG-CE2 4.38Å; Q527-Y536 PolarHBondContact N-O 3.24Å; Q527-Y536 WeakPolarHBondContact O-CD1 3.1Å; Q527-Y536 PolarHBondContact O-N 2.87Å; Q527-Y536 PolarHBondContact OE1-OH 3.5Å
528	S	73.1	Confident	60.7	Low	83 Å²	83	99.1 Å²	99.1	58%	0.58	53%	0.53	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.5	143.9	172.3	49.4	0	0	0	0	111	Y536	S528-Y536 WeakPolarHBondContact O-CE1 3Å
529	S	73.9	Confident	63.5	Low	5 Å²	5	93.6 Å²	93.6	4%	0.035	49%	0.491	C	S	.	.	P	Polyproline II helix	trans	-65.6	156.2	169.1	66.6	0	0	0	0	111.4	D531 G532 T533 Y534	S529-D531 WeakPolarHBondContact CB-OD1 3.21Å; S529-D531 PolarHBondContact O-N 3.35Å; S529-D531 PolarHBondContact OG-OD1 3.11Å; S529-G532 PolarHBondContact O-N 3.04Å; S529-G532 PolarHBondContact OG-N 2.84Å; S529-T533 PolarHBondContact OG-N 2.81Å; S529-Y534 VanDerWaalsContact CB-CZ 3.41Å; S529-Y534 WeakPolarHBondContact CB-O 3.44Å; S529-Y534 PolarHBondContact N-O 2.82Å; S529-Y534 PolarHBondContact OG-N 2.88Å; S529-Y534 VanDerWaalsContact OG-N 3.15Å; S529-Y534 PolarHBondContact OG-O 2.87Å; S529-Y534 VanDerWaalsContact OG-O 3.09Å
530	P	70.6	Confident	66.4	Low	135 Å²	135	92 Å²	92	88%	0.877	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-23.5	-178.3	-23.8	35.1	0	0	0	114.5
531	D	69.2	Low	69.2	Low	99 Å²	99	81.3 Å²	81.3	53%	0.529	43%	0.426	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97	-2.1	176.7	65.2	-29.5	0	0	0	113.2	S529 T533	S529-D531 WeakPolarHBondContact CB-OD1 3.21Å; S529-D531 PolarHBondContact O-N 3.35Å; S529-D531 PolarHBondContact OG-OD1 3.11Å; D531-T533 HydrophobicContact CB-CG2 4.34Å; D531-T533 VanDerWaalsContact CG-OG1 3.27Å; D531-T533 PolarHBondContact O-N 2.65Å; D531-T533 VanDerWaalsContact O-N 3.15Å; D531-T533 PolarHBondContact OD1-OG1 3.48Å; D531-T533 WeakPolarHBondContact OD2-CB 3.46Å; D531-T533 WeakPolarHBondContact OD2-CG2 3.31Å; D531-T533 PolarHBondContact OD2-OG1 2.81Å
532	G	71	Confident	71.8	Confident	43 Å²	43	76 Å²	76	44%	0.443	40%	0.401	S	S	.	.	S	Bend	trans	71.5	-3.5	179.3	0	0	0	0	0	116.2	S529 Y534	S529-G532 PolarHBondContact O-N 3.04Å; S529-G532 PolarHBondContact OG-N 2.84Å; G532-Y534 VanDerWaalsContact C-N 3.31Å; G532-Y534 PolarHBondContact O-N 2.87Å
533	T	68	Low	74.2	Confident	69 Å²	69	70.5 Å²	70.5	42%	0.423	37%	0.371	S	S	.	.	S	Bend	trans	-73.6	-18.5	-173.6	65.5	0	0	0	0	114.2	S529 D531 S625 V626	S529-T533 PolarHBondContact OG-N 2.81Å; D531-T533 HydrophobicContact CB-CG2 4.34Å; D531-T533 VanDerWaalsContact CG-OG1 3.27Å; D531-T533 PolarHBondContact O-N 2.65Å; D531-T533 VanDerWaalsContact O-N 3.15Å; D531-T533 PolarHBondContact OD1-OG1 3.48Å; D531-T533 WeakPolarHBondContact OD2-CB 3.46Å; D531-T533 WeakPolarHBondContact OD2-CG2 3.31Å; D531-T533 PolarHBondContact OD2-OG1 2.81Å; T533-S625 WeakPolarHBondContact O-CA 3.49Å; T533-S625 PolarHBondContact O-OG 2.76Å; T533-V626 PolarHBondContact O-N 2.82Å
534	Y	78.7	Confident	76.1	Confident	78 Å²	78	72 Å²	72	31%	0.306	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	161.8	174.4	63.8	-86.6	0	0	0	112.9	S529 G532 Y536 L590 A623 R624	S529-Y534 VanDerWaalsContact CB-CZ 3.41Å; S529-Y534 WeakPolarHBondContact CB-O 3.44Å; S529-Y534 PolarHBondContact N-O 2.82Å; S529-Y534 PolarHBondContact OG-N 2.88Å; S529-Y534 VanDerWaalsContact OG-N 3.15Å; S529-Y534 PolarHBondContact OG-O 2.87Å; S529-Y534 VanDerWaalsContact OG-O 3.09Å; G532-Y534 VanDerWaalsContact C-N 3.31Å; G532-Y534 PolarHBondContact O-N 2.87Å; Y534-Y536 HydrophobicContact CD2-CD1 4.14Å; Y534-Y536 AromaticContact CE2-CD1 3.73Å; Y534-Y536 HydrophobicContact CE2-CD1 3.73Å; Y534-Y536 HydrophobicContact CE2-CG 4.25Å; Y534-L590 HydrophobicContact CE2-CD1 4.41Å; Y534-A623 HydrophobicContact CD2-CB 3.73Å; Y534-A623 HydrophobicContact CE2-CB 4.24Å; Y534-A623 HydrophobicContact CG-CB 4.43Å; Y534-R624 CarbonylContact C-O 3.58Å; Y534-R624 WeakPolarHBondContact CA-O 3.43Å; Y534-R624 WeakPolarHBondContact CB-O 3.23Å
535	I	85.6	Confident	76.5	Confident	44 Å²	44	70.2 Å²	70.2	23%	0.226	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	141.1	163.2	50.3	176.5	0	0	0	109.2	W526 Q527 A623 R624 V626	W526-I535 HydrophobicContact CB-CB 4.13Å; W526-I535 HydrophobicContact CB-CD1 4.1Å; W526-I535 HydrophobicContact CD2-CB 4.43Å; W526-I535 HydrophobicContact CD2-CD1 3.76Å; W526-I535 HydrophobicContact CD2-CG1 4.1Å; W526-I535 HydrophobicContact CE3-CB 3.9Å; W526-I535 HydrophobicContact CE3-CD1 3.85Å; W526-I535 HydrophobicContact CE3-CG1 3.64Å; W526-I535 HydrophobicContact CG-CD1 3.93Å; W526-I535 HydrophobicContact CZ3-CD1 4.42Å; W526-I535 HydrophobicContact CZ3-CG1 4.07Å; W526-I535 WeakPolarHBondContact CZ3-O 3.45Å; Q527-I535 CarbonylContact O-C 3.44Å; Q527-I535 WeakPolarHBondContact O-CA 3.31Å; I535-A623 CarbonylContact O-C 3.58Å; I535-A623 VanDerWaalsContact O-CA 3.28Å; I535-A623 WeakPolarHBondContact O-CA 3.25Å; I535-R624 HydrophobicContact CG1-CB 4.14Å; I535-R624 WeakPolarHBondContact CG1-O 3.15Å; I535-R624 PolarHBondContact N-O 2.96Å; I535-R624 PolarHBondContact O-N 3.28Å; I535-V626 HydrophobicContact CB-CG2 4.09Å; I535-V626 HydrophobicContact CD1-CG2 4.21Å; I535-V626 HydrophobicContact CG1-CG2 3.67Å; I535-V626 HydrophobicContact CG2-CG2 3.78Å
536	Y	87.4	Confident	76.6	Confident	64 Å²	64	67.5 Å²	67.5	25%	0.251	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	160.1	178.3	66.8	-85.7	0	0	0	111.9	Q527 S528 Y534 V622	Q527-Y536 HydrophobicContact CB-CD1 4.35Å; Q527-Y536 HydrophobicContact CB-CD2 4.31Å; Q527-Y536 HydrophobicContact CB-CE1 3.83Å; Q527-Y536 HydrophobicContact CB-CE2 3.76Å; Q527-Y536 VanDerWaalsContact CB-CZ 3.48Å; Q527-Y536 HydrophobicContact CG-CE2 4.38Å; Q527-Y536 PolarHBondContact N-O 3.24Å; Q527-Y536 WeakPolarHBondContact O-CD1 3.1Å; Q527-Y536 PolarHBondContact O-N 2.87Å; Q527-Y536 PolarHBondContact OE1-OH 3.5Å; S528-Y536 WeakPolarHBondContact O-CE1 3Å; Y534-Y536 HydrophobicContact CD2-CD1 4.14Å; Y534-Y536 AromaticContact CE2-CD1 3.73Å; Y534-Y536 HydrophobicContact CE2-CD1 3.73Å; Y534-Y536 HydrophobicContact CE2-CG 4.25Å; Y536-V622 CarbonylContact C-O 3.55Å; Y536-V622 WeakPolarHBondContact CA-O 3.47Å
537	R	87.3	Confident	76	Confident	19 Å²	19	67 Å²	67	7%	0.072	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.6	161.2	176.6	56.9	174.1	171.7	160.8	-1	111.1	W526 V539 G581 R582 D587 V621 V622	W526-R537 HydrophobicContact CD2-CB 4.34Å; W526-R537 HydrophobicContact CD2-CG 3.96Å; W526-R537 VanDerWaalsContact CE2-NE 3.34Å; W526-R537 HydrophobicContact CE3-CB 4.13Å; W526-R537 HydrophobicContact CE3-CG 3.67Å; W526-R537 HydrophobicContact CH2-CG 4.2Å; W526-R537 HydrophobicContact CZ2-CG 4.43Å; W526-R537 VanDerWaalsContact CZ2-NH2 3.31Å; W526-R537 HydrophobicContact CZ3-CG 3.8Å; R537-V539 HydrophobicContact CG-CG2 3.93Å; R537-G581 VanDerWaalsContact CZ-O 3.25Å; R537-G581 PolarHBondContact NH1-O 3.4Å; R537-G581 PolarHBondContact NH2-O 3.19Å; R537-R582 PolarHBondContact NH2-O 3.02Å; R537-D587 IonicContact NH2-OD2 3.72Å; R537-V621 WeakPolarHBondContact O-CA 3.34Å; R537-V622 PolarHBondContact N-O 2.83Å; R537-V622 PolarHBondContact O-N 2.94Å
538	R	89.2	Confident	75.9	Confident	148 Å²	148	63.8 Å²	63.8	56%	0.558	38%	0.376	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96	138.6	168.4	-165.8	169.7	-179.2	155.7	-1.3	110.2	D619 L620 V621	R538-D619 VanDerWaalsContact CG-OD1 3.27Å; R538-D619 WeakPolarHBondContact CG-OD1 3.46Å; R538-D619 IonicContact CZ-OD1 2.69Å; R538-D619 IonicContact CZ-OD2 2.82Å; R538-D619 IonicContact NE-OD1 2.65Å; R538-D619 PolarHBondContact NE-OD1 3.48Å; R538-D619 IonicContact NE-OD2 2.62Å; R538-D619 PolarHBondContact NE-OD2 3.3Å; R538-D619 IonicContact NH2-OD1 3.22Å; R538-D619 IonicContact NH2-OD2 2.69Å; R538-D619 PolarHBondContact NH2-OD2 3.25Å; R538-L620 CarbonylContact C-O 3.59Å; R538-L620 VanDerWaalsContact CA-O 3.3Å; R538-L620 WeakPolarHBondContact CA-O 3.25Å; R538-V621 HydrophobicContact CG-CG2 4.29Å
539	V	88	Confident	76.3	Confident	7 Å²	7	59.9 Å²	59.9	4%	0.042	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	114.5	-173.1	-179.6	0	0	0	0	109.4	R537 L541 L583 L620	R537-V539 HydrophobicContact CG-CG2 3.93Å; V539-L541 HydrophobicContact CG1-CD2 3.69Å; V539-L541 HydrophobicContact CG1-CG 4.19Å; V539-L583 HydrophobicContact CG2-CD2 4.32Å; V539-L620 HydrophobicContact CB-CB 4.45Å; V539-L620 PolarHBondContact N-O 3.31Å; V539-L620 PolarHBondContact O-N 2.78Å
540	V	88.3	Confident	76.7	Confident	42 Å²	42	60.3 Å²	60.3	26%	0.255	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	113	178	-170.9	0	0	0	0	109.9	R617 I618	V540-R617 HydrophobicContact CG1-CG 3.66Å; V540-I618 CarbonylContact C-O 3.53Å; V540-I618 WeakPolarHBondContact CA-O 3.15Å
541	L	87.5	Confident	77.5	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	133.5	177.8	-54.2	-178.9	0	0	0	110.4	V539 L549 L551 V576 A577 L583 R617 I618 L620	V539-L541 HydrophobicContact CG1-CD2 3.69Å; V539-L541 HydrophobicContact CG1-CG 4.19Å; L541-L549 HydrophobicContact CB-CD2 3.99Å; L541-L551 HydrophobicContact CD1-CD2 3.35Å; L541-V576 HydrophobicContact CB-CG1 4.06Å; L541-V576 HydrophobicContact CD2-CG1 4.18Å; L541-A577 HydrophobicContact CD1-CB 4.38Å; L541-L583 HydrophobicContact CD1-CD1 4.04Å; L541-R617 WeakPolarHBondContact O-CA 3.47Å; L541-I618 PolarHBondContact N-O 3.17Å; L541-I618 PolarHBondContact O-N 3.21Å; L541-L620 HydrophobicContact CD1-CD1 3.82Å; L541-L620 HydrophobicContact CG-CD1 4.37Å
542	H	82.2	Confident	78.4	Confident	87 Å²	87	50.2 Å²	50.2	40%	0.403	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	128	178.7	-64.6	92.4	0	0	0	110.2	V576 N616	H542-V576 WeakPolarHBondContact O-CG1 3.36Å; H542-V576 WeakPolarHBondContact O-CG2 2.97Å; H542-N616 WeakPolarHBondContact CA-O 3.48Å
543	R	75.3	Confident	79.3	Confident	17 Å²	17	48.3 Å²	48.3	6%	0.064	27%	0.272	C	S	.	.			trans	-99.8	114.6	-178.2	-175	-179.4	64.2	-176.7	-1.8	110.3	T547 L549 K613 F614 S615 N616	R543-T547 WeakPolarHBondContact CG-O 3.08Å; R543-L549 HydrophobicContact CB-CD2 3.98Å; R543-K613 PolarHBondContact NH1-O 2.96Å; R543-K613 PolarHBondContact NH2-O 2.99Å; R543-F614 PolarHBondContact NH2-O 3.34Å; R543-S615 PolarHBondContact NH2-O 3.31Å; R543-S615 VanDerWaalsContact NH2-O 3.16Å; R543-N616 PolarHBondContact N-O 3.28Å; R543-N616 PolarHBondContact NH2-OD1 3.13Å; R543-N616 VanDerWaalsContact NH2-OD1 3.08Å
544	H	70.8	Confident	80.1	Confident	126 Å²	126	46 Å²	46	58%	0.583	26%	0.258	S	S	*	.			trans	-81.2	151.8	172.7	-52.1	-77.2	0	0	0	110.9	G546 T547	H544-G546 PolarHBondContact O-N 3.25Å; H544-T547 HydrophobicContact CB-CG2 4.16Å; H544-T547 PolarHBondContact N-OG1 3.11Å; H544-T547 PolarHBondContact O-N 3.22Å; H544-T547 PolarHBondContact O-OG1 3.45Å
545	A	56.5	Low	80.3	Confident	107 Å²	107	42.5 Å²	42.5	88%	0.884	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53	137.5	177.4	0	0	0	0	0	111.4	T547	A545-T547 PolarHBondContact O-N 3.37Å; A545-T547 VanDerWaalsContact O-N 3.16Å
546	G	56.2	Low	79.8	Confident	76 Å²	76	41.4 Å²	41.4	78%	0.784	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	72.6	-8.5	-175.5	0	0	0	0	0	116.2	H544	H544-G546 PolarHBondContact O-N 3.25Å
547	T	62.8	Low	79.2	Confident	54 Å²	54	43.3 Å²	43.3	33%	0.331	25%	0.252	S	S	.	.			trans	-100	139.5	-177.6	70	0	0	0	0	113	R543 H544 A545	R543-T547 WeakPolarHBondContact CG-O 3.08Å; H544-T547 HydrophobicContact CB-CG2 4.16Å; H544-T547 PolarHBondContact N-OG1 3.11Å; H544-T547 PolarHBondContact O-N 3.22Å; H544-T547 PolarHBondContact O-OG1 3.45Å; A545-T547 PolarHBondContact O-N 3.37Å; A545-T547 VanDerWaalsContact O-N 3.16Å
548	S	73.3	Confident	78.5	Confident	37 Å²	37	45.8 Å²	45.8	26%	0.259	27%	0.271	S	S	.	.			trans	-85.1	140.6	166.6	60.7	0	0	0	0	110.1	G550 I680	S548-G550 PolarHBondContact O-N 2.96Å; S548-G550 VanDerWaalsContact O-N 3.1Å; S548-I680 WeakPolarHBondContact CB-O 3.32Å
549	L	81	Confident	77.7	Confident	1 Å²	1	39.4 Å²	39.4	1%	0.005	25%	0.249	C	C	.	.			trans	-55.1	-30.8	172.8	-66.4	169	0	0	0	113	L541 R543 L551 S575 V576 A577 I618 I680	L541-L549 HydrophobicContact CB-CD2 3.99Å; R543-L549 HydrophobicContact CB-CD2 3.98Å; L549-L551 HydrophobicContact CB-CD2 4.07Å; L549-L551 HydrophobicContact CB-CG 4.28Å; L549-L551 HydrophobicContact CD1-CD2 4.33Å; L549-S575 WeakPolarHBondContact O-CB 3.14Å; L549-S575 PolarHBondContact O-OG 3.48Å; L549-V576 PolarHBondContact O-N 3.09Å; L549-A577 VanDerWaalsContact O-CB 3.3Å; L549-A577 WeakPolarHBondContact O-CB 3.4Å; L549-A577 PolarHBondContact O-N 3Å; L549-I618 HydrophobicContact CD1-CD1 3.59Å; L549-I680 HydrophobicContact CD1-CB 4.29Å; L549-I680 HydrophobicContact CD1-CD1 3.79Å; L549-I680 HydrophobicContact CD1-CG2 3.91Å; L549-I680 HydrophobicContact CG-CG2 4.43Å
550	G	82.2	Confident	76.6	Confident	14 Å²	14	46 Å²	46	14%	0.144	29%	0.292	C	S	.	.			trans	85	3.1	174.9	0	0	0	0	0	115.5	S548 V571 K572	S548-G550 PolarHBondContact O-N 2.96Å; S548-G550 VanDerWaalsContact O-N 3.1Å; G550-V571 CarbonylContact O-C 3.45Å; G550-V571 WeakPolarHBondContact O-CA 3.37Å; G550-K572 WeakPolarHBondContact O-CB 3.4Å; G550-K572 PolarHBondContact O-N 2.84Å
551	L	87.7	Confident	75.7	Confident	8 Å²	8	49.6 Å²	49.6	4%	0.042	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	154.3	172	66.1	95.8	0	0	0	112.3	L541 L549 V553 K570 A577 W592 L620 I680	L541-L551 HydrophobicContact CD1-CD2 3.35Å; L549-L551 HydrophobicContact CB-CD2 4.07Å; L549-L551 HydrophobicContact CB-CG 4.28Å; L549-L551 HydrophobicContact CD1-CD2 4.33Å; L551-V553 HydrophobicContact CD1-CG2 3.75Å; L551-K570 CarbonylContact C-O 3.6Å; L551-A577 HydrophobicContact CB-CB 3.8Å; L551-A577 HydrophobicContact CD2-CB 4.15Å; L551-A577 HydrophobicContact CG-CB 4.5Å; L551-W592 HydrophobicContact CD1-CH2 3.98Å; L551-W592 HydrophobicContact CD1-CZ3 4.06Å; L551-L620 HydrophobicContact CD2-CD1 4.4Å; L551-I680 HydrophobicContact CD1-CD1 4.23Å
552	K	88.3	Confident	74.9	Confident	14 Å²	14	52.6 Å²	52.6	6%	0.061	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	121.2	171.1	175.7	-167.5	157.4	179.8	0	109	T569 K570 I677	K552-T569 VanDerWaalsContact CD-OG1 3.3Å; K552-T569 WeakPolarHBondContact CD-OG1 3.24Å; K552-T569 WeakPolarHBondContact CE-OG1 3.41Å; K552-T569 WeakPolarHBondContact CG-OG1 3.38Å; K552-T569 PolarHBondContact O-N 3.38Å; K552-T569 PolarHBondContact O-OG1 2.87Å; K552-K570 HydrophobicContact CB-CB 4.06Å; K552-K570 HydrophobicContact CD-CB 4.27Å; K552-K570 HydrophobicContact CD-CD 4.42Å; K552-K570 HydrophobicContact CD-CG 4.26Å; K552-K570 PolarHBondContact N-O 3.15Å; K552-I677 HydrophobicContact CD-CG2 3.68Å; K552-I677 HydrophobicContact CG-CG2 3.9Å; K552-I677 VanDerWaalsContact NZ-CD1 3.31Å
553	V	89.1	Confident	74.9	Confident	3 Å²	3	52.1 Å²	52.1	2%	0.018	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	148.5	176.8	179.2	0	0	0	0	110.1	L551 A566 F567 I568 V589 W592 V605 I609	L551-V553 HydrophobicContact CD1-CG2 3.75Å; V553-A566 HydrophobicContact CG1-CB 4.02Å; V553-F567 CarbonylContact C-O 3.35Å; V553-F567 WeakPolarHBondContact CA-O 3.05Å; V553-I568 HydrophobicContact CG2-CG1 4.36Å; V553-V589 HydrophobicContact CG2-CG2 4.17Å; V553-W592 HydrophobicContact CG2-CZ3 4.14Å; V553-V605 HydrophobicContact CG1-CG1 4.31Å; V553-I609 HydrophobicContact CB-CD1 4.02Å; V553-I609 HydrophobicContact CG1-CD1 4.25Å
554	V	84.1	Confident	75.1	Confident	21 Å²	21	54.2 Å²	54.2	13%	0.127	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	123.7	169.2	175.5	0	0	0	0	108	A566 F567 T569 T675	V554-A566 CarbonylContact O-C 3.48Å; V554-A566 WeakPolarHBondContact O-CA 3.44Å; V554-F567 PolarHBondContact N-O 3.03Å; V554-F567 PolarHBondContact O-N 3.2Å; V554-T569 HydrophobicContact CB-CG2 4.09Å; V554-T569 HydrophobicContact CG2-CG2 3.74Å; V554-T675 HydrophobicContact CG1-CG2 4.35Å
555	G	83.9	Confident	75.8	Confident	3 Å²	3	48.2 Å²	48.2	3%	0.031	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	167.2	176.5	0	0	0	0	0	113.2
556	G	74.9	Confident	77.5	Confident	22 Å²	22	43.1 Å²	43.1	23%	0.227	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	72.3	24.8	175.7	0	0	0	0	0	114.8	G565	G556-G565 PolarHBondContact N-O 3.4Å
557	R	74.1	Confident	79.1	Confident	104 Å²	104	40.6 Å²	40.6	39%	0.392	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	131.4	174.3	-176.3	-171.8	-174.9	-147.8	0	109.9	T559 G565 F567	R557-T559 PolarHBondContact O-N 3Å; R557-G565 PolarHBondContact N-O 3.49Å; R557-G565 VanDerWaalsContact N-O 3.17Å; R557-G565 PolarHBondContact O-N 2.83Å; R557-F567 HydrophobicContact CB-CD2 3.85Å; R557-F567 HydrophobicContact CB-CE2 3.93Å; R557-F567 HydrophobicContact CG-CD2 4.3Å; R557-F567 HydrophobicContact CG-CE2 4.23Å
558	S	73.9	Confident	80.5	Confident	70 Å²	70	38.1 Å²	38.1	49%	0.49	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	130.5	173.7	-56.7	0	0	0	0	112	R563	S558-R563 CarbonylContact C-O 3.5Å; S558-R563 WeakPolarHBondContact CA-O 3.34Å
559	T	71.8	Confident	81.2	Confident	15 Å²	15	38 Å²	38	9%	0.092	23%	0.232	C	C	.	.	P	Polyproline II helix	trans	-71.3	165.3	164.6	57.8	0	0	0	0	110.5	R557 T561 G562 R563 F567	R557-T559 PolarHBondContact O-N 3Å; T559-T561 PolarHBondContact O-N 3.48Å; T559-T561 PolarHBondContact OG1-N 2.79Å; T559-T561 PolarHBondContact OG1-OG1 3.21Å; T559-G562 PolarHBondContact O-N 2.73Å; T559-G562 PolarHBondContact OG1-N 2.8Å; T559-R563 HydrophobicContact CG2-CG 3.84Å; T559-R563 PolarHBondContact N-O 3.47Å; T559-R563 PolarHBondContact OG1-N 3.41Å; T559-R563 PolarHBondContact OG1-O 2.87Å; T559-F567 HydrophobicContact CG2-CZ 4.1Å
560	P	64.9	Low	81.4	Confident	144 Å²	144	42.4 Å²	42.4	94%	0.935	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	-16.1	166.2	-25.2	35.7	0	0	0	114.3
561	T	68.7	Low	81.7	Confident	119 Å²	119	43.1 Å²	43.1	73%	0.73	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95	8.7	175.2	52.5	0	0	0	0	113.9	T559 R563	T559-T561 PolarHBondContact O-N 3.48Å; T559-T561 PolarHBondContact OG1-N 2.79Å; T559-T561 PolarHBondContact OG1-OG1 3.21Å; T561-R563 VanDerWaalsContact C-N 3.28Å; T561-R563 PolarHBondContact O-N 3.22Å
562	G	71.1	Confident	81.5	Confident	63 Å²	63	48.9 Å²	48.9	65%	0.649	28%	0.277	S	S	*	.	S	Bend	trans	75.7	7	177.4	0	0	0	0	0	115.7	T559	T559-G562 PolarHBondContact O-N 2.73Å; T559-G562 PolarHBondContact OG1-N 2.8Å
563	R	81.6	Confident	81.1	Confident	76 Å²	76	59 Å²	59	29%	0.287	32%	0.315	S	S	.	.			trans	-87.4	146.3	178.2	123.7	-179.2	-74.3	-162.1	-7.3	110.3	S558 T559 T561 N599	S558-R563 CarbonylContact C-O 3.5Å; S558-R563 WeakPolarHBondContact CA-O 3.34Å; T559-R563 HydrophobicContact CG2-CG 3.84Å; T559-R563 PolarHBondContact N-O 3.47Å; T559-R563 PolarHBondContact OG1-N 3.41Å; T559-R563 PolarHBondContact OG1-O 2.87Å; T561-R563 VanDerWaalsContact C-N 3.28Å; T561-R563 PolarHBondContact O-N 3.22Å; R563-N599 WeakPolarHBondContact CB-OD1 3.38Å; R563-N599 WeakPolarHBondContact CG-OD1 3.34Å; R563-N599 PolarHBondContact NE-OD1 3.4Å; R563-N599 PolarHBondContact NH2-ND2 3.44Å
564	L	81.4	Confident	80.5	Confident	62 Å²	62	61.7 Å²	61.7	33%	0.325	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	128.1	169.6	-60.3	-180	0	0	0	110.5	N599	L564-N599 WeakPolarHBondContact O-CA 3.33Å; L564-N599 PolarHBondContact O-N 2.76Å
565	G	85.3	Confident	80.5	Confident	0 Å²	0	61.1 Å²	61.1	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	165.9	178.8	0	0	0	0	0	113.1	G556 R557	G556-G565 PolarHBondContact N-O 3.4Å; R557-G565 PolarHBondContact N-O 3.49Å; R557-G565 VanDerWaalsContact N-O 3.17Å; R557-G565 PolarHBondContact O-N 2.83Å
566	A	90.7	Very high	80.5	Confident	0 Å²	0	61.6 Å²	61.6	0%	0	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	127.3	175.7	0	0	0	0	0	110.4	V553 V554 E588 V589 L597 V605	V553-A566 HydrophobicContact CG1-CB 4.02Å; V554-A566 CarbonylContact O-C 3.48Å; V554-A566 WeakPolarHBondContact O-CA 3.44Å; A566-E588 CarbonylContact O-C 3.48Å; A566-E588 WeakPolarHBondContact O-CA 3.46Å; A566-E588 WeakPolarHBondContact O-CG 3.42Å; A566-V589 HydrophobicContact CB-CB 4.39Å; A566-V589 PolarHBondContact O-N 2.62Å; A566-L597 HydrophobicContact CB-CB 4.04Å; A566-L597 HydrophobicContact CB-CD1 3.89Å; A566-V605 HydrophobicContact CB-CG1 4.08Å; A566-V605 HydrophobicContact CB-CG2 4.03Å
567	F	91.3	Very high	81	Confident	23 Å²	23	60.6 Å²	60.6	10%	0.101	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	140.2	-171.1	-64.7	-90.4	0	0	0	113	V553 V554 R557 T559 T569 E588	V553-F567 CarbonylContact C-O 3.35Å; V553-F567 WeakPolarHBondContact CA-O 3.05Å; V554-F567 PolarHBondContact N-O 3.03Å; V554-F567 PolarHBondContact O-N 3.2Å; R557-F567 HydrophobicContact CB-CD2 3.85Å; R557-F567 HydrophobicContact CB-CE2 3.93Å; R557-F567 HydrophobicContact CG-CD2 4.3Å; R557-F567 HydrophobicContact CG-CE2 4.23Å; T559-F567 HydrophobicContact CG2-CZ 4.1Å; F567-T569 PolarHBondContact O-N 3.15Å; F567-E588 HydrophobicContact CD1-CB 3.93Å; F567-E588 HydrophobicContact CD1-CG 4.18Å; F567-E588 HydrophobicContact CE1-CB 3.72Å; F567-E588 HydrophobicContact CE1-CG 3.79Å; F567-E588 HydrophobicContact CZ-CB 4.46Å; F567-E588 HydrophobicContact CZ-CG 4.03Å
568	I	91.3	Very high	81.5	Confident	2 Å²	2	58.3 Å²	58.3	1%	0.01	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	121.4	171.3	-56.9	-173.2	0	0	0	108.4	V553 V571 L583 P585 G586 D587 V589	V553-I568 HydrophobicContact CG2-CG1 4.36Å; I568-V571 HydrophobicContact CG2-CG2 3.51Å; I568-L583 HydrophobicContact CD1-CB 3.97Å; I568-L583 HydrophobicContact CD1-CD1 4.03Å; I568-L583 HydrophobicContact CD1-CD2 3.87Å; I568-L583 HydrophobicContact CD1-CG 4.17Å; I568-P585 CarbonylContact O-C 3.56Å; I568-P585 WeakPolarHBondContact O-CA 3.26Å; I568-G586 PolarHBondContact O-N 3.37Å; I568-D587 HydrophobicContact CB-CB 4.4Å; I568-D587 HydrophobicContact CD1-CB 4.05Å; I568-D587 HydrophobicContact CG1-CB 4.34Å; I568-D587 PolarHBondContact N-O 3.17Å; I568-V589 HydrophobicContact CD1-CG2 4.11Å; I568-V589 HydrophobicContact CG1-CG2 3.68Å
569	T	87.2	Confident	81.8	Confident	34 Å²	34	60.6 Å²	60.6	21%	0.209	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	-23.5	-174.2	54.2	0	0	0	0	114.1	K552 V554 F567	K552-T569 VanDerWaalsContact CD-OG1 3.3Å; K552-T569 WeakPolarHBondContact CD-OG1 3.24Å; K552-T569 WeakPolarHBondContact CE-OG1 3.41Å; K552-T569 WeakPolarHBondContact CG-OG1 3.38Å; K552-T569 PolarHBondContact O-N 3.38Å; K552-T569 PolarHBondContact O-OG1 2.87Å; V554-T569 HydrophobicContact CB-CG2 4.09Å; V554-T569 HydrophobicContact CG2-CG2 3.74Å; F567-T569 PolarHBondContact O-N 3.15Å
570	K	85.2	Confident	81.9	Confident	94 Å²	94	63.4 Å²	63.4	41%	0.409	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	141.5	168.3	-67.7	-172.3	176.4	179.9	0	109.7	L551 K552 K708 G709	L551-K570 CarbonylContact C-O 3.6Å; K552-K570 HydrophobicContact CB-CB 4.06Å; K552-K570 HydrophobicContact CD-CB 4.27Å; K552-K570 HydrophobicContact CD-CD 4.42Å; K552-K570 HydrophobicContact CD-CG 4.26Å; K552-K570 PolarHBondContact N-O 3.15Å; K570-K708 PolarHBondContact NZ-O 3.23Å; K570-G709 WeakPolarHBondContact CE-O 3.5Å; K570-G709 PolarHBondContact NZ-O 3.35Å
571	V	88.4	Confident	82	Confident	28 Å²	28	56.6 Å²	56.6	17%	0.17	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	127.4	168.9	-179.9	0	0	0	0	107.5	G550 I568 A577 D578 L583	G550-V571 CarbonylContact O-C 3.45Å; G550-V571 WeakPolarHBondContact O-CA 3.37Å; I568-V571 HydrophobicContact CG2-CG2 3.51Å; V571-A577 HydrophobicContact CG1-CB 3.99Å; V571-D578 HydrophobicContact CG1-CB 3.92Å; V571-L583 HydrophobicContact CG2-CB 4.21Å
572	K	83.3	Confident	82.5	Confident	129 Å²	129	60.3 Å²	60.3	56%	0.561	31%	0.307	S	S	*	.			trans	-81.4	120	-178.6	-177.5	-175.4	177.1	-172.8	0	109.3	G550 G574 S575 D578	G550-K572 WeakPolarHBondContact O-CB 3.4Å; G550-K572 PolarHBondContact O-N 2.84Å; K572-G574 PolarHBondContact O-N 3.17Å; K572-S575 WeakPolarHBondContact O-CB 3.48Å; K572-S575 PolarHBondContact O-N 3.11Å; K572-S575 PolarHBondContact O-OG 3.19Å; K572-D578 WeakPolarHBondContact O-CB 3.09Å
573	R	80.2	Confident	83.3	Confident	226 Å²	226	57.5 Å²	57.5	85%	0.853	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54	135.4	173.6	-68.8	-175.1	178.7	-130.1	0.2	111	D578	R573-D578 VanDerWaalsContact CA-OD2 3.3Å; R573-D578 WeakPolarHBondContact CA-OD2 3.2Å
574	G	77.6	Confident	83.6	Confident	60 Å²	60	57 Å²	57	62%	0.619	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.6	25.1	-176.7	0	0	0	0	0	114.8	K572 D578	K572-G574 PolarHBondContact O-N 3.17Å; G574-D578 PolarHBondContact N-OD2 3.38Å
575	S	83.9	Confident	83.8	Confident	9 Å²	9	57.5 Å²	57.5	6%	0.063	29%	0.29	C	S	.	.	S	Bend	trans	-109.6	171	174.4	70.8	0	0	0	0	112.4	L549 K572 A577 D578 I579	L549-S575 WeakPolarHBondContact O-CB 3.14Å; L549-S575 PolarHBondContact O-OG 3.48Å; K572-S575 WeakPolarHBondContact O-CB 3.48Å; K572-S575 PolarHBondContact O-N 3.11Å; K572-S575 PolarHBondContact O-OG 3.19Å; S575-A577 VanDerWaalsContact C-N 3.27Å; S575-A577 PolarHBondContact O-N 3.32Å; S575-D578 WeakPolarHBondContact O-CB 3.36Å; S575-D578 PolarHBondContact O-N 2.59Å; S575-D578 VanDerWaalsContact O-N 3.07Å; S575-I579 WeakPolarHBondContact O-CG1 3.24Å; S575-I579 PolarHBondContact O-N 2.54Å
576	V	83.7	Confident	83.8	Confident	14 Å²	14	60.1 Å²	60.1	9%	0.085	32%	0.316	C	S	.	.	H	α-helix	trans	-58.2	-39.8	178.6	-172.5	0	0	0	0	111.5	L541 H542 L549 D578 T580 G581	L541-V576 HydrophobicContact CB-CG1 4.06Å; L541-V576 HydrophobicContact CD2-CG1 4.18Å; H542-V576 WeakPolarHBondContact O-CG1 3.36Å; H542-V576 WeakPolarHBondContact O-CG2 2.97Å; L549-V576 PolarHBondContact O-N 3.09Å; V576-D578 VanDerWaalsContact C-N 3.29Å; V576-D578 PolarHBondContact O-N 2.83Å; V576-T580 WeakPolarHBondContact O-CA 3.27Å; V576-T580 VanDerWaalsContact O-CB 3.26Å; V576-T580 WeakPolarHBondContact O-CB 3.13Å; V576-T580 PolarHBondContact O-N 3.25Å; V576-G581 PolarHBondContact O-N 3.14Å
577	A	85.5	Confident	83.8	Confident	0 Å²	0	60.2 Å²	60.2	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-64.4	-31.5	176.8	0	0	0	0	0	113.8	L541 L549 L551 V571 S575 G581 R582 L583	L541-A577 HydrophobicContact CD1-CB 4.38Å; L549-A577 VanDerWaalsContact O-CB 3.3Å; L549-A577 WeakPolarHBondContact O-CB 3.4Å; L549-A577 PolarHBondContact O-N 3Å; L551-A577 HydrophobicContact CB-CB 3.8Å; L551-A577 HydrophobicContact CD2-CB 4.15Å; L551-A577 HydrophobicContact CG-CB 4.5Å; V571-A577 HydrophobicContact CG1-CB 3.99Å; S575-A577 VanDerWaalsContact C-N 3.27Å; S575-A577 PolarHBondContact O-N 3.32Å; A577-G581 CarbonylContact O-C 3.56Å; A577-G581 VanDerWaalsContact O-CA 3.27Å; A577-G581 WeakPolarHBondContact O-CA 3.32Å; A577-R582 PolarHBondContact O-N 2.93Å; A577-L583 HydrophobicContact CB-CD1 4.11Å; A577-L583 WeakPolarHBondContact O-CB 3.23Å; A577-L583 PolarHBondContact O-N 2.63Å
578	D	84.9	Confident	83.8	Confident	57 Å²	57	60.8 Å²	60.8	31%	0.305	32%	0.32	S	S	.	.	H	α-helix	trans	-80	-54.6	178.2	-173	51.1	0	0	0	110.7	V571 K572 R573 G574 S575 V576 R582	V571-D578 HydrophobicContact CG1-CB 3.92Å; K572-D578 WeakPolarHBondContact O-CB 3.09Å; R573-D578 VanDerWaalsContact CA-OD2 3.3Å; R573-D578 WeakPolarHBondContact CA-OD2 3.2Å; G574-D578 PolarHBondContact N-OD2 3.38Å; S575-D578 WeakPolarHBondContact O-CB 3.36Å; S575-D578 PolarHBondContact O-N 2.59Å; S575-D578 VanDerWaalsContact O-N 3.07Å; V576-D578 VanDerWaalsContact C-N 3.29Å; V576-D578 PolarHBondContact O-N 2.83Å; D578-R582 VanDerWaalsContact O-CA 3.25Å; D578-R582 WeakPolarHBondContact O-CA 3.42Å; D578-R582 PolarHBondContact O-N 2.83Å
579	I	78.8	Confident	83.8	Confident	117 Å²	117	60.8 Å²	60.8	60%	0.6	32%	0.32	S	S	*	.	H	α-helix	trans	-75.9	-58.7	-172.8	-58.5	166.2	0	0	0	111.7	S575	S575-I579 WeakPolarHBondContact O-CG1 3.24Å; S575-I579 PolarHBondContact O-N 2.54Å
580	T	73.9	Confident	84	Confident	75 Å²	75	59.8 Å²	59.8	46%	0.46	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-39.5	-178.3	-45	0	0	0	0	110.7	V576	V576-T580 WeakPolarHBondContact O-CA 3.27Å; V576-T580 VanDerWaalsContact O-CB 3.26Å; V576-T580 WeakPolarHBondContact O-CB 3.13Å; V576-T580 PolarHBondContact O-N 3.25Å
581	G	67.2	Low	84.3	Confident	1 Å²	1	58.4 Å²	58.4	1%	0.01	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.2	-33	-176.2	0	0	0	0	0	114.8	R537 V576 A577 L583	R537-G581 VanDerWaalsContact CZ-O 3.25Å; R537-G581 PolarHBondContact NH1-O 3.4Å; R537-G581 PolarHBondContact NH2-O 3.19Å; V576-G581 PolarHBondContact O-N 3.14Å; A577-G581 CarbonylContact O-C 3.56Å; A577-G581 VanDerWaalsContact O-CA 3.27Å; A577-G581 WeakPolarHBondContact O-CA 3.32Å; G581-L583 PolarHBondContact O-N 3.18Å; G581-L583 VanDerWaalsContact O-N 3.14Å
582	R	80.5	Confident	84.5	Confident	196 Å²	196	57.1 Å²	57.1	74%	0.74	30%	0.3	S	S	*	.			trans	44.3	38	-161.9	-58.3	-171.8	-179.2	-152.6	2.4	111.9	R537 A577 D578	R537-R582 PolarHBondContact NH2-O 3.02Å; A577-R582 PolarHBondContact O-N 2.93Å; D578-R582 VanDerWaalsContact O-CA 3.25Å; D578-R582 WeakPolarHBondContact O-CA 3.42Å; D578-R582 PolarHBondContact O-N 2.83Å
583	L	87.8	Confident	84.8	Confident	4 Å²	4	54 Å²	54	2%	0.021	29%	0.29	C	S	.	.			trans	-79.1	141.8	-178.4	-65.2	168.8	0	0	0	109.1	V539 L541 I568 V571 A577 G581 L620 V622	V539-L583 HydrophobicContact CG2-CD2 4.32Å; L541-L583 HydrophobicContact CD1-CD1 4.04Å; I568-L583 HydrophobicContact CD1-CB 3.97Å; I568-L583 HydrophobicContact CD1-CD1 4.03Å; I568-L583 HydrophobicContact CD1-CD2 3.87Å; I568-L583 HydrophobicContact CD1-CG 4.17Å; V571-L583 HydrophobicContact CG2-CB 4.21Å; A577-L583 HydrophobicContact CB-CD1 4.11Å; A577-L583 WeakPolarHBondContact O-CB 3.23Å; A577-L583 PolarHBondContact O-N 2.63Å; G581-L583 PolarHBondContact O-N 3.18Å; G581-L583 VanDerWaalsContact O-N 3.14Å; L583-L620 HydrophobicContact CD1-CD1 4.22Å; L583-V622 HydrophobicContact CD2-CB 4.32Å; L583-V622 HydrophobicContact CD2-CG1 3.94Å; L583-V622 HydrophobicContact CD2-CG2 3.95Å
584	V	86.5	Confident	85	Confident	66 Å²	66	45.8 Å²	45.8	40%	0.4	28%	0.276	S	S	.	.			trans	-123.3	140.5	-175.1	-177.6	0	0	0	0	109.4	G586 D587 R624	V584-G586 PolarHBondContact O-N 2.84Å; V584-D587 PolarHBondContact N-OD2 3.19Å; V584-D587 VanDerWaalsContact O-CB 3.28Å; V584-D587 WeakPolarHBondContact O-CB 3.42Å; V584-D587 VanDerWaalsContact O-CG 3.24Å; V584-D587 PolarHBondContact O-N 3.27Å; V584-R624 VanDerWaalsContact CG2-NH2 3.28Å
585	P	87.1	Confident	85.5	Confident	73 Å²	73	46.6 Å²	46.6	47%	0.474	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.5	127.1	169.8	-25.1	35.5	0	0	0	111	I568	I568-P585 CarbonylContact O-C 3.56Å; I568-P585 WeakPolarHBondContact O-CA 3.26Å
586	G	84.1	Confident	85.7	Confident	54 Å²	54	49.4 Å²	49.4	56%	0.557	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	108.4	-19.4	-170.4	0	0	0	0	0	114.2	I568 V584	I568-G586 PolarHBondContact O-N 3.37Å; V584-G586 PolarHBondContact O-N 2.84Å
587	D	90.7	Very high	85.9	Confident	2 Å²	2	48.9 Å²	48.9	1%	0.011	28%	0.28	C	S	.	.			trans	-61.7	133.5	170.8	-72.5	-11.1	0	0	0	110.6	R537 I568 V584 V622 A623 R624	R537-D587 IonicContact NH2-OD2 3.72Å; I568-D587 HydrophobicContact CB-CB 4.4Å; I568-D587 HydrophobicContact CD1-CB 4.05Å; I568-D587 HydrophobicContact CG1-CB 4.34Å; I568-D587 PolarHBondContact N-O 3.17Å; V584-D587 PolarHBondContact N-OD2 3.19Å; V584-D587 VanDerWaalsContact O-CB 3.28Å; V584-D587 WeakPolarHBondContact O-CB 3.42Å; V584-D587 VanDerWaalsContact O-CG 3.24Å; V584-D587 PolarHBondContact O-N 3.27Å; D587-V622 HydrophobicContact CB-CG1 3.64Å; D587-A623 CarbonylContact C-O 3.57Å; D587-A623 WeakPolarHBondContact CA-O 3.21Å; D587-R624 VanDerWaalsContact CG-NH2 3.29Å; D587-R624 IonicContact OD1-CZ 2.65Å; D587-R624 IonicContact OD1-NE 2.76Å; D587-R624 PolarHBondContact OD1-NE 3.46Å; D587-R624 IonicContact OD1-NH2 2.75Å; D587-R624 PolarHBondContact OD1-NH2 3.47Å; D587-R624 IonicContact OD2-CZ 2.87Å; D587-R624 IonicContact OD2-NH2 2.79Å; D587-R624 PolarHBondContact OD2-NH2 2.89Å
588	E	91.2	Very high	85.9	Confident	36 Å²	36	51.7 Å²	51.7	17%	0.168	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	136.4	174.4	-172.1	177.9	175.2	0	0	110.1	A566 F567 L590 V622 A623	A566-E588 CarbonylContact O-C 3.48Å; A566-E588 WeakPolarHBondContact O-CA 3.46Å; A566-E588 WeakPolarHBondContact O-CG 3.42Å; F567-E588 HydrophobicContact CD1-CB 3.93Å; F567-E588 HydrophobicContact CD1-CG 4.18Å; F567-E588 HydrophobicContact CE1-CB 3.72Å; F567-E588 HydrophobicContact CE1-CG 3.79Å; F567-E588 HydrophobicContact CZ-CB 4.46Å; F567-E588 HydrophobicContact CZ-CG 4.03Å; E588-L590 HydrophobicContact CG-CD2 4.24Å; E588-V622 CarbonylContact O-C 3.49Å; E588-V622 VanDerWaalsContact O-CA 3.23Å; E588-V622 WeakPolarHBondContact O-CA 3.17Å; E588-V622 WeakPolarHBondContact O-CG1 3.11Å; E588-A623 HydrophobicContact CB-CB 4.48Å; E588-A623 PolarHBondContact N-O 3.01Å; E588-A623 PolarHBondContact O-N 3.36Å
589	V	92.5	Very high	85.9	Confident	1 Å²	1	53.5 Å²	53.5	1%	0.006	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	105.9	175.7	-172.3	0	0	0	0	108.4	V553 A566 I568 E591 W592 L597 L620 V621	V553-V589 HydrophobicContact CG2-CG2 4.17Å; A566-V589 HydrophobicContact CB-CB 4.39Å; A566-V589 PolarHBondContact O-N 2.62Å; I568-V589 HydrophobicContact CD1-CG2 4.11Å; I568-V589 HydrophobicContact CG1-CG2 3.68Å; V589-E591 WeakPolarHBondContact CG1-O 3.32Å; V589-W592 HydrophobicContact CG1-CE3 4.34Å; V589-L597 HydrophobicContact CB-CD1 4.42Å; V589-L597 HydrophobicContact CG1-CD1 4.01Å; V589-L620 HydrophobicContact CG1-CD2 4.37Å; V589-V621 CarbonylContact C-O 3.46Å
590	L	90.6	Very high	86	Confident	13 Å²	13	48.2 Å²	48.2	7%	0.068	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	-34.5	178.7	-61.1	-176.1	0	0	0	112.3	Y534 E588 L597 Q598 V621 A623	Y534-L590 HydrophobicContact CE2-CD1 4.41Å; E588-L590 HydrophobicContact CG-CD2 4.24Å; L590-L597 PolarHBondContact O-N 2.82Å; L590-Q598 HydrophobicContact CB-CG 4.11Å; L590-Q598 HydrophobicContact CD2-CG 3.94Å; L590-Q598 WeakPolarHBondContact O-CG 3.38Å; L590-V621 HydrophobicContact CB-CB 4.39Å; L590-V621 HydrophobicContact CB-CG1 4.2Å; L590-V621 HydrophobicContact CD1-CG1 4.34Å; L590-V621 PolarHBondContact N-O 2.78Å; L590-A623 HydrophobicContact CD1-CB 3.81Å; L590-A623 HydrophobicContact CD2-CB 4.26Å; L590-A623 HydrophobicContact CG-CB 3.92Å
591	E	92.8	Very high	86.5	Confident	66 Å²	66	46.6 Å²	46.6	31%	0.308	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	148.7	178.1	-59	174.6	-158.1	0	0	111.9	V589 Q595 L620 V621	V589-E591 WeakPolarHBondContact CG1-O 3.32Å; E591-Q595 CarbonylContact C-O 3.55Å; E591-Q595 VanDerWaalsContact CA-O 3.29Å; E591-Q595 WeakPolarHBondContact CA-O 3.16Å; E591-L620 WeakPolarHBondContact O-CA 3.4Å; E591-V621 HydrophobicContact CB-CB 3.79Å; E591-V621 HydrophobicContact CB-CG2 3.92Å; E591-V621 HydrophobicContact CG-CB 3.94Å; E591-V621 HydrophobicContact CG-CG2 4.03Å; E591-V621 PolarHBondContact N-O 2.84Å; E591-V621 PolarHBondContact O-N 3.15Å; E591-V621 WeakPolarHBondContact OE2-CG2 3.31Å
592	W	91.8	Very high	87.2	Confident	0 Å²	0	49 Å²	49	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	111.3	176.7	-174.7	-77.8	0	0	0	109.8	L551 V553 V589 G594 Q595 L597 A608 I609 S612 I618 L620 I680	L551-W592 HydrophobicContact CD1-CH2 3.98Å; L551-W592 HydrophobicContact CD1-CZ3 4.06Å; V553-W592 HydrophobicContact CG2-CZ3 4.14Å; V589-W592 HydrophobicContact CG1-CE3 4.34Å; W592-G594 PolarHBondContact O-N 2.81Å; W592-Q595 PolarHBondContact N-O 2.79Å; W592-Q595 WeakPolarHBondContact O-CB 3.28Å; W592-Q595 PolarHBondContact O-N 2.91Å; W592-L597 HydrophobicContact CB-CD1 3.68Å; W592-L597 HydrophobicContact CB-CD2 4.12Å; W592-L597 HydrophobicContact CB-CG 3.84Å; W592-L597 HydrophobicContact CG-CD1 4.44Å; W592-A608 HydrophobicContact CG-CB 4.42Å; W592-A608 PolarHBondContact NE1-O 2.68Å; W592-I609 HydrophobicContact CD2-CG1 3.96Å; W592-I609 HydrophobicContact CE3-CG1 4.06Å; W592-I609 HydrophobicContact CH2-CG1 4.09Å; W592-I609 HydrophobicContact CH2-CG2 4.25Å; W592-I609 HydrophobicContact CZ2-CB 4.23Å; W592-I609 HydrophobicContact CZ2-CG1 3.92Å; W592-I609 HydrophobicContact CZ2-CG2 3.9Å; W592-I609 HydrophobicContact CZ3-CG1 4.14Å; W592-S612 WeakPolarHBondContact CZ2-OG 3.39Å; W592-S612 PolarHBondContact NE1-OG 2.86Å; W592-I618 HydrophobicContact CH2-CG2 4.2Å; W592-I618 HydrophobicContact CZ2-CD1 4.16Å; W592-I618 HydrophobicContact CZ2-CG2 3.9Å; W592-L620 HydrophobicContact CD2-CD2 3.7Å; W592-L620 HydrophobicContact CE3-CD2 3.24Å; W592-L620 HydrophobicContact CG-CD2 4.29Å; W592-L620 HydrophobicContact CH2-CD2 4.24Å; W592-L620 HydrophobicContact CZ3-CD2 3.55Å; W592-I680 HydrophobicContact CH2-CD1 3.58Å; W592-I680 HydrophobicContact CZ2-CD1 3.83Å
593	N	90	Very high	87.4	Confident	63 Å²	63	43.9 Å²	43.9	34%	0.337	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.5	31.1	-172.4	-66.1	-24.5	0	0	0	114.4	Q595 S612 I618 D619	N593-Q595 VanDerWaalsContact C-N 3.32Å; N593-S612 VanDerWaalsContact ND2-CB 3.31Å; N593-S612 WeakPolarHBondContact ND2-CB 3.49Å; N593-I618 VanDerWaalsContact OD1-CA 3.29Å; N593-I618 WeakPolarHBondContact OD1-CA 3.31Å; N593-D619 WeakPolarHBondContact CA-O 2.91Å; N593-D619 PolarHBondContact N-O 2.8Å; N593-D619 PolarHBondContact OD1-N 2.84Å
594	G	84.7	Confident	87.2	Confident	55 Å²	55	48.9 Å²	48.9	57%	0.567	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.1	0.7	-176	0	0	0	0	0	115.1	W592	W592-G594 PolarHBondContact O-N 2.81Å
595	Q	86.5	Confident	87.2	Confident	77 Å²	77	45.9 Å²	45.9	36%	0.36	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	123.4	162.8	-67.4	170.1	-28.3	0	0	108.4	E591 W592 N593 L597	E591-Q595 CarbonylContact C-O 3.55Å; E591-Q595 VanDerWaalsContact CA-O 3.29Å; E591-Q595 WeakPolarHBondContact CA-O 3.16Å; W592-Q595 PolarHBondContact N-O 2.79Å; W592-Q595 WeakPolarHBondContact O-CB 3.28Å; W592-Q595 PolarHBondContact O-N 2.91Å; N593-Q595 VanDerWaalsContact C-N 3.32Å; Q595-L597 PolarHBondContact O-N 2.85Å
596	S	88.6	Confident	87.1	Confident	68 Å²	68	43.3 Å²	43.3	48%	0.476	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.5	129.4	171.4	-179.2	0	0	0	0	109.7	Q598	S596-Q598 PolarHBondContact OG-N 3.3Å
597	L	88.7	Confident	87.1	Confident	3 Å²	3	43.5 Å²	43.5	2%	0.016	24%	0.243	C	C	.	.			trans	-99.8	3.9	171.1	-60.3	-167.1	0	0	0	112.2	A566 V589 L590 W592 Q595 A600 V605 A608	A566-L597 HydrophobicContact CB-CB 4.04Å; A566-L597 HydrophobicContact CB-CD1 3.89Å; V589-L597 HydrophobicContact CB-CD1 4.42Å; V589-L597 HydrophobicContact CG1-CD1 4.01Å; L590-L597 PolarHBondContact O-N 2.82Å; W592-L597 HydrophobicContact CB-CD1 3.68Å; W592-L597 HydrophobicContact CB-CD2 4.12Å; W592-L597 HydrophobicContact CB-CG 3.84Å; W592-L597 HydrophobicContact CG-CD1 4.44Å; Q595-L597 PolarHBondContact O-N 2.85Å; L597-A600 VanDerWaalsContact O-CB 3.31Å; L597-A600 WeakPolarHBondContact O-CB 3.14Å; L597-A600 PolarHBondContact O-N 3.43Å; L597-V605 HydrophobicContact CB-CG2 4.37Å; L597-V605 HydrophobicContact CD1-CG1 4.16Å; L597-V605 HydrophobicContact CD1-CG2 4.41Å; L597-V605 HydrophobicContact CD2-CG2 4.23Å; L597-A608 HydrophobicContact CD2-CB 3.79Å
598	Q	84.6	Confident	86.9	Confident	59 Å²	59	43.6 Å²	43.6	28%	0.276	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.5	130.4	178.7	-39.2	176.8	26.2	0	0	110.3	L590 S596 A600	L590-Q598 HydrophobicContact CB-CG 4.11Å; L590-Q598 HydrophobicContact CD2-CG 3.94Å; L590-Q598 WeakPolarHBondContact O-CG 3.38Å; S596-Q598 PolarHBondContact OG-N 3.3Å; Q598-A600 PolarHBondContact O-N 2.84Å
599	N	84.4	Confident	86.7	Confident	94 Å²	94	42 Å²	42	50%	0.503	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.8	4.4	-165.8	-58	-23.7	0	0	0	114.8	R563 L564 S601	R563-N599 WeakPolarHBondContact CB-OD1 3.38Å; R563-N599 WeakPolarHBondContact CG-OD1 3.34Å; R563-N599 PolarHBondContact NE-OD1 3.4Å; R563-N599 PolarHBondContact NH2-ND2 3.44Å; L564-N599 WeakPolarHBondContact O-CA 3.33Å; L564-N599 PolarHBondContact O-N 2.76Å; N599-S601 PolarHBondContact O-N 2.92Å
600	A	82.5	Confident	86.3	Confident	7 Å²	7	44.5 Å²	44.5	6%	0.058	25%	0.25	C	S	.	.			trans	-69.2	133.5	-179.1	0	0	0	0	0	110.9	L597 Q598 E604 V605	L597-A600 VanDerWaalsContact O-CB 3.31Å; L597-A600 WeakPolarHBondContact O-CB 3.14Å; L597-A600 PolarHBondContact O-N 3.43Å; Q598-A600 PolarHBondContact O-N 2.84Å; A600-E604 HydrophobicContact CB-CB 4.07Å; A600-V605 HydrophobicContact CB-CG2 3.79Å
601	S	83.1	Confident	85.9	Confident	41 Å²	41	49.6 Å²	49.6	29%	0.287	27%	0.273	S	S	.	.			trans	-61.1	164.1	171.5	67.4	0	0	0	0	111.3	N599 D603 E604 V605	N599-S601 PolarHBondContact O-N 2.92Å; S601-D603 VanDerWaalsContact C-N 3.26Å; S601-D603 PolarHBondContact O-N 3.45Å; S601-E604 WeakPolarHBondContact CB-OE2 3.34Å; S601-E604 PolarHBondContact N-OE2 3.23Å; S601-E604 PolarHBondContact O-N 2.63Å; S601-E604 WeakPolarHBondContact OG-CG 3.42Å; S601-E604 PolarHBondContact OG-N 3.29Å; S601-E604 PolarHBondContact OG-OE2 3.46Å; S601-V605 WeakPolarHBondContact O-CG2 3.32Å; S601-V605 PolarHBondContact O-N 2.96Å; S601-V605 VanDerWaalsContact O-N 3.13Å
602	F	82.2	Confident	85.4	Confident	52 Å²	52	46.5 Å²	46.5	23%	0.228	26%	0.259	C	S	.	.	H	α-helix	trans	-52.7	-44.5	174.7	156.2	-100.6	0	0	0	111.9	V605 C606 P676	F602-V605 PolarHBondContact O-N 2.92Å; F602-C606 HydrophobicContact CE2-CB 3.96Å; F602-C606 HydrophobicContact CZ-CB 3.84Å; F602-C606 WeakPolarHBondContact O-CB 3.09Å; F602-C606 PolarHBondContact O-N 3.14Å; F602-P676 HydrophobicContact CD2-CG 4.31Å; F602-P676 HydrophobicContact CE1-CG 3.89Å; F602-P676 VanDerWaalsContact CE2-CD 3.42Å; F602-P676 HydrophobicContact CE2-CG 3.38Å; F602-P676 HydrophobicContact CZ-CG 3.14Å
603	D	84.2	Confident	84.6	Confident	88 Å²	88	50.5 Å²	50.5	47%	0.471	28%	0.276	S	S	.	.	H	α-helix	trans	-69.9	-38.6	-176.5	-165.8	62.7	0	0	0	112.2	S601 V605 C606 N607	S601-D603 VanDerWaalsContact C-N 3.26Å; S601-D603 PolarHBondContact O-N 3.45Å; D603-V605 PolarHBondContact O-N 3.01Å; D603-C606 CarbonylContact O-C 3.57Å; D603-C606 WeakPolarHBondContact O-CA 3.36Å; D603-C606 WeakPolarHBondContact O-CB 3.46Å; D603-C606 PolarHBondContact O-N 3.43Å; D603-C606 VanDerWaalsContact O-N 3.16Å; D603-N607 WeakPolarHBondContact O-CB 3.46Å; D603-N607 PolarHBondContact O-N 2.85Å; D603-N607 PolarHBondContact O-ND2 2.92Å; D603-N607 VanDerWaalsContact O-ND2 3.11Å; D603-N607 PolarHBondContact OD2-ND2 3.21Å
604	E	84.8	Confident	83.7	Confident	109 Å²	109	55.1 Å²	55.1	51%	0.509	29%	0.294	S	S	.	.	H	α-helix	trans	-61.6	-44.4	175.2	-72.6	164.7	117.4	0	0	112.3	A600 S601 C606 N607 A608	A600-E604 HydrophobicContact CB-CB 4.07Å; S601-E604 WeakPolarHBondContact CB-OE2 3.34Å; S601-E604 PolarHBondContact N-OE2 3.23Å; S601-E604 PolarHBondContact O-N 2.63Å; S601-E604 WeakPolarHBondContact OG-CG 3.42Å; S601-E604 PolarHBondContact OG-N 3.29Å; S601-E604 PolarHBondContact OG-OE2 3.46Å; E604-C606 VanDerWaalsContact C-N 3.3Å; E604-C606 PolarHBondContact O-N 3.39Å; E604-N607 PolarHBondContact O-N 2.86Å; E604-A608 PolarHBondContact O-N 2.53Å
605	V	87.1	Confident	83.4	Confident	2 Å²	2	54.5 Å²	54.5	1%	0.012	28%	0.281	C	S	.	.	H	α-helix	trans	-61.9	-41	173.5	175.4	0	0	0	0	110.8	V553 A566 L597 A600 S601 F602 D603 N607 I609	V553-V605 HydrophobicContact CG1-CG1 4.31Å; A566-V605 HydrophobicContact CB-CG1 4.08Å; A566-V605 HydrophobicContact CB-CG2 4.03Å; L597-V605 HydrophobicContact CB-CG2 4.37Å; L597-V605 HydrophobicContact CD1-CG1 4.16Å; L597-V605 HydrophobicContact CD1-CG2 4.41Å; L597-V605 HydrophobicContact CD2-CG2 4.23Å; A600-V605 HydrophobicContact CB-CG2 3.79Å; S601-V605 WeakPolarHBondContact O-CG2 3.32Å; S601-V605 PolarHBondContact O-N 2.96Å; S601-V605 VanDerWaalsContact O-N 3.13Å; F602-V605 PolarHBondContact O-N 2.92Å; D603-V605 PolarHBondContact O-N 3.01Å; V605-N607 VanDerWaalsContact C-N 3.33Å; V605-N607 PolarHBondContact O-N 2.79Å; V605-I609 HydrophobicContact CG1-CD1 3.92Å; V605-I609 WeakPolarHBondContact O-CD1 3.33Å; V605-I609 VanDerWaalsContact O-CG1 3.28Å; V605-I609 WeakPolarHBondContact O-CG1 3.48Å; V605-I609 PolarHBondContact O-N 2.82Å; V605-I609 VanDerWaalsContact O-N 3.17Å
606	C	83.7	Confident	83.1	Confident	19 Å²	19	55.9 Å²	55.9	13%	0.128	29%	0.291	C	S	.	.	H	α-helix	trans	-62.7	-41.8	175.8	-136	0	0	0	0	111.4	F602 D603 E604 I609 N610 V678	F602-C606 HydrophobicContact CE2-CB 3.96Å; F602-C606 HydrophobicContact CZ-CB 3.84Å; F602-C606 WeakPolarHBondContact O-CB 3.09Å; F602-C606 PolarHBondContact O-N 3.14Å; D603-C606 CarbonylContact O-C 3.57Å; D603-C606 WeakPolarHBondContact O-CA 3.36Å; D603-C606 WeakPolarHBondContact O-CB 3.46Å; D603-C606 PolarHBondContact O-N 3.43Å; D603-C606 VanDerWaalsContact O-N 3.16Å; E604-C606 VanDerWaalsContact C-N 3.3Å; E604-C606 PolarHBondContact O-N 3.39Å; C606-I609 PolarHBondContact O-N 2.89Å; C606-N610 WeakPolarHBondContact O-CB 3.46Å; C606-N610 PolarHBondContact O-N 3.19Å; C606-N610 PolarHBondContact O-ND2 3.27Å; C606-V678 VanDerWaalsContact SG-CG2 3.59Å
607	N	85.1	Confident	82.9	Confident	59 Å²	59	59.6 Å²	59.6	32%	0.316	29%	0.294	S	S	.	.	H	α-helix	trans	-69	-42.6	179.8	-73.8	-35	0	0	0	112.7	D603 E604 V605 I609 N610 Q611	D603-N607 WeakPolarHBondContact O-CB 3.46Å; D603-N607 PolarHBondContact O-N 2.85Å; D603-N607 PolarHBondContact O-ND2 2.92Å; D603-N607 VanDerWaalsContact O-ND2 3.11Å; D603-N607 PolarHBondContact OD2-ND2 3.21Å; E604-N607 PolarHBondContact O-N 2.86Å; V605-N607 VanDerWaalsContact C-N 3.33Å; V605-N607 PolarHBondContact O-N 2.79Å; N607-I609 PolarHBondContact O-N 3.39Å; N607-N610 PolarHBondContact O-N 2.94Å; N607-Q611 WeakPolarHBondContact O-CB 3.02Å; N607-Q611 WeakPolarHBondContact O-CG 2.97Å; N607-Q611 PolarHBondContact O-N 2.91Å
608	A	86.2	Confident	82.9	Confident	4 Å²	4	59.5 Å²	59.5	3%	0.033	29%	0.294	C	S	.	.	H	α-helix	trans	-58.5	-46.1	173.4	0	0	0	0	0	111.8	W592 L597 E604 S612	W592-A608 HydrophobicContact CG-CB 4.42Å; W592-A608 PolarHBondContact NE1-O 2.68Å; L597-A608 HydrophobicContact CD2-CB 3.79Å; E604-A608 PolarHBondContact O-N 2.53Å; A608-S612 PolarHBondContact O-N 2.85Å
609	I	87.3	Confident	83.2	Confident	3 Å²	3	57.6 Å²	57.6	2%	0.015	29%	0.286	C	S	.	.	H	α-helix	trans	-67.8	-40.5	176.4	-57.8	164.5	0	0	0	110.6	V553 W592 V605 C606 N607 S612 K613 V678 I680	V553-I609 HydrophobicContact CB-CD1 4.02Å; V553-I609 HydrophobicContact CG1-CD1 4.25Å; W592-I609 HydrophobicContact CD2-CG1 3.96Å; W592-I609 HydrophobicContact CE3-CG1 4.06Å; W592-I609 HydrophobicContact CH2-CG1 4.09Å; W592-I609 HydrophobicContact CH2-CG2 4.25Å; W592-I609 HydrophobicContact CZ2-CB 4.23Å; W592-I609 HydrophobicContact CZ2-CG1 3.92Å; W592-I609 HydrophobicContact CZ2-CG2 3.9Å; W592-I609 HydrophobicContact CZ3-CG1 4.14Å; V605-I609 HydrophobicContact CG1-CD1 3.92Å; V605-I609 WeakPolarHBondContact O-CD1 3.33Å; V605-I609 VanDerWaalsContact O-CG1 3.28Å; V605-I609 WeakPolarHBondContact O-CG1 3.48Å; V605-I609 PolarHBondContact O-N 2.82Å; V605-I609 VanDerWaalsContact O-N 3.17Å; C606-I609 PolarHBondContact O-N 2.89Å; N607-I609 PolarHBondContact O-N 3.39Å; I609-S612 PolarHBondContact O-N 2.83Å; I609-S612 PolarHBondContact O-OG 2.98Å; I609-K613 PolarHBondContact O-N 2.77Å; I609-V678 HydrophobicContact CB-CG1 4.17Å; I609-V678 HydrophobicContact CD1-CB 4.19Å; I609-V678 HydrophobicContact CD1-CG1 4.49Å; I609-V678 HydrophobicContact CD1-CG2 4.2Å; I609-V678 HydrophobicContact CG2-CB 4.31Å; I609-V678 HydrophobicContact CG2-CG1 3.47Å; I609-V678 VanDerWaalsContact CG2-CG1 3.47Å; I609-I680 HydrophobicContact CG2-CD1 3.73Å; I609-I680 HydrophobicContact CG2-CG1 3.95Å
610	N	83.4	Confident	83.5	Confident	53 Å²	53	53.2 Å²	53.2	28%	0.283	26%	0.262	S	S	.	.	H	α-helix	trans	-60.9	-44.8	176.9	-77.3	-33	0	0	0	112.6	C606 N607 S612 K613	C606-N610 WeakPolarHBondContact O-CB 3.46Å; C606-N610 PolarHBondContact O-N 3.19Å; C606-N610 PolarHBondContact O-ND2 3.27Å; N607-N610 PolarHBondContact O-N 2.94Å; N610-S612 PolarHBondContact O-N 2.89Å; N610-K613 VanDerWaalsContact O-CB 3.29Å; N610-K613 WeakPolarHBondContact O-CB 3.31Å; N610-K613 WeakPolarHBondContact O-CG 3.48Å; N610-K613 PolarHBondContact O-N 2.92Å; N610-K613 VanDerWaalsContact O-N 3.09Å; N610-K613 WeakPolarHBondContact OD1-CE 3.39Å; N610-K613 PolarHBondContact OD1-NZ 2.69Å
611	Q	82.9	Confident	84	Confident	119 Å²	119	53.6 Å²	53.6	56%	0.556	26%	0.264	S	S	*	.	H	α-helix	trans	-57.9	-38.4	175.4	-71.8	164.9	34.2	0	0	110.9	N607 K613	N607-Q611 WeakPolarHBondContact O-CB 3.02Å; N607-Q611 WeakPolarHBondContact O-CG 2.97Å; N607-Q611 PolarHBondContact O-N 2.91Å; Q611-K613 VanDerWaalsContact C-N 3.32Å; Q611-K613 PolarHBondContact O-N 2.78Å
612	S	81.7	Confident	84.4	Confident	1 Å²	1	51.7 Å²	51.7	1%	0.007	25%	0.25	C	S	.	.	G	3₁₀ helix	trans	-77.3	-3.7	177.8	77	0	0	0	0	116.1	W592 N593 A608 I609 N610 F614 S615	W592-S612 WeakPolarHBondContact CZ2-OG 3.39Å; W592-S612 PolarHBondContact NE1-OG 2.86Å; N593-S612 VanDerWaalsContact ND2-CB 3.31Å; N593-S612 WeakPolarHBondContact ND2-CB 3.49Å; A608-S612 PolarHBondContact O-N 2.85Å; I609-S612 PolarHBondContact O-N 2.83Å; I609-S612 PolarHBondContact O-OG 2.98Å; N610-S612 PolarHBondContact O-N 2.89Å; S612-F614 PolarHBondContact O-N 2.7Å; S612-S615 WeakPolarHBondContact O-CB 3.42Å; S612-S615 PolarHBondContact O-N 2.6Å
613	K	75.3	Confident	84.7	Confident	84 Å²	84	49.3 Å²	49.3	37%	0.365	24%	0.24	S	C	.	.	G	3₁₀ helix	trans	-57.3	-25.4	-176.7	-82.9	174.5	168.4	167.2	0	114	R543 I609 N610 Q611	R543-K613 PolarHBondContact NH1-O 2.96Å; R543-K613 PolarHBondContact NH2-O 2.99Å; I609-K613 PolarHBondContact O-N 2.77Å; N610-K613 VanDerWaalsContact O-CB 3.29Å; N610-K613 WeakPolarHBondContact O-CB 3.31Å; N610-K613 WeakPolarHBondContact O-CG 3.48Å; N610-K613 PolarHBondContact O-N 2.92Å; N610-K613 VanDerWaalsContact O-N 3.09Å; N610-K613 WeakPolarHBondContact OD1-CE 3.39Å; N610-K613 PolarHBondContact OD1-NZ 2.69Å; Q611-K613 VanDerWaalsContact C-N 3.32Å; Q611-K613 PolarHBondContact O-N 2.78Å
614	F	71.1	Confident	84.8	Confident	160 Å²	160	48.7 Å²	48.7	70%	0.702	23%	0.232	S	C	*	.	G	3₁₀ helix	trans	-98.7	-10.4	178.6	-56.1	-72.8	0	0	0	113.4	R543 S612	R543-F614 PolarHBondContact NH2-O 3.34Å; S612-F614 PolarHBondContact O-N 2.7Å
615	S	78.2	Confident	84.4	Confident	43 Å²	43	47.2 Å²	47.2	30%	0.301	23%	0.233	S	C	.	.			trans	-72.5	132.6	179.8	-54.1	0	0	0	0	112.3	R543 S612 R617	R543-S615 PolarHBondContact NH2-O 3.31Å; R543-S615 VanDerWaalsContact NH2-O 3.16Å; S612-S615 WeakPolarHBondContact O-CB 3.42Å; S612-S615 PolarHBondContact O-N 2.6Å; S615-R617 WeakPolarHBondContact CB-O 3.17Å
616	N	79.7	Confident	83.4	Confident	106 Å²	106	50.1 Å²	50.1	57%	0.567	25%	0.251	S	S	*	.	S	Bend	trans	-91.6	-6.3	175.2	-65.4	-21.8	0	0	0	113.3	H542 R543	H542-N616 WeakPolarHBondContact CA-O 3.48Å; R543-N616 PolarHBondContact N-O 3.28Å; R543-N616 PolarHBondContact NH2-OD1 3.13Å; R543-N616 VanDerWaalsContact NH2-OD1 3.08Å
617	R	85.5	Confident	81.7	Confident	146 Å²	146	55.1 Å²	55.1	55%	0.551	28%	0.281	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-127.9	131.8	169.2	173.3	177.8	164	-176	-3.9	107.5	V540 L541 S615 D619	V540-R617 HydrophobicContact CG1-CG 3.66Å; L541-R617 WeakPolarHBondContact O-CA 3.47Å; S615-R617 WeakPolarHBondContact CB-O 3.17Å; R617-D619 IonicContact NH2-OD2 3.14Å
618	I	88.3	Confident	79.2	Confident	1 Å²	1	59.8 Å²	59.8	1%	0.005	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	131.3	174.6	-81.2	154.4	0	0	0	108.4	V540 L541 L549 W592 N593 L620	V540-I618 CarbonylContact C-O 3.53Å; V540-I618 WeakPolarHBondContact CA-O 3.15Å; L541-I618 PolarHBondContact N-O 3.17Å; L541-I618 PolarHBondContact O-N 3.21Å; L549-I618 HydrophobicContact CD1-CD1 3.59Å; W592-I618 HydrophobicContact CH2-CG2 4.2Å; W592-I618 HydrophobicContact CZ2-CD1 4.16Å; W592-I618 HydrophobicContact CZ2-CG2 3.9Å; N593-I618 VanDerWaalsContact OD1-CA 3.29Å; N593-I618 WeakPolarHBondContact OD1-CA 3.31Å; I618-L620 HydrophobicContact CG2-CD2 3.65Å; I618-L620 HydrophobicContact CG2-CG 4Å
619	D	90.2	Very high	76.4	Confident	19 Å²	19	65 Å²	65	10%	0.102	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	124.8	-174.8	-159.4	-20.8	0	0	0	108.2	R538 N593 R617	R538-D619 VanDerWaalsContact CG-OD1 3.27Å; R538-D619 WeakPolarHBondContact CG-OD1 3.46Å; R538-D619 IonicContact CZ-OD1 2.69Å; R538-D619 IonicContact CZ-OD2 2.82Å; R538-D619 IonicContact NE-OD1 2.65Å; R538-D619 PolarHBondContact NE-OD1 3.48Å; R538-D619 IonicContact NE-OD2 2.62Å; R538-D619 PolarHBondContact NE-OD2 3.3Å; R538-D619 IonicContact NH2-OD1 3.22Å; R538-D619 IonicContact NH2-OD2 2.69Å; R538-D619 PolarHBondContact NH2-OD2 3.25Å; N593-D619 WeakPolarHBondContact CA-O 2.91Å; N593-D619 PolarHBondContact N-O 2.8Å; N593-D619 PolarHBondContact OD1-N 2.84Å; R617-D619 IonicContact NH2-OD2 3.14Å
620	L	91.7	Very high	73.6	Confident	1 Å²	1	70.2 Å²	70.2	1%	0.005	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	136.9	-173.2	-55	176.5	0	0	0	110	R538 V539 L541 L551 L583 V589 E591 W592 I618 V622	R538-L620 CarbonylContact C-O 3.59Å; R538-L620 VanDerWaalsContact CA-O 3.3Å; R538-L620 WeakPolarHBondContact CA-O 3.25Å; V539-L620 HydrophobicContact CB-CB 4.45Å; V539-L620 PolarHBondContact N-O 3.31Å; V539-L620 PolarHBondContact O-N 2.78Å; L541-L620 HydrophobicContact CD1-CD1 3.82Å; L541-L620 HydrophobicContact CG-CD1 4.37Å; L551-L620 HydrophobicContact CD2-CD1 4.4Å; L583-L620 HydrophobicContact CD1-CD1 4.22Å; V589-L620 HydrophobicContact CG1-CD2 4.37Å; E591-L620 WeakPolarHBondContact O-CA 3.4Å; W592-L620 HydrophobicContact CD2-CD2 3.7Å; W592-L620 HydrophobicContact CE3-CD2 3.24Å; W592-L620 HydrophobicContact CG-CD2 4.29Å; W592-L620 HydrophobicContact CH2-CD2 4.24Å; W592-L620 HydrophobicContact CZ3-CD2 3.55Å; I618-L620 HydrophobicContact CG2-CD2 3.65Å; I618-L620 HydrophobicContact CG2-CG 4Å; L620-V622 HydrophobicContact CB-CG2 3.78Å
621	V	91.5	Very high	71	Confident	16 Å²	16	74.4 Å²	74.4	10%	0.097	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	127.4	159.4	-177.7	0	0	0	0	107.8	R537 R538 V589 L590 E591	R537-V621 WeakPolarHBondContact O-CA 3.34Å; R538-V621 HydrophobicContact CG-CG2 4.29Å; V589-V621 CarbonylContact C-O 3.46Å; L590-V621 HydrophobicContact CB-CB 4.39Å; L590-V621 HydrophobicContact CB-CG1 4.2Å; L590-V621 HydrophobicContact CD1-CG1 4.34Å; L590-V621 PolarHBondContact N-O 2.78Å; E591-V621 HydrophobicContact CB-CB 3.79Å; E591-V621 HydrophobicContact CB-CG2 3.92Å; E591-V621 HydrophobicContact CG-CB 3.94Å; E591-V621 HydrophobicContact CG-CG2 4.03Å; E591-V621 PolarHBondContact N-O 2.84Å; E591-V621 PolarHBondContact O-N 3.15Å; E591-V621 WeakPolarHBondContact OE2-CG2 3.31Å
622	V	91.7	Very high	68.4	Low	0 Å²	0	74 Å²	74	0%	0	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	128.7	-167.4	-178.3	0	0	0	0	109.9	Y536 R537 L583 D587 E588 L620	Y536-V622 CarbonylContact C-O 3.55Å; Y536-V622 WeakPolarHBondContact CA-O 3.47Å; R537-V622 PolarHBondContact N-O 2.83Å; R537-V622 PolarHBondContact O-N 2.94Å; L583-V622 HydrophobicContact CD2-CB 4.32Å; L583-V622 HydrophobicContact CD2-CG1 3.94Å; L583-V622 HydrophobicContact CD2-CG2 3.95Å; D587-V622 HydrophobicContact CB-CG1 3.64Å; E588-V622 CarbonylContact O-C 3.49Å; E588-V622 VanDerWaalsContact O-CA 3.23Å; E588-V622 WeakPolarHBondContact O-CA 3.17Å; E588-V622 WeakPolarHBondContact O-CG1 3.11Å; L620-V622 HydrophobicContact CB-CG2 3.78Å
623	A	90	Very high	65.9	Low	3 Å²	3	80.5 Å²	80.5	3%	0.025	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	155.6	176.3	0	0	0	0	0	112.4	Y534 I535 D587 E588 L590	Y534-A623 HydrophobicContact CD2-CB 3.73Å; Y534-A623 HydrophobicContact CE2-CB 4.24Å; Y534-A623 HydrophobicContact CG-CB 4.43Å; I535-A623 CarbonylContact O-C 3.58Å; I535-A623 VanDerWaalsContact O-CA 3.28Å; I535-A623 WeakPolarHBondContact O-CA 3.25Å; D587-A623 CarbonylContact C-O 3.57Å; D587-A623 WeakPolarHBondContact CA-O 3.21Å; E588-A623 HydrophobicContact CB-CB 4.48Å; E588-A623 PolarHBondContact N-O 3.01Å; E588-A623 PolarHBondContact O-N 3.36Å; L590-A623 HydrophobicContact CD1-CB 3.81Å; L590-A623 HydrophobicContact CD2-CB 4.26Å; L590-A623 HydrophobicContact CG-CB 3.92Å
624	R	86.5	Confident	63.7	Low	75 Å²	75	82.6 Å²	82.6	28%	0.283	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	122.8	175.8	174.6	-179.8	-61.2	169.9	5.7	107.9	W526 Y534 I535 V584 D587	W526-R624 HydrophobicContact CH2-CB 3.76Å; W526-R624 VanDerWaalsContact CZ2-CZ 3.4Å; W526-R624 HydrophobicContact CZ3-CB 3.78Å; Y534-R624 CarbonylContact C-O 3.58Å; Y534-R624 WeakPolarHBondContact CA-O 3.43Å; Y534-R624 WeakPolarHBondContact CB-O 3.23Å; I535-R624 HydrophobicContact CG1-CB 4.14Å; I535-R624 WeakPolarHBondContact CG1-O 3.15Å; I535-R624 PolarHBondContact N-O 2.96Å; I535-R624 PolarHBondContact O-N 3.28Å; V584-R624 VanDerWaalsContact CG2-NH2 3.28Å; D587-R624 VanDerWaalsContact CG-NH2 3.29Å; D587-R624 IonicContact OD1-CZ 2.65Å; D587-R624 IonicContact OD1-NE 2.76Å; D587-R624 PolarHBondContact OD1-NE 3.46Å; D587-R624 IonicContact OD1-NH2 2.75Å; D587-R624 PolarHBondContact OD1-NH2 3.47Å; D587-R624 IonicContact OD2-CZ 2.87Å; D587-R624 IonicContact OD2-NH2 2.79Å; D587-R624 PolarHBondContact OD2-NH2 2.89Å
625	S	75.8	Confident	61.8	Low	77 Å²	77	82.2 Å²	82.2	54%	0.538	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.4	142.2	178.8	-177	0	0	0	0	111.7	T533 V627	T533-S625 WeakPolarHBondContact O-CA 3.49Å; T533-S625 PolarHBondContact O-OG 2.76Å; S625-V627 PolarHBondContact OG-N 3.05Å
626	V	65.1	Low	59.4	Low	64 Å²	64	90.9 Å²	90.9	39%	0.388	48%	0.483	S	S	.	.			trans	-111.9	45.7	175.2	-168	0	0	0	0	109.6	T533 I535 Q628	T533-V626 PolarHBondContact O-N 2.82Å; I535-V626 HydrophobicContact CB-CG2 4.09Å; I535-V626 HydrophobicContact CD1-CG2 4.21Å; I535-V626 HydrophobicContact CG1-CG2 3.67Å; I535-V626 HydrophobicContact CG2-CG2 3.78Å; V626-Q628 PolarHBondContact O-N 3.08Å; V626-Q628 VanDerWaalsContact O-N 3.11Å
627	V	48.1	Very low	57.2	Low	124 Å²	124	91.1 Å²	91.1	75%	0.752	49%	0.49	S	S	*	.			trans	-68.7	105.8	160.4	173.3	0	0	0	0	107.4	S625	S625-V627 PolarHBondContact OG-N 3.05Å
628	Q	33.5	Very low	54.5	Low	157 Å²	157	94.1 Å²	94.1	73%	0.734	51%	0.508	S	S	*	.			trans	-62.5	137.5	170.2	-68	-177.6	-9.3	0	0	109.5	V626 S630	V626-Q628 PolarHBondContact O-N 3.08Å; V626-Q628 VanDerWaalsContact O-N 3.11Å; Q628-S630 PolarHBondContact O-N 3.11Å
629	P	27.1	Very low	51.5	Low	113 Å²	113	99.1 Å²	99.1	73%	0.734	54%	0.543	S	S	*	.			trans	-69.5	102.6	168.2	28.8	-32.1	0	0	0	108.9	L631	P629-L631 VanDerWaalsContact C-N 3.34Å; P629-L631 PolarHBondContact O-N 2.95Å
630	S	27.8	Very low	48.7	Very low	112 Å²	112	106.5 Å²	106.5	78%	0.783	58%	0.582	S	S	*	*			trans	-73.6	84.6	-178.8	56	0	0	0	0	111.9	Q628	Q628-S630 PolarHBondContact O-N 3.11Å
631	L	28.7	Very low	45.8	Very low	141 Å²	141	112.5 Å²	112.5	74%	0.738	62%	0.621	S	S	*	*	S	Bend	trans	58.8	70.3	153.3	-55.6	-179.5	0	0	0	117.8	P629 Q633	P629-L631 VanDerWaalsContact C-N 3.34Å; P629-L631 PolarHBondContact O-N 2.95Å; L631-Q633 HydrophobicContact CD2-CG 4.45Å
632	A	30.3	Very low	42.7	Very low	112 Å²	112	114.8 Å²	114.8	93%	0.926	65%	0.647	S	S	*	*			trans	-124.6	82.2	134.7	0	0	0	0	0	107.7
633	Q	28.9	Very low	39.9	Very low	136 Å²	136	125.3 Å²	125.3	64%	0.636	69%	0.693	S	S	*	*			trans	-102.1	151.1	-175.4	-78.3	-174	-12.7	0	0	112	L631	L631-Q633 HydrophobicContact CD2-CG 4.45Å
634	N	28.7	Very low	37.2	Very low	128 Å²	128	129.5 Å²	129.5	68%	0.684	73%	0.728	S	S	*	*			trans	73.7	139	159.6	-64.4	8.5	0	0	0	118.3
635	E	31.3	Very low	35	Very low	152 Å²	152	131.4 Å²	131.4	71%	0.71	75%	0.75	S	S	*	*			cis	-164.3	162.1	-22.4	-132.1	169.1	-175.5	0	0	110.4
636	Y	28	Very low	32.9	Very low	225 Å²	225	135.2 Å²	135.2	88%	0.882	76%	0.759	S	S	*	*	S	Bend	trans	-82.1	119	158.6	-73.4	-80.7	0	0	0	107.9
637	P	32.3	Very low	31.4	Very low	112 Å²	112	138.4 Å²	138.4	73%	0.727	77%	0.773	S	S	*	*			trans	-78	134.3	-159.3	28.4	-35.8	0	0	0	114.1
638	F	28.5	Very low	30.5	Very low	208 Å²	208	140 Å²	140	91%	0.912	77%	0.773	S	S	*	*			trans	-131.8	69.2	155.8	-143.4	-85.4	0	0	0	111.2
639	S	27	Very low	30.4	Very low	107 Å²	107	137.9 Å²	137.9	75%	0.748	77%	0.771	S	S	*	*			trans	32.6	113.2	157.8	-57.1	0	0	0	0	120.5
640	L	30.8	Very low	30.5	Very low	174 Å²	174	136.8 Å²	136.8	91%	0.911	77%	0.771	S	S	*	*			trans	-158.5	139.6	134.7	-103.5	165.4	0	0	0	109.3
641	P	29.7	Very low	30.7	Very low	127 Å²	127	138.6 Å²	138.6	83%	0.825	78%	0.777	S	S	*	*			trans	-107.2	149.6	-171.3	38.2	-31.8	0	0	0	114.6
642	G	27.3	Very low	30.6	Very low	63 Å²	63	140.5 Å²	140.5	65%	0.649	79%	0.785	S	S	*	*			trans	154.5	115.9	159.1	0	0	0	0	0	116.8
643	F	32.8	Very low	30.7	Very low	221 Å²	221	139.8 Å²	139.8	97%	0.969	78%	0.778	S	S	*	*			trans	68.2	150.4	162.4	-60.5	-84	0	0	0	119.5
644	A	33.5	Very low	30.6	Very low	92 Å²	92	136.8 Å²	136.8	76%	0.76	79%	0.785	S	S	*	*			trans	-169	-179.6	-171.5	0	0	0	0	0	107.3
645	P	39.4	Very low	30.7	Very low	115 Å²	115	137 Å²	137	75%	0.747	80%	0.796	S	S	*	*			cis	-126	-149.1	-38.5	35.9	-17.2	0	0	0	110.4
646	E	31.7	Very low	30.6	Very low	157 Å²	157	135.4 Å²	135.4	73%	0.734	80%	0.802	S	S	*	*				127.3	148.5	127.7	-138.3	179.1	122.5	0	0	117.9
647	L	34.5	Very low	30.7	Very low	130 Å²	130	132.7 Å²	132.7	68%	0.681	80%	0.801	S	S	*	*			trans	69.1	152.6	168.8	-55.4	176.7	0	0	0	119.5
648	Q	30	Very low	30.5	Very low	158 Å²	158	132.5 Å²	132.5	74%	0.738	80%	0.802	S	S	*	*				-167.3	155.2	-50.4	-121.8	-174.5	41.3	0	0	111.7
649	T	29.8	Very low	30.7	Very low	112 Å²	112	130.6 Å²	130.6	69%	0.687	80%	0.8	S	S	*	*			trans	58.1	101.9	142.3	-51	0	0	0	0	121.5
650	A	29.1	Very low	30.9	Very low	91 Å²	91	131 Å²	131	75%	0.752	80%	0.8	S	S	*	*			trans	48.2	150	131.5	0	0	0	0	0	124
651	V	32	Very low	30.6	Very low	150 Å²	150	129 Å²	129	91%	0.909	80%	0.796	S	S	*	*				-160.2	157.2	122.3	139.2	0	0	0	0	109.9
652	M	27.2	Very low	30.8	Very low	181 Å²	181	130.6 Å²	130.6	89%	0.892	80%	0.796	S	S	*	*			trans	-92.4	175.7	-170.6	-75.3	-86.5	-152.6	0	0	115.1
653	A	31.4	Very low	30.7	Very low	96 Å²	96	131.6 Å²	131.6	79%	0.793	80%	0.797	S	S	*	*			trans	100.1	93.1	143.9	0	0	0	0	0	120.2
654	G	27	Very low	30.6	Very low	74 Å²	74	126.9 Å²	126.9	76%	0.763	79%	0.792	S	S	*	*				67.4	123	110.6	0	0	0	0	0	121.4
655	S	31.5	Very low	30.3	Very low	132 Å²	132	129 Å²	129	92%	0.923	80%	0.796	S	S	*	*				-172.5	144.8	122.1	-80.6	0	0	0	0	111.5
656	S	28.6	Very low	29.7	Very low	119 Å²	119	131.5 Å²	131.5	83%	0.832	80%	0.801	S	S	*	*			trans	-107.8	140.4	176.9	48.6	0	0	0	0	111.4
657	I	30.8	Very low	29.6	Very low	168 Å²	168	128.8 Å²	128.8	86%	0.862	81%	0.805	S	S	*	*			trans	-138.4	139.2	167.2	-60.1	-176	0	0	0	108.6
658	S	27.9	Very low	29.2	Very low	108 Å²	108	126.1 Å²	126.1	76%	0.755	81%	0.81	S	S	*	*			trans	-92.5	169.8	-175.6	47.6	0	0	0	0	113.9
659	L	33.4	Very low	28.9	Very low	167 Å²	167	121.8 Å²	121.8	87%	0.874	81%	0.808	S	S	*	*			trans	-62.9	162.8	178.2	-59.9	110.7	0	0	0	113.4
660	P	30.3	Very low	28.8	Very low	115 Å²	115	122.5 Å²	122.5	75%	0.747	81%	0.812	S	S	*	*			trans	-124.6	144.8	133.5	36.4	-30.3	0	0	0	113.7
661	T	25.7	Very low	28.8	Very low	134 Å²	134	126.2 Å²	126.2	82%	0.822	82%	0.817	S	S	*	*			trans	-71.2	133.1	167.9	-58.1	0	0	0	0	111.1
662	I	33.4	Very low	28.6	Very low	160 Å²	160	122 Å²	122	82%	0.821	80%	0.804	S	S	*	*			trans	-134.3	126.7	156.9	-56.4	-179.1	0	0	0	107.9
663	A	25.8	Very low	28.6	Very low	83 Å²	83	116.3 Å²	116.3	69%	0.686	79%	0.792	S	S	*	*			trans	-108.5	144.1	177	0	0	0	0	0	110.8
664	S	30.7	Very low	28.7	Very low	123 Å²	123	115.6 Å²	115.6	86%	0.86	77%	0.772	S	S	*	*			trans	-157.7	114.6	159.4	-82.6	0	0	0	0	111.3
665	T	25.5	Very low	28.8	Very low	135 Å²	135	115.1 Å²	115.1	83%	0.828	76%	0.755	S	S	*	*			trans	-58.5	143.2	175.5	-49.2	0	0	0	0	113.2
666	I	28.2	Very low	28.7	Very low	168 Å²	168	111.5 Å²	111.5	86%	0.862	73%	0.728	S	S	*	*			trans	-163.4	154.9	141.9	-99.6	147.1	0	0	0	109.1
667	A	28.7	Very low	28.9	Very low	100 Å²	100	108 Å²	108	83%	0.826	70%	0.699	S	S	*	*			trans	-58.1	160.9	-173.9	0	0	0	0	0	115.2
668	G	25.7	Very low	29.3	Very low	75 Å²	75	100.8 Å²	100.8	77%	0.773	66%	0.663	S	S	*	*			cis	144.5	143.7	-3.9	0	0	0	0	0	112.9
669	G	24.7	Very low	29.7	Very low	67 Å²	67	101.5 Å²	101.5	69%	0.691	66%	0.656	S	S	*	*			trans	107	123.3	164.7	0	0	0	0	0	118.6
670	T	26.8	Very low	30.2	Very low	127 Å²	127	94 Å²	94	78%	0.779	62%	0.617	S	S	*	*			trans	69.9	142.3	145.2	63	0	0	0	0	122.1
671	I	29.6	Very low	30.6	Very low	168 Å²	168	93.5 Å²	93.5	86%	0.862	61%	0.611	S	S	*	*			trans	70	137.1	163.4	-54.6	141	0	0	0	114.3
672	G	27.9	Very low	31.1	Very low	61 Å²	61	89 Å²	89	63%	0.629	59%	0.588	S	S	*	*			cis	149.3	65.3	1.5	0	0	0	0	0	110.6	Q674	G672-Q674 PolarHBondContact O-N 2.94Å
673	G	28.2	Very low	31.2	Very low	62 Å²	62	84.8 Å²	84.8	64%	0.639	57%	0.571	S	S	*	*			trans	-74.3	60.9	-157.8	0	0	0	0	0	118.2	P740	G673-P740 WeakPolarHBondContact O-CD 3.48Å; G673-P740 VanDerWaalsContact O-CG 3.31Å; G673-P740 WeakPolarHBondContact O-CG 3.34Å
674	Q	33.3	Very low	31.5	Very low	82 Å²	82	89.1 Å²	89.1	38%	0.383	58%	0.582	S	S	.	*			trans	-94.6	140.5	153.9	-69	-170.8	17.9	0	0	109.9	G672 P676 P740 R741	G672-Q674 PolarHBondContact O-N 2.94Å; Q674-P676 WeakPolarHBondContact O-CD 3.32Å; Q674-P740 HydrophobicContact CG-CG 3.71Å; Q674-R741 PolarHBondContact NE2-O 3.25Å
675	T	28.8	Very low	31.7	Very low	64 Å²	64	88.9 Å²	88.9	39%	0.393	58%	0.58	S	S	.	*			trans	-107.9	73	175.8	43.8	0	0	0	0	111.2	V554	V554-T675 HydrophobicContact CG1-CG2 4.35Å
676	P	28.2	Very low	32	Very low	55 Å²	55	91.4 Å²	91.4	36%	0.357	58%	0.582	S	S	.	*			trans	-69.4	163.8	-178.9	32.2	-38.2	0	0	0	112.5	F602 Q674	F602-P676 HydrophobicContact CD2-CG 4.31Å; F602-P676 HydrophobicContact CE1-CG 3.89Å; F602-P676 VanDerWaalsContact CE2-CD 3.42Å; F602-P676 HydrophobicContact CE2-CG 3.38Å; F602-P676 HydrophobicContact CZ-CG 3.14Å; Q674-P676 WeakPolarHBondContact O-CD 3.32Å
677	I	34.4	Very low	32.2	Very low	45 Å²	45	90.2 Å²	90.2	23%	0.231	58%	0.583	C	S	.	*			trans	-107	114.1	-160.5	-71.2	166	0	0	0	109.9	K552 M679 Q710	K552-I677 HydrophobicContact CD-CG2 3.68Å; K552-I677 HydrophobicContact CG-CG2 3.9Å; K552-I677 VanDerWaalsContact NZ-CD1 3.31Å; I677-M679 HydrophobicContact CG2-CG 4.06Å; I677-Q710 HydrophobicContact CD1-CB 4.25Å; I677-Q710 HydrophobicContact CD1-CG 3.78Å
678	V	38.1	Very low	32.3	Very low	18 Å²	18	93.1 Å²	93.1	11%	0.109	58%	0.583	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-87.5	118.9	175.7	-163.6	0	0	0	0	110.4	C606 I609	C606-V678 VanDerWaalsContact SG-CG2 3.59Å; I609-V678 HydrophobicContact CB-CG1 4.17Å; I609-V678 HydrophobicContact CD1-CB 4.19Å; I609-V678 HydrophobicContact CD1-CG1 4.49Å; I609-V678 HydrophobicContact CD1-CG2 4.2Å; I609-V678 HydrophobicContact CG2-CB 4.31Å; I609-V678 HydrophobicContact CG2-CG1 3.47Å; I609-V678 VanDerWaalsContact CG2-CG1 3.47Å
679	M	37.2	Very low	32.6	Very low	123 Å²	123	98.4 Å²	98.4	61%	0.606	59%	0.588	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-113	129.3	172.2	-69.5	-114.9	-66.8	0	0	109.3	I677 T681	I677-M679 HydrophobicContact CG2-CG 4.06Å; M679-T681 PolarHBondContact O-N 3.16Å
680	I	43.6	Very low	33	Very low	10 Å²	10	103.3 Å²	103.3	5%	0.051	60%	0.598	C	S	.	*			trans	-99.1	88.6	-176.9	-55.6	169	0	0	0	109.6	S548 L549 L551 W592 I609	S548-I680 WeakPolarHBondContact CB-O 3.32Å; L549-I680 HydrophobicContact CD1-CB 4.29Å; L549-I680 HydrophobicContact CD1-CD1 3.79Å; L549-I680 HydrophobicContact CD1-CG2 3.91Å; L549-I680 HydrophobicContact CG-CG2 4.43Å; L551-I680 HydrophobicContact CD1-CD1 4.23Å; W592-I680 HydrophobicContact CH2-CD1 3.58Å; W592-I680 HydrophobicContact CZ2-CD1 3.83Å; I609-I680 HydrophobicContact CG2-CD1 3.73Å; I609-I680 HydrophobicContact CG2-CG1 3.95Å
681	T	38.8	Very low	33.4	Very low	103 Å²	103	107.7 Å²	107.7	63%	0.632	61%	0.606	S	S	*	*	P	Polyproline II helix	trans	-92.7	152.7	167.9	45.9	0	0	0	0	110.9	M679	M679-T681 PolarHBondContact O-N 3.16Å
682	A	36	Very low	33.6	Very low	39 Å²	39	108.3 Å²	108.3	32%	0.322	61%	0.605	S	S	.	*	P	Polyproline II helix	trans	-76	149.5	-174.4	0	0	0	0	0	112.7
683	P	34.1	Very low	33.8	Very low	72 Å²	72	114.7 Å²	114.7	47%	0.468	62%	0.618	S	S	.	*	P	Polyproline II helix	trans	-74.9	138.6	171.2	31.4	-33.6	0	0	0	111.1
684	L	33.2	Very low	34.1	Very low	175 Å²	175	120.7 Å²	120.7	92%	0.916	63%	0.63	S	S	*	*	P	Polyproline II helix	trans	-82.6	132.6	165.1	-78.8	169.4	0	0	0	109.6
685	S	34.6	Very low	33.9	Very low	117 Å²	117	125.9 Å²	125.9	82%	0.818	65%	0.654	S	S	*	*			trans	-99.6	95.3	-171.5	53.3	0	0	0	0	112.4
686	E	32.8	Very low	34.2	Very low	188 Å²	188	132.2 Å²	132.2	88%	0.879	68%	0.679	S	S	*	*			trans	-147.2	41.6	158.7	-150.2	164.4	-136.2	0	0	112.7	L688	E686-L688 VanDerWaalsContact C-N 3.35Å; E686-L688 PolarHBondContact O-N 3.13Å; E686-L688 VanDerWaalsContact O-N 3.13Å
687	V	31	Very low	34.3	Very low	144 Å²	144	138.2 Å²	138.2	87%	0.873	71%	0.707	S	S	*	*			trans	-85.6	74.2	174.7	-174.9	0	0	0	0	109.9
688	L	30.7	Very low	34.1	Very low	160 Å²	160	141.7 Å²	141.7	84%	0.838	74%	0.736	S	S	*	*	S	Bend	trans	-151.9	25.6	168.8	-114.9	179.2	0	0	0	115.7	E686	E686-L688 VanDerWaalsContact C-N 3.35Å; E686-L688 PolarHBondContact O-N 3.13Å; E686-L688 VanDerWaalsContact O-N 3.13Å
689	Q	32.5	Very low	33.9	Very low	187 Å²	187	148.4 Å²	148.4	87%	0.874	77%	0.769	S	S	*	*	S	Bend	trans	-149.7	160.2	165.9	-105.6	152.8	99.1	0	0	110.3
690	L	34.3	Very low	33.5	Very low	170 Å²	170	147.8 Å²	147.8	89%	0.89	77%	0.774	S	S	*	*			trans	73.7	62.7	-174.8	-61.1	165.2	0	0	0	117.3
691	K	34.5	Very low	32.8	Very low	219 Å²	219	153 Å²	153	95%	0.952	81%	0.811	S	S	*	*			trans	-101	29.1	161.2	-156	179.3	179.5	177.8	0	112.9
692	Q	32.8	Very low	32.6	Very low	181 Å²	181	154.5 Å²	154.5	85%	0.846	82%	0.821	S	S	*	*	S	Bend	trans	-148.5	39.7	-170.2	-150.4	174.6	21.9	0	0	116.4
693	Q	33.8	Very low	32.3	Very low	194 Å²	194	155.6 Å²	155.6	91%	0.907	84%	0.835	S	S	*	*			trans	-154.2	113.5	153.3	-115	177.2	20.1	0	0	109.8
694	Q	33.3	Very low	32.3	Very low	188 Å²	188	157.1 Å²	157.1	88%	0.879	85%	0.854	S	S	*	*			trans	-152.2	94.6	-177.1	-176.5	-175.9	92.7	0	0	109.9
695	Q	29.9	Very low	32.3	Very low	191 Å²	191	154.3 Å²	154.3	89%	0.893	85%	0.849	S	S	*	*			trans	-167	65.6	165.6	-119.1	171.8	58.9	0	0	113.5
696	Q	35.3	Very low	32.5	Very low	197 Å²	197	157 Å²	157	92%	0.921	84%	0.841	S	S	*	*			trans	-170.8	130.5	142.7	-106.7	166.3	32.2	0	0	110
697	L	28.4	Very low	32.8	Very low	182 Å²	182	151.1 Å²	151.1	95%	0.953	82%	0.821	S	S	*	*			trans	-106.7	115.8	-172.7	-73.5	157.3	0	0	0	110.5
698	S	30.3	Very low	33.3	Very low	118 Å²	118	150.3 Å²	150.3	83%	0.825	81%	0.806	S	S	*	*			trans	-150.8	125.9	160.6	55.7	0	0	0	0	111.5
699	I	34.1	Very low	34	Very low	158 Å²	158	143.3 Å²	143.3	81%	0.81	77%	0.772	S	S	*	*			trans	-61.3	136.8	-169.6	-59.7	158.7	0	0	0	112	S701	I699-S701 PolarHBondContact O-N 3.06Å
700	P	29.9	Very low	35	Very low	110 Å²	110	136.8 Å²	136.8	71%	0.714	74%	0.741	S	S	*	*			trans	-73	110.5	166.7	30.3	-32.4	0	0	0	110.2	V702	P700-V702 PolarHBondContact O-N 2.79Å
701	S	28.4	Very low	36.1	Very low	119 Å²	119	132.7 Å²	132.7	83%	0.832	72%	0.719	S	S	*	*			trans	-68	98.3	176.7	-179.4	0	0	0	0	111.1	I699 G703	I699-S701 PolarHBondContact O-N 3.06Å; S701-G703 PolarHBondContact O-N 2.88Å; S701-G703 VanDerWaalsContact O-N 3.14Å
702	V	34.9	Very low	37.7	Very low	136 Å²	136	123.8 Å²	123.8	82%	0.824	68%	0.681	S	S	*	*			trans	-67.6	109.3	179	-178.4	0	0	0	0	110.2	P700	P700-V702 PolarHBondContact O-N 2.79Å
703	G	29.2	Very low	40.2	Very low	61 Å²	61	115.5 Å²	115.5	63%	0.629	64%	0.644	S	S	*	*			trans	-69.9	131.9	174.1	0	0	0	0	0	111.7	S701 S705	S701-G703 PolarHBondContact O-N 2.88Å; S701-G703 VanDerWaalsContact O-N 3.14Å; G703-S705 PolarHBondContact O-N 2.95Å
704	A	35.5	Very low	43	Very low	104 Å²	104	108.6 Å²	108.6	86%	0.86	61%	0.612	S	S	*	*			trans	-68.5	86.8	-178.7	0	0	0	0	0	112.5	R706	A704-R706 PolarHBondContact O-N 2.88Å
705	S	32.8	Very low	45.9	Very low	116 Å²	116	99.7 Å²	99.7	81%	0.811	57%	0.57	S	S	*	*			trans	-75.2	108.7	174.5	-168	0	0	0	0	110.4	G703 S707	G703-S705 PolarHBondContact O-N 2.95Å; S705-S707 PolarHBondContact O-N 3.18Å
706	R	39	Very low	49	Very low	174 Å²	174	90.8 Å²	90.8	66%	0.657	53%	0.529	S	S	*	.			trans	-64	113.2	-178.4	-66.1	-174	-178	-162.4	-3.3	111	A704 D811	A704-R706 PolarHBondContact O-N 2.88Å; R706-D811 IonicContact CZ-OD1 2.8Å; R706-D811 IonicContact NH1-OD1 2.88Å; R706-D811 IonicContact NH2-OD1 2.95Å; R706-D811 PolarHBondContact NH2-OD1 2.98Å; R706-D811 IonicContact NH2-OD2 2.84Å
707	S	38.5	Very low	51.8	Low	64 Å²	64	81.4 Å²	81.4	45%	0.448	49%	0.485	S	S	.	.			trans	-86.7	121.2	176.6	62.8	0	0	0	0	111.5	S705	S705-S707 PolarHBondContact O-N 3.18Å
708	K	41.2	Very low	55	Low	128 Å²	128	73 Å²	73	56%	0.557	44%	0.442	S	S	*	.	S	Bend	trans	-47.6	135.6	-178.5	-86.2	-174.1	156.3	-128.4	0	114.6	K570 D836 D838	K570-K708 PolarHBondContact NZ-O 3.23Å; K708-D836 WeakPolarHBondContact CA-OD2 3.39Å; K708-D838 IonicContact NZ-OD1 3.74Å; K708-D838 PolarHBondContact NZ-OD1 2.84Å
709	G	44.9	Very low	58.1	Low	13 Å²	13	67.6 Å²	67.6	13%	0.134	40%	0.404	C	S	.	.	S	Bend	trans	69.7	46.5	174.3	0	0	0	0	0	111.9	K570 D836	K570-G709 WeakPolarHBondContact CE-O 3.5Å; K570-G709 PolarHBondContact NZ-O 3.35Å; G709-D836 PolarHBondContact N-OD2 2.95Å
710	Q	55	Low	61	Low	49 Å²	49	62.5 Å²	62.5	23%	0.229	38%	0.378	C	S	.	.			trans	-74.6	150	158.2	178.8	162.5	-4.5	0	0	109.2	I677 F712 D836	I677-Q710 HydrophobicContact CD1-CB 4.25Å; I677-Q710 HydrophobicContact CD1-CG 3.78Å; Q710-F712 HydrophobicContact CB-CD2 4.48Å; Q710-F712 HydrophobicContact CB-CE1 4.01Å; Q710-F712 HydrophobicContact CB-CE2 3.8Å; Q710-F712 HydrophobicContact CB-CZ 3.55Å; Q710-F712 HydrophobicContact CG-CD1 3.81Å; Q710-F712 HydrophobicContact CG-CD2 4.43Å; Q710-F712 HydrophobicContact CG-CE1 3.37Å; Q710-F712 HydrophobicContact CG-CE2 4.02Å; Q710-F712 HydrophobicContact CG-CG 4.36Å; Q710-F712 HydrophobicContact CG-CZ 3.49Å; Q710-F712 VanDerWaalsContact CG-CZ 3.49Å; Q710-D836 PolarHBondContact O-N 2.75Å; Q710-D836 VanDerWaalsContact O-N 3.17Å
711	I	57	Low	64.1	Low	84 Å²	84	58.6 Å²	58.6	43%	0.431	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	140.7	174.5	-62.8	169.6	0	0	0	106.5	T833	I711-T833 HydrophobicContact CG2-CG2 3.52Å
712	F	67.3	Low	67.1	Low	32 Å²	32	55.3 Å²	55.3	14%	0.14	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	59.7	-167	-64.4	-66.9	0	0	0	112.2	Q710 P739 L813 L834 D836	Q710-F712 HydrophobicContact CB-CD2 4.48Å; Q710-F712 HydrophobicContact CB-CE1 4.01Å; Q710-F712 HydrophobicContact CB-CE2 3.8Å; Q710-F712 HydrophobicContact CB-CZ 3.55Å; Q710-F712 HydrophobicContact CG-CD1 3.81Å; Q710-F712 HydrophobicContact CG-CD2 4.43Å; Q710-F712 HydrophobicContact CG-CE1 3.37Å; Q710-F712 HydrophobicContact CG-CE2 4.02Å; Q710-F712 HydrophobicContact CG-CG 4.36Å; Q710-F712 HydrophobicContact CG-CZ 3.49Å; Q710-F712 VanDerWaalsContact CG-CZ 3.49Å; F712-P739 HydrophobicContact CD1-CG 3.78Å; F712-P739 HydrophobicContact CE1-CG 4.37Å; F712-L813 WeakPolarHBondContact CB-O 3.31Å; F712-L813 WeakPolarHBondContact CD2-O 3.27Å; F712-L813 WeakPolarHBondContact CG-O 3.38Å; F712-L834 HydrophobicContact CB-CB 4.47Å; F712-L834 PolarHBondContact N-O 2.99Å; F712-L834 WeakPolarHBondContact O-CB 3.38Å; F712-L834 WeakPolarHBondContact O-CD1 3.41Å; F712-D836 HydrophobicContact CE2-CB 4.15Å
713	G	86.1	Confident	69.8	Low	8 Å²	8	51.7 Å²	51.7	8%	0.082	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	79	-165.7	-179.1	0	0	0	0	0	114.2	V736 D737 L834	G713-V736 CarbonylContact C-O 3.43Å; G713-V736 WeakPolarHBondContact CA-O 3.31Å; G713-D737 VanDerWaalsContact CA-O 3.28Å; G713-D737 WeakPolarHBondContact CA-O 3.41Å; G713-D737 PolarHBondContact N-O 2.7Å; G713-L834 PolarHBondContact O-N 3.17Å
714	Q	91.1	Very high	72.6	Confident	49 Å²	49	56.5 Å²	56.5	23%	0.229	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	153.1	-178.2	-52.2	-169	-87.9	0	0	110.3	A735 V736 W831 Y832 T833	Q714-A735 CarbonylContact O-C 3.55Å; Q714-A735 WeakPolarHBondContact O-CA 3.48Å; Q714-A735 VanDerWaalsContact O-CB 3.27Å; Q714-A735 WeakPolarHBondContact O-CB 3.19Å; Q714-V736 HydrophobicContact CB-CG2 4.17Å; Q714-V736 PolarHBondContact N-O 3.12Å; Q714-V736 PolarHBondContact O-N 2.91Å; Q714-W831 HydrophobicContact CB-CE3 3.87Å; Q714-W831 HydrophobicContact CB-CZ3 4.25Å; Q714-Y832 CarbonylContact C-O 3.34Å; Q714-Y832 WeakPolarHBondContact CA-O 3.26Å; Q714-T833 PolarHBondContact NE2-OG1 2.86Å
715	I	94.7	Very high	75.3	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	131.4	179.9	-172.5	172.5	0	0	0	110.4	I717 E734 A735 V751 W778 I799 V801 V816 Y832 L834	I715-I717 HydrophobicContact CD1-CD1 4.31Å; I715-I717 HydrophobicContact CD1-CG1 4.39Å; I715-I717 HydrophobicContact CG1-CD1 4.2Å; I715-I717 HydrophobicContact CG1-CG1 4.03Å; I715-I717 HydrophobicContact CG2-CD1 3.84Å; I715-I717 HydrophobicContact CG2-CG1 4.45Å; I715-E734 WeakPolarHBondContact CA-O 3.29Å; I715-E734 WeakPolarHBondContact CG1-O 3.21Å; I715-A735 HydrophobicContact CB-CB 4.11Å; I715-A735 HydrophobicContact CG1-CB 4.15Å; I715-V751 HydrophobicContact CD1-CG2 4.21Å; I715-W778 HydrophobicContact CD1-CZ3 4.15Å; I715-W778 HydrophobicContact CG1-CZ3 4.43Å; I715-I799 HydrophobicContact CD1-CG2 4.34Å; I715-V801 HydrophobicContact CD1-CG2 3.96Å; I715-V816 HydrophobicContact CG2-CG2 3.85Å; I715-Y832 PolarHBondContact N-O 3.47Å; I715-Y832 PolarHBondContact O-N 2.84Å; I715-L834 HydrophobicContact CB-CD1 4.29Å; I715-L834 HydrophobicContact CB-CG 4.45Å; I715-L834 HydrophobicContact CG2-CD1 4.49Å; I715-L834 HydrophobicContact CG2-CD2 4.15Å; I715-L834 HydrophobicContact CG2-CG 4.12Å
716	S	94.7	Very high	78.1	Confident	4 Å²	4	53.6 Å²	53.6	3%	0.028	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	123.2	179.6	-176.1	0	0	0	0	110.2	L733 E734 T829	S716-L733 PolarHBondContact O-N 3.43Å; S716-L733 VanDerWaalsContact O-N 3.12Å; S716-E734 PolarHBondContact N-O 3.17Å; S716-T829 VanDerWaalsContact OG-CG2 3.29Å; S716-T829 WeakPolarHBondContact OG-CG2 3.11Å
717	I	95.3	Very high	80.7	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	140.7	-171.5	-56.6	160	0	0	0	108.9	I715 I719 V730 N731 L732 I799 A830 Y832	I715-I717 HydrophobicContact CD1-CD1 4.31Å; I715-I717 HydrophobicContact CD1-CG1 4.39Å; I715-I717 HydrophobicContact CG1-CD1 4.2Å; I715-I717 HydrophobicContact CG1-CG1 4.03Å; I715-I717 HydrophobicContact CG2-CD1 3.84Å; I715-I717 HydrophobicContact CG2-CG1 4.45Å; I717-I719 HydrophobicContact CG2-CG1 4.14Å; I717-V730 HydrophobicContact CG2-CG1 3.51Å; I717-N731 WeakPolarHBondContact CA-O 3.37Å; I717-L732 HydrophobicContact CG1-CD2 4.3Å; I717-I799 HydrophobicContact CD1-CD1 3.52Å; I717-I799 HydrophobicContact CD1-CG2 4.49Å; I717-A830 PolarHBondContact N-O 2.9Å; I717-A830 PolarHBondContact O-N 2.85Å; I717-Y832 HydrophobicContact CB-CD2 4.15Å; I717-Y832 HydrophobicContact CB-CE2 4.06Å; I717-Y832 HydrophobicContact CD1-CD2 3.8Å; I717-Y832 HydrophobicContact CD1-CE2 4.32Å; I717-Y832 HydrophobicContact CD1-CG 4.48Å; I717-Y832 HydrophobicContact CG1-CD2 4.33Å
718	S	94.7	Very high	83.3	Confident	7 Å²	7	44.9 Å²	44.9	5%	0.049	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	140.8	168.2	124.5	0	0	0	0	110.2	V730 N731 G827 T828 T829	S718-V730 CarbonylContact O-C 3.39Å; S718-V730 WeakPolarHBondContact O-CA 3.34Å; S718-N731 PolarHBondContact N-O 3.16Å; S718-N731 VanDerWaalsContact N-O 3.08Å; S718-N731 PolarHBondContact O-N 2.89Å; S718-N731 PolarHBondContact OG-ND2 3.44Å; S718-G827 WeakPolarHBondContact CB-O 2.89Å; S718-G827 PolarHBondContact OG-O 3.44Å; S718-T828 WeakPolarHBondContact CA-O 3.07Å; S718-T828 WeakPolarHBondContact CB-O 3.33Å; S718-T829 WeakPolarHBondContact CB-OG1 3.23Å
719	I	95.5	Very high	85.9	Confident	3 Å²	3	41.1 Å²	41.1	2%	0.015	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	125.5	-176.5	-57.8	-178.3	0	0	0	108.8	I717 L728 V730 V818 L820 V823 L825 G827	I717-I719 HydrophobicContact CG2-CG1 4.14Å; I719-L728 HydrophobicContact CG2-CD1 3.76Å; I719-V730 HydrophobicContact CG1-CG1 4.14Å; I719-V730 HydrophobicContact CG1-CG2 4.33Å; I719-V730 HydrophobicContact CG2-CG2 4.41Å; I719-V818 HydrophobicContact CD1-CG1 3.9Å; I719-L820 HydrophobicContact CD1-CD2 4.41Å; I719-L820 HydrophobicContact CG2-CD2 4.35Å; I719-V823 HydrophobicContact CD1-CG1 4.36Å; I719-L825 HydrophobicContact CB-CD2 4.44Å; I719-L825 HydrophobicContact CG2-CD2 3.62Å; I719-L825 CarbonylContact O-C 3.59Å; I719-L825 VanDerWaalsContact O-C 3.28Å; I719-L825 WeakPolarHBondContact O-CA 3.23Å; I719-G827 VanDerWaalsContact O-CA 3.3Å; I719-G827 WeakPolarHBondContact O-CA 3.46Å; I719-G827 PolarHBondContact O-N 3.48Å
720	L	94.5	Very high	88.3	Confident	52 Å²	52	40.5 Å²	40.5	27%	0.272	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	124.6	178.1	174.1	66.1	0	0	0	109.6	I722 M729 L825	L720-I722 HydrophobicContact CD2-CD1 4.25Å; L720-I722 HydrophobicContact CD2-CG1 4.27Å; L720-I722 HydrophobicContact CG-CG1 4.13Å; L720-M729 HydrophobicContact CB-CB 4.32Å; L720-M729 HydrophobicContact CD2-SD 4.29Å; L720-M729 PolarHBondContact N-O 3.05Å; L720-M729 PolarHBondContact O-N 2.94Å; L720-L825 CarbonylContact C-O 3.58Å; L720-L825 WeakPolarHBondContact CA-O 3.21Å
721	Y	95	Very high	90.2	Very high	27 Å²	27	39.8 Å²	39.8	11%	0.106	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	133	169.9	179.3	-121.7	0	0	0	109.9	P723 Q727 L728 V787 S788 E789 I792 L825	Y721-P723 HydrophobicContact CD1-CG 3.97Å; Y721-P723 HydrophobicContact CE1-CB 4Å; Y721-P723 HydrophobicContact CE1-CG 3.73Å; Y721-Q727 VanDerWaalsContact CD2-O 3.31Å; Y721-Q727 WeakPolarHBondContact CD2-O 3.03Å; Y721-L728 HydrophobicContact CD2-CB 4.32Å; Y721-L728 HydrophobicContact CD2-CD1 4.3Å; Y721-V787 HydrophobicContact CE2-CG1 4.38Å; Y721-V787 PolarHBondContact OH-O 2.92Å; Y721-S788 VanDerWaalsContact OH-C 3.23Å; Y721-E789 PolarHBondContact OH-N 3.22Å; Y721-I792 HydrophobicContact CD1-CG1 4.18Å; Y721-I792 HydrophobicContact CD2-CD1 3.85Å; Y721-I792 HydrophobicContact CD2-CG1 4.16Å; Y721-I792 HydrophobicContact CE1-CG1 4.14Å; Y721-I792 HydrophobicContact CE2-CD1 4.15Å; Y721-I792 HydrophobicContact CE2-CG1 4.13Å; Y721-I792 HydrophobicContact CG-CD1 4.1Å; Y721-I792 HydrophobicContact CG-CG1 4.2Å; Y721-L825 PolarHBondContact N-O 2.82Å
722	I	92.7	Very high	92	Very high	50 Å²	50	35.8 Å²	35.8	26%	0.256	18%	0.18	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	97.9	177.9	-54.6	178.4	0	0	0	107.2	L720 E724 A725 R726 Q727 M729	L720-I722 HydrophobicContact CD2-CD1 4.25Å; L720-I722 HydrophobicContact CD2-CG1 4.27Å; L720-I722 HydrophobicContact CG-CG1 4.13Å; I722-E724 WeakPolarHBondContact CG2-OE2 3.16Å; I722-E724 PolarHBondContact O-N 3.06Å; I722-A725 HydrophobicContact CB-CB 4.14Å; I722-A725 HydrophobicContact CG2-CB 3.64Å; I722-A725 PolarHBondContact O-N 3.41Å; I722-R726 PolarHBondContact O-N 2.9Å; I722-R726 VanDerWaalsContact O-N 3.08Å; I722-Q727 PolarHBondContact N-O 3.12Å; I722-Q727 PolarHBondContact O-N 3.2Å; I722-M729 HydrophobicContact CD1-SD 3.79Å
723	P	90.4	Very high	93.3	Very high	60 Å²	60	36 Å²	36	39%	0.39	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-43.1	-174.5	-23.8	32.5	0	0	0	113.4	Y721 A725 R726	Y721-P723 HydrophobicContact CD1-CG 3.97Å; Y721-P723 HydrophobicContact CE1-CB 4Å; Y721-P723 HydrophobicContact CE1-CG 3.73Å; P723-A725 VanDerWaalsContact C-N 3.27Å; P723-A725 PolarHBondContact O-N 3.29Å; P723-R726 PolarHBondContact O-N 2.71Å; P723-R726 VanDerWaalsContact O-N 3.09Å
724	E	89.5	Confident	93.7	Very high	163 Å²	163	38.7 Å²	38.7	76%	0.762	19%	0.193	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63	-38.3	-175.4	-53.6	67.7	-144.5	0	0	110.8	I722	I722-E724 WeakPolarHBondContact CG2-OE2 3.16Å; I722-E724 PolarHBondContact O-N 3.06Å
725	A	90.8	Very high	93.9	Very high	40 Å²	40	36.4 Å²	36.4	33%	0.331	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88	-8.3	-179.4	0	0	0	0	0	113.1	I722 P723 Q727	I722-A725 HydrophobicContact CB-CB 4.14Å; I722-A725 HydrophobicContact CG2-CB 3.64Å; I722-A725 PolarHBondContact O-N 3.41Å; P723-A725 VanDerWaalsContact C-N 3.27Å; P723-A725 PolarHBondContact O-N 3.29Å; A725-Q727 HydrophobicContact CB-CB 4.06Å; A725-Q727 HydrophobicContact CB-CG 4.26Å; A725-Q727 WeakPolarHBondContact O-CG 3.31Å; A725-Q727 PolarHBondContact O-N 2.91Å; A725-Q727 PolarHBondContact O-NE2 3.03Å
726	R	92.7	Very high	93.7	Very high	119 Å²	119	38 Å²	38	45%	0.449	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.3	45.2	-170.1	-61.2	-179.3	-59.4	102.8	12.3	111.8	I722 P723 D786 V787	I722-R726 PolarHBondContact O-N 2.9Å; I722-R726 VanDerWaalsContact O-N 3.08Å; P723-R726 PolarHBondContact O-N 2.71Å; P723-R726 VanDerWaalsContact O-N 3.09Å; R726-D786 IonicContact CZ-OD1 3.99Å; R726-D786 VanDerWaalsContact CZ-OD1 3.26Å; R726-D786 IonicContact NH1-OD1 3.64Å; R726-D786 PolarHBondContact NH1-OD1 3.33Å; R726-D786 IonicContact NH2-OD1 2.66Å; R726-D786 PolarHBondContact NH2-OD1 2.85Å; R726-D786 PolarHBondContact O-N 3.27Å; R726-V787 CarbonylContact C-O 3.55Å; R726-V787 VanDerWaalsContact C-O 3.26Å; R726-V787 VanDerWaalsContact CA-O 3.23Å; R726-V787 WeakPolarHBondContact CA-O 3.41Å; R726-V787 WeakPolarHBondContact CB-O 3.28Å; R726-V787 PolarHBondContact O-N 3.2Å
727	Q	92.7	Very high	93.4	Very high	54 Å²	54	41.6 Å²	41.6	25%	0.252	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	135.5	-171.4	-85.2	172.4	71	0	0	111.5	Y721 I722 A725 L783 Y784 R785	Y721-Q727 VanDerWaalsContact CD2-O 3.31Å; Y721-Q727 WeakPolarHBondContact CD2-O 3.03Å; I722-Q727 PolarHBondContact N-O 3.12Å; I722-Q727 PolarHBondContact O-N 3.2Å; A725-Q727 HydrophobicContact CB-CB 4.06Å; A725-Q727 HydrophobicContact CB-CG 4.26Å; A725-Q727 WeakPolarHBondContact O-CG 3.31Å; A725-Q727 PolarHBondContact O-N 2.91Å; A725-Q727 PolarHBondContact O-NE2 3.03Å; Q727-L783 HydrophobicContact CB-CD1 4.01Å; Q727-L783 HydrophobicContact CG-CD1 3.98Å; Q727-Y784 WeakPolarHBondContact CA-O 3.23Å; Q727-R785 HydrophobicContact CG-CG 4.21Å
728	L	94.3	Very high	93.1	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	113	175.8	-179.5	68.2	0	0	0	108.2	I719 Y721 L755 Y784 V787 I792 I797 L820	I719-L728 HydrophobicContact CG2-CD1 3.76Å; Y721-L728 HydrophobicContact CD2-CB 4.32Å; Y721-L728 HydrophobicContact CD2-CD1 4.3Å; L728-L755 HydrophobicContact CD2-CD1 4.33Å; L728-Y784 PolarHBondContact N-O 3.49Å; L728-Y784 PolarHBondContact O-N 2.87Å; L728-V787 HydrophobicContact CB-CB 4.32Å; L728-V787 HydrophobicContact CB-CG1 4.38Å; L728-V787 HydrophobicContact CB-CG2 4.17Å; L728-I792 HydrophobicContact CD1-CD1 4.11Å; L728-I792 HydrophobicContact CD2-CD1 4.14Å; L728-I797 HydrophobicContact CD2-CD1 4.13Å; L728-L820 HydrophobicContact CD2-CD1 3.69Å; L728-L820 HydrophobicContact CD2-CD2 4.32Å
729	M	93.9	Very high	92.6	Very high	49 Å²	49	42.6 Å²	42.6	24%	0.241	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	133.2	178.9	-69.9	170.2	64.2	0	0	109.3	L720 I722 T781 L783	L720-M729 HydrophobicContact CB-CB 4.32Å; L720-M729 HydrophobicContact CD2-SD 4.29Å; L720-M729 PolarHBondContact N-O 3.05Å; L720-M729 PolarHBondContact O-N 2.94Å; I722-M729 HydrophobicContact CD1-SD 3.79Å; M729-T781 HydrophobicContact CB-CG2 4.33Å; M729-T781 HydrophobicContact CE-CG2 3.88Å; M729-L783 HydrophobicContact CG-CD1 3.63Å
730	V	95.4	Very high	92.1	Very high	0 Å²	0	43 Å²	43	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	117.2	174.3	-175.7	0	0	0	0	109.6	I717 S718 I719 M753 T781 M782 I797	I717-V730 HydrophobicContact CG2-CG1 3.51Å; S718-V730 CarbonylContact O-C 3.39Å; S718-V730 WeakPolarHBondContact O-CA 3.34Å; I719-V730 HydrophobicContact CG1-CG1 4.14Å; I719-V730 HydrophobicContact CG1-CG2 4.33Å; I719-V730 HydrophobicContact CG2-CG2 4.41Å; V730-M753 HydrophobicContact CB-CE 3.79Å; V730-M753 HydrophobicContact CG1-CE 3.51Å; V730-M753 HydrophobicContact CG2-CE 4.15Å; V730-T781 CarbonylContact O-C 3.53Å; V730-M782 PolarHBondContact N-O 2.83Å; V730-M782 PolarHBondContact O-N 3.12Å; V730-I797 HydrophobicContact CG2-CD1 3.62Å
731	N	94.8	Very high	91.8	Very high	34 Å²	34	42.7 Å²	42.7	18%	0.182	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	109.6	178.7	-62	-44.2	0	0	0	109.2	I717 S718 L733 T781	I717-N731 WeakPolarHBondContact CA-O 3.37Å; S718-N731 PolarHBondContact N-O 3.16Å; S718-N731 VanDerWaalsContact N-O 3.08Å; S718-N731 PolarHBondContact O-N 2.89Å; S718-N731 PolarHBondContact OG-ND2 3.44Å; N731-L733 HydrophobicContact CB-CD2 4.19Å; N731-L733 PolarHBondContact O-N 3.47Å; N731-T781 WeakPolarHBondContact OD1-CB 3.45Å; N731-T781 WeakPolarHBondContact OD1-CG2 3.41Å; N731-T781 PolarHBondContact OD1-OG1 2.84Å
732	L	95.3	Very high	90.9	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	106.6	168	-63.1	175.4	0	0	0	107.9	I717 V751 M753 H779 Q780 M782	I717-L732 HydrophobicContact CG1-CD2 4.3Å; L732-V751 HydrophobicContact CD1-CB 3.89Å; L732-V751 HydrophobicContact CD1-CG1 4.02Å; L732-V751 HydrophobicContact CD1-CG2 4.2Å; L732-V751 HydrophobicContact CD2-CG1 4.23Å; L732-M753 HydrophobicContact CD1-SD 3.83Å; L732-M753 HydrophobicContact CD2-CE 4.44Å; L732-M753 HydrophobicContact CD2-SD 3.98Å; L732-M753 HydrophobicContact CG-SD 4.07Å; L732-H779 CarbonylContact O-C 3.49Å; L732-H779 WeakPolarHBondContact O-CA 3.34Å; L732-H779 PolarHBondContact O-N 2.64Å; L732-H779 VanDerWaalsContact O-N 3.16Å; L732-Q780 PolarHBondContact N-O 3.1Å; L732-Q780 PolarHBondContact O-N 2.91Å; L732-M782 HydrophobicContact CD1-CG 3.93Å; L732-M782 HydrophobicContact CG-CG 4.25Å
733	L	94.3	Very high	90.2	Very high	38 Å²	38	49.5 Å²	49.5	20%	0.199	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	-70.6	-176.4	-58.9	176.6	0	0	0	110.1	S716 N731 W778 H779 T829	S716-L733 PolarHBondContact O-N 3.43Å; S716-L733 VanDerWaalsContact O-N 3.12Å; N731-L733 HydrophobicContact CB-CD2 4.19Å; N731-L733 PolarHBondContact O-N 3.47Å; L733-W778 PolarHBondContact O-N 2.9Å; L733-H779 PolarHBondContact O-N 3.13Å; L733-H779 VanDerWaalsContact O-N 3.08Å; L733-T829 HydrophobicContact CD1-CG2 3.47Å; L733-T829 VanDerWaalsContact CD1-CG2 3.47Å
734	E	95.4	Very high	89.6	Confident	63 Å²	63	49.2 Å²	49.2	29%	0.294	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.2	168.7	-173.2	59.6	178.1	-175.5	0	0	112.3	I715 S716 P776 V777 W831	I715-E734 WeakPolarHBondContact CA-O 3.29Å; I715-E734 WeakPolarHBondContact CG1-O 3.21Å; S716-E734 PolarHBondContact N-O 3.17Å; E734-P776 CarbonylContact C-O 3.58Å; E734-P776 WeakPolarHBondContact CA-O 3.33Å; E734-P776 WeakPolarHBondContact CB-O 3.46Å; E734-V777 HydrophobicContact CB-CB 4.47Å; E734-V777 HydrophobicContact CB-CG2 4.07Å; E734-W831 HydrophobicContact CG-CH2 3.84Å; E734-W831 HydrophobicContact CG-CZ2 4.4Å; E734-W831 VanDerWaalsContact OE1-CH2 3.29Å; E734-W831 WeakPolarHBondContact OE1-CH2 3.03Å; E734-W831 WeakPolarHBondContact OE1-CZ2 3.36Å
735	A	94.7	Very high	89.3	Confident	1 Å²	1	44.5 Å²	44.5	1%	0.008	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	156.5	163.5	0	0	0	0	0	110.9	Q714 I715 L738 H775 P776 W778	Q714-A735 CarbonylContact O-C 3.55Å; Q714-A735 WeakPolarHBondContact O-CA 3.48Å; Q714-A735 VanDerWaalsContact O-CB 3.27Å; Q714-A735 WeakPolarHBondContact O-CB 3.19Å; I715-A735 HydrophobicContact CB-CB 4.11Å; I715-A735 HydrophobicContact CG1-CB 4.15Å; A735-L738 HydrophobicContact CB-CD1 4.29Å; A735-L738 HydrophobicContact CB-CD2 4.32Å; A735-L738 HydrophobicContact CB-CG 4.38Å; A735-H775 CarbonylContact O-C 3.57Å; A735-H775 WeakPolarHBondContact O-CA 3.35Å; A735-P776 HydrophobicContact CB-CG 3.97Å; A735-P776 PolarHBondContact N-O 2.87Å; A735-P776 VanDerWaalsContact O-CD 3.3Å; A735-P776 WeakPolarHBondContact O-CD 3.44Å; A735-W778 HydrophobicContact CB-CH2 4.06Å; A735-W778 HydrophobicContact CB-CZ3 3.8Å
736	V	91.8	Very high	88.8	Confident	34 Å²	34	44.1 Å²	44.1	21%	0.206	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	160.6	-179.3	-61.4	0	0	0	0	111	G713 Q714 L738 W831	G713-V736 CarbonylContact C-O 3.43Å; G713-V736 WeakPolarHBondContact CA-O 3.31Å; Q714-V736 HydrophobicContact CB-CG2 4.17Å; Q714-V736 PolarHBondContact N-O 3.12Å; Q714-V736 PolarHBondContact O-N 2.91Å; V736-L738 PolarHBondContact O-N 3.26Å; V736-W831 HydrophobicContact CG1-CH2 3.91Å; V736-W831 HydrophobicContact CG1-CZ3 4.32Å; V736-W831 HydrophobicContact CG2-CH2 4.06Å; V736-W831 HydrophobicContact CG2-CZ3 3.77Å
737	D	88.2	Confident	88.6	Confident	79 Å²	79	39.4 Å²	39.4	42%	0.422	24%	0.238	S	C	.	.			trans	56.3	31.4	176.6	-65.4	0.1	0	0	0	114.2	G713 H775	G713-D737 VanDerWaalsContact CA-O 3.28Å; G713-D737 WeakPolarHBondContact CA-O 3.41Å; G713-D737 PolarHBondContact N-O 2.7Å; D737-H775 PolarHBondContact N-CE1 2.66Å; D737-H775 IonicContact OD1-CE1 2.66Å; D737-H775 PolarHBondContact OD1-CE1 2.84Å
738	L	89.3	Confident	88.7	Confident	4 Å²	4	38.3 Å²	38.3	2%	0.021	23%	0.234	C	C	.	.			trans	-68.8	136.1	172.4	-57.4	-178.7	0	0	0	109.7	A735 V736 P749 C774 P776 V801 L813 L834	A735-L738 HydrophobicContact CB-CD1 4.29Å; A735-L738 HydrophobicContact CB-CD2 4.32Å; A735-L738 HydrophobicContact CB-CG 4.38Å; V736-L738 PolarHBondContact O-N 3.26Å; L738-P749 HydrophobicContact CD1-CB 3.75Å; L738-P749 HydrophobicContact CD1-CG 4.13Å; L738-C774 HydrophobicContact CB-CB 4.44Å; L738-C774 VanDerWaalsContact CB-O 3.32Å; L738-C774 WeakPolarHBondContact CB-O 3.45Å; L738-C774 WeakPolarHBondContact CG-O 3.38Å; L738-C774 PolarHBondContact N-O 2.78Å; L738-C774 VanDerWaalsContact O-CB 3.31Å; L738-C774 WeakPolarHBondContact O-CB 3.43Å; L738-C774 PolarHBondContact O-SG 2.72Å; L738-P776 HydrophobicContact CD1-CG 3.74Å; L738-V801 HydrophobicContact CD1-CG1 4.26Å; L738-V801 HydrophobicContact CD2-CG1 4.48Å; L738-L813 HydrophobicContact CD1-CD1 4.25Å; L738-L834 HydrophobicContact CD2-CD1 3.6Å
739	P	84.3	Confident	88.7	Confident	25 Å²	25	38.3 Å²	38.3	16%	0.162	23%	0.234	C	C	.	.			trans	-68.2	131.6	-177.8	30.1	-37.8	0	0	0	110.8	F712 R747 L813	F712-P739 HydrophobicContact CD1-CG 3.78Å; F712-P739 HydrophobicContact CE1-CG 4.37Å; P739-R747 WeakPolarHBondContact O-CG 3.39Å; P739-R747 PolarHBondContact O-NE 2.87Å; P739-L813 HydrophobicContact CG-CD2 4.13Å
740	P	84.8	Confident	88.8	Confident	12 Å²	12	36.1 Å²	36.1	8%	0.078	22%	0.223	C	C	.	.			trans	-63.8	174.5	172.2	26.7	-33	0	0	0	111.7	G673 Q674 T745 R747	G673-P740 WeakPolarHBondContact O-CD 3.48Å; G673-P740 VanDerWaalsContact O-CG 3.31Å; G673-P740 WeakPolarHBondContact O-CG 3.34Å; Q674-P740 HydrophobicContact CG-CG 3.71Å; P740-T745 WeakPolarHBondContact CB-O 3.21Å; P740-R747 VanDerWaalsContact C-NE 3.26Å; P740-R747 PolarHBondContact O-NE 3.34Å; P740-R747 PolarHBondContact O-NH2 3.13Å
741	R	87.1	Confident	88.9	Confident	44 Å²	44	36.1 Å²	36.1	17%	0.166	22%	0.223	C	C	.	.			trans	-69.4	167	176.3	-66.3	-163.5	-178.4	124.4	2.4	111.3	Q674 D743 G744 T745 N748 D803 Y804	Q674-R741 PolarHBondContact NE2-O 3.25Å; R741-D743 WeakPolarHBondContact CB-OD1 3.47Å; R741-D743 PolarHBondContact O-N 3.02Å; R741-G744 PolarHBondContact O-N 2.98Å; R741-T745 WeakPolarHBondContact CB-O 3.22Å; R741-T745 WeakPolarHBondContact CB-OG1 3.33Å; R741-T745 WeakPolarHBondContact CD-OG1 3.33Å; R741-T745 PolarHBondContact N-O 3.3Å; R741-N748 PolarHBondContact NH2-ND2 3.23Å; R741-D803 IonicContact CZ-OD1 3.73Å; R741-D803 IonicContact CZ-OD2 3.62Å; R741-D803 IonicContact NE-OD1 3.49Å; R741-D803 IonicContact NE-OD2 3.48Å; R741-D803 PolarHBondContact NE-OD2 2.89Å; R741-D803 IonicContact NH2-OD1 3.23Å; R741-D803 PolarHBondContact NH2-OD1 3.03Å; R741-D803 IonicContact NH2-OD2 2.66Å; R741-D803 PolarHBondContact NH2-OD2 3.34Å; R741-Y804 PolarHBondContact NH2-O 2.71Å
742	A	76.3	Confident	88.9	Confident	103 Å²	103	36.6 Å²	36.6	85%	0.851	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.8	-17.5	-175.8	0	0	0	0	0	114
743	D	77.7	Confident	88.9	Confident	118 Å²	118	36.6 Å²	36.6	63%	0.631	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.7	-0.2	173	52.1	19.7	0	0	0	113.3	R741 T745	R741-D743 WeakPolarHBondContact CB-OD1 3.47Å; R741-D743 PolarHBondContact O-N 3.02Å; D743-T745 VanDerWaalsContact C-N 3.35Å; D743-T745 WeakPolarHBondContact OD1-CB 3.35Å; D743-T745 WeakPolarHBondContact OD1-CG2 3.4Å; D743-T745 PolarHBondContact OD1-N 3.2Å; D743-T745 PolarHBondContact OD1-OG1 3.11Å
744	G	77.5	Confident	88.9	Confident	53 Å²	53	36.1 Å²	36.1	55%	0.546	22%	0.22	S	C	.	.	S	Bend	trans	86	-4.2	-175	0	0	0	0	0	114.8	R741	R741-G744 PolarHBondContact O-N 2.98Å
745	T	83	Confident	88.9	Confident	64 Å²	64	33.7 Å²	33.7	39%	0.393	21%	0.208	S	C	.	.	P	Polyproline II helix	trans	-68.7	150.5	178.1	62.4	0	0	0	0	111.8	P740 R741 D743	P740-T745 WeakPolarHBondContact CB-O 3.21Å; R741-T745 WeakPolarHBondContact CB-O 3.22Å; R741-T745 WeakPolarHBondContact CB-OG1 3.33Å; R741-T745 WeakPolarHBondContact CD-OG1 3.33Å; R741-T745 PolarHBondContact N-O 3.3Å; D743-T745 VanDerWaalsContact C-N 3.35Å; D743-T745 WeakPolarHBondContact OD1-CB 3.35Å; D743-T745 WeakPolarHBondContact OD1-CG2 3.4Å; D743-T745 PolarHBondContact OD1-N 3.2Å; D743-T745 PolarHBondContact OD1-OG1 3.11Å
746	A	80.4	Confident	88.7	Confident	32 Å²	32	34 Å²	34	26%	0.264	21%	0.21	S	C	.	.	P	Polyproline II helix	trans	-67.9	155.7	177.6	0	0	0	0	0	111.8	E772	A746-E772 HydrophobicContact CB-CB 4.34Å; A746-E772 VanDerWaalsContact CB-O 3.27Å; A746-E772 WeakPolarHBondContact CB-O 3.36Å
747	R	90.2	Very high	88.5	Confident	21 Å²	21	33.7 Å²	33.7	8%	0.079	21%	0.209	C	C	.	.	P	Polyproline II helix	trans	-80.7	163.4	-178.4	-65.3	-67.4	-177.3	163.1	2.1	111.4	P739 P740 P749 E772 T773 D803 D811 L813	P739-R747 WeakPolarHBondContact O-CG 3.39Å; P739-R747 PolarHBondContact O-NE 2.87Å; P740-R747 VanDerWaalsContact C-NE 3.26Å; P740-R747 PolarHBondContact O-NE 3.34Å; P740-R747 PolarHBondContact O-NH2 3.13Å; R747-P749 WeakPolarHBondContact O-CD 3.48Å; R747-E772 CarbonylContact O-C 3.57Å; R747-E772 VanDerWaalsContact O-CA 3.26Å; R747-E772 WeakPolarHBondContact O-CA 3.34Å; R747-E772 PolarHBondContact O-N 2.83Å; R747-T773 PolarHBondContact O-N 3.32Å; R747-D803 WeakPolarHBondContact CD-OD2 3.29Å; R747-D803 IonicContact CZ-OD2 3.52Å; R747-D803 IonicContact NE-OD2 3.14Å; R747-D803 IonicContact NH1-OD2 2.83Å; R747-D803 PolarHBondContact NH1-OD2 3.23Å; R747-D811 IonicContact CZ-OD2 2.72Å; R747-D811 IonicContact NH1-OD2 2.84Å; R747-D811 PolarHBondContact NH1-OD2 2.8Å; R747-D811 IonicContact NH2-OD2 3.63Å; R747-L813 HydrophobicContact CB-CD1 4.3Å; R747-L813 HydrophobicContact CG-CD1 4.22Å; R747-L813 HydrophobicContact CG-CD2 4.26Å
748	N	93.4	Very high	88.3	Confident	30 Å²	30	33.2 Å²	33.2	16%	0.16	21%	0.206	C	C	.	.			trans	-109.1	67.8	167	-64.9	-29.7	0	0	0	110.3	R741 T769 M770 E772 D803 Y804	R741-N748 PolarHBondContact NH2-ND2 3.23Å; N748-T769 HydrophobicContact CB-CG2 4.04Å; N748-T769 WeakPolarHBondContact O-CG2 3.42Å; N748-M770 CarbonylContact C-O 3.26Å; N748-M770 WeakPolarHBondContact CA-O 3.38Å; N748-E772 PolarHBondContact OD1-N 3.19Å; N748-D803 PolarHBondContact N-OD1 2.67Å; N748-Y804 VanDerWaalsContact CB-O 3.31Å; N748-Y804 WeakPolarHBondContact CB-O 3.43Å; N748-Y804 PolarHBondContact ND2-O 2.71Å; N748-Y804 WeakPolarHBondContact O-CB 3.36Å; N748-Y804 PolarHBondContact O-N 3.4Å
749	P	94.9	Very high	88.1	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	139.8	-166.8	31.2	-39.2	0	0	0	113.8	L738 R747 M770 T773 P776 W778 V801 W802 L813	L738-P749 HydrophobicContact CD1-CB 3.75Å; L738-P749 HydrophobicContact CD1-CG 4.13Å; R747-P749 WeakPolarHBondContact O-CD 3.48Å; P749-M770 WeakPolarHBondContact CD-O 3.46Å; P749-M770 HydrophobicContact CG-CB 4.32Å; P749-M770 PolarHBondContact O-N 3.41Å; P749-T773 VanDerWaalsContact CD-O 3.24Å; P749-T773 WeakPolarHBondContact CD-O 3.43Å; P749-T773 HydrophobicContact CG-CG2 4.08Å; P749-T773 WeakPolarHBondContact CG-O 3.49Å; P749-P776 HydrophobicContact CB-CB 4.36Å; P749-P776 HydrophobicContact CB-CG 3.96Å; P749-P776 HydrophobicContact CG-CB 3.49Å; P749-P776 VanDerWaalsContact CG-CB 3.49Å; P749-P776 HydrophobicContact CG-CG 3.47Å; P749-P776 VanDerWaalsContact CG-CG 3.47Å; P749-W778 HydrophobicContact CB-CZ2 4.14Å; P749-V801 HydrophobicContact CB-CG1 4.38Å; P749-W802 CarbonylContact C-O 3.53Å; P749-W802 VanDerWaalsContact CA-O 3.27Å; P749-W802 WeakPolarHBondContact CA-O 3.36Å; P749-L813 HydrophobicContact CB-CD1 4.21Å
750	Y	96.4	Very high	88	Confident	4 Å²	4	39.8 Å²	39.8	2%	0.016	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	152.7	171.2	74.6	-72.5	0	0	0	110.9	K752 Q766 W802 N810	Y750-K752 HydrophobicContact CE2-CD 4.36Å; Y750-K752 HydrophobicContact CE2-CG 4.09Å; Y750-K752 WeakPolarHBondContact OH-CE 3.22Å; Y750-K752 PolarHBondContact OH-NZ 2.91Å; Y750-Q766 HydrophobicContact CD2-CG 4.02Å; Y750-Q766 HydrophobicContact CE2-CG 4.39Å; Y750-W802 HydrophobicContact CD1-CB 3.9Å; Y750-W802 WeakPolarHBondContact CD1-O 3.49Å; Y750-W802 HydrophobicContact CE1-CB 3.28Å; Y750-W802 HydrophobicContact CE1-CG 4.3Å; Y750-W802 WeakPolarHBondContact CE1-O 3.17Å; Y750-W802 HydrophobicContact CE2-CB 4.39Å; Y750-W802 PolarHBondContact N-O 2.64Å; Y750-W802 PolarHBondContact O-N 3.06Å; Y750-N810 HydrophobicContact CE1-CB 4.3Å; Y750-N810 PolarHBondContact OH-ND2 3.17Å
751	V	96.7	Very high	87.9	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	138.1	-174.3	-169.5	0	0	0	0	110.4	I715 L732 M753 Q766 S767 W778 I799 T800 V801	I715-V751 HydrophobicContact CD1-CG2 4.21Å; L732-V751 HydrophobicContact CD1-CB 3.89Å; L732-V751 HydrophobicContact CD1-CG1 4.02Å; L732-V751 HydrophobicContact CD1-CG2 4.2Å; L732-V751 HydrophobicContact CD2-CG1 4.23Å; V751-M753 HydrophobicContact CG1-CG 4.06Å; V751-Q766 CarbonylContact O-C 3.54Å; V751-Q766 VanDerWaalsContact O-CA 3.24Å; V751-Q766 WeakPolarHBondContact O-CA 3.47Å; V751-Q766 WeakPolarHBondContact O-CG 3.4Å; V751-S767 PolarHBondContact N-OG 3.28Å; V751-S767 PolarHBondContact O-N 3.05Å; V751-W778 HydrophobicContact CG2-CD2 4.14Å; V751-W778 HydrophobicContact CG2-CE3 4.09Å; V751-W778 HydrophobicContact CG2-CH2 3.48Å; V751-W778 VanDerWaalsContact CG2-CH2 3.48Å; V751-W778 HydrophobicContact CG2-CZ2 3.53Å; V751-W778 HydrophobicContact CG2-CZ3 3.78Å; V751-I799 HydrophobicContact CG1-CG2 3.55Å; V751-T800 CarbonylContact C-O 3.14Å; V751-T800 WeakPolarHBondContact CA-O 3.41Å; V751-V801 HydrophobicContact CG2-CG2 4.39Å
752	K	95.6	Very high	87.7	Confident	43 Å²	43	50.3 Å²	50.3	19%	0.187	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	135.8	163.6	-61	171.4	-165.1	157.4	0	109.4	Y750 R765 Q766 T800	Y750-K752 HydrophobicContact CE2-CD 4.36Å; Y750-K752 HydrophobicContact CE2-CG 4.09Å; Y750-K752 WeakPolarHBondContact OH-CE 3.22Å; Y750-K752 PolarHBondContact OH-NZ 2.91Å; K752-R765 WeakPolarHBondContact CA-O 3.49Å; K752-Q766 HydrophobicContact CG-CG 4.08Å; K752-T800 PolarHBondContact N-O 3.1Å; K752-T800 PolarHBondContact O-N 2.98Å; K752-T800 PolarHBondContact O-OG1 2.9Å
753	M	95.3	Very high	88.4	Confident	1 Å²	1	45.7 Å²	45.7	1%	0.005	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	148.2	178.3	-44.9	162.1	67.1	0	0	111.1	V730 L732 V751 R764 R765 M782 I797 E798 I799	V730-M753 HydrophobicContact CB-CE 3.79Å; V730-M753 HydrophobicContact CG1-CE 3.51Å; V730-M753 HydrophobicContact CG2-CE 4.15Å; L732-M753 HydrophobicContact CD1-SD 3.83Å; L732-M753 HydrophobicContact CD2-CE 4.44Å; L732-M753 HydrophobicContact CD2-SD 3.98Å; L732-M753 HydrophobicContact CG-SD 4.07Å; V751-M753 HydrophobicContact CG1-CG 4.06Å; M753-R764 CarbonylContact O-C 3.58Å; M753-R764 WeakPolarHBondContact O-CA 3.1Å; M753-R765 HydrophobicContact CB-CB 4.21Å; M753-R765 PolarHBondContact N-O 2.85Å; M753-R765 PolarHBondContact O-N 2.74Å; M753-R765 HydrophobicContact SD-CB 4.39Å; M753-M782 HydrophobicContact SD-CB 4.01Å; M753-M782 HydrophobicContact SD-CG 3.82Å; M753-I797 HydrophobicContact CB-CG2 4.47Å; M753-I797 HydrophobicContact CE-CG2 3.88Å; M753-E798 CarbonylContact C-O 3.47Å; M753-E798 WeakPolarHBondContact CA-O 3.48Å; M753-I799 HydrophobicContact CE-CD1 4.11Å; M753-I799 HydrophobicContact CE-CG1 4.2Å; M753-I799 HydrophobicContact CG-CG1 4.21Å; M753-I799 HydrophobicContact CG-CG2 4.31Å
754	F	94.5	Very high	89.2	Confident	28 Å²	28	40.8 Å²	40.8	12%	0.123	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	134.3	172	-69.7	-95.2	0	0	0	110.4	L756 R759 S763 R764 I797 E798	F754-L756 HydrophobicContact CB-CD2 3.76Å; F754-L756 HydrophobicContact CB-CG 4.43Å; F754-L756 PolarHBondContact O-N 3.43Å; F754-R759 HydrophobicContact CD1-CB 4.24Å; F754-R759 HydrophobicContact CD1-CG 4.01Å; F754-R759 HydrophobicContact CE1-CB 4.34Å; F754-R759 HydrophobicContact CE1-CG 4.39Å; F754-R759 HydrophobicContact CG-CG 4.5Å; F754-S763 WeakPolarHBondContact CA-O 3.26Å; F754-R764 HydrophobicContact CD1-CB 4.09Å; F754-R764 HydrophobicContact CD1-CG 3.82Å; F754-R764 HydrophobicContact CD2-CG 4.44Å; F754-R764 HydrophobicContact CE1-CB 3.97Å; F754-R764 HydrophobicContact CE1-CG 3.44Å; F754-R764 VanDerWaalsContact CE1-CG 3.44Å; F754-R764 HydrophobicContact CE2-CG 4.09Å; F754-R764 HydrophobicContact CG-CG 4.32Å; F754-R764 HydrophobicContact CZ-CG 3.59Å; F754-I797 WeakPolarHBondContact O-CA 3.27Å; F754-E798 HydrophobicContact CB-CB 4.43Å; F754-E798 PolarHBondContact N-O 3Å; F754-E798 PolarHBondContact O-N 3.46Å
755	L	93.7	Very high	90	Very high	11 Å²	11	40.8 Å²	40.8	6%	0.058	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	89.7	170.5	-176.8	65.3	0	0	0	109.7	L728 D758 S763 Y784 V787 K795 I797 L820	L728-L755 HydrophobicContact CD2-CD1 4.33Å; L755-D758 PolarHBondContact O-N 3.48Å; L755-S763 PolarHBondContact N-O 3.49Å; L755-S763 VanDerWaalsContact N-O 3.11Å; L755-Y784 HydrophobicContact CB-CD1 4.18Å; L755-Y784 HydrophobicContact CB-CE1 3.74Å; L755-Y784 HydrophobicContact CD2-CD1 3.99Å; L755-Y784 HydrophobicContact CD2-CE1 4.41Å; L755-Y784 HydrophobicContact CD2-CG 4.22Å; L755-V787 HydrophobicContact CD2-CG2 3.98Å; L755-K795 HydrophobicContact CD1-CB 3.94Å; L755-K795 HydrophobicContact CD1-CD 4.09Å; L755-K795 HydrophobicContact CD2-CD 3.98Å; L755-K795 HydrophobicContact CG-CB 4.5Å; L755-K795 HydrophobicContact CG-CD 3.88Å; L755-I797 HydrophobicContact CD1-CG1 3.95Å; L755-L820 HydrophobicContact CD1-CD1 3.75Å
756	L	91.1	Very high	90.6	Very high	8 Å²	8	39.3 Å²	39.3	4%	0.042	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	149.2	-176.8	-55.9	-171.3	0	0	0	111.2	F754 D758 R759 K795 I796 E798 L847	F754-L756 HydrophobicContact CB-CD2 3.76Å; F754-L756 HydrophobicContact CB-CG 4.43Å; F754-L756 PolarHBondContact O-N 3.43Å; L756-D758 WeakPolarHBondContact CD2-O 3.35Å; L756-R759 HydrophobicContact CD2-CG 3.45Å; L756-R759 VanDerWaalsContact CD2-CG 3.45Å; L756-K795 VanDerWaalsContact O-CA 3.27Å; L756-K795 WeakPolarHBondContact O-CA 3.49Å; L756-K795 VanDerWaalsContact O-CB 3.24Å; L756-K795 WeakPolarHBondContact O-CB 3.26Å; L756-K795 WeakPolarHBondContact O-CG 3.37Å; L756-I796 WeakPolarHBondContact CA-O 3.42Å; L756-I796 HydrophobicContact CB-CB 4.5Å; L756-I796 WeakPolarHBondContact CB-O 3.23Å; L756-I796 PolarHBondContact N-O 2.88Å; L756-I796 PolarHBondContact O-N 3.39Å; L756-I796 VanDerWaalsContact O-N 3.11Å; L756-E798 HydrophobicContact CD1-CB 3.6Å; L756-E798 HydrophobicContact CD1-CG 4.32Å; L756-E798 HydrophobicContact CD2-CB 4.44Å; L756-E798 HydrophobicContact CG-CB 3.85Å; L756-L847 HydrophobicContact CB-CD1 4.19Å; L756-L847 HydrophobicContact CB-CD2 3.8Å; L756-L847 HydrophobicContact CD1-CD1 3.52Å
757	P	87.3	Confident	91.4	Very high	27 Å²	27	38.1 Å²	38.1	18%	0.175	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	cis	-81.1	-6.4	15.4	31.8	-36.8	0	0	0	116	L847 R851 F854	P757-L847 HydrophobicContact CB-CD2 4.24Å; P757-R851 PolarHBondContact O-NH1 2.92Å; P757-F854 HydrophobicContact CG-CD2 4.25Å; P757-F854 HydrophobicContact CG-CE2 4.28Å
758	D	83.8	Confident	91.6	Very high	70 Å²	70	44.1 Å²	44.1	37%	0.374	20%	0.204	S	C	.	.			trans	-69.6	139.1	175.2	-171.7	23.5	0	0	0	111.2	L755 L756 S760 S763	L755-D758 PolarHBondContact O-N 3.48Å; L756-D758 WeakPolarHBondContact CD2-O 3.35Å; D758-S760 VanDerWaalsContact OD1-CB 3.23Å; D758-S760 WeakPolarHBondContact OD1-CB 3.23Å; D758-S760 PolarHBondContact OD1-N 2.91Å; D758-S760 PolarHBondContact OD1-OG 3.11Å; D758-S760 VanDerWaalsContact OD2-CB 3.31Å; D758-S760 WeakPolarHBondContact OD2-CB 3.26Å; D758-S760 PolarHBondContact OD2-OG 3.16Å; D758-S763 PolarHBondContact O-OG 2.84Å; D758-S763 WeakPolarHBondContact OD2-CB 3.46Å
759	R	85.2	Confident	91.6	Very high	123 Å²	123	45.6 Å²	45.6	46%	0.464	21%	0.214	S	C	.	.			trans	-128.9	22.8	169.7	-77	-167.8	170.9	173.7	-0.6	111.5	F754 L756 E798	F754-R759 HydrophobicContact CD1-CB 4.24Å; F754-R759 HydrophobicContact CD1-CG 4.01Å; F754-R759 HydrophobicContact CE1-CB 4.34Å; F754-R759 HydrophobicContact CE1-CG 4.39Å; F754-R759 HydrophobicContact CG-CG 4.5Å; L756-R759 HydrophobicContact CD2-CG 3.45Å; L756-R759 VanDerWaalsContact CD2-CG 3.45Å; R759-E798 IonicContact CZ-OE1 3.59Å; R759-E798 IonicContact CZ-OE2 3.61Å; R759-E798 VanDerWaalsContact CZ-OE2 3.26Å; R759-E798 IonicContact NE-OE2 2.76Å; R759-E798 PolarHBondContact NE-OE2 3.03Å; R759-E798 VanDerWaalsContact NE-OE2 3.14Å; R759-E798 IonicContact NH2-OE1 2.81Å; R759-E798 PolarHBondContact NH2-OE1 3.29Å; R759-E798 IonicContact NH2-OE2 2.69Å; R759-E798 PolarHBondContact NH2-OE2 3.37Å
760	S	82.9	Confident	91.6	Very high	43 Å²	43	47.8 Å²	47.8	30%	0.301	23%	0.225	S	C	.	.	S	Bend	trans	-67.9	166	168.1	84.9	0	0	0	0	111.2	D758 K762 S763 R764	D758-S760 VanDerWaalsContact OD1-CB 3.23Å; D758-S760 WeakPolarHBondContact OD1-CB 3.23Å; D758-S760 PolarHBondContact OD1-N 2.91Å; D758-S760 PolarHBondContact OD1-OG 3.11Å; D758-S760 VanDerWaalsContact OD2-CB 3.31Å; D758-S760 WeakPolarHBondContact OD2-CB 3.26Å; D758-S760 PolarHBondContact OD2-OG 3.16Å; S760-K762 PolarHBondContact O-N 3.45Å; S760-K762 WeakPolarHBondContact OG-CB 3.4Å; S760-K762 PolarHBondContact OG-N 2.77Å; S760-K762 VanDerWaalsContact OG-N 3.11Å; S760-S763 PolarHBondContact N-OG 2.99Å; S760-S763 PolarHBondContact O-N 3.17Å; S760-S763 PolarHBondContact O-OG 3.21Å; S760-R764 PolarHBondContact O-N 2.75Å
761	E	82	Confident	91.3	Very high	99 Å²	99	51.1 Å²	51.1	46%	0.463	25%	0.254	S	S	.	.	G	3₁₀ helix	trans	-61.7	-24.2	173.7	-169	58.5	-164.4	0	0	112.7	R764	E761-R764 PolarHBondContact O-N 3Å; E761-R764 IonicContact OE1-CZ 3.76Å; E761-R764 IonicContact OE1-NE 2.7Å; E761-R764 IonicContact OE1-NH2 2.92Å; E761-R764 PolarHBondContact OE1-NH2 3.47Å; E761-R764 IonicContact OE2-CZ 2.65Å; E761-R764 IonicContact OE2-NE 3.55Å; E761-R764 PolarHBondContact OE2-NE 2.94Å; E761-R764 IonicContact OE2-NH2 3.64Å; E761-R764 PolarHBondContact OE2-NH2 2.86Å
762	K	84.3	Confident	90.9	Very high	179 Å²	179	58.7 Å²	58.7	78%	0.778	29%	0.289	S	S	*	.	G	3₁₀ helix	trans	-67.3	-36.4	176.1	-61.1	-170.1	176.4	-168.7	0	112.5	S760 R764 R765	S760-K762 PolarHBondContact O-N 3.45Å; S760-K762 WeakPolarHBondContact OG-CB 3.4Å; S760-K762 PolarHBondContact OG-N 2.77Å; S760-K762 VanDerWaalsContact OG-N 3.11Å; K762-R764 VanDerWaalsContact C-N 3.31Å; K762-R765 PolarHBondContact O-NH1 2.85Å
763	S	90.7	Very high	90.7	Very high	6 Å²	6	58.3 Å²	58.3	4%	0.042	29%	0.29	C	S	.	.	G	3₁₀ helix	trans	-79.6	-9.5	176.8	70.5	0	0	0	0	114	F754 L755 D758 S760 Y784	F754-S763 WeakPolarHBondContact CA-O 3.26Å; L755-S763 PolarHBondContact N-O 3.49Å; L755-S763 VanDerWaalsContact N-O 3.11Å; D758-S763 PolarHBondContact O-OG 2.84Å; D758-S763 WeakPolarHBondContact OD2-CB 3.46Å; S760-S763 PolarHBondContact N-OG 2.99Å; S760-S763 PolarHBondContact O-N 3.17Å; S760-S763 PolarHBondContact O-OG 3.21Å; S763-Y784 VanDerWaalsContact O-CE1 3.24Å; S763-Y784 WeakPolarHBondContact O-CE1 3.36Å; S763-Y784 PolarHBondContact O-OH 3.47Å; S763-Y784 VanDerWaalsContact O-OH 3.1Å
764	R	94.1	Very high	90.4	Very high	15 Å²	15	59.2 Å²	59.2	6%	0.057	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	138.7	-170.8	-154.4	175.3	67.1	70.7	27.1	112.1	M753 F754 S760 E761 K762 P1230	M753-R764 CarbonylContact O-C 3.58Å; M753-R764 WeakPolarHBondContact O-CA 3.1Å; F754-R764 HydrophobicContact CD1-CB 4.09Å; F754-R764 HydrophobicContact CD1-CG 3.82Å; F754-R764 HydrophobicContact CD2-CG 4.44Å; F754-R764 HydrophobicContact CE1-CB 3.97Å; F754-R764 HydrophobicContact CE1-CG 3.44Å; F754-R764 VanDerWaalsContact CE1-CG 3.44Å; F754-R764 HydrophobicContact CE2-CG 4.09Å; F754-R764 HydrophobicContact CG-CG 4.32Å; F754-R764 HydrophobicContact CZ-CG 3.59Å; S760-R764 PolarHBondContact O-N 2.75Å; E761-R764 PolarHBondContact O-N 3Å; E761-R764 IonicContact OE1-CZ 3.76Å; E761-R764 IonicContact OE1-NE 2.7Å; E761-R764 IonicContact OE1-NH2 2.92Å; E761-R764 PolarHBondContact OE1-NH2 3.47Å; E761-R764 IonicContact OE2-CZ 2.65Å; E761-R764 IonicContact OE2-NE 3.55Å; E761-R764 PolarHBondContact OE2-NE 2.94Å; E761-R764 IonicContact OE2-NH2 3.64Å; E761-R764 PolarHBondContact OE2-NH2 2.86Å; K762-R764 VanDerWaalsContact C-N 3.31Å; R764-P1230 PolarHBondContact NE-O 2.62Å; R764-P1230 PolarHBondContact NH2-O 2.88Å
765	R	95.3	Very high	90.3	Very high	52 Å²	52	62.6 Å²	62.6	20%	0.196	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	154.1	177.3	-66.3	-63.1	179.3	-80.4	-5.9	109.5	K752 M753 K762 M782 L783 Y784	K752-R765 WeakPolarHBondContact CA-O 3.49Å; M753-R765 HydrophobicContact CB-CB 4.21Å; M753-R765 PolarHBondContact N-O 2.85Å; M753-R765 PolarHBondContact O-N 2.74Å; M753-R765 HydrophobicContact SD-CB 4.39Å; K762-R765 PolarHBondContact O-NH1 2.85Å; R765-M782 HydrophobicContact CB-CB 4.39Å; R765-M782 HydrophobicContact CB-CE 3.68Å; R765-M782 HydrophobicContact CG-CB 4.41Å; R765-M782 HydrophobicContact CG-CE 4.34Å; R765-L783 VanDerWaalsContact CZ-O 3.27Å; R765-L783 PolarHBondContact NE-O 3.13Å; R765-L783 PolarHBondContact NH2-O 3.42Å; R765-Y784 HydrophobicContact CG-CE1 3.78Å; R765-Y784 HydrophobicContact CG-CE2 4.03Å; R765-Y784 VanDerWaalsContact CG-CZ 3.45Å; R765-Y784 WeakPolarHBondContact CG-OH 3.46Å
766	Q	95.3	Very high	90.3	Very high	33 Å²	33	62.1 Å²	62.1	15%	0.154	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	134.6	-178.3	-168.2	175.2	-50.1	0	0	111.5	Y750 V751 K752 M782 R1232	Y750-Q766 HydrophobicContact CD2-CG 4.02Å; Y750-Q766 HydrophobicContact CE2-CG 4.39Å; V751-Q766 CarbonylContact O-C 3.54Å; V751-Q766 VanDerWaalsContact O-CA 3.24Å; V751-Q766 WeakPolarHBondContact O-CA 3.47Å; V751-Q766 WeakPolarHBondContact O-CG 3.4Å; K752-Q766 HydrophobicContact CG-CG 4.08Å; Q766-M782 VanDerWaalsContact O-CE 3.23Å; Q766-M782 WeakPolarHBondContact O-CE 3.32Å; Q766-R1232 PolarHBondContact O-NH1 3.45Å
767	S	96.1	Very high	90.5	Very high	8 Å²	8	64.8 Å²	64.8	6%	0.056	33%	0.327	C	S	.	.	P	Polyproline II helix	trans	-81.5	171.7	177.2	74.5	0	0	0	0	112.7	V751 W778 Q780	V751-S767 PolarHBondContact N-OG 3.28Å; V751-S767 PolarHBondContact O-N 3.05Å; S767-W778 PolarHBondContact OG-NE1 2.82Å; S767-Q780 VanDerWaalsContact CA-OE1 3.28Å
768	K	93.9	Very high	90.8	Very high	146 Å²	146	64.3 Å²	64.3	64%	0.635	32%	0.321	S	S	*	.	P	Polyproline II helix	trans	-61.5	146.9	163.5	-66.6	174.8	-178.6	175	0	110.4	M770 W778	K768-M770 HydrophobicContact CB-CE 3.66Å; K768-M770 HydrophobicContact CD-CE 4.4Å; K768-W778 VanDerWaalsContact O-CD1 3.23Å; K768-W778 PolarHBondContact O-NE1 2.99Å
769	T	95.1	Very high	91.3	Very high	61 Å²	61	67.6 Å²	67.6	37%	0.374	33%	0.334	S	S	.	.	P	Polyproline II helix	trans	-76.9	122.9	166	-52.3	0	0	0	0	109.4	N748 Y804	N748-T769 HydrophobicContact CB-CG2 4.04Å; N748-T769 WeakPolarHBondContact O-CG2 3.42Å; T769-Y804 HydrophobicContact CG2-CD1 4.48Å; T769-Y804 HydrophobicContact CG2-CG 4.17Å
770	M	93.9	Very high	91.7	Very high	46 Å²	46	63.1 Å²	63.1	23%	0.227	32%	0.319	C	S	.	.	P	Polyproline II helix	trans	-83.7	139.9	164.3	-63.4	-59.9	104.8	0	0	108.2	N748 P749 K768 T773 P776 V777	N748-M770 CarbonylContact C-O 3.26Å; N748-M770 WeakPolarHBondContact CA-O 3.38Å; P749-M770 WeakPolarHBondContact CD-O 3.46Å; P749-M770 HydrophobicContact CG-CB 4.32Å; P749-M770 PolarHBondContact O-N 3.41Å; K768-M770 HydrophobicContact CB-CE 3.66Å; K768-M770 HydrophobicContact CD-CE 4.4Å; M770-T773 HydrophobicContact CB-CG2 3.73Å; M770-P776 HydrophobicContact CB-CB 3.95Å; M770-P776 HydrophobicContact CG-CB 3.79Å; M770-V777 VanDerWaalsContact SD-O 3.35Å
771	A	90.1	Very high	92.2	Very high	75 Å²	75	64.5 Å²	64.5	62%	0.62	33%	0.325	S	S	*	.	P	Polyproline II helix	trans	-92.2	144.8	177.8	0	0	0	0	0	110.8	T773	A771-T773 VanDerWaalsContact C-N 3.31Å; A771-T773 PolarHBondContact O-N 2.88Å; A771-T773 VanDerWaalsContact O-N 3.1Å
772	E	88.5	Confident	92.8	Very high	158 Å²	158	60 Å²	60	74%	0.738	30%	0.304	S	S	*	.	S	Bend	trans	46.9	44.7	164	-60.3	-178.4	-169	0	0	115.3	A746 R747 N748	A746-E772 HydrophobicContact CB-CB 4.34Å; A746-E772 VanDerWaalsContact CB-O 3.27Å; A746-E772 WeakPolarHBondContact CB-O 3.36Å; R747-E772 CarbonylContact O-C 3.57Å; R747-E772 VanDerWaalsContact O-CA 3.26Å; R747-E772 WeakPolarHBondContact O-CA 3.34Å; R747-E772 PolarHBondContact O-N 2.83Å; N748-E772 PolarHBondContact OD1-N 3.19Å
773	T	91.6	Very high	93.2	Very high	35 Å²	35	53.9 Å²	53.9	22%	0.215	28%	0.28	C	S	.	.			trans	-138.5	141.6	177.2	-178.6	0	0	0	0	113.2	R747 P749 M770 A771 H775 P776	R747-T773 PolarHBondContact O-N 3.32Å; P749-T773 VanDerWaalsContact CD-O 3.24Å; P749-T773 WeakPolarHBondContact CD-O 3.43Å; P749-T773 HydrophobicContact CG-CG2 4.08Å; P749-T773 WeakPolarHBondContact CG-O 3.49Å; M770-T773 HydrophobicContact CB-CG2 3.73Å; A771-T773 VanDerWaalsContact C-N 3.31Å; A771-T773 PolarHBondContact O-N 2.88Å; A771-T773 VanDerWaalsContact O-N 3.1Å; T773-H775 VanDerWaalsContact OG1-C 3.23Å; T773-H775 PolarHBondContact OG1-N 2.79Å; T773-H775 PolarHBondContact OG1-O 2.84Å; T773-H775 VanDerWaalsContact OG1-O 3.13Å; T773-P776 HydrophobicContact CG2-CB 3.89Å
774	C	89.5	Confident	93.4	Very high	20 Å²	20	53.9 Å²	53.9	14%	0.135	28%	0.279	C	S	.	.	S	Bend	trans	-96.6	-4.8	167.2	-67	0	0	0	0	113	L738	L738-C774 HydrophobicContact CB-CB 4.44Å; L738-C774 VanDerWaalsContact CB-O 3.32Å; L738-C774 WeakPolarHBondContact CB-O 3.45Å; L738-C774 WeakPolarHBondContact CG-O 3.38Å; L738-C774 PolarHBondContact N-O 2.78Å; L738-C774 VanDerWaalsContact O-CB 3.31Å; L738-C774 WeakPolarHBondContact O-CB 3.43Å; L738-C774 PolarHBondContact O-SG 2.72Å
775	H	90.7	Very high	93.3	Very high	100 Å²	100	61.7 Å²	61.7	46%	0.463	31%	0.308	S	S	.	.	S	Bend	trans	-128.2	70	177.3	-56.2	-100.3	0	0	0	109.1	A735 D737 T773	A735-H775 CarbonylContact O-C 3.57Å; A735-H775 WeakPolarHBondContact O-CA 3.35Å; D737-H775 PolarHBondContact N-CE1 2.66Å; D737-H775 IonicContact OD1-CE1 2.66Å; D737-H775 PolarHBondContact OD1-CE1 2.84Å; T773-H775 VanDerWaalsContact OG1-C 3.23Å; T773-H775 PolarHBondContact OG1-N 2.79Å; T773-H775 PolarHBondContact OG1-O 2.84Å; T773-H775 VanDerWaalsContact OG1-O 3.13Å
776	P	94.2	Very high	93	Very high	1 Å²	1	64.1 Å²	64.1	1%	0.006	33%	0.325	C	S	.	.			trans	-74.3	136.4	-176.1	29.6	-37	0	0	0	113	E734 A735 L738 P749 M770 T773 W778	E734-P776 CarbonylContact C-O 3.58Å; E734-P776 WeakPolarHBondContact CA-O 3.33Å; E734-P776 WeakPolarHBondContact CB-O 3.46Å; A735-P776 HydrophobicContact CB-CG 3.97Å; A735-P776 PolarHBondContact N-O 2.87Å; A735-P776 VanDerWaalsContact O-CD 3.3Å; A735-P776 WeakPolarHBondContact O-CD 3.44Å; L738-P776 HydrophobicContact CD1-CG 3.74Å; P749-P776 HydrophobicContact CB-CB 4.36Å; P749-P776 HydrophobicContact CB-CG 3.96Å; P749-P776 HydrophobicContact CG-CB 3.49Å; P749-P776 VanDerWaalsContact CG-CB 3.49Å; P749-P776 HydrophobicContact CG-CG 3.47Å; P749-P776 VanDerWaalsContact CG-CG 3.47Å; M770-P776 HydrophobicContact CB-CB 3.95Å; M770-P776 HydrophobicContact CG-CB 3.79Å; T773-P776 HydrophobicContact CG2-CB 3.89Å; P776-W778 HydrophobicContact CB-CD2 4.45Å; P776-W778 HydrophobicContact CB-CH2 3.94Å; P776-W778 HydrophobicContact CB-CZ2 3.79Å; P776-W778 HydrophobicContact CB-CZ3 4.32Å; P776-W778 HydrophobicContact CG-CH2 3.34Å; P776-W778 HydrophobicContact CG-CZ2 3.66Å; P776-W778 HydrophobicContact CG-CZ3 3.82Å
777	V	95.3	Very high	92.8	Very high	64 Å²	64	62.7 Å²	62.7	39%	0.388	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	119.6	170.8	-178.1	0	0	0	0	108.1	E734 M770 H779	E734-V777 HydrophobicContact CB-CB 4.47Å; E734-V777 HydrophobicContact CB-CG2 4.07Å; M770-V777 VanDerWaalsContact SD-O 3.35Å; V777-H779 WeakPolarHBondContact CG1-CD2 3.28Å; V777-H779 WeakPolarHBondContact CG1-NE2 3.29Å
778	W	94.6	Very high	92.5	Very high	17 Å²	17	64 Å²	64	6%	0.064	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	-38.2	-178.3	-70	-73.8	0	0	0	113.6	I715 L733 A735 P749 V751 S767 K768 P776 Q780 V801	I715-W778 HydrophobicContact CD1-CZ3 4.15Å; I715-W778 HydrophobicContact CG1-CZ3 4.43Å; L733-W778 PolarHBondContact O-N 2.9Å; A735-W778 HydrophobicContact CB-CH2 4.06Å; A735-W778 HydrophobicContact CB-CZ3 3.8Å; P749-W778 HydrophobicContact CB-CZ2 4.14Å; V751-W778 HydrophobicContact CG2-CD2 4.14Å; V751-W778 HydrophobicContact CG2-CE3 4.09Å; V751-W778 HydrophobicContact CG2-CH2 3.48Å; V751-W778 VanDerWaalsContact CG2-CH2 3.48Å; V751-W778 HydrophobicContact CG2-CZ2 3.53Å; V751-W778 HydrophobicContact CG2-CZ3 3.78Å; S767-W778 PolarHBondContact OG-NE1 2.82Å; K768-W778 VanDerWaalsContact O-CD1 3.23Å; K768-W778 PolarHBondContact O-NE1 2.99Å; P776-W778 HydrophobicContact CB-CD2 4.45Å; P776-W778 HydrophobicContact CB-CH2 3.94Å; P776-W778 HydrophobicContact CB-CZ2 3.79Å; P776-W778 HydrophobicContact CB-CZ3 4.32Å; P776-W778 HydrophobicContact CG-CH2 3.34Å; P776-W778 HydrophobicContact CG-CZ2 3.66Å; P776-W778 HydrophobicContact CG-CZ3 3.82Å; W778-Q780 HydrophobicContact CB-CB 4.21Å; W778-Q780 PolarHBondContact O-N 2.79Å; W778-Q780 VanDerWaalsContact O-N 3.16Å; W778-V801 HydrophobicContact CH2-CG1 4.39Å
779	H	93.4	Very high	92.2	Very high	139 Å²	139	63.7 Å²	63.7	64%	0.644	33%	0.329	S	S	*	.	E	Extended strand (participates in β ladder)	trans	36.5	51.8	-168.4	-65.1	-53.3	0	0	0	113.3	L732 L733 V777	L732-H779 CarbonylContact O-C 3.49Å; L732-H779 WeakPolarHBondContact O-CA 3.34Å; L732-H779 PolarHBondContact O-N 2.64Å; L732-H779 VanDerWaalsContact O-N 3.16Å; L733-H779 PolarHBondContact O-N 3.13Å; L733-H779 VanDerWaalsContact O-N 3.08Å; V777-H779 WeakPolarHBondContact CG1-CD2 3.28Å; V777-H779 WeakPolarHBondContact CG1-NE2 3.29Å
780	Q	93.4	Very high	91.8	Very high	29 Å²	29	67.2 Å²	67.2	14%	0.136	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	111.1	-170.2	-167.3	-175.3	-31.4	0	0	112.3	L732 S767 W778 M782	L732-Q780 PolarHBondContact N-O 3.1Å; L732-Q780 PolarHBondContact O-N 2.91Å; S767-Q780 VanDerWaalsContact CA-OE1 3.28Å; W778-Q780 HydrophobicContact CB-CB 4.21Å; W778-Q780 PolarHBondContact O-N 2.79Å; W778-Q780 VanDerWaalsContact O-N 3.16Å; Q780-M782 HydrophobicContact CG-SD 3.81Å; Q780-M782 PolarHBondContact NE2-SD 3.42Å
781	T	94	Very high	91.5	Very high	72 Å²	72	67 Å²	67	44%	0.442	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	131.8	172.2	-50.1	0	0	0	0	112	M729 V730 N731	M729-T781 HydrophobicContact CB-CG2 4.33Å; M729-T781 HydrophobicContact CE-CG2 3.88Å; V730-T781 CarbonylContact O-C 3.53Å; N731-T781 WeakPolarHBondContact OD1-CB 3.45Å; N731-T781 WeakPolarHBondContact OD1-CG2 3.41Å; N731-T781 PolarHBondContact OD1-OG1 2.84Å
782	M	94.2	Very high	91.5	Very high	4 Å²	4	64 Å²	64	2%	0.02	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	108.4	178.8	-54.1	-51.8	-71.5	0	0	109.5	V730 L732 M753 R765 Q766 Q780	V730-M782 PolarHBondContact N-O 2.83Å; V730-M782 PolarHBondContact O-N 3.12Å; L732-M782 HydrophobicContact CD1-CG 3.93Å; L732-M782 HydrophobicContact CG-CG 4.25Å; M753-M782 HydrophobicContact SD-CB 4.01Å; M753-M782 HydrophobicContact SD-CG 3.82Å; R765-M782 HydrophobicContact CB-CB 4.39Å; R765-M782 HydrophobicContact CB-CE 3.68Å; R765-M782 HydrophobicContact CG-CB 4.41Å; R765-M782 HydrophobicContact CG-CE 4.34Å; Q766-M782 VanDerWaalsContact O-CE 3.23Å; Q766-M782 WeakPolarHBondContact O-CE 3.32Å; Q780-M782 HydrophobicContact CG-SD 3.81Å; Q780-M782 PolarHBondContact NE2-SD 3.42Å
783	L	93.8	Very high	91.4	Very high	51 Å²	51	61.8 Å²	61.8	27%	0.267	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	133.4	-174.7	-179.4	65.6	0	0	0	113.1	Q727 M729 R765 R785	Q727-L783 HydrophobicContact CB-CD1 4.01Å; Q727-L783 HydrophobicContact CG-CD1 3.98Å; M729-L783 HydrophobicContact CG-CD1 3.63Å; R765-L783 VanDerWaalsContact CZ-O 3.27Å; R765-L783 PolarHBondContact NE-O 3.13Å; R765-L783 PolarHBondContact NH2-O 3.42Å; L783-R785 HydrophobicContact CD2-CG 4.07Å; L783-R785 HydrophobicContact CG-CG 4.28Å
784	Y	93.6	Very high	91	Very high	5 Å²	5	63.9 Å²	63.9	2%	0.02	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	131.4	161.8	-65.5	-83.3	0	0	0	109.8	Q727 L728 L755 S763 R765	Q727-Y784 WeakPolarHBondContact CA-O 3.23Å; L728-Y784 PolarHBondContact N-O 3.49Å; L728-Y784 PolarHBondContact O-N 2.87Å; L755-Y784 HydrophobicContact CB-CD1 4.18Å; L755-Y784 HydrophobicContact CB-CE1 3.74Å; L755-Y784 HydrophobicContact CD2-CD1 3.99Å; L755-Y784 HydrophobicContact CD2-CE1 4.41Å; L755-Y784 HydrophobicContact CD2-CG 4.22Å; S763-Y784 VanDerWaalsContact O-CE1 3.24Å; S763-Y784 WeakPolarHBondContact O-CE1 3.36Å; S763-Y784 PolarHBondContact O-OH 3.47Å; S763-Y784 VanDerWaalsContact O-OH 3.1Å; R765-Y784 HydrophobicContact CG-CE1 3.78Å; R765-Y784 HydrophobicContact CG-CE2 4.03Å; R765-Y784 VanDerWaalsContact CG-CZ 3.45Å; R765-Y784 WeakPolarHBondContact CG-OH 3.46Å
785	R	92.2	Very high	91	Very high	179 Å²	179	64.7 Å²	64.7	68%	0.675	31%	0.314	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.3	157.3	173.4	-61.9	-177.3	-179.7	-176.5	-1.1	109.2	Q727 L783	Q727-R785 HydrophobicContact CG-CG 4.21Å; L783-R785 HydrophobicContact CD2-CG 4.07Å; L783-R785 HydrophobicContact CG-CG 4.28Å
786	D	89.5	Confident	91.1	Very high	104 Å²	104	60.1 Å²	60.1	56%	0.556	29%	0.293	S	S	*	.	S	Bend	trans	57.9	48	-178.6	-58.5	-68	0	0	0	113.1	R726	R726-D786 IonicContact CZ-OD1 3.99Å; R726-D786 VanDerWaalsContact CZ-OD1 3.26Å; R726-D786 IonicContact NH1-OD1 3.64Å; R726-D786 PolarHBondContact NH1-OD1 3.33Å; R726-D786 IonicContact NH2-OD1 2.66Å; R726-D786 PolarHBondContact NH2-OD1 2.85Å; R726-D786 PolarHBondContact O-N 3.27Å
787	V	90.5	Very high	91	Very high	2 Å²	2	60 Å²	60	1%	0.012	29%	0.292	C	S	.	.			trans	-106.8	119	167.6	-175.6	0	0	0	0	107.6	Y721 R726 L728 L755 D791 I792	Y721-V787 HydrophobicContact CE2-CG1 4.38Å; Y721-V787 PolarHBondContact OH-O 2.92Å; R726-V787 CarbonylContact C-O 3.55Å; R726-V787 VanDerWaalsContact C-O 3.26Å; R726-V787 VanDerWaalsContact CA-O 3.23Å; R726-V787 WeakPolarHBondContact CA-O 3.41Å; R726-V787 WeakPolarHBondContact CB-O 3.28Å; R726-V787 PolarHBondContact O-N 3.2Å; L728-V787 HydrophobicContact CB-CB 4.32Å; L728-V787 HydrophobicContact CB-CG1 4.38Å; L728-V787 HydrophobicContact CB-CG2 4.17Å; L755-V787 HydrophobicContact CD2-CG2 3.98Å; V787-D791 HydrophobicContact CG1-CB 3.89Å; V787-I792 HydrophobicContact CG1-CD1 3.71Å; V787-I792 HydrophobicContact CG1-CG1 4.35Å
788	S	90.5	Very high	91	Very high	35 Å²	35	57.2 Å²	57.2	25%	0.245	28%	0.275	C	S	.	.			trans	-92.1	170	173.8	67.8	0	0	0	0	112.2	Y721 M790 D791 I792	Y721-S788 VanDerWaalsContact OH-C 3.23Å; S788-M790 PolarHBondContact O-N 2.69Å; S788-D791 WeakPolarHBondContact CB-OD2 3.49Å; S788-D791 PolarHBondContact N-OD2 2.86Å; S788-D791 WeakPolarHBondContact O-CA 3.21Å; S788-D791 WeakPolarHBondContact O-CB 3.11Å; S788-D791 PolarHBondContact O-N 2.81Å; S788-D791 VanDerWaalsContact OG-CG 3.27Å; S788-D791 PolarHBondContact OG-N 3.09Å; S788-D791 PolarHBondContact OG-OD2 2.68Å; S788-I792 PolarHBondContact O-N 3.16Å
789	E	87.2	Confident	91	Very high	141 Å²	141	56.4 Å²	56.4	66%	0.659	27%	0.272	S	S	*	.	H	α-helix	trans	-63.5	-41.8	178.3	-170.6	171.2	-155.7	0	0	111.8	Y721 D791 I792 E793	Y721-E789 PolarHBondContact OH-N 3.22Å; E789-D791 PolarHBondContact O-N 2.79Å; E789-I792 VanDerWaalsContact O-CB 3.3Å; E789-I792 WeakPolarHBondContact O-CB 3.46Å; E789-I792 PolarHBondContact O-N 3.13Å; E789-E793 PolarHBondContact O-N 2.83Å
790	M	86.9	Confident	91	Very high	135 Å²	135	50.4 Å²	50.4	67%	0.665	25%	0.245	S	C	*	.	H	α-helix	trans	-60.5	-25.5	170.3	-175.4	-172.1	66.2	0	0	113	S788 Q794	S788-M790 PolarHBondContact O-N 2.69Å; M790-Q794 WeakPolarHBondContact O-CG 3.44Å
791	D	88.6	Confident	91.1	Very high	40 Å²	40	49 Å²	49	21%	0.214	24%	0.238	C	C	.	.	H	α-helix	trans	-75.1	-29.3	172.9	-70.3	-70.3	0	0	0	112.5	V787 S788 E789 Q794 K795	V787-D791 HydrophobicContact CG1-CB 3.89Å; S788-D791 WeakPolarHBondContact CB-OD2 3.49Å; S788-D791 PolarHBondContact N-OD2 2.86Å; S788-D791 WeakPolarHBondContact O-CA 3.21Å; S788-D791 WeakPolarHBondContact O-CB 3.11Å; S788-D791 PolarHBondContact O-N 2.81Å; S788-D791 VanDerWaalsContact OG-CG 3.27Å; S788-D791 PolarHBondContact OG-N 3.09Å; S788-D791 PolarHBondContact OG-OD2 2.68Å; E789-D791 PolarHBondContact O-N 2.79Å; D791-Q794 PolarHBondContact O-N 3.21Å; D791-K795 HydrophobicContact CB-CD 3.9Å; D791-K795 VanDerWaalsContact CB-NZ 3.32Å; D791-K795 WeakPolarHBondContact O-CB 3.25Å; D791-K795 WeakPolarHBondContact O-CD 3.49Å; D791-K795 WeakPolarHBondContact O-CG 3.5Å; D791-K795 PolarHBondContact O-N 3.49Å; D791-K795 WeakPolarHBondContact OD1-CE 3.41Å; D791-K795 IonicContact OD1-NZ 3.84Å; D791-K795 PolarHBondContact OD1-NZ 2.86Å; D791-K795 IonicContact OD2-NZ 3.26Å
792	I	90.3	Very high	91.2	Very high	13 Å²	13	48.4 Å²	48.4	7%	0.067	23%	0.228	C	C	.	.	H	α-helix	trans	-64.7	-48.2	178.1	-64.7	-58.7	0	0	0	110.2	Y721 L728 V787 S788 E789 Q794 K795 L820 L825	Y721-I792 HydrophobicContact CD1-CG1 4.18Å; Y721-I792 HydrophobicContact CD2-CD1 3.85Å; Y721-I792 HydrophobicContact CD2-CG1 4.16Å; Y721-I792 HydrophobicContact CE1-CG1 4.14Å; Y721-I792 HydrophobicContact CE2-CD1 4.15Å; Y721-I792 HydrophobicContact CE2-CG1 4.13Å; Y721-I792 HydrophobicContact CG-CD1 4.1Å; Y721-I792 HydrophobicContact CG-CG1 4.2Å; L728-I792 HydrophobicContact CD1-CD1 4.11Å; L728-I792 HydrophobicContact CD2-CD1 4.14Å; V787-I792 HydrophobicContact CG1-CD1 3.71Å; V787-I792 HydrophobicContact CG1-CG1 4.35Å; S788-I792 PolarHBondContact O-N 3.16Å; E789-I792 VanDerWaalsContact O-CB 3.3Å; E789-I792 WeakPolarHBondContact O-CB 3.46Å; E789-I792 PolarHBondContact O-N 3.13Å; I792-Q794 PolarHBondContact O-N 3.08Å; I792-Q794 VanDerWaalsContact O-N 3.11Å; I792-K795 PolarHBondContact O-N 2.94Å; I792-L820 HydrophobicContact CD1-CD1 4.31Å; I792-L820 HydrophobicContact CG2-CB 4.07Å; I792-L820 WeakPolarHBondContact CG2-O 3.47Å; I792-L820 WeakPolarHBondContact O-CB 3.37Å; I792-L825 HydrophobicContact CD1-CD1 4.45Å; I792-L825 HydrophobicContact CG1-CD1 4.47Å; I792-L825 HydrophobicContact CG2-CD1 3.4Å
793	E	86.1	Confident	91.2	Very high	112 Å²	112	48.3 Å²	48.3	52%	0.523	23%	0.228	S	C	.	.	H	α-helix	trans	-57.7	-29.1	179.1	-61.5	-175.7	158.6	0	0	114.1	E789	E789-E793 PolarHBondContact O-N 2.83Å
794	Q	83.4	Confident	91.2	Very high	79 Å²	79	50.7 Å²	50.7	37%	0.369	23%	0.234	S	C	.	.	H	α-helix	trans	-109.7	-1.7	-167.1	-58.4	-58.3	-40.8	0	0	114.1	M790 D791 I792	M790-Q794 WeakPolarHBondContact O-CG 3.44Å; D791-Q794 PolarHBondContact O-N 3.21Å; I792-Q794 PolarHBondContact O-N 3.08Å; I792-Q794 VanDerWaalsContact O-N 3.11Å
795	K	88.9	Confident	90.9	Very high	37 Å²	37	52.4 Å²	52.4	16%	0.161	24%	0.243	C	C	.	.			trans	-117.5	153	-174.4	-68.6	178.4	-170.9	172	0	113.4	L755 L756 D791 I792 L820	L755-K795 HydrophobicContact CD1-CB 3.94Å; L755-K795 HydrophobicContact CD1-CD 4.09Å; L755-K795 HydrophobicContact CD2-CD 3.98Å; L755-K795 HydrophobicContact CG-CB 4.5Å; L755-K795 HydrophobicContact CG-CD 3.88Å; L756-K795 VanDerWaalsContact O-CA 3.27Å; L756-K795 WeakPolarHBondContact O-CA 3.49Å; L756-K795 VanDerWaalsContact O-CB 3.24Å; L756-K795 WeakPolarHBondContact O-CB 3.26Å; L756-K795 WeakPolarHBondContact O-CG 3.37Å; D791-K795 HydrophobicContact CB-CD 3.9Å; D791-K795 VanDerWaalsContact CB-NZ 3.32Å; D791-K795 WeakPolarHBondContact O-CB 3.25Å; D791-K795 WeakPolarHBondContact O-CD 3.49Å; D791-K795 WeakPolarHBondContact O-CG 3.5Å; D791-K795 PolarHBondContact O-N 3.49Å; D791-K795 WeakPolarHBondContact OD1-CE 3.41Å; D791-K795 IonicContact OD1-NZ 3.84Å; D791-K795 PolarHBondContact OD1-NZ 2.86Å; D791-K795 IonicContact OD2-NZ 3.26Å; I792-K795 PolarHBondContact O-N 2.94Å; K795-L820 HydrophobicContact CB-CD1 4.14Å; K795-L820 WeakPolarHBondContact O-CB 3.37Å; K795-L820 PolarHBondContact O-N 3.01Å
796	I	92	Very high	90.6	Very high	3 Å²	3	50.2 Å²	50.2	2%	0.015	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	133.1	178.7	-78.8	150.9	0	0	0	108.2	L756 L817 V818 D819 L843 K846 L847	L756-I796 WeakPolarHBondContact CA-O 3.42Å; L756-I796 HydrophobicContact CB-CB 4.5Å; L756-I796 WeakPolarHBondContact CB-O 3.23Å; L756-I796 PolarHBondContact N-O 2.88Å; L756-I796 PolarHBondContact O-N 3.39Å; L756-I796 VanDerWaalsContact O-N 3.11Å; I796-L817 HydrophobicContact CG2-CB 4.29Å; I796-V818 CarbonylContact C-O 3.5Å; I796-V818 VanDerWaalsContact CA-O 3.23Å; I796-V818 WeakPolarHBondContact CA-O 3.39Å; I796-D819 HydrophobicContact CG1-CB 4.19Å; I796-D819 WeakPolarHBondContact CG1-OD1 3.47Å; I796-L843 HydrophobicContact CD1-CB 4.14Å; I796-L843 HydrophobicContact CD1-CD2 4.26Å; I796-K846 HydrophobicContact CD1-CD 4.24Å; I796-L847 HydrophobicContact CB-CD1 4.24Å; I796-L847 HydrophobicContact CB-CD2 4.42Å; I796-L847 HydrophobicContact CD1-CD1 3.82Å; I796-L847 HydrophobicContact CD1-CD2 3.97Å; I796-L847 HydrophobicContact CD1-CG 3.59Å; I796-L847 HydrophobicContact CG2-CD1 4.15Å
797	I	93.7	Very high	90.1	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	118.3	169.4	-49.7	-169	0	0	0	108.7	L728 V730 M753 F754 L755 I799 V818 L820	L728-I797 HydrophobicContact CD2-CD1 4.13Å; V730-I797 HydrophobicContact CG2-CD1 3.62Å; M753-I797 HydrophobicContact CB-CG2 4.47Å; M753-I797 HydrophobicContact CE-CG2 3.88Å; F754-I797 WeakPolarHBondContact O-CA 3.27Å; L755-I797 HydrophobicContact CD1-CG1 3.95Å; I797-I799 HydrophobicContact CB-CG1 4.48Å; I797-I799 HydrophobicContact CG2-CD1 4Å; I797-I799 HydrophobicContact CG2-CG1 3.6Å; I797-V818 HydrophobicContact CB-CB 4.42Å; I797-V818 PolarHBondContact N-O 3.48Å; I797-V818 PolarHBondContact O-N 2.64Å; I797-L820 HydrophobicContact CD1-CD1 4.33Å; I797-L820 HydrophobicContact CD1-CD2 3.93Å; I797-L820 HydrophobicContact CD1-CG 4.5Å; I797-L820 HydrophobicContact CG1-CD1 3.91Å; I797-L820 HydrophobicContact CG1-CD2 3.97Å; I797-L820 HydrophobicContact CG1-CG 4.05Å
798	E	94.2	Very high	89.6	Confident	5 Å²	5	55.3 Å²	55.3	2%	0.023	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	116.8	169.5	172.3	173.2	-113.1	0	0	108.9	M753 F754 L756 R759 T800 L817 R844	M753-E798 CarbonylContact C-O 3.47Å; M753-E798 WeakPolarHBondContact CA-O 3.48Å; F754-E798 HydrophobicContact CB-CB 4.43Å; F754-E798 PolarHBondContact N-O 3Å; F754-E798 PolarHBondContact O-N 3.46Å; L756-E798 HydrophobicContact CD1-CB 3.6Å; L756-E798 HydrophobicContact CD1-CG 4.32Å; L756-E798 HydrophobicContact CD2-CB 4.44Å; L756-E798 HydrophobicContact CG-CB 3.85Å; R759-E798 IonicContact CZ-OE1 3.59Å; R759-E798 IonicContact CZ-OE2 3.61Å; R759-E798 VanDerWaalsContact CZ-OE2 3.26Å; R759-E798 IonicContact NE-OE2 2.76Å; R759-E798 PolarHBondContact NE-OE2 3.03Å; R759-E798 VanDerWaalsContact NE-OE2 3.14Å; R759-E798 IonicContact NH2-OE1 2.81Å; R759-E798 PolarHBondContact NH2-OE1 3.29Å; R759-E798 IonicContact NH2-OE2 2.69Å; R759-E798 PolarHBondContact NH2-OE2 3.37Å; E798-T800 HydrophobicContact CG-CG2 4.21Å; E798-L817 HydrophobicContact CB-CD2 3.63Å; E798-L817 HydrophobicContact CG-CD2 3.66Å; E798-R844 IonicContact OE1-CZ 2.68Å; E798-R844 IonicContact OE1-NE 3.88Å; E798-R844 IonicContact OE1-NH2 2.64Å; E798-R844 PolarHBondContact OE1-NH2 2.96Å
799	I	94.9	Very high	89.2	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	128.7	-176.4	-55.8	179.7	0	0	0	107.4	I715 I717 V751 M753 I797 E815 V816 V818	I715-I799 HydrophobicContact CD1-CG2 4.34Å; I717-I799 HydrophobicContact CD1-CD1 3.52Å; I717-I799 HydrophobicContact CD1-CG2 4.49Å; V751-I799 HydrophobicContact CG1-CG2 3.55Å; M753-I799 HydrophobicContact CE-CD1 4.11Å; M753-I799 HydrophobicContact CE-CG1 4.2Å; M753-I799 HydrophobicContact CG-CG1 4.21Å; M753-I799 HydrophobicContact CG-CG2 4.31Å; I797-I799 HydrophobicContact CB-CG1 4.48Å; I797-I799 HydrophobicContact CG2-CD1 4Å; I797-I799 HydrophobicContact CG2-CG1 3.6Å; I799-E815 CarbonylContact O-C 3.58Å; I799-E815 VanDerWaalsContact O-CA 3.23Å; I799-E815 WeakPolarHBondContact O-CA 3.5Å; I799-V816 HydrophobicContact CB-CB 4.41Å; I799-V816 PolarHBondContact N-O 2.89Å; I799-V816 PolarHBondContact O-N 3.07Å; I799-V818 HydrophobicContact CD1-CG2 4.14Å
800	T	94.3	Very high	89.4	Confident	12 Å²	12	51.1 Å²	51.1	7%	0.074	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	129	-175.2	60.2	0	0	0	0	110.6	V751 K752 E798 W802 F812 G814 E815	V751-T800 CarbonylContact C-O 3.14Å; V751-T800 WeakPolarHBondContact CA-O 3.41Å; K752-T800 PolarHBondContact N-O 3.1Å; K752-T800 PolarHBondContact O-N 2.98Å; K752-T800 PolarHBondContact O-OG1 2.9Å; E798-T800 HydrophobicContact CG-CG2 4.21Å; T800-W802 PolarHBondContact OG1-NE1 3Å; T800-F812 HydrophobicContact CG2-CE2 4.41Å; T800-G814 CarbonylContact C-O 3.46Å; T800-G814 WeakPolarHBondContact CA-O 3.25Å; T800-E815 HydrophobicContact CG2-CB 3.9Å
801	V	95.3	Very high	89.5	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	136	-179.8	-172.5	0	0	0	0	109	I715 L738 P749 V751 W778 L813 G814 L834	I715-V801 HydrophobicContact CD1-CG2 3.96Å; L738-V801 HydrophobicContact CD1-CG1 4.26Å; L738-V801 HydrophobicContact CD2-CG1 4.48Å; P749-V801 HydrophobicContact CB-CG1 4.38Å; V751-V801 HydrophobicContact CG2-CG2 4.39Å; W778-V801 HydrophobicContact CH2-CG1 4.39Å; V801-L813 HydrophobicContact CB-CB 4.34Å; V801-L813 HydrophobicContact CG1-CB 4.19Å; V801-L813 HydrophobicContact CG1-CD1 4.19Å; V801-L813 PolarHBondContact O-N 3.29Å; V801-G814 PolarHBondContact N-O 3.08Å; V801-G814 PolarHBondContact O-N 3.44Å; V801-L834 HydrophobicContact CB-CD2 4.26Å; V801-L834 HydrophobicContact CG2-CD1 4.03Å; V801-L834 HydrophobicContact CG2-CD2 3.59Å; V801-L834 HydrophobicContact CG2-CG 4.49Å
802	W	94.7	Very high	89.6	Confident	60 Å²	60	46.2 Å²	46.2	23%	0.227	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	140.9	-172.9	-63.2	80.9	0	0	0	110.4	P749 Y750 T800 N810 D811 F812	P749-W802 CarbonylContact C-O 3.53Å; P749-W802 VanDerWaalsContact CA-O 3.27Å; P749-W802 WeakPolarHBondContact CA-O 3.36Å; Y750-W802 HydrophobicContact CD1-CB 3.9Å; Y750-W802 WeakPolarHBondContact CD1-O 3.49Å; Y750-W802 HydrophobicContact CE1-CB 3.28Å; Y750-W802 HydrophobicContact CE1-CG 4.3Å; Y750-W802 WeakPolarHBondContact CE1-O 3.17Å; Y750-W802 HydrophobicContact CE2-CB 4.39Å; Y750-W802 PolarHBondContact N-O 2.64Å; Y750-W802 PolarHBondContact O-N 3.06Å; T800-W802 PolarHBondContact OG1-NE1 3Å; W802-N810 HydrophobicContact CE3-CB 4.45Å; W802-D811 CarbonylContact C-O 3.47Å; W802-D811 VanDerWaalsContact CA-O 3.26Å; W802-D811 WeakPolarHBondContact CA-O 3.37Å; W802-F812 HydrophobicContact CD2-CD2 4.34Å; W802-F812 HydrophobicContact CE3-CB 4.05Å; W802-F812 HydrophobicContact CH2-CB 4.22Å; W802-F812 HydrophobicContact CH2-CD2 4.09Å; W802-F812 AromaticContact CZ2-CD2 3.89Å; W802-F812 HydrophobicContact CZ2-CD2 3.89Å; W802-F812 HydrophobicContact CZ3-CB 3.84Å; W802-F812 HydrophobicContact CZ3-CD2 4.41Å
803	D	94.1	Very high	89.6	Confident	2 Å²	2	45.7 Å²	45.7	1%	0.011	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	131.8	165	-175	12.6	0	0	0	109.4	R741 R747 N748 N810 D811 L813	R741-D803 IonicContact CZ-OD1 3.73Å; R741-D803 IonicContact CZ-OD2 3.62Å; R741-D803 IonicContact NE-OD1 3.49Å; R741-D803 IonicContact NE-OD2 3.48Å; R741-D803 PolarHBondContact NE-OD2 2.89Å; R741-D803 IonicContact NH2-OD1 3.23Å; R741-D803 PolarHBondContact NH2-OD1 3.03Å; R741-D803 IonicContact NH2-OD2 2.66Å; R741-D803 PolarHBondContact NH2-OD2 3.34Å; R747-D803 WeakPolarHBondContact CD-OD2 3.29Å; R747-D803 IonicContact CZ-OD2 3.52Å; R747-D803 IonicContact NE-OD2 3.14Å; R747-D803 IonicContact NH1-OD2 2.83Å; R747-D803 PolarHBondContact NH1-OD2 3.23Å; N748-D803 PolarHBondContact N-OD1 2.67Å; D803-N810 CarbonylContact O-C 3.59Å; D803-N810 WeakPolarHBondContact O-CA 3.42Å; D803-N810 WeakPolarHBondContact O-CB 3.37Å; D803-D811 HydrophobicContact CB-CB 3.73Å; D803-D811 PolarHBondContact N-O 3.01Å; D803-D811 PolarHBondContact O-N 3.18Å; D803-D811 VanDerWaalsContact O-N 3.07Å; D803-L813 HydrophobicContact CB-CD1 4.09Å; D803-L813 HydrophobicContact CB-CD2 4.26Å; D803-L813 HydrophobicContact CB-CG 4.14Å
804	Y	93.8	Very high	89.8	Confident	101 Å²	101	40.4 Å²	40.4	40%	0.396	20%	0.197	S	C	.	.			trans	-89.3	114.1	173.1	179.4	-93.7	0	0	0	110.9	R741 N748 T769 Q806	R741-Y804 PolarHBondContact NH2-O 2.71Å; N748-Y804 VanDerWaalsContact CB-O 3.31Å; N748-Y804 WeakPolarHBondContact CB-O 3.43Å; N748-Y804 PolarHBondContact ND2-O 2.71Å; N748-Y804 WeakPolarHBondContact O-CB 3.36Å; N748-Y804 PolarHBondContact O-N 3.4Å; T769-Y804 HydrophobicContact CG2-CD1 4.48Å; T769-Y804 HydrophobicContact CG2-CG 4.17Å; Y804-Q806 HydrophobicContact CE1-CB 4.11Å
805	D	88	Confident	90.2	Very high	41 Å²	41	36.7 Å²	36.7	22%	0.219	18%	0.179	C	C	.	.			trans	-118.1	118.3	175.4	-173.1	-28.6	0	0	0	109.3	Y807 S808 N810	D805-Y807 VanDerWaalsContact C-N 3.33Å; D805-Y807 PolarHBondContact OD1-N 2.71Å; D805-S808 PolarHBondContact OD1-N 2.74Å; D805-S808 WeakPolarHBondContact OD2-CB 3.24Å; D805-S808 PolarHBondContact OD2-OG 3.32Å; D805-N810 PolarHBondContact N-OD1 3.08Å; D805-N810 VanDerWaalsContact N-OD1 3.1Å; D805-N810 PolarHBondContact O-OD1 3.32Å
806	Q	85.2	Confident	90.4	Very high	133 Å²	133	35.3 Å²	35.3	62%	0.621	17%	0.174	S	C	*	.	S	Bend	trans	-72.4	-20.6	-178.5	64.3	-172.4	-3.2	0	0	114.1	Y804	Y804-Q806 HydrophobicContact CE1-CB 4.11Å
807	Y	79.5	Confident	90.4	Very high	127 Å²	127	36.3 Å²	36.3	50%	0.498	18%	0.179	S	C	.	.	S	Bend	trans	-117	-26.7	-174.5	-60	-42.8	0	0	0	114.1	D805 Q1435	D805-Y807 VanDerWaalsContact C-N 3.33Å; D805-Y807 PolarHBondContact OD1-N 2.71Å; Y807-Q1435 VanDerWaalsContact CD1-NE2 3.33Å
808	S	80.1	Confident	90.3	Very high	85 Å²	85	36.5 Å²	36.5	59%	0.594	18%	0.18	S	C	*	.	S	Bend	trans	-99.1	-121.6	174.3	91.6	0	0	0	0	111.8	D805	D805-S808 PolarHBondContact OD1-N 2.74Å; D805-S808 WeakPolarHBondContact OD2-CB 3.24Å; D805-S808 PolarHBondContact OD2-OG 3.32Å
809	S	82.5	Confident	90.1	Very high	44 Å²	44	37.1 Å²	37.1	31%	0.308	18%	0.184	S	C	.	.			trans	-149.5	124.9	169.8	68.8	0	0	0	0	110.8	D811 R1227	S809-D811 PolarHBondContact O-N 2.95Å; S809-R1227 PolarHBondContact OG-NH1 2.78Å; S809-R1227 PolarHBondContact OG-NH2 3.48Å
810	N	90.9	Very high	90	Very high	44 Å²	44	37.2 Å²	37.2	24%	0.235	18%	0.184	C	C	.	.			trans	-31.6	114.8	-173.7	-61.9	7	0	0	0	113.6	Y750 W802 D803 D805	Y750-N810 HydrophobicContact CE1-CB 4.3Å; Y750-N810 PolarHBondContact OH-ND2 3.17Å; W802-N810 HydrophobicContact CE3-CB 4.45Å; D803-N810 CarbonylContact O-C 3.59Å; D803-N810 WeakPolarHBondContact O-CA 3.42Å; D803-N810 WeakPolarHBondContact O-CB 3.37Å; D805-N810 PolarHBondContact N-OD1 3.08Å; D805-N810 VanDerWaalsContact N-OD1 3.1Å; D805-N810 PolarHBondContact O-OD1 3.32Å
811	D	89	Confident	89.7	Confident	46 Å²	46	39.1 Å²	39.1	25%	0.246	20%	0.198	C	C	.	.			trans	-77	133.3	-172.3	-139.5	2.4	0	0	0	109.1	R706 R747 W802 D803 S809 L813	R706-D811 IonicContact CZ-OD1 2.8Å; R706-D811 IonicContact NH1-OD1 2.88Å; R706-D811 IonicContact NH2-OD1 2.95Å; R706-D811 PolarHBondContact NH2-OD1 2.98Å; R706-D811 IonicContact NH2-OD2 2.84Å; R747-D811 IonicContact CZ-OD2 2.72Å; R747-D811 IonicContact NH1-OD2 2.84Å; R747-D811 PolarHBondContact NH1-OD2 2.8Å; R747-D811 IonicContact NH2-OD2 3.63Å; W802-D811 CarbonylContact C-O 3.47Å; W802-D811 VanDerWaalsContact CA-O 3.26Å; W802-D811 WeakPolarHBondContact CA-O 3.37Å; D803-D811 HydrophobicContact CB-CB 3.73Å; D803-D811 PolarHBondContact N-O 3.01Å; D803-D811 PolarHBondContact O-N 3.18Å; D803-D811 VanDerWaalsContact O-N 3.07Å; S809-D811 PolarHBondContact O-N 2.95Å; D811-L813 PolarHBondContact O-N 3.24Å
812	F	91.2	Very high	89.1	Confident	27 Å²	27	45 Å²	45	12%	0.118	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	120.8	175.4	174	-102.6	0	0	0	108.8	T800 W802 G814 E815 M837	T800-F812 HydrophobicContact CG2-CE2 4.41Å; W802-F812 HydrophobicContact CD2-CD2 4.34Å; W802-F812 HydrophobicContact CE3-CB 4.05Å; W802-F812 HydrophobicContact CH2-CB 4.22Å; W802-F812 HydrophobicContact CH2-CD2 4.09Å; W802-F812 AromaticContact CZ2-CD2 3.89Å; W802-F812 HydrophobicContact CZ2-CD2 3.89Å; W802-F812 HydrophobicContact CZ3-CB 3.84Å; W802-F812 HydrophobicContact CZ3-CD2 4.41Å; F812-G814 VanDerWaalsContact CE2-O 3.32Å; F812-G814 WeakPolarHBondContact CE2-O 3.41Å; F812-G814 VanDerWaalsContact CZ-CA 3.48Å; F812-E815 HydrophobicContact CE2-CB 4.19Å; F812-E815 HydrophobicContact CZ-CB 3.89Å; F812-E815 HydrophobicContact CZ-CG 4.09Å; F812-M837 HydrophobicContact CE1-CB 3.95Å; F812-M837 HydrophobicContact CZ-CB 3.86Å
813	L	89.7	Confident	88.8	Confident	2 Å²	2	44.2 Å²	44.2	1%	0.01	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	-35.4	178.9	-63.9	178.1	0	0	0	111.7	F712 L738 P739 R747 P749 V801 D803 D811	F712-L813 WeakPolarHBondContact CB-O 3.31Å; F712-L813 WeakPolarHBondContact CD2-O 3.27Å; F712-L813 WeakPolarHBondContact CG-O 3.38Å; L738-L813 HydrophobicContact CD1-CD1 4.25Å; P739-L813 HydrophobicContact CG-CD2 4.13Å; R747-L813 HydrophobicContact CB-CD1 4.3Å; R747-L813 HydrophobicContact CG-CD1 4.22Å; R747-L813 HydrophobicContact CG-CD2 4.26Å; P749-L813 HydrophobicContact CB-CD1 4.21Å; V801-L813 HydrophobicContact CB-CB 4.34Å; V801-L813 HydrophobicContact CG1-CB 4.19Å; V801-L813 HydrophobicContact CG1-CD1 4.19Å; V801-L813 PolarHBondContact O-N 3.29Å; D803-L813 HydrophobicContact CB-CD1 4.09Å; D803-L813 HydrophobicContact CB-CD2 4.26Å; D803-L813 HydrophobicContact CB-CG 4.14Å; D811-L813 PolarHBondContact O-N 3.24Å
814	G	90.2	Very high	88.4	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	168.9	176.3	174	0	0	0	0	0	114	T800 V801 F812 I835	T800-G814 CarbonylContact C-O 3.46Å; T800-G814 WeakPolarHBondContact CA-O 3.25Å; V801-G814 PolarHBondContact N-O 3.08Å; V801-G814 PolarHBondContact O-N 3.44Å; F812-G814 VanDerWaalsContact CE2-O 3.32Å; F812-G814 WeakPolarHBondContact CE2-O 3.41Å; F812-G814 VanDerWaalsContact CZ-CA 3.48Å; G814-I835 CarbonylContact C-O 3.53Å; G814-I835 WeakPolarHBondContact CA-O 3.28Å
815	E	92.9	Very high	88.2	Confident	1 Å²	1	47.2 Å²	47.2	1%	0.005	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	160.5	176.8	67.9	177.8	-149.6	0	0	113.8	I799 T800 F812 I835 M837 R844	I799-E815 CarbonylContact O-C 3.58Å; I799-E815 VanDerWaalsContact O-CA 3.23Å; I799-E815 WeakPolarHBondContact O-CA 3.5Å; T800-E815 HydrophobicContact CG2-CB 3.9Å; F812-E815 HydrophobicContact CE2-CB 4.19Å; F812-E815 HydrophobicContact CZ-CB 3.89Å; F812-E815 HydrophobicContact CZ-CG 4.09Å; E815-I835 HydrophobicContact CG-CG1 3.87Å; E815-I835 PolarHBondContact N-O 2.96Å; E815-I835 WeakPolarHBondContact O-CG1 3.11Å; E815-I835 PolarHBondContact O-N 2.89Å; E815-M837 WeakPolarHBondContact OE2-CG 3.16Å; E815-R844 VanDerWaalsContact CD-NH1 3.34Å; E815-R844 VanDerWaalsContact CD-NH2 3.32Å; E815-R844 IonicContact OE1-CZ 3.24Å; E815-R844 IonicContact OE1-NH1 3.5Å; E815-R844 PolarHBondContact OE1-NH1 3.06Å; E815-R844 IonicContact OE1-NH2 3.61Å; E815-R844 PolarHBondContact OE1-NH2 3.26Å; E815-R844 IonicContact OE2-CZ 3.84Å; E815-R844 IonicContact OE2-NH1 2.76Å; E815-R844 PolarHBondContact OE2-NH1 2.75Å; E815-R844 IonicContact OE2-NH2 2.85Å; E815-R844 PolarHBondContact OE2-NH2 2.89Å
816	V	91.4	Very high	88.2	Confident	9 Å²	9	49.9 Å²	49.9	6%	0.055	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	141.8	168.2	175.6	0	0	0	0	107.6	I715 I799 V818 Y832 L834	I715-V816 HydrophobicContact CG2-CG2 3.85Å; I799-V816 HydrophobicContact CB-CB 4.41Å; I799-V816 PolarHBondContact N-O 2.89Å; I799-V816 PolarHBondContact O-N 3.07Å; V816-V818 HydrophobicContact CG1-CG2 3.69Å; V816-Y832 HydrophobicContact CG1-CD1 3.75Å; V816-Y832 HydrophobicContact CG1-CG 3.85Å; V816-L834 HydrophobicContact CG2-CD2 3.96Å; V816-L834 HydrophobicContact CG2-CG 4.43Å
817	L	91.8	Very high	88.4	Confident	24 Å²	24	44.6 Å²	44.6	13%	0.126	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	117.6	170.6	-61.4	177.1	0	0	0	107.9	I796 E798 T841 L843 R844	I796-L817 HydrophobicContact CG2-CB 4.29Å; E798-L817 HydrophobicContact CB-CD2 3.63Å; E798-L817 HydrophobicContact CG-CD2 3.66Å; L817-T841 HydrophobicContact CD1-CG2 4.33Å; L817-L843 HydrophobicContact CB-CB 4.34Å; L817-L843 HydrophobicContact CB-CD1 3.75Å; L817-L843 HydrophobicContact CD1-CB 4.18Å; L817-L843 VanDerWaalsContact O-CD1 3.29Å; L817-L843 WeakPolarHBondContact O-CD1 3.47Å; L817-R844 HydrophobicContact CD1-CG 3.79Å
818	V	92	Very high	88.9	Confident	3 Å²	3	41.7 Å²	41.7	2%	0.018	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	118.5	-176.7	-167.7	0	0	0	0	109	I719 I796 I797 I799 V816 V823 Y832	I719-V818 HydrophobicContact CD1-CG1 3.9Å; I796-V818 CarbonylContact C-O 3.5Å; I796-V818 VanDerWaalsContact CA-O 3.23Å; I796-V818 WeakPolarHBondContact CA-O 3.39Å; I797-V818 HydrophobicContact CB-CB 4.42Å; I797-V818 PolarHBondContact N-O 3.48Å; I797-V818 PolarHBondContact O-N 2.64Å; I799-V818 HydrophobicContact CD1-CG2 4.14Å; V816-V818 HydrophobicContact CG1-CG2 3.69Å; V818-V823 HydrophobicContact CG1-CB 4.31Å; V818-V823 HydrophobicContact CG1-CG1 4.29Å; V818-V823 HydrophobicContact CG1-CG2 3.72Å; V818-Y832 HydrophobicContact CG1-CE1 4.15Å; V818-Y832 HydrophobicContact CG2-CD1 4.32Å; V818-Y832 HydrophobicContact CG2-CE1 4.05Å
819	D	91.3	Very high	89.4	Confident	18 Å²	18	41.1 Å²	41.1	10%	0.096	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	111.4	179.7	-153.5	7.6	0	0	0	109.1	I796 S821 N822 L843 K846	I796-D819 HydrophobicContact CG1-CB 4.19Å; I796-D819 WeakPolarHBondContact CG1-OD1 3.47Å; D819-S821 PolarHBondContact O-N 3.15Å; D819-N822 HydrophobicContact CB-CB 4.46Å; D819-N822 PolarHBondContact O-N 2.75Å; D819-L843 HydrophobicContact CB-CD1 4.18Å; D819-L843 HydrophobicContact CB-CD2 3.76Å; D819-L843 WeakPolarHBondContact OD2-CD2 3.28Å; D819-K846 IonicContact OD1-NZ 2.71Å; D819-K846 PolarHBondContact OD1-NZ 3.21Å; D819-K846 IonicContact OD2-NZ 3.17Å; D819-K846 PolarHBondContact OD2-NZ 2.76Å
820	L	92	Very high	89.8	Confident	2 Å²	2	40.6 Å²	40.6	1%	0.01	23%	0.233	C	C	.	.	G	3₁₀ helix	trans	-70.9	-15.1	-168.2	-71	172.8	0	0	0	113.5	I719 L728 L755 I792 K795 I797 N822 L825	I719-L820 HydrophobicContact CD1-CD2 4.41Å; I719-L820 HydrophobicContact CG2-CD2 4.35Å; L728-L820 HydrophobicContact CD2-CD1 3.69Å; L728-L820 HydrophobicContact CD2-CD2 4.32Å; L755-L820 HydrophobicContact CD1-CD1 3.75Å; I792-L820 HydrophobicContact CD1-CD1 4.31Å; I792-L820 HydrophobicContact CG2-CB 4.07Å; I792-L820 WeakPolarHBondContact CG2-O 3.47Å; I792-L820 WeakPolarHBondContact O-CB 3.37Å; K795-L820 HydrophobicContact CB-CD1 4.14Å; K795-L820 WeakPolarHBondContact O-CB 3.37Å; K795-L820 PolarHBondContact O-N 3.01Å; I797-L820 HydrophobicContact CD1-CD1 4.33Å; I797-L820 HydrophobicContact CD1-CD2 3.93Å; I797-L820 HydrophobicContact CD1-CG 4.5Å; I797-L820 HydrophobicContact CG1-CD1 3.91Å; I797-L820 HydrophobicContact CG1-CD2 3.97Å; I797-L820 HydrophobicContact CG1-CG 4.05Å; L820-N822 VanDerWaalsContact C-N 3.27Å; L820-N822 PolarHBondContact O-N 3.04Å; L820-L825 HydrophobicContact CD2-CD2 4.03Å
821	S	88.1	Confident	89.8	Confident	53 Å²	53	44.2 Å²	44.2	37%	0.371	24%	0.243	S	C	.	.	G	3₁₀ helix	trans	-74.2	-12	170.6	58.1	0	0	0	0	114.4	D819 K846	D819-S821 PolarHBondContact O-N 3.15Å; S821-K846 PolarHBondContact OG-NZ 3.21Å
822	N	83.5	Confident	90	Very high	123 Å²	123	44 Å²	44	66%	0.658	24%	0.239	S	C	*	.	G	3₁₀ helix	trans	-129.6	18	-165.7	-68.1	42.1	0	0	0	113.2	D819 L820	D819-N822 HydrophobicContact CB-CB 4.46Å; D819-N822 PolarHBondContact O-N 2.75Å; L820-N822 VanDerWaalsContact C-N 3.27Å; L820-N822 PolarHBondContact O-N 3.04Å
823	V	87.1	Confident	89.9	Confident	43 Å²	43	45.6 Å²	45.6	26%	0.261	25%	0.251	S	S	.	.	S	Bend	trans	-136	146.6	-174	170.2	0	0	0	0	109.6	I719 V818 L825 Y832	I719-V823 HydrophobicContact CD1-CG1 4.36Å; V818-V823 HydrophobicContact CG1-CB 4.31Å; V818-V823 HydrophobicContact CG1-CG1 4.29Å; V818-V823 HydrophobicContact CG1-CG2 3.72Å; V823-L825 WeakPolarHBondContact O-CG 3.35Å; V823-L825 PolarHBondContact O-N 3.49Å; V823-Y832 WeakPolarHBondContact CG1-OH 3.3Å
824	E	86.2	Confident	89.9	Confident	128 Å²	128	45.5 Å²	45.5	60%	0.598	25%	0.251	S	S	*	.			trans	-64.7	125.2	176	-67.1	155.5	174.5	0	0	109.8
825	L	88.9	Confident	89.7	Confident	39 Å²	39	48.3 Å²	48.3	20%	0.204	27%	0.265	C	S	.	.			trans	-110.8	23.2	-175.5	-52.9	177.4	0	0	0	112	I719 L720 Y721 I792 L820 V823	I719-L825 HydrophobicContact CB-CD2 4.44Å; I719-L825 HydrophobicContact CG2-CD2 3.62Å; I719-L825 CarbonylContact O-C 3.59Å; I719-L825 VanDerWaalsContact O-C 3.28Å; I719-L825 WeakPolarHBondContact O-CA 3.23Å; L720-L825 CarbonylContact C-O 3.58Å; L720-L825 WeakPolarHBondContact CA-O 3.21Å; Y721-L825 PolarHBondContact N-O 2.82Å; I792-L825 HydrophobicContact CD1-CD1 4.45Å; I792-L825 HydrophobicContact CG1-CD1 4.47Å; I792-L825 HydrophobicContact CG2-CD1 3.4Å; L820-L825 HydrophobicContact CD2-CD2 4.03Å; V823-L825 WeakPolarHBondContact O-CG 3.35Å; V823-L825 PolarHBondContact O-N 3.49Å
826	D	89.1	Confident	89	Confident	96 Å²	96	49.8 Å²	49.8	51%	0.513	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	-7.1	-176.9	65	-21.4	0	0	0	113.3	T828	D826-T828 VanDerWaalsContact CG-OG1 3.27Å; D826-T828 WeakPolarHBondContact OD1-CB 3.47Å; D826-T828 PolarHBondContact OD1-N 2.92Å; D826-T828 PolarHBondContact OD1-OG1 3.22Å; D826-T828 WeakPolarHBondContact OD2-CB 3.22Å; D826-T828 PolarHBondContact OD2-OG1 2.84Å
827	G	88.4	Confident	88.2	Confident	23 Å²	23	55 Å²	55	24%	0.237	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	96.4	0.7	-172.4	0	0	0	0	0	114.8	S718 I719	S718-G827 WeakPolarHBondContact CB-O 2.89Å; S718-G827 PolarHBondContact OG-O 3.44Å; I719-G827 VanDerWaalsContact O-CA 3.3Å; I719-G827 WeakPolarHBondContact O-CA 3.46Å; I719-G827 PolarHBondContact O-N 3.48Å
828	T	89.6	Confident	87	Confident	66 Å²	66	55.8 Å²	55.8	41%	0.405	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59	144.1	175.8	-73.6	0	0	0	0	111.4	S718 D826	S718-T828 WeakPolarHBondContact CA-O 3.07Å; S718-T828 WeakPolarHBondContact CB-O 3.33Å; D826-T828 VanDerWaalsContact CG-OG1 3.27Å; D826-T828 WeakPolarHBondContact OD1-CB 3.47Å; D826-T828 PolarHBondContact OD1-N 2.92Å; D826-T828 PolarHBondContact OD1-OG1 3.22Å; D826-T828 WeakPolarHBondContact OD2-CB 3.22Å; D826-T828 PolarHBondContact OD2-OG1 2.84Å
829	T	91	Very high	85.5	Confident	73 Å²	73	60.6 Å²	60.6	45%	0.448	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	121.8	-173.3	-66.1	0	0	0	0	111	S716 S718 L733	S716-T829 VanDerWaalsContact OG-CG2 3.29Å; S716-T829 WeakPolarHBondContact OG-CG2 3.11Å; S718-T829 WeakPolarHBondContact CB-OG1 3.23Å; L733-T829 HydrophobicContact CD1-CG2 3.47Å; L733-T829 VanDerWaalsContact CD1-CG2 3.47Å
830	A	90.6	Very high	83.8	Confident	33 Å²	33	65.8 Å²	65.8	27%	0.273	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	143.6	-178.8	0	0	0	0	0	112.3	I717 Y832	I717-A830 PolarHBondContact N-O 2.9Å; I717-A830 PolarHBondContact O-N 2.85Å; A830-Y832 HydrophobicContact CB-CD2 4.44Å; A830-Y832 HydrophobicContact CB-CE2 3.68Å; A830-Y832 WeakPolarHBondContact O-CD2 3.34Å
831	W	92.4	Very high	82.8	Confident	119 Å²	119	67.7 Å²	67.7	45%	0.451	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	120	175.3	-79.2	100.1	0	0	0	111.3	Q714 E734 V736	Q714-W831 HydrophobicContact CB-CE3 3.87Å; Q714-W831 HydrophobicContact CB-CZ3 4.25Å; E734-W831 HydrophobicContact CG-CH2 3.84Å; E734-W831 HydrophobicContact CG-CZ2 4.4Å; E734-W831 VanDerWaalsContact OE1-CH2 3.29Å; E734-W831 WeakPolarHBondContact OE1-CH2 3.03Å; E734-W831 WeakPolarHBondContact OE1-CZ2 3.36Å; V736-W831 HydrophobicContact CG1-CH2 3.91Å; V736-W831 HydrophobicContact CG1-CZ3 4.32Å; V736-W831 HydrophobicContact CG2-CH2 4.06Å; V736-W831 HydrophobicContact CG2-CZ3 3.77Å
832	Y	92.2	Very high	81.8	Confident	41 Å²	41	68.7 Å²	68.7	16%	0.161	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	131.8	178.2	-61.5	-92	0	0	0	110.9	Q714 I715 I717 V816 V818 V823 A830	Q714-Y832 CarbonylContact C-O 3.34Å; Q714-Y832 WeakPolarHBondContact CA-O 3.26Å; I715-Y832 PolarHBondContact N-O 3.47Å; I715-Y832 PolarHBondContact O-N 2.84Å; I717-Y832 HydrophobicContact CB-CD2 4.15Å; I717-Y832 HydrophobicContact CB-CE2 4.06Å; I717-Y832 HydrophobicContact CD1-CD2 3.8Å; I717-Y832 HydrophobicContact CD1-CE2 4.32Å; I717-Y832 HydrophobicContact CD1-CG 4.48Å; I717-Y832 HydrophobicContact CG1-CD2 4.33Å; V816-Y832 HydrophobicContact CG1-CD1 3.75Å; V816-Y832 HydrophobicContact CG1-CG 3.85Å; V818-Y832 HydrophobicContact CG1-CE1 4.15Å; V818-Y832 HydrophobicContact CG2-CD1 4.32Å; V818-Y832 HydrophobicContact CG2-CE1 4.05Å; V823-Y832 WeakPolarHBondContact CG1-OH 3.3Å; A830-Y832 HydrophobicContact CB-CD2 4.44Å; A830-Y832 HydrophobicContact CB-CE2 3.68Å; A830-Y832 WeakPolarHBondContact O-CD2 3.34Å
833	T	89.4	Confident	81.2	Confident	62 Å²	62	64.6 Å²	64.6	38%	0.38	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	126.7	179.1	-61	0	0	0	0	111	I711 Q714	I711-T833 HydrophobicContact CG2-CG2 3.52Å; Q714-T833 PolarHBondContact NE2-OG1 2.86Å
834	L	90.2	Very high	80.7	Confident	0 Å²	0	63.8 Å²	63.8	0%	0	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	125	-178.9	-74.4	160	0	0	0	111.1	F712 G713 I715 L738 V801 V816	F712-L834 HydrophobicContact CB-CB 4.47Å; F712-L834 PolarHBondContact N-O 2.99Å; F712-L834 WeakPolarHBondContact O-CB 3.38Å; F712-L834 WeakPolarHBondContact O-CD1 3.41Å; G713-L834 PolarHBondContact O-N 3.17Å; I715-L834 HydrophobicContact CB-CD1 4.29Å; I715-L834 HydrophobicContact CB-CG 4.45Å; I715-L834 HydrophobicContact CG2-CD1 4.49Å; I715-L834 HydrophobicContact CG2-CD2 4.15Å; I715-L834 HydrophobicContact CG2-CG 4.12Å; L738-L834 HydrophobicContact CD2-CD1 3.6Å; V801-L834 HydrophobicContact CB-CD2 4.26Å; V801-L834 HydrophobicContact CG2-CD1 4.03Å; V801-L834 HydrophobicContact CG2-CD2 3.59Å; V801-L834 HydrophobicContact CG2-CG 4.49Å; V816-L834 HydrophobicContact CG2-CD2 3.96Å; V816-L834 HydrophobicContact CG2-CG 4.43Å
835	I	85.1	Confident	80.1	Confident	58 Å²	58	62.8 Å²	62.8	30%	0.297	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	162.8	-179.7	61.1	168.3	0	0	0	112.4	G814 E815	G814-I835 CarbonylContact C-O 3.53Å; G814-I835 WeakPolarHBondContact CA-O 3.28Å; E815-I835 HydrophobicContact CG-CG1 3.87Å; E815-I835 PolarHBondContact N-O 2.96Å; E815-I835 WeakPolarHBondContact O-CG1 3.11Å; E815-I835 PolarHBondContact O-N 2.89Å
836	D	79.5	Confident	79.3	Confident	32 Å²	32	63.9 Å²	63.9	17%	0.171	34%	0.339	C	S	.	.			trans	-66.5	157.2	167.3	-169.2	16.1	0	0	0	112.1	K708 G709 Q710 F712 D838	K708-D836 WeakPolarHBondContact CA-OD2 3.39Å; G709-D836 PolarHBondContact N-OD2 2.95Å; Q710-D836 PolarHBondContact O-N 2.75Å; Q710-D836 VanDerWaalsContact O-N 3.17Å; F712-D836 HydrophobicContact CE2-CB 4.15Å; D836-D838 VanDerWaalsContact C-N 3.32Å; D836-D838 PolarHBondContact O-N 3.17Å
837	M	73.4	Confident	78.5	Confident	118 Å²	118	60.1 Å²	60.1	58%	0.581	32%	0.319	S	S	*	.			trans	-77	74.7	-173.7	-173.2	-172.3	65.7	0	0	112.3	F812 E815	F812-M837 HydrophobicContact CE1-CB 3.95Å; F812-M837 HydrophobicContact CZ-CB 3.86Å; E815-M837 WeakPolarHBondContact OE2-CG 3.16Å
838	D	66.8	Low	77.6	Confident	41 Å²	41	65.1 Å²	65.1	22%	0.219	33%	0.33	C	S	.	.			trans	-81.8	126.1	175.1	-93.3	-45.9	0	0	0	112.1	K708 D836 E840 T841 R844	K708-D838 IonicContact NZ-OD1 3.74Å; K708-D838 PolarHBondContact NZ-OD1 2.84Å; D836-D838 VanDerWaalsContact C-N 3.32Å; D836-D838 PolarHBondContact O-N 3.17Å; D838-E840 PolarHBondContact O-N 3.05Å; D838-T841 PolarHBondContact O-OG1 2.88Å; D838-R844 WeakPolarHBondContact O-CD 3.35Å; D838-R844 PolarHBondContact O-NH1 2.79Å
839	E	61.3	Low	76.5	Confident	104 Å²	104	68 Å²	68	49%	0.486	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-13.5	177.6	-103.7	-157.7	-120.1	0	0	113.1	R848	E839-R848 PolarHBondContact O-NH2 3.23Å; E839-R848 IonicContact OE2-CZ 3.9Å; E839-R848 VanDerWaalsContact OE2-CZ 3.32Å; E839-R848 IonicContact OE2-NH1 3.64Å; E839-R848 PolarHBondContact OE2-NH1 3.18Å; E839-R848 IonicContact OE2-NH2 3.71Å; E839-R848 PolarHBondContact OE2-NH2 3.2Å
840	E	56.3	Low	75.3	Confident	127 Å²	127	65.6 Å²	65.6	59%	0.593	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.7	0.6	-165	-66.4	178.1	-137.9	0	0	114.8	D838 K845	D838-E840 PolarHBondContact O-N 3.05Å; E840-K845 WeakPolarHBondContact O-CD 3.3Å; E840-K845 WeakPolarHBondContact O-CE 3.25Å; E840-K845 PolarHBondContact O-NZ 3.2Å
841	T	69.1	Low	74	Confident	42 Å²	42	70.7 Å²	70.7	26%	0.258	34%	0.337	S	S	.	.			trans	-54.1	142.4	176.4	-46.9	0	0	0	0	111.4	L817 D838 L843 R844 K845	L817-T841 HydrophobicContact CD1-CG2 4.33Å; D838-T841 PolarHBondContact O-OG1 2.88Å; T841-L843 VanDerWaalsContact C-N 3.29Å; T841-L843 PolarHBondContact O-N 2.77Å; T841-R844 CarbonylContact O-C 3.1Å; T841-R844 WeakPolarHBondContact O-CA 3.46Å; T841-R844 WeakPolarHBondContact O-CB 3.35Å; T841-R844 PolarHBondContact O-N 2.75Å; T841-K845 PolarHBondContact O-N 3.42Å
842	A	68.6	Low	72.2	Confident	75 Å²	75	67.9 Å²	67.9	62%	0.62	34%	0.339	S	S	*	.	H	α-helix	trans	-54.1	-42.1	-174.5	0	0	0	0	0	113.1	R844 K845 K846	A842-R844 VanDerWaalsContact C-N 3.33Å; A842-R844 PolarHBondContact O-N 3.15Å; A842-K845 CarbonylContact O-C 3.59Å; A842-K845 WeakPolarHBondContact O-CA 3.39Å; A842-K845 WeakPolarHBondContact O-CB 3.18Å; A842-K845 PolarHBondContact O-N 2.96Å; A842-K846 PolarHBondContact O-N 3.34Å
843	L	70.8	Confident	70.4	Confident	37 Å²	37	72.5 Å²	72.5	19%	0.194	36%	0.362	C	S	.	.	H	α-helix	trans	-63.8	-34	175.9	-61.4	-179.7	0	0	0	113.1	I796 L817 D819 T841 K845 K846 L847	I796-L843 HydrophobicContact CD1-CB 4.14Å; I796-L843 HydrophobicContact CD1-CD2 4.26Å; L817-L843 HydrophobicContact CB-CB 4.34Å; L817-L843 HydrophobicContact CB-CD1 3.75Å; L817-L843 HydrophobicContact CD1-CB 4.18Å; L817-L843 VanDerWaalsContact O-CD1 3.29Å; L817-L843 WeakPolarHBondContact O-CD1 3.47Å; D819-L843 HydrophobicContact CB-CD1 4.18Å; D819-L843 HydrophobicContact CB-CD2 3.76Å; D819-L843 WeakPolarHBondContact OD2-CD2 3.28Å; T841-L843 VanDerWaalsContact C-N 3.29Å; T841-L843 PolarHBondContact O-N 2.77Å; L843-K845 VanDerWaalsContact C-N 3.3Å; L843-K845 PolarHBondContact O-N 2.89Å; L843-K846 HydrophobicContact CD2-CD 4.46Å; L843-K846 PolarHBondContact O-N 2.8Å; L843-L847 WeakPolarHBondContact O-CB 3.11Å; L843-L847 WeakPolarHBondContact O-CD1 3.22Å; L843-L847 VanDerWaalsContact O-CG 3.32Å; L843-L847 WeakPolarHBondContact O-CG 3.3Å; L843-L847 PolarHBondContact O-N 2.99Å
844	R	76.9	Confident	68.6	Low	25 Å²	25	74.6 Å²	74.6	9%	0.094	37%	0.365	C	S	.	.	H	α-helix	trans	-72.7	-20.3	170.7	-82.1	179.4	175	148.2	6.3	113.3	E798 E815 L817 D838 T841 A842 R848	E798-R844 IonicContact OE1-CZ 2.68Å; E798-R844 IonicContact OE1-NE 3.88Å; E798-R844 IonicContact OE1-NH2 2.64Å; E798-R844 PolarHBondContact OE1-NH2 2.96Å; E815-R844 VanDerWaalsContact CD-NH1 3.34Å; E815-R844 VanDerWaalsContact CD-NH2 3.32Å; E815-R844 IonicContact OE1-CZ 3.24Å; E815-R844 IonicContact OE1-NH1 3.5Å; E815-R844 PolarHBondContact OE1-NH1 3.06Å; E815-R844 IonicContact OE1-NH2 3.61Å; E815-R844 PolarHBondContact OE1-NH2 3.26Å; E815-R844 IonicContact OE2-CZ 3.84Å; E815-R844 IonicContact OE2-NH1 2.76Å; E815-R844 PolarHBondContact OE2-NH1 2.75Å; E815-R844 IonicContact OE2-NH2 2.85Å; E815-R844 PolarHBondContact OE2-NH2 2.89Å; L817-R844 HydrophobicContact CD1-CG 3.79Å; D838-R844 WeakPolarHBondContact O-CD 3.35Å; D838-R844 PolarHBondContact O-NH1 2.79Å; T841-R844 CarbonylContact O-C 3.1Å; T841-R844 WeakPolarHBondContact O-CA 3.46Å; T841-R844 WeakPolarHBondContact O-CB 3.35Å; T841-R844 PolarHBondContact O-N 2.75Å; A842-R844 VanDerWaalsContact C-N 3.33Å; A842-R844 PolarHBondContact O-N 3.15Å; R844-R848 VanDerWaalsContact O-CG 3.25Å; R844-R848 WeakPolarHBondContact O-CG 3.47Å; R844-R848 PolarHBondContact O-N 3.12Å; R844-R848 PolarHBondContact O-NE 3.41Å
845	K	72.1	Confident	66.7	Low	107 Å²	107	77.2 Å²	77.2	47%	0.465	39%	0.387	S	S	.	.	H	α-helix	trans	-77.7	-47.1	169	-71	164.6	172	152.6	0	110.6	E840 T841 A842 L843 L847 R848 Q849	E840-K845 WeakPolarHBondContact O-CD 3.3Å; E840-K845 WeakPolarHBondContact O-CE 3.25Å; E840-K845 PolarHBondContact O-NZ 3.2Å; T841-K845 PolarHBondContact O-N 3.42Å; A842-K845 CarbonylContact O-C 3.59Å; A842-K845 WeakPolarHBondContact O-CA 3.39Å; A842-K845 WeakPolarHBondContact O-CB 3.18Å; A842-K845 PolarHBondContact O-N 2.96Å; L843-K845 VanDerWaalsContact C-N 3.3Å; L843-K845 PolarHBondContact O-N 2.89Å; K845-L847 PolarHBondContact O-N 3.39Å; K845-R848 PolarHBondContact O-N 2.91Å; K845-R848 VanDerWaalsContact O-N 3.13Å; K845-Q849 PolarHBondContact O-N 3.17Å; K845-Q849 VanDerWaalsContact O-N 3.15Å; K845-Q849 PolarHBondContact O-OE1 2.92Å
846	K	72.5	Confident	64.8	Low	62 Å²	62	76.1 Å²	76.1	27%	0.27	39%	0.387	S	S	.	.	H	α-helix	trans	-48.7	-56.3	169.7	-171.6	-176.7	-179.8	-169.3	0	110.2	I796 D819 S821 A842 L843 R848 Q849 T850	I796-K846 HydrophobicContact CD1-CD 4.24Å; D819-K846 IonicContact OD1-NZ 2.71Å; D819-K846 PolarHBondContact OD1-NZ 3.21Å; D819-K846 IonicContact OD2-NZ 3.17Å; D819-K846 PolarHBondContact OD2-NZ 2.76Å; S821-K846 PolarHBondContact OG-NZ 3.21Å; A842-K846 PolarHBondContact O-N 3.34Å; L843-K846 HydrophobicContact CD2-CD 4.46Å; L843-K846 PolarHBondContact O-N 2.8Å; K846-R848 VanDerWaalsContact C-N 3.34Å; K846-R848 PolarHBondContact O-N 3.33Å; K846-Q849 WeakPolarHBondContact O-CA 3.1Å; K846-Q849 WeakPolarHBondContact O-CB 3.42Å; K846-Q849 PolarHBondContact O-N 3.13Å; K846-T850 PolarHBondContact O-N 2.99Å; K846-T850 PolarHBondContact O-OG1 2.85Å
847	L	72.8	Confident	63.1	Low	17 Å²	17	78.3 Å²	78.3	9%	0.089	41%	0.405	C	S	.	.	H	α-helix	trans	-58.4	-35.6	178.8	-76.4	163.2	0	0	0	115	L756 P757 I796 L843 K845 Q849 R851	L756-L847 HydrophobicContact CB-CD1 4.19Å; L756-L847 HydrophobicContact CB-CD2 3.8Å; L756-L847 HydrophobicContact CD1-CD1 3.52Å; P757-L847 HydrophobicContact CB-CD2 4.24Å; I796-L847 HydrophobicContact CB-CD1 4.24Å; I796-L847 HydrophobicContact CB-CD2 4.42Å; I796-L847 HydrophobicContact CD1-CD1 3.82Å; I796-L847 HydrophobicContact CD1-CD2 3.97Å; I796-L847 HydrophobicContact CD1-CG 3.59Å; I796-L847 HydrophobicContact CG2-CD1 4.15Å; L843-L847 WeakPolarHBondContact O-CB 3.11Å; L843-L847 WeakPolarHBondContact O-CD1 3.22Å; L843-L847 VanDerWaalsContact O-CG 3.32Å; L843-L847 WeakPolarHBondContact O-CG 3.3Å; L843-L847 PolarHBondContact O-N 2.99Å; K845-L847 PolarHBondContact O-N 3.39Å; L847-Q849 VanDerWaalsContact C-N 3.32Å; L847-R851 WeakPolarHBondContact O-CB 3.42Å; L847-R851 PolarHBondContact O-N 3Å
848	R	69.3	Low	61.5	Low	128 Å²	128	77.3 Å²	77.3	48%	0.483	41%	0.409	S	S	.	.	H	α-helix	trans	-68.8	-32.6	175.7	-75.8	176.4	-147	-121.8	9	111.6	E839 R844 K845 K846	E839-R848 PolarHBondContact O-NH2 3.23Å; E839-R848 IonicContact OE2-CZ 3.9Å; E839-R848 VanDerWaalsContact OE2-CZ 3.32Å; E839-R848 IonicContact OE2-NH1 3.64Å; E839-R848 PolarHBondContact OE2-NH1 3.18Å; E839-R848 IonicContact OE2-NH2 3.71Å; E839-R848 PolarHBondContact OE2-NH2 3.2Å; R844-R848 VanDerWaalsContact O-CG 3.25Å; R844-R848 WeakPolarHBondContact O-CG 3.47Å; R844-R848 PolarHBondContact O-N 3.12Å; R844-R848 PolarHBondContact O-NE 3.41Å; K845-R848 PolarHBondContact O-N 2.91Å; K845-R848 VanDerWaalsContact O-N 3.13Å; K846-R848 VanDerWaalsContact C-N 3.34Å; K846-R848 PolarHBondContact O-N 3.33Å
849	Q	66.8	Low	60.2	Low	128 Å²	128	83.7 Å²	83.7	60%	0.598	43%	0.432	S	S	*	.	H	α-helix	trans	-72.7	-56.6	174.4	-65.4	161.3	-37	0	0	110.3	K845 K846 L847 R851 A852 H853	K845-Q849 PolarHBondContact O-N 3.17Å; K845-Q849 VanDerWaalsContact O-N 3.15Å; K845-Q849 PolarHBondContact O-OE1 2.92Å; K846-Q849 WeakPolarHBondContact O-CA 3.1Å; K846-Q849 WeakPolarHBondContact O-CB 3.42Å; K846-Q849 PolarHBondContact O-N 3.13Å; L847-Q849 VanDerWaalsContact C-N 3.32Å; Q849-R851 VanDerWaalsContact C-N 3.26Å; Q849-R851 PolarHBondContact O-N 3.18Å; Q849-A852 WeakPolarHBondContact O-CA 3.21Å; Q849-A852 VanDerWaalsContact O-CB 3.28Å; Q849-A852 WeakPolarHBondContact O-CB 3.28Å; Q849-A852 PolarHBondContact O-N 2.9Å; Q849-H853 PolarHBondContact O-CD2 2.9Å; Q849-H853 VanDerWaalsContact O-CD2 3.3Å; Q849-H853 PolarHBondContact O-N 3.15Å
850	T	65.8	Low	58.9	Low	22 Å²	22	82.5 Å²	82.5	14%	0.135	44%	0.435	C	S	.	.	H	α-helix	trans	-57.4	-38.4	-179	-33.8	0	0	0	0	112.2	K846 A852 H853 F854	K846-T850 PolarHBondContact O-N 2.99Å; K846-T850 PolarHBondContact O-OG1 2.85Å; T850-A852 VanDerWaalsContact C-N 3.27Å; T850-A852 PolarHBondContact O-N 3.28Å; T850-H853 PolarHBondContact O-N 3.44Å; T850-H853 VanDerWaalsContact O-N 3.11Å; T850-F854 HydrophobicContact CG2-CD2 3.97Å; T850-F854 HydrophobicContact CG2-CE2 3.71Å; T850-F854 WeakPolarHBondContact O-CD2 3.5Å; T850-F854 PolarHBondContact O-N 3.06Å
851	R	62	Low	57.8	Low	140 Å²	140	82.3 Å²	82.3	53%	0.528	44%	0.442	S	S	.	.	H	α-helix	trans	-66.2	-25.7	176.3	-168.4	173.6	-170.3	139.2	7.6	113.5	P757 L847 Q849 A855	P757-R851 PolarHBondContact O-NH1 2.92Å; L847-R851 WeakPolarHBondContact O-CB 3.42Å; L847-R851 PolarHBondContact O-N 3Å; Q849-R851 VanDerWaalsContact C-N 3.26Å; Q849-R851 PolarHBondContact O-N 3.18Å; R851-A855 VanDerWaalsContact O-CB 3.26Å; R851-A855 WeakPolarHBondContact O-CB 3.45Å; R851-A855 PolarHBondContact O-N 3.46Å
852	A	56	Low	56.2	Low	59 Å²	59	87 Å²	87	49%	0.488	47%	0.471	S	S	.	.	H	α-helix	trans	-70.2	-40.1	170.7	0	0	0	0	0	111.3	Q849 T850 A855 A856	Q849-A852 WeakPolarHBondContact O-CA 3.21Å; Q849-A852 VanDerWaalsContact O-CB 3.28Å; Q849-A852 WeakPolarHBondContact O-CB 3.28Å; Q849-A852 PolarHBondContact O-N 2.9Å; T850-A852 VanDerWaalsContact C-N 3.27Å; T850-A852 PolarHBondContact O-N 3.28Å; A852-A855 PolarHBondContact O-N 3Å; A852-A856 VanDerWaalsContact O-CB 3.3Å; A852-A856 WeakPolarHBondContact O-CB 3.39Å; A852-A856 PolarHBondContact O-N 3.49Å
853	H	54.4	Low	54.3	Low	139 Å²	139	86.6 Å²	86.6	64%	0.644	47%	0.474	S	S	*	.	H	α-helix	trans	-65.4	-44.8	174.7	-67.8	-85.7	0	0	0	112.4	Q849 T850 A855 A856 S857	Q849-H853 PolarHBondContact O-CD2 2.9Å; Q849-H853 VanDerWaalsContact O-CD2 3.3Å; Q849-H853 PolarHBondContact O-N 3.15Å; T850-H853 PolarHBondContact O-N 3.44Å; T850-H853 VanDerWaalsContact O-N 3.11Å; H853-A855 PolarHBondContact O-N 3.33Å; H853-A856 PolarHBondContact O-N 2.88Å; H853-A856 VanDerWaalsContact O-N 3.16Å; H853-S857 PolarHBondContact O-N 3.42Å
854	F	51.9	Low	52.5	Low	105 Å²	105	89.9 Å²	89.9	46%	0.461	50%	0.5	S	S	.	.	H	α-helix	trans	-63.2	-39.8	174.7	-80.3	-67.7	0	0	0	112.6	P757 T850 A856 S858	P757-F854 HydrophobicContact CG-CD2 4.25Å; P757-F854 HydrophobicContact CG-CE2 4.28Å; T850-F854 HydrophobicContact CG2-CD2 3.97Å; T850-F854 HydrophobicContact CG2-CE2 3.71Å; T850-F854 WeakPolarHBondContact O-CD2 3.5Å; T850-F854 PolarHBondContact O-N 3.06Å; F854-A856 VanDerWaalsContact C-N 3.33Å; F854-S858 WeakPolarHBondContact O-CB 3.33Å; F854-S858 PolarHBondContact O-N 2.88Å; F854-S858 VanDerWaalsContact O-N 3.17Å; F854-S858 PolarHBondContact O-OG 3.15Å
855	A	49.5	Very low	50.1	Low	55 Å²	55	97.1 Å²	97.1	46%	0.455	54%	0.54	S	S	.	.	H	α-helix	trans	-63.8	-37.9	172.9	0	0	0	0	0	112.1	R851 A852 H853 S858 Y859	R851-A855 VanDerWaalsContact O-CB 3.26Å; R851-A855 WeakPolarHBondContact O-CB 3.45Å; R851-A855 PolarHBondContact O-N 3.46Å; A852-A855 PolarHBondContact O-N 3Å; H853-A855 PolarHBondContact O-N 3.33Å; A855-S858 PolarHBondContact O-N 2.94Å; A855-Y859 WeakPolarHBondContact O-CD1 3.39Å; A855-Y859 WeakPolarHBondContact O-CE1 3.48Å
856	A	44.2	Very low	48.1	Very low	35 Å²	35	97.5 Å²	97.5	29%	0.289	55%	0.551	S	S	.	*	H	α-helix	trans	-69	-38.7	178.1	0	0	0	0	0	113.5	A852 H853 F854 S858 Y859	A852-A856 VanDerWaalsContact O-CB 3.3Å; A852-A856 WeakPolarHBondContact O-CB 3.39Å; A852-A856 PolarHBondContact O-N 3.49Å; H853-A856 PolarHBondContact O-N 2.88Å; H853-A856 VanDerWaalsContact O-N 3.16Å; F854-A856 VanDerWaalsContact C-N 3.33Å; A856-S858 VanDerWaalsContact C-N 3.34Å; A856-Y859 HydrophobicContact CB-CE1 4.47Å; A856-Y859 WeakPolarHBondContact O-CE2 3.45Å
857	S	44.2	Very low	46.2	Very low	78 Å²	78	101 Å²	101	55%	0.545	58%	0.578	S	S	.	*	H	α-helix	trans	-62.3	-42.5	173.3	-178.2	0	0	0	0	111.6	H853 Y859 S860	H853-S857 PolarHBondContact O-N 3.42Å; S857-Y859 PolarHBondContact O-N 2.82Å; S857-S860 PolarHBondContact O-N 3.26Å
858	S	39.8	Very low	44.2	Very low	98 Å²	98	111 Å²	111	69%	0.685	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.6	-11	-171.5	-60.4	0	0	0	0	116	F854 A855 A856	F854-S858 WeakPolarHBondContact O-CB 3.33Å; F854-S858 PolarHBondContact O-N 2.88Å; F854-S858 VanDerWaalsContact O-N 3.17Å; F854-S858 PolarHBondContact O-OG 3.15Å; A855-S858 PolarHBondContact O-N 2.94Å; A856-S858 VanDerWaalsContact C-N 3.34Å
859	Y	39	Very low	42.3	Very low	175 Å²	175	109.2 Å²	109.2	69%	0.686	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.5	0.5	178.1	58.8	-119.8	0	0	0	115.1	A855 A856 S857	A855-Y859 WeakPolarHBondContact O-CD1 3.39Å; A855-Y859 WeakPolarHBondContact O-CE1 3.48Å; A856-Y859 HydrophobicContact CB-CE1 4.47Å; A856-Y859 WeakPolarHBondContact O-CE2 3.45Å; S857-Y859 PolarHBondContact O-N 2.82Å
860	S	34.5	Very low	40.8	Very low	79 Å²	79	109 Å²	109	55%	0.552	64%	0.635	S	S	*	*			trans	-99.6	-2.7	-175.7	-67.6	0	0	0	0	114.7	S857 T862	S857-S860 PolarHBondContact O-N 3.26Å; S860-T862 PolarHBondContact O-N 3.14Å
861	T	33.7	Very low	39.1	Very low	122 Å²	122	116 Å²	116	75%	0.748	67%	0.666	S	S	*	*			trans	-81.1	37.4	-170.6	-29.9	0	0	0	0	115.1
862	T	34.8	Very low	37.8	Very low	142 Å²	142	118.4 Å²	118.4	87%	0.871	68%	0.683	S	S	*	*	S	Bend	trans	-141.8	64.7	169.6	57.7	0	0	0	0	112.7	S860	S860-T862 PolarHBondContact O-N 3.14Å
863	G	30.2	Very low	36.6	Very low	65 Å²	65	122.9 Å²	122.9	67%	0.67	70%	0.699	S	S	*	*	S	Bend	trans	152.3	143.4	164.3	0	0	0	0	0	115.9
864	S	31.2	Very low	35.7	Very low	107 Å²	107	123.4 Å²	123.4	75%	0.748	71%	0.712	S	S	*	*			trans	62.1	76.8	162.2	-158.4	0	0	0	0	118.9	T866	S864-T866 PolarHBondContact O-N 3Å; S864-T866 VanDerWaalsContact O-N 3.12Å
865	L	28.3	Very low	34.6	Very low	177 Å²	177	129.4 Å²	129.4	93%	0.927	73%	0.731	S	S	*	*			trans	-69.9	91.2	152	-97.2	165.6	0	0	0	110.3
866	T	30	Very low	33.9	Very low	115 Å²	115	132.6 Å²	132.6	71%	0.706	75%	0.748	S	S	*	*			trans	-178.7	119.2	152.5	39.3	0	0	0	0	110.6	S864	S864-T866 PolarHBondContact O-N 3Å; S864-T866 VanDerWaalsContact O-N 3.12Å
867	T	31.9	Very low	33.5	Very low	134 Å²	134	138.5 Å²	138.5	82%	0.822	77%	0.769	S	S	*	*				170.9	113.3	126.1	-69.9	0	0	0	0	110.5
868	Y	29.9	Very low	33	Very low	227 Å²	227	139.2 Å²	139.2	89%	0.89	77%	0.774	S	S	*	*			trans	30.8	137.4	152.7	-93.7	-101.7	0	0	0	124
869	C	31.2	Very low	32.8	Very low	91 Å²	91	141.1 Å²	141.1	62%	0.615	78%	0.776	S	S	*	*			trans	-85.7	153.8	159.1	179.3	0	0	0	0	110.2
870	S	33.7	Very low	32.7	Very low	124 Å²	124	140.9 Å²	140.9	87%	0.867	79%	0.785	S	S	*	*			trans	-124.4	117.8	152.5	-66.5	0	0	0	0	108
871	Q	30.2	Very low	32.7	Very low	169 Å²	169	140.6 Å²	140.6	79%	0.79	79%	0.788	S	S	*	*			trans	-124.5	126.1	174	177.3	176.3	9.2	0	0	106.3
872	E	34.6	Very low	32.8	Very low	190 Å²	190	143.3 Å²	143.3	89%	0.888	79%	0.792	S	S	*	*			trans	-89.6	145	-179.9	-65.1	-175.3	127.1	0	0	111.1
873	D	30.9	Very low	33.1	Very low	154 Å²	154	141.4 Å²	141.4	82%	0.824	78%	0.781	S	S	*	*			trans	-79.9	136.3	-164.4	-60.7	-99.1	0	0	0	115.3
874	V	35.1	Very low	33.2	Very low	150 Å²	150	143.6 Å²	143.6	91%	0.909	78%	0.782	S	S	*	*			trans	-136.7	139	141.9	-173.8	0	0	0	0	108.5
875	R	29.4	Very low	33.7	Very low	230 Å²	230	146.8 Å²	146.8	87%	0.868	79%	0.787	S	S	*	*			trans	-124.8	129	-164.5	-174.5	-176.3	-170	164.9	3.6	111.3
876	P	34.6	Very low	34.2	Very low	123 Å²	123	146.7 Å²	146.7	80%	0.799	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-79.4	142.1	176	31.4	-33.5	0	0	0	112.1
877	E	36.2	Very low	34.6	Very low	159 Å²	159	147.4 Å²	147.4	74%	0.743	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-86.2	148	171	-78.8	-169	130.5	0	0	111.9	R929	E877-R929 IonicContact OE1-CZ 3.19Å; E877-R929 IonicContact OE1-NE 3.2Å; E877-R929 IonicContact OE1-NH2 3.39Å; E877-R929 PolarHBondContact OE1-NH2 2.87Å; E877-R929 IonicContact OE2-NH2 2.64Å; E877-R929 PolarHBondContact OE2-NH2 2.69Å
878	S	34.7	Very low	34.7	Very low	92 Å²	92	144.8 Å²	144.8	64%	0.643	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-91.1	167.7	170.5	56.1	0	0	0	0	110.2
879	N	35.2	Very low	35	Very low	138 Å²	138	140.2 Å²	140.2	74%	0.738	76%	0.761	S	S	*	*			cis	-167.6	163.5	49.3	-62.3	-85.3	0	0	0	110.8
880	I	36.8	Very low	35.4	Very low	171 Å²	171	143.7 Å²	143.7	88%	0.877	77%	0.766	S	S	*	*				-174.7	151	108.3	-92.5	160.5	0	0	0	109.2
881	A	34.9	Very low	35.4	Very low	72 Å²	72	142.3 Å²	142.3	60%	0.595	76%	0.762	S	S	*	*			trans	-89.2	168.3	-174.5	0	0	0	0	0	112
882	H	35.7	Very low	35.5	Very low	180 Å²	180	139.3 Å²	139.3	83%	0.833	76%	0.755	S	S	*	*				-162.7	169.6	73.3	-101.1	-90.1	0	0	0	112.2
883	P	41.2	Very low	35.5	Very low	101 Å²	101	137.6 Å²	137.6	66%	0.656	75%	0.747	S	S	*	*			trans	-136.3	-152.6	-136.1	30	-3	0	0	0	114
884	V	31.8	Very low	35.4	Very low	112 Å²	112	134.8 Å²	134.8	68%	0.679	75%	0.746	S	S	*	*			trans	80.5	93.1	156.9	179.2	0	0	0	0	117.2
885	M	41.1	Very low	35.3	Very low	174 Å²	174	138.9 Å²	138.9	86%	0.857	75%	0.745	S	S	*	*				-162.7	162.8	97.5	-106.1	-55.3	168.2	0	0	113.3
886	K	39	Very low	35.2	Very low	175 Å²	175	139.2 Å²	139.2	76%	0.761	75%	0.746	S	S	*	*			trans	-143.5	157	178.9	-113.3	-178.7	-176.6	178.4	0	107.6
887	P	37.9	Very low	35	Very low	129 Å²	129	144.9 Å²	144.9	84%	0.838	75%	0.751	S	S	*	*				-141.7	143.8	97.5	27.3	-8.2	0	0	0	115.3
888	S	35.6	Very low	34.5	Very low	79 Å²	79	148.1 Å²	148.1	55%	0.552	76%	0.757	S	S	*	*			trans	-83.8	-175.4	157.5	47.7	0	0	0	0	110.7
889	M	36	Very low	34.2	Very low	131 Å²	131	153.2 Å²	153.2	65%	0.645	76%	0.763	S	S	*	*				170.8	164.5	111.8	-86.4	-55.5	-78	0	0	113.6
890	F	38.2	Very low	33.7	Very low	165 Å²	165	154.6 Å²	154.6	72%	0.724	77%	0.765	S	S	*	*			trans	57.6	106.9	165.6	-55.9	-62.2	0	0	0	118.1
891	A	33.4	Very low	33.5	Very low	95 Å²	95	151 Å²	151	79%	0.785	76%	0.761	S	S	*	*			cis	87.7	167.4	8.3	0	0	0	0	0	119.3
892	T	32.4	Very low	33.1	Very low	105 Å²	105	154.3 Å²	154.3	64%	0.644	77%	0.769	S	S	*	*			trans	104.4	142.3	151.9	-0.1	0	0	0	0	121.6
893	Q	36	Very low	32.8	Very low	155 Å²	155	156.3 Å²	156.3	72%	0.724	77%	0.771	S	S	*	*			trans	67.9	112.9	159.7	-65	168.3	79.8	0	0	116.6
894	A	28.3	Very low	32.3	Very low	95 Å²	95	155.3 Å²	155.3	79%	0.785	78%	0.778	S	S	*	*			cis	67.3	118.1	14.8	0	0	0	0	0	117.2
895	R	32.2	Very low	32.5	Very low	236 Å²	236	153.4 Å²	153.4	89%	0.891	78%	0.781	S	S	*	*			trans	-153.1	130.7	150.9	-111.8	170.8	-163.4	-158.1	3.2	113
896	R	28.6	Very low	32	Very low	236 Å²	236	155.8 Å²	155.8	89%	0.891	78%	0.781	S	S	*	*			trans	-77.5	154.8	165.6	-55.7	165.6	172.1	173.7	-5.8	109.4
897	R	29.2	Very low	31.7	Very low	243 Å²	243	153 Å²	153	92%	0.917	77%	0.773	S	S	*	*				-175.7	165.5	118.3	-101.4	165.3	-170	-101.7	2	113.7
898	R	25.6	Very low	31.4	Very low	227 Å²	227	153.2 Å²	153.2	86%	0.857	77%	0.765	S	S	*	*			trans	-86.7	153.2	176.6	-48.6	163.2	-177.1	153.9	-3.7	110.1
899	Y	29.3	Very low	31.2	Very low	199 Å²	199	155.4 Å²	155.4	78%	0.78	77%	0.766	S	S	*	*			trans	-178.8	126.6	139.9	-87	-70	0	0	0	103.4
900	E	25.5	Very low	30.9	Very low	167 Å²	167	156 Å²	156	78%	0.78	77%	0.767	S	S	*	*				67.1	153.3	65.5	-63.8	178.9	173.4	0	0	114.1
901	A	32.2	Very low	30.5	Very low	95 Å²	95	154.9 Å²	154.9	79%	0.785	77%	0.767	S	S	*	*			trans	61.3	105.4	-165.4	0	0	0	0	0	113.6
902	N	26.7	Very low	30.6	Very low	142 Å²	142	159.8 Å²	159.8	76%	0.759	77%	0.765	S	S	*	*			cis	70.7	136.5	47.6	-153.6	8.2	0	0	0	113.7
903	Y	29.4	Very low	30.6	Very low	222 Å²	222	160.4 Å²	160.4	87%	0.871	77%	0.774	S	S	*	*			trans	67.7	152.2	-175	-74	-93.7	0	0	0	118.5
904	G	30.7	Very low	30.4	Very low	79 Å²	79	155.3 Å²	155.3	81%	0.814	76%	0.763	S	S	*	*			trans	153.9	-83.2	-179.2	0	0	0	0	0	112.4
905	G	34.3	Very low	30.6	Very low	72 Å²	72	159.1 Å²	159.1	74%	0.742	76%	0.758	S	S	*	*			trans	92.1	173.2	178.3	0	0	0	0	0	114.6
906	R	32	Very low	30.5	Very low	224 Å²	224	157.9 Å²	157.9	85%	0.845	75%	0.753	S	S	*	*			cis	-166.5	147.9	-7.7	-110.9	178.5	-178.7	-119.9	-1	106.7
907	L	31.3	Very low	30.7	Very low	116 Å²	116	151.6 Å²	151.6	61%	0.607	75%	0.746	S	S	*	*			cis	-161.8	120.1	-8.7	-154.7	57.5	0	0	0	108.4
908	M	32	Very low	30.9	Very low	135 Å²	135	147.3 Å²	147.3	67%	0.665	74%	0.741	S	S	*	*				64.9	162.6	124.7	-61.5	-45.7	-167.3	0	0	123.5
909	H	31.1	Very low	31.2	Very low	124 Å²	124	141.6 Å²	141.6	57%	0.574	74%	0.736	S	S	*	*			cis	-154.4	154.9	0.4	-122.7	-39.4	0	0	0	113.9
910	H	30	Very low	31.2	Very low	145 Å²	145	135.3 Å²	135.3	67%	0.671	73%	0.732	S	S	*	*			trans	63.9	149.9	149.5	-61.2	-49.2	0	0	0	120.3
911	I	30.2	Very low	31.4	Very low	140 Å²	140	136 Å²	136	72%	0.718	74%	0.74	S	S	*	*			cis	-164	143.4	-20.1	-110.5	166.3	0	0	0	104.8
912	R	35.8	Very low	31.3	Very low	198 Å²	198	135.1 Å²	135.1	75%	0.747	73%	0.733	S	S	*	*			cis	74.2	98.7	-12.8	-158.5	-177	-172.9	-148.3	1.4	120.8	Y915	R912-Y915 PolarHBondContact NH2-OH 3.44Å
913	S	32.3	Very low	31.5	Very low	119 Å²	119	136.2 Å²	136.2	83%	0.832	74%	0.735	S	S	*	*			trans	-161.6	147	142.3	-160.4	0	0	0	0	111.3
914	G	31.6	Very low	31.6	Very low	47 Å²	47	134.2 Å²	134.2	49%	0.485	73%	0.734	S	S	.	*			cis	147	113.8	-20.8	0	0	0	0	0	117.7
915	Y	32.5	Very low	32	Very low	176 Å²	176	135.7 Å²	135.7	69%	0.69	73%	0.729	S	S	*	*			trans	59.4	167	139.5	-54.2	-65.8	0	0	0	119.5	R912	R912-Y915 PolarHBondContact NH2-OH 3.44Å
916	R	29.3	Very low	31.8	Very low	209 Å²	209	137 Å²	137	79%	0.789	73%	0.733	S	S	*	*			cis	-159.8	137.8	-12.3	-114.2	164.5	-178.3	-97.9	3.7	105.8
917	S	33.7	Very low	31.8	Very low	105 Å²	105	131.4 Å²	131.4	73%	0.734	74%	0.735	S	S	*	*				67	104.5	85.4	-46.9	0	0	0	0	118.4
918	D	32.1	Very low	31.8	Very low	152 Å²	152	129.8 Å²	129.8	81%	0.813	75%	0.746	S	S	*	*				102.7	139.9	122.1	-155.6	23.7	0	0	0	124
919	S	32.7	Very low	32	Very low	107 Å²	107	132.5 Å²	132.5	75%	0.748	75%	0.749	S	S	*	*			trans	81.3	125.2	150.3	73.1	0	0	0	0	124.3
920	G	30.2	Very low	32.5	Very low	68 Å²	68	131.8 Å²	131.8	70%	0.701	76%	0.755	S	S	*	*				138.5	84.3	123.6	0	0	0	0	0	123.7
921	L	29.8	Very low	32.6	Very low	181 Å²	181	133.2 Å²	133.2	95%	0.948	76%	0.756	S	S	*	*			trans	66.2	166	148.1	-43	174.2	0	0	0	117.7
922	A	28.4	Very low	32.8	Very low	77 Å²	77	135.6 Å²	135.6	64%	0.636	76%	0.757	S	S	*	*			cis	-157.1	167.1	3	0	0	0	0	0	112.5
923	M	32.2	Very low	32.8	Very low	165 Å²	165	134.8 Å²	134.8	81%	0.813	76%	0.761	S	S	*	*			trans	60.5	118.8	159	-58.3	-53.3	160.4	0	0	118.9
924	Q	30.5	Very low	32.9	Very low	180 Å²	180	137.4 Å²	137.4	84%	0.841	76%	0.761	S	S	*	*				97.4	151.2	61.5	-84.1	-138.9	18.5	0	0	114
925	P	40.6	Very low	33.4	Very low	109 Å²	109	139.6 Å²	139.6	71%	0.708	77%	0.766	S	S	*	*			trans	-130	-161.9	-131.2	46.3	-33.9	0	0	0	116.8
926	A	29.9	Very low	33.5	Very low	101 Å²	101	139.1 Å²	139.1	84%	0.835	77%	0.77	S	S	*	*			trans	82.5	154.1	172.4	0	0	0	0	0	115.3
927	A	30.5	Very low	33.6	Very low	106 Å²	106	138.2 Å²	138.2	88%	0.876	78%	0.775	S	S	*	*			cis	-152	169.8	0.7	0	0	0	0	0	111.3
928	G	33	Very low	33.6	Very low	81 Å²	81	137.3 Å²	137.3	84%	0.835	77%	0.774	S	S	*	*			trans	138.5	114.9	157.3	0	0	0	0	0	118.2
929	R	36.3	Very low	33.4	Very low	193 Å²	193	142.1 Å²	142.1	73%	0.728	78%	0.781	S	S	*	*			trans	-104.2	-161.4	156.2	-61.1	-178.3	175.5	-162	1.4	107.9	E877	E877-R929 IonicContact OE1-CZ 3.19Å; E877-R929 IonicContact OE1-NE 3.2Å; E877-R929 IonicContact OE1-NH2 3.39Å; E877-R929 PolarHBondContact OE1-NH2 2.87Å; E877-R929 IonicContact OE2-NH2 2.64Å; E877-R929 PolarHBondContact OE2-NH2 2.69Å
930	P	41.6	Very low	33.3	Very low	108 Å²	108	140.3 Å²	140.3	70%	0.701	78%	0.779	S	S	*	*			cis	-110.8	-154.3	-35.8	5	21.9	0	0	0	110.3
931	Y	31.7	Very low	33.4	Very low	176 Å²	176	147.3 Å²	147.3	69%	0.69	79%	0.786	S	S	*	*			cis	-174.8	139.1	45.5	-140.3	-94.6	0	0	0	112.4
932	Y	34.8	Very low	33.4	Very low	190 Å²	190	144.8 Å²	144.8	75%	0.745	77%	0.773	S	S	*	*			trans	59.1	166.2	156.9	-81.9	-138.6	0	0	0	118.4
933	E	35.4	Very low	33.4	Very low	180 Å²	180	146.1 Å²	146.1	84%	0.841	78%	0.778	S	S	*	*			cis	-145.4	-178.9	21.4	-154.4	159	177.3	0	0	114
934	Q	34.5	Very low	33.3	Very low	175 Å²	175	146.9 Å²	146.9	82%	0.818	78%	0.779	S	S	*	*			trans	-144.1	-167	-172.5	-130	-167.3	16.3	0	0	108.7
935	P	42.3	Very low	33.2	Very low	92 Å²	92	146.3 Å²	146.3	60%	0.597	78%	0.777	S	S	*	*			cis	-135.5	-144.2	-23	34.7	-10.9	0	0	0	112.8
936	Q	34.9	Very low	32.7	Very low	167 Å²	167	148.1 Å²	148.1	78%	0.78	78%	0.779	S	S	*	*			trans	92	123.1	167	-54.6	178.7	27.3	0	0	115.8
937	Q	29.8	Very low	32.7	Very low	189 Å²	189	150.9 Å²	150.9	88%	0.883	78%	0.775	S	S	*	*				76.7	137.8	56	-65.4	-178.9	7.7	0	0	112.6
938	A	34.9	Very low	32.6	Very low	86 Å²	86	152 Å²	152	71%	0.711	76%	0.762	S	S	*	*			cis	-156.8	170.8	21	0	0	0	0	0	116.1
939	R	28.2	Very low	32.3	Very low	253 Å²	253	158 Å²	158	96%	0.955	76%	0.76	S	S	*	*			trans	18.4	144.1	150.8	-59.4	176.4	-178.8	-179.1	0.2	123.1
940	G	29.8	Very low	31.9	Very low	69 Å²	69	152.2 Å²	152.2	71%	0.711	76%	0.76	S	S	*	*				151.7	112.7	127.6	0	0	0	0	0	121
941	Y	32.6	Very low	31.4	Very low	215 Å²	215	157.2 Å²	157.2	84%	0.843	77%	0.771	S	S	*	*			trans	44	117.1	142.7	-79.2	-91.2	0	0	0	124.6
942	D	29.4	Very low	31.5	Very low	128 Å²	128	156.3 Å²	156.3	68%	0.684	77%	0.773	S	S	*	*				52.6	122.9	115.9	-63.8	2.1	0	0	0	125.5
943	S	29.6	Very low	31.4	Very low	105 Å²	105	152.3 Å²	152.3	73%	0.734	77%	0.77	S	S	*	*				88.8	154	124	-62.8	0	0	0	0	124.1
944	E	28.8	Very low	31.1	Very low	182 Å²	182	152.1 Å²	152.1	85%	0.85	77%	0.769	S	S	*	*			trans	67.1	122.4	167.6	-41.6	-163.1	142.8	0	0	115.9
945	E	29.2	Very low	30.9	Very low	168 Å²	168	147 Å²	147	79%	0.785	76%	0.757	S	S	*	*			cis	103.4	151.9	47.1	-161.1	176.8	-128.8	0	0	110.9
946	L	30.2	Very low	30.4	Very low	146 Å²	146	150.3 Å²	150.3	76%	0.764	76%	0.764	S	S	*	*			trans	69.3	161.4	178.7	-56.9	165.6	0	0	0	116.5
947	E	28.8	Very low	30.1	Very low	159 Å²	159	153 Å²	153	74%	0.743	77%	0.767	S	S	*	*			cis	-163	170.5	-45	-158.3	169.5	-148.1	0	0	107.5
948	E	28.3	Very low	30.3	Very low	130 Å²	130	151.7 Å²	151.7	61%	0.607	77%	0.765	S	S	*	*			trans	65.8	162.4	165.7	-57	-152.1	121.5	0	0	117.1
949	R	26.8	Very low	30	Very low	208 Å²	208	152.5 Å²	152.5	79%	0.785	77%	0.766	S	S	*	*			cis	-146.5	148.1	-14.8	-122.1	168.5	-151.4	166.3	18.7	106.9
950	G	28	Very low	30.2	Very low	70 Å²	70	143.3 Å²	143.3	72%	0.722	75%	0.749	S	S	*	*			trans	-89.5	171.1	-176.3	0	0	0	0	0	115.2
951	F	30.7	Very low	30.3	Very low	213 Å²	213	149.5 Å²	149.5	93%	0.934	75%	0.753	S	S	*	*			trans	-151.9	134.2	160.1	-116.2	-80.5	0	0	0	110.9
952	E	33.7	Very low	30.5	Very low	157 Å²	157	149.3 Å²	149.3	73%	0.734	75%	0.752	S	S	*	*			trans	-121.1	149.5	171.5	-127.1	-80.7	158	0	0	106.8	E954	E952-E954 PolarHBondContact OE2-N 3.09Å; E952-E954 VanDerWaalsContact OE2-N 3.1Å
953	P	34.1	Very low	30.6	Very low	107 Å²	107	147.8 Å²	147.8	70%	0.695	75%	0.751	S	S	*	*			trans	-147.8	133.9	131.5	33.4	-16	0	0	0	115.9
954	E	28.2	Very low	30.8	Very low	176 Å²	176	148.3 Å²	148.3	82%	0.822	75%	0.746	S	S	*	*				36	141	104.9	-77.8	-151	112.9	0	0	119.1	E952	E952-E954 PolarHBondContact OE2-N 3.09Å; E952-E954 VanDerWaalsContact OE2-N 3.1Å
955	A	30	Very low	31.2	Very low	67 Å²	67	149.8 Å²	149.8	55%	0.554	75%	0.745	S	S	*	*			cis	-171.6	-155.9	0.1	0	0	0	0	0	110.9
956	H	33.5	Very low	31.4	Very low	162 Å²	162	145.1 Å²	145.1	75%	0.75	74%	0.742	S	S	*	*			trans	96.5	83.8	159.8	-62.3	-82.5	0	0	0	120.2
957	R	28.2	Very low	31.4	Very low	224 Å²	224	147.4 Å²	147.4	85%	0.845	75%	0.749	S	S	*	*				31.4	134.2	116.7	-55.9	179.1	-177	-177.5	1.1	118.7
958	L	33.7	Very low	31.5	Very low	161 Å²	161	148.2 Å²	148.2	84%	0.843	75%	0.752	S	S	*	*				-173.3	105.3	99.8	-98	166.6	0	0	0	114.8
959	S	28.7	Very low	31.6	Very low	103 Å²	103	150.8 Å²	150.8	72%	0.72	76%	0.764	S	S	*	*				36.9	128.9	127.2	177.8	0	0	0	0	122.1
960	G	31.5	Very low	31.8	Very low	59 Å²	59	150.6 Å²	150.6	61%	0.608	76%	0.764	S	S	*	*				153.1	109	107.6	0	0	0	0	0	120.9
961	Y	33	Very low	32	Very low	199 Å²	199	152.5 Å²	152.5	78%	0.78	77%	0.766	S	S	*	*			trans	64.1	158.3	146.2	-62.5	-86.4	0	0	0	119.4
962	Y	35.8	Very low	32.1	Very low	212 Å²	212	146.7 Å²	146.7	83%	0.831	75%	0.752	S	S	*	*			cis	-132.7	169	5	-138.1	-79.7	0	0	0	111
963	S	32.7	Very low	32.3	Very low	96 Å²	96	145.3 Å²	145.3	67%	0.671	75%	0.746	S	S	*	*			trans	-129.5	173	-156	-44.8	0	0	0	0	116.4
964	D	32.9	Very low	32.4	Very low	116 Å²	116	143.3 Å²	143.3	62%	0.62	74%	0.738	S	S	*	*			trans	84	124.7	138.3	-143.7	7.2	0	0	0	120.4
965	Y	37.4	Very low	32.7	Very low	212 Å²	212	142.9 Å²	142.9	83%	0.831	73%	0.73	S	S	*	*				-177.9	150.2	101.2	-98.6	-71.4	0	0	0	113.4
966	G	34	Very low	33.4	Very low	70 Å²	70	145.4 Å²	145.4	72%	0.722	73%	0.73	S	S	*	*			trans	-78.9	-153.6	-171.4	0	0	0	0	0	117.4
967	E	30.1	Very low	33.9	Very low	195 Å²	195	143.2 Å²	143.2	91%	0.911	72%	0.72	S	S	*	*			cis	-156.4	167.6	20.6	-160.6	175.1	-164.3	0	0	113.2
968	H	30.2	Very low	34.7	Very low	175 Å²	175	138.5 Å²	138.5	81%	0.81	71%	0.708	S	S	*	*			trans	-74.6	131.3	-179.7	-65.7	-21.4	0	0	0	114.5
969	Q	30.5	Very low	35.2	Very low	184 Å²	184	136.5 Å²	136.5	86%	0.86	69%	0.694	S	S	*	*			trans	-175.5	100.9	137.3	-106.2	168.6	37.1	0	0	112.9
970	R	31.7	Very low	35.9	Very low	204 Å²	204	136.4 Å²	136.4	77%	0.77	68%	0.682	S	S	*	*			trans	-177.6	-14.1	156.2	-106.3	155.6	-136.8	-87.3	0.8	116.3	S972 Q973	R970-S972 PolarHBondContact O-N 3.33Å; R970-Q973 PolarHBondContact O-N 3.23Å
971	S	30.9	Very low	36.5	Very low	111 Å²	111	139.5 Å²	139.5	78%	0.776	68%	0.681	S	S	*	*	H	α-helix	trans	-57.3	-21.7	-175.3	43.9	0	0	0	0	116
972	S	34.3	Very low	36.8	Very low	91 Å²	91	137.1 Å²	137.1	64%	0.636	68%	0.676	S	S	*	*	H	α-helix	trans	-82.8	-24.8	-179.5	-164	0	0	0	0	114.6	R970	R970-S972 PolarHBondContact O-N 3.33Å
973	Q	36.9	Very low	36.9	Very low	128 Å²	128	133.5 Å²	133.5	60%	0.598	67%	0.667	S	S	*	*	H	α-helix	trans	-84.2	-30.3	-176	-74.6	-179.5	-17.9	0	0	113.6	R970 Y975 Q976 H977	R970-Q973 PolarHBondContact O-N 3.23Å; Q973-Y975 PolarHBondContact O-N 3.18Å; Q973-Q976 PolarHBondContact O-N 3.37Å; Q973-H977 PolarHBondContact O-N 3.3Å
974	A	36.4	Very low	37.1	Very low	64 Å²	64	136.2 Å²	136.2	53%	0.529	67%	0.669	S	S	.	*	H	α-helix	trans	-62.3	-41.8	-178.9	0	0	0	0	0	112.6	Q976 H977 Q978	A974-Q976 VanDerWaalsContact C-N 3.32Å; A974-Q976 PolarHBondContact O-N 2.81Å; A974-H977 PolarHBondContact O-N 3.25Å; A974-Q978 PolarHBondContact O-N 3.3Å
975	Y	34.4	Very low	37.2	Very low	168 Å²	168	139.4 Å²	139.4	66%	0.659	68%	0.681	S	S	*	*	H	α-helix	trans	-66.6	-32.2	178.3	-115	-99.8	0	0	0	112.8	Q973 Q979	Q973-Y975 PolarHBondContact O-N 3.18Å; Y975-Q979 WeakPolarHBondContact O-CG 3.3Å; Y975-Q979 PolarHBondContact O-N 3.39Å
976	Q	44.7	Very low	36.8	Very low	119 Å²	119	140.1 Å²	140.1	56%	0.556	68%	0.682	S	S	*	*	H	α-helix	trans	-75	-39.6	173.5	-68.9	-172.4	-13.5	0	0	112	Q973 A974 Q978 Q979 Q980	Q973-Q976 PolarHBondContact O-N 3.37Å; A974-Q976 VanDerWaalsContact C-N 3.32Å; A974-Q976 PolarHBondContact O-N 2.81Å; Q976-Q978 VanDerWaalsContact C-N 3.34Å; Q976-Q978 PolarHBondContact O-N 3.07Å; Q976-Q979 PolarHBondContact O-N 2.9Å; Q976-Q980 WeakPolarHBondContact O-CB 3.48Å; Q976-Q980 WeakPolarHBondContact O-CG 3.31Å; Q976-Q980 PolarHBondContact O-N 2.8Å
977	H	45	Very low	36.6	Very low	117 Å²	117	142.6 Å²	142.6	54%	0.542	68%	0.683	S	S	.	*	H	α-helix	trans	-62.3	-40.2	175.9	-119.9	-101.7	0	0	0	112.3	Q973 A974 Q980 Q981	Q973-H977 PolarHBondContact O-N 3.3Å; A974-H977 PolarHBondContact O-N 3.25Å; H977-Q980 PolarHBondContact O-N 2.7Å; H977-Q981 WeakPolarHBondContact O-CG 3.48Å; H977-Q981 PolarHBondContact O-N 3Å
978	Q	44.7	Very low	36.5	Very low	125 Å²	125	136.3 Å²	136.3	58%	0.584	67%	0.671	S	S	*	*	H	α-helix	trans	-70.8	-30.6	178.1	-160.4	169.1	19.6	0	0	112.6	A974 Q976	A974-Q978 PolarHBondContact O-N 3.3Å; Q976-Q978 VanDerWaalsContact C-N 3.34Å; Q976-Q978 PolarHBondContact O-N 3.07Å
979	Q	42.8	Very low	36.4	Very low	118 Å²	118	140 Å²	140	55%	0.551	68%	0.678	S	S	*	*	H	α-helix	trans	-74.2	-36.9	170.7	-72	-178	10.2	0	0	112.6	Y975 Q976 Q982 Q983	Y975-Q979 WeakPolarHBondContact O-CG 3.3Å; Y975-Q979 PolarHBondContact O-N 3.39Å; Q976-Q979 PolarHBondContact O-N 2.9Å; Q979-Q982 PolarHBondContact O-N 3.14Å; Q979-Q983 PolarHBondContact O-N 3.01Å
980	Q	44.2	Very low	36.3	Very low	101 Å²	101	142.3 Å²	142.3	47%	0.472	68%	0.679	S	S	.	*	H	α-helix	trans	-68.8	-36.4	176.2	-76	-176.9	-4.7	0	0	112.9	Q976 H977 Q982 Q983 Q984	Q976-Q980 WeakPolarHBondContact O-CB 3.48Å; Q976-Q980 WeakPolarHBondContact O-CG 3.31Å; Q976-Q980 PolarHBondContact O-N 2.8Å; H977-Q980 PolarHBondContact O-N 2.7Å; Q980-Q982 PolarHBondContact O-N 3.06Å; Q980-Q983 PolarHBondContact O-N 3.23Å; Q980-Q984 PolarHBondContact O-N 2.71Å; Q980-Q984 VanDerWaalsContact O-N 3.15Å
981	Q	43.2	Very low	36.2	Very low	125 Å²	125	137.8 Å²	137.8	58%	0.584	67%	0.666	S	S	*	*	H	α-helix	trans	-64.7	-27.4	174.4	-75.5	-178	-8.3	0	0	113	H977	H977-Q981 WeakPolarHBondContact O-CG 3.48Å; H977-Q981 PolarHBondContact O-N 3Å
982	Q	39.1	Very low	36.1	Very low	148 Å²	148	142.7 Å²	142.7	69%	0.692	67%	0.668	S	S	*	*	H	α-helix	trans	-79.3	-15.8	170.6	-66.9	-170.8	9.1	0	0	113.7	Q979 Q980	Q979-Q982 PolarHBondContact O-N 3.14Å; Q980-Q982 PolarHBondContact O-N 3.06Å
983	Q	38.4	Very low	35.9	Very low	136 Å²	136	145.8 Å²	145.8	64%	0.636	67%	0.672	S	S	*	*	H	α-helix	trans	-84.5	-29.4	173.7	-70.7	179.9	-4	0	0	112.7	Q979 Q980 Q985 R986	Q979-Q983 PolarHBondContact O-N 3.01Å; Q980-Q983 PolarHBondContact O-N 3.23Å; Q983-Q985 VanDerWaalsContact C-N 3.26Å; Q983-Q985 PolarHBondContact O-N 3.02Å; Q983-R986 PolarHBondContact O-N 2.74Å
984	Q	37.9	Very low	35.8	Very low	153 Å²	153	142.8 Å²	142.8	72%	0.715	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.8	-9.2	-179.4	-69.7	-175.3	1.5	0	0	115.1	Q980	Q980-Q984 PolarHBondContact O-N 2.71Å; Q980-Q984 VanDerWaalsContact O-N 3.15Å
985	Q	33.4	Very low	35.7	Very low	184 Å²	184	144.8 Å²	144.8	86%	0.86	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.3	13	171.4	-62.8	-165.6	7.5	0	0	114.1	Q983	Q983-Q985 VanDerWaalsContact C-N 3.26Å; Q983-Q985 PolarHBondContact O-N 3.02Å
986	R	30.2	Very low	35.7	Very low	226 Å²	226	144.1 Å²	144.1	85%	0.853	69%	0.689	S	S	*	*	S	Bend	trans	-117.2	24.9	176.8	-66.7	-169.4	73.1	-163.8	2.8	114.9	Q983	Q983-R986 PolarHBondContact O-N 2.74Å
987	T	29.9	Very low	35.2	Very low	122 Å²	122	144.2 Å²	144.2	75%	0.748	70%	0.698	S	S	*	*	S	Bend	trans	-135.6	101.5	174.1	40.5	0	0	0	0	113.7
988	G	27.6	Very low	34.6	Very low	64 Å²	64	146 Å²	146	66%	0.66	71%	0.708	S	S	*	*			trans	79.2	86.5	140.9	0	0	0	0	0	120
989	W	27.7	Very low	33.9	Very low	253 Å²	253	145.8 Å²	145.8	96%	0.958	71%	0.707	S	S	*	*				-136.4	123.8	129.8	-83.1	102.1	0	0	0	108.7
990	R	28.3	Very low	33.4	Very low	232 Å²	232	148.5 Å²	148.5	88%	0.875	71%	0.713	S	S	*	*			trans	-107.1	171.8	-179.1	-68.1	-171.7	-173.4	-116.5	8.2	111.1
991	Q	29.8	Very low	32.7	Very low	109 Å²	109	154.3 Å²	154.3	51%	0.509	73%	0.73	S	S	.	*			trans	76.4	88.1	144.6	-160	172	14.1	0	0	117.7
992	W	28.1	Very low	32.2	Very low	213 Å²	213	152.8 Å²	152.8	81%	0.807	74%	0.739	S	S	*	*				-120.1	126.5	110.8	-96.8	81.1	0	0	0	109.6	W287	W287-W992 HydrophobicContact CE3-CZ2 4.11Å; W287-W992 HydrophobicContact CH2-CD2 4.26Å; W287-W992 AromaticContact CH2-CE2 3.51Å; W287-W992 AromaticContact CH2-CH2 3.84Å; W287-W992 HydrophobicContact CH2-CH2 3.84Å; W287-W992 AromaticContact CH2-CZ2 3.29Å; W287-W992 HydrophobicContact CH2-CZ2 3.29Å; W287-W992 HydrophobicContact CH2-CZ3 4.49Å; W287-W992 AromaticContact CH2-NE1 3.83Å; W287-W992 AromaticContact CZ2-CE2 3.99Å; W287-W992 HydrophobicContact CZ2-CZ2 4.16Å; W287-W992 AromaticContact CZ2-NE1 3.81Å; W287-W992 AromaticContact CZ3-CE2 3.95Å; W287-W992 AromaticContact CZ3-CH2 3.78Å; W287-W992 HydrophobicContact CZ3-CH2 3.78Å; W287-W992 AromaticContact CZ3-CZ2 3.27Å; W287-W992 HydrophobicContact CZ3-CZ2 3.27Å
993	Q	31.4	Very low	31.7	Very low	156 Å²	156	154.1 Å²	154.1	73%	0.729	75%	0.747	S	S	*	*			trans	-107.9	162.7	169.8	-76	170.8	-54.8	0	0	107.8
994	G	34.6	Very low	31.4	Very low	66 Å²	66	155 Å²	155	68%	0.68	76%	0.755	S	S	*	*			cis	160.8	-147.6	-0.3	0	0	0	0	0	110.6
995	S	33.6	Very low	31.5	Very low	105 Å²	105	152.7 Å²	152.7	73%	0.734	75%	0.753	S	S	*	*			trans	72	135	172.2	-66.9	0	0	0	0	117.7
996	E	34.5	Very low	31.3	Very low	154 Å²	154	150.7 Å²	150.7	72%	0.72	75%	0.747	S	S	*	*			cis	-161.1	137.2	-12.7	-128.2	155.6	144.2	0	0	113.2
997	T	35.7	Very low	31.3	Very low	121 Å²	121	146.8 Å²	146.8	74%	0.742	74%	0.739	S	S	*	*			trans	51.4	169.4	139.9	56.6	0	0	0	0	121.2
998	M	31.6	Very low	31.5	Very low	155 Å²	155	147.5 Å²	147.5	76%	0.764	74%	0.737	S	S	*	*			cis	-145.9	148.4	8.9	-154.3	159	174.3	0	0	116
999	E	30.5	Very low	31.8	Very low	120 Å²	120	155.8 Å²	155.8	56%	0.561	75%	0.749	S	S	*	*			trans	3.1	140.9	160.5	-61.6	-156.4	110.8	0	0	127.4
1000	R	31.7	Very low	32.4	Very low	176 Å²	176	148.9 Å²	148.9	66%	0.664	74%	0.736	S	S	*	*				84.9	126.4	127.8	-80.9	175.1	-153.8	-157.1	13.3	124.9
1001	R	30	Very low	32.7	Very low	222 Å²	222	143.9 Å²	143.9	84%	0.838	74%	0.737	S	S	*	*			trans	84.7	157.4	133.9	-79.2	179.1	169	173.4	-5.3	121
1002	A	32.2	Very low	32.9	Very low	93 Å²	93	144.2 Å²	144.2	77%	0.769	75%	0.751	S	S	*	*			trans	79.3	80.9	163.2	0	0	0	0	0	120.8
1003	M	29.3	Very low	33.8	Very low	177 Å²	177	139.4 Å²	139.4	87%	0.872	75%	0.748	S	S	*	*				37	114.4	110.9	-85.2	174.5	167	0	0	122.4
1004	I	32.4	Very low	34	Very low	155 Å²	155	138 Å²	138	80%	0.795	75%	0.749	S	S	*	*			trans	70.1	172.5	144.6	5.9	-174.5	0	0	0	118.2
1005	P	38.2	Very low	34.2	Very low	103 Å²	103	143.1 Å²	143.1	67%	0.669	76%	0.756	S	S	*	*				-133.2	-163	-109.1	45.7	-27	0	0	0	116.7
1006	L	30.6	Very low	34.3	Very low	142 Å²	142	146.1 Å²	146.1	74%	0.743	76%	0.758	S	S	*	*			trans	94.1	131.7	154	-75.4	160.4	0	0	0	120.8
1007	E	28.8	Very low	34.4	Very low	144 Å²	144	144.1 Å²	144.1	67%	0.673	76%	0.761	S	S	*	*			trans	76.3	133.9	142.7	-68.3	-45.7	89.2	0	0	126.4
1008	L	34.1	Very low	34.4	Very low	138 Å²	138	141.4 Å²	141.4	72%	0.723	76%	0.758	S	S	*	*			trans	70.9	96.4	140.3	-67.1	167	0	0	0	123.4
1009	R	34.1	Very low	34.6	Very low	238 Å²	238	141.5 Å²	141.5	90%	0.898	76%	0.761	S	S	*	*				58.9	160.3	123.2	-95.8	-159.5	138	103.1	-2.3	122.2
1010	P	40.2	Very low	34.7	Very low	108 Å²	108	142.8 Å²	142.8	70%	0.701	77%	0.767	S	S	*	*			trans	-112.8	176	-163.5	43.6	-37	0	0	0	116
1011	S	34.7	Very low	34.8	Very low	126 Å²	126	139.4 Å²	139.4	88%	0.881	77%	0.766	S	S	*	*			trans	-153.3	172.1	152.8	-78.9	0	0	0	0	110.4
1012	S	34.7	Very low	35.1	Very low	117 Å²	117	134.5 Å²	134.5	82%	0.818	77%	0.766	S	S	*	*			trans	-127.2	-145.2	-156.5	51.8	0	0	0	0	114.8
1013	P	46.6	Very low	35.3	Very low	112 Å²	112	135.6 Å²	135.6	73%	0.727	77%	0.768	S	S	*	*				-132.3	168	-117.3	41.1	-22.4	0	0	0	117.7
1014	T	36.9	Very low	35.9	Very low	125 Å²	125	133 Å²	133	77%	0.767	77%	0.765	S	S	*	*			trans	-165.5	149.9	149	16.1	0	0	0	0	113.8
1015	E	37	Very low	36.2	Very low	175 Å²	175	130.7 Å²	130.7	82%	0.818	76%	0.762	S	S	*	*			trans	20	159.8	133.1	-65.6	157	170.5	0	0	121.2
1016	E	36.7	Very low	36.1	Very low	167 Å²	167	134.6 Å²	134.6	78%	0.78	77%	0.771	S	S	*	*			cis	-162.7	151.2	16.8	-147.7	-167.1	144.1	0	0	113.9
1017	S	36.4	Very low	36.8	Very low	112 Å²	112	132.6 Å²	132.6	78%	0.783	77%	0.767	S	S	*	*			trans	61.2	170.1	150	82.8	0	0	0	0	123.3
1018	G	36.3	Very low	37.2	Very low	65 Å²	65	131.7 Å²	131.7	67%	0.67	77%	0.767	S	S	*	*			trans	96.1	110.9	169.9	0	0	0	0	0	115.3
1019	N	34.8	Very low	37.3	Very low	157 Å²	157	131.7 Å²	131.7	84%	0.84	77%	0.767	S	S	*	*				66	144.6	61.4	126.2	-7.9	0	0	0	113.8
1020	E	32.8	Very low	37.6	Very low	147 Å²	147	130.1 Å²	130.1	69%	0.687	76%	0.761	S	S	*	*			cis	-163.4	162.1	-13	-114.6	-80.5	68.4	0	0	108.7
1021	T	34.1	Very low	37.6	Very low	104 Å²	104	131.8 Å²	131.8	64%	0.638	76%	0.759	S	S	*	*			trans	39.3	124.4	159.6	57.8	0	0	0	0	122.4
1022	S	36.1	Very low	37.7	Very low	119 Å²	119	132.5 Å²	132.5	83%	0.832	75%	0.752	S	S	*	*				168.8	133.5	112.5	-78.1	0	0	0	0	115.1
1023	S	36.3	Very low	38.2	Very low	117 Å²	117	133.2 Å²	133.2	82%	0.818	75%	0.754	S	S	*	*			trans	-134	152.4	160.2	-56.5	0	0	0	0	107.2
1024	P	42.5	Very low	37.6	Very low	123 Å²	123	138.5 Å²	138.5	80%	0.799	76%	0.759	S	S	*	*				-145.4	-171.4	86.6	31.1	-7	0	0	0	111.8
1025	S	39	Very low	38.3	Very low	106 Å²	106	137.1 Å²	137.1	74%	0.741	75%	0.753	S	S	*	*			cis	-162.6	163.6	36.4	-52.6	0	0	0	0	114.3
1026	H	36.5	Very low	38.7	Very low	184 Å²	184	134.8 Å²	134.8	85%	0.852	75%	0.752	S	S	*	*			trans	-87.8	-159	169.8	-57.1	-85	0	0	0	110.7
1027	P	43.5	Very low	38.6	Very low	101 Å²	101	132.2 Å²	132.2	66%	0.656	75%	0.753	S	S	*	*			cis	-132	-174.9	-9	25.7	2.4	0	0	0	112.8
1028	N	38.2	Very low	38.8	Very low	125 Å²	125	136.3 Å²	136.3	67%	0.668	76%	0.757	S	S	*	*				-173.8	146.4	61.5	-92.5	-60.1	0	0	0	114.5
1029	L	36.9	Very low	38.8	Very low	138 Å²	138	138 Å²	138	72%	0.723	76%	0.756	S	S	*	*			trans	35.8	126.2	133.5	-47.6	170.5	0	0	0	118
1030	R	39.9	Very low	38.7	Very low	205 Å²	205	137.2 Å²	137.2	77%	0.774	75%	0.75	S	S	*	*				-161.7	162.1	51.7	-74.1	176.9	-172.2	-105.9	6.2	108.9
1031	H	40.3	Very low	38.8	Very low	142 Å²	142	135.7 Å²	135.7	66%	0.657	75%	0.751	S	S	*	*			cis	-151.7	-151	-3.9	-107.5	-33.9	0	0	0	108.4
1032	L	36.2	Very low	38.8	Very low	141 Å²	141	138.2 Å²	138.2	74%	0.738	76%	0.755	S	S	*	*			trans	-132.9	167.7	178.7	-62.1	169.5	0	0	0	110
1033	P	44.7	Very low	38.8	Very low	133 Å²	133	142.6 Å²	142.6	86%	0.864	75%	0.754	S	S	*	*				-116.5	169.7	73	-4.3	26	0	0	0	115.4
1034	R	35	Very low	38.5	Very low	222 Å²	222	143.1 Å²	143.1	84%	0.838	75%	0.752	S	S	*	*			trans	-130.6	-169	-176.9	-124.5	-155.7	164.7	-171.9	-2.6	110.1
1035	P	51.5	Low	38.1	Very low	97 Å²	97	144.2 Å²	144.2	63%	0.63	75%	0.747	S	S	*	*			trans	-92.7	-158.5	-160.5	40.7	-36.2	0	0	0	112.8
1036	P	45.2	Very low	37.9	Very low	125 Å²	125	147 Å²	147	81%	0.812	75%	0.746	S	S	*	*				-141.7	147.7	108.2	37.5	-25.1	0	0	0	115.8
1037	S	34.9	Very low	37.9	Very low	113 Å²	113	146.8 Å²	146.8	79%	0.79	75%	0.747	S	S	*	*			trans	-106	146.1	156.3	47.8	0	0	0	0	109.4
1038	K	41.3	Very low	37.6	Very low	198 Å²	198	147.9 Å²	147.9	86%	0.861	75%	0.754	S	S	*	*			trans	-151.1	157.9	-179.4	-96.7	-159.1	175.3	-175.9	0	112.3
1039	P	34.6	Very low	37.6	Very low	100 Å²	100	147.3 Å²	147.3	65%	0.649	76%	0.757	S	S	*	*				-149.1	-170.8	-119.5	43.1	-22.4	0	0	0	117.9
1040	I	32.7	Very low	37.4	Very low	142 Å²	142	148 Å²	148	73%	0.728	76%	0.761	S	S	*	*			trans	83.4	152.2	143.1	-86.9	166.6	0	0	0	120.2
1041	T	35.8	Very low	36.9	Very low	115 Å²	115	144.9 Å²	144.9	71%	0.706	76%	0.76	S	S	*	*			trans	65.8	136.1	171	40.1	0	0	0	0	118.7
1042	E	34.7	Very low	36.4	Very low	156 Å²	156	143.4 Å²	143.4	73%	0.729	76%	0.76	S	S	*	*			cis	-163	168.7	-15.1	-138.8	178.7	-121.9	0	0	112.6
1043	R	35.7	Very low	35.9	Very low	211 Å²	211	144 Å²	144	80%	0.796	76%	0.764	S	S	*	*			trans	72.6	98.3	162.7	-72.1	-176.2	175.8	-172.8	-5.8	122.1
1044	T	30.3	Very low	35.3	Very low	128 Å²	128	149 Å²	149	79%	0.785	77%	0.766	S	S	*	*				88.4	136.9	123.2	-39.4	0	0	0	0	120.9
1045	E	33.7	Very low	34.9	Very low	146 Å²	146	144.3 Å²	144.3	68%	0.682	77%	0.767	S	S	*	*			trans	95.5	117.4	167.3	-62.4	-139.8	-179.9	0	0	121.5
1046	K	34.7	Very low	33.8	Very low	166 Å²	166	151.1 Å²	151.1	72%	0.722	78%	0.78	S	S	*	*			trans	70.7	89.3	145.4	-69.8	168.9	-177.8	143.2	0	121.5
1047	M	35.5	Very low	33.3	Very low	179 Å²	179	150.1 Å²	150.1	88%	0.882	77%	0.774	S	S	*	*			trans	82.1	143.4	134.9	-66.7	-175.6	170.5	0	0	120
1048	P	37.1	Very low	33.1	Very low	124 Å²	124	152.1 Å²	152.1	81%	0.805	78%	0.775	S	S	*	*			trans	-99.5	152.3	-165.6	38.6	-35.5	0	0	0	114.8
1049	P	38.5	Very low	32.5	Very low	112 Å²	112	149.4 Å²	149.4	73%	0.727	77%	0.77	S	S	*	*			trans	-104.8	-174.4	170.2	40	-33.7	0	0	0	113.3
1050	L	32.4	Very low	32.5	Very low	152 Å²	152	156 Å²	156	80%	0.796	78%	0.782	S	S	*	*			trans	80.5	110.4	171.6	-55.5	172.6	0	0	0	114.2
1051	N	30.5	Very low	32.4	Very low	141 Å²	141	155.7 Å²	155.7	75%	0.754	78%	0.782	S	S	*	*			cis	59.6	124.7	49.1	-147.2	15.6	0	0	0	109.2
1052	T	29.1	Very low	32.4	Very low	110 Å²	110	158.1 Å²	158.1	68%	0.675	79%	0.787	S	S	*	*			cis	-160.1	162.6	48.7	49.2	0	0	0	0	112.8
1053	D	26.1	Very low	32.4	Very low	153 Å²	153	155.5 Å²	155.5	82%	0.818	78%	0.778	S	S	*	*			trans	73	159.9	158.4	-147	-18.9	0	0	0	115.7
1054	R	32	Very low	32.4	Very low	238 Å²	238	151.7 Å²	151.7	90%	0.898	77%	0.773	S	S	*	*			trans	61.5	115.3	-174.6	-54.7	173.4	171.8	-176.3	-3.9	116.2
1055	S	27	Very low	32.5	Very low	124 Å²	124	152.8 Å²	152.8	87%	0.867	76%	0.763	S	S	*	*			trans	-144.3	90.5	163.1	56.5	0	0	0	0	111.9
1056	R	27.6	Very low	32.5	Very low	240 Å²	240	154.6 Å²	154.6	91%	0.906	76%	0.763	S	S	*	*			trans	-167	151	175.6	-111.5	-167.6	175.5	-146.4	0.7	107.6
1057	P	35.5	Very low	32.5	Very low	104 Å²	104	154.6 Å²	154.6	68%	0.675	76%	0.763	S	S	*	*			cis	-127.8	-146.7	-29.1	30.1	-7	0	0	0	110.2
1058	L	29.9	Very low	32.4	Very low	156 Å²	156	151.1 Å²	151.1	82%	0.817	75%	0.752	S	S	*	*			trans	84.3	75.5	162.7	-52.6	178.7	0	0	0	119.3
1059	N	28.8	Very low	32.1	Very low	141 Å²	141	151 Å²	151	75%	0.754	75%	0.745	S	S	*	*				16.9	117.6	113.5	-171.7	20.5	0	0	0	118.9
1060	R	34.3	Very low	31.8	Very low	237 Å²	237	152.9 Å²	152.9	89%	0.894	74%	0.744	S	S	*	*				-168.2	145.5	129.1	-113.4	173.4	-179.7	165.2	-0.5	113
1061	D	31.5	Very low	31.7	Very low	136 Å²	136	150.3 Å²	150.3	73%	0.727	74%	0.738	S	S	*	*			trans	-70	156.4	170.6	-40.7	-99.9	0	0	0	112.1
1062	M	34.9	Very low	32	Very low	167 Å²	167	150.3 Å²	150.3	82%	0.823	74%	0.738	S	S	*	*				-177.6	124.7	104.5	-102.5	-168.3	148.4	0	0	114.1
1063	D	35.4	Very low	32.2	Very low	100 Å²	100	150.8 Å²	150.8	54%	0.535	74%	0.736	S	S	.	*				50	163.8	120.5	-163.8	19.2	0	0	0	120.1	R1065	D1063-R1065 IonicContact OD1-NE 3.69Å; D1063-R1065 IonicContact OD2-CZ 3.09Å; D1063-R1065 IonicContact OD2-NE 2.73Å; D1063-R1065 IonicContact OD2-NH2 2.69Å; D1063-R1065 PolarHBondContact OD2-NH2 3.21Å
1064	L	34.8	Very low	32.2	Very low	131 Å²	131	148.9 Å²	148.9	69%	0.686	73%	0.726	S	S	*	*			trans	85.5	130.2	168.6	-65	101.4	0	0	0	120
1065	R	33	Very low	32.1	Very low	152 Å²	152	146 Å²	146	57%	0.574	71%	0.714	S	S	*	*			cis	-174.1	153.5	-29.9	-119.8	173.9	-142.7	-172.4	5.8	110.9	D1063	D1063-R1065 IonicContact OD1-NE 3.69Å; D1063-R1065 IonicContact OD2-CZ 3.09Å; D1063-R1065 IonicContact OD2-NE 2.73Å; D1063-R1065 IonicContact OD2-NH2 2.69Å; D1063-R1065 PolarHBondContact OD2-NH2 3.21Å
1066	R	32.9	Very low	32.3	Very low	183 Å²	183	149.2 Å²	149.2	69%	0.691	71%	0.709	S	S	*	*			trans	72.7	136.5	139.5	-79.5	177.8	177.8	179.8	-3.7	122.4
1067	F	35.3	Very low	32.6	Very low	166 Å²	166	143.7 Å²	143.7	73%	0.728	70%	0.702	S	S	*	*				92.1	144.2	129.4	-83.7	-150.4	0	0	0	120.2
1068	V	34.2	Very low	32.3	Very low	106 Å²	106	144.4 Å²	144.4	64%	0.642	71%	0.71	S	S	*	*			cis	-164.8	147.2	-31.8	101.1	0	0	0	0	111.3
1069	D	31.1	Very low	32.3	Very low	122 Å²	122	140 Å²	140	65%	0.652	70%	0.701	S	S	*	*			trans	71.6	158.6	152	-107.6	-26.7	0	0	0	125.6
1070	Q	32.4	Very low	32.7	Very low	151 Å²	151	142.8 Å²	142.8	71%	0.706	71%	0.707	S	S	*	*			trans	58.7	110.3	148.8	-70.4	160.2	58.6	0	0	117.7
1071	S	30.2	Very low	32.4	Very low	98 Å²	98	137.4 Å²	137.4	69%	0.685	70%	0.701	S	S	*	*				61.8	121.4	69.9	-172.9	0	0	0	0	112.7
1072	L	36	Very low	32.6	Very low	142 Å²	142	135.4 Å²	135.4	74%	0.743	70%	0.703	S	S	*	*				-174.5	139.3	111.1	-91.2	173.7	0	0	0	111
1073	L	32.2	Very low	32.5	Very low	120 Å²	120	132.1 Å²	132.1	63%	0.628	70%	0.702	S	S	*	*			trans	58.1	107.4	144.3	-88.3	36.8	0	0	0	121.8
1074	N	28.1	Very low	32.5	Very low	113 Å²	113	130.7 Å²	130.7	60%	0.604	70%	0.704	S	S	*	*				60.3	137.2	99.5	-88.8	-43.1	0	0	0	121.6
1075	R	29.7	Very low	32.5	Very low	176 Å²	176	132 Å²	132	66%	0.664	71%	0.707	S	S	*	*			trans	71.3	144	143.6	-65.9	177.7	-70.2	-139	3	114.9
1076	Y	30.1	Very low	32.6	Very low	193 Å²	193	130.6 Å²	130.6	76%	0.757	71%	0.707	S	S	*	*			cis	-163.9	178.8	18.7	-129.9	-171.7	0	0	0	111.5
1077	T	33.8	Very low	32.4	Very low	123 Å²	123	132.3 Å²	132.3	76%	0.755	71%	0.713	S	S	*	*			trans	58	121.4	158.3	49.5	0	0	0	0	118.7
1078	S	28.8	Very low	32.4	Very low	120 Å²	120	128 Å²	128	84%	0.839	72%	0.715	S	S	*	*			cis	94	116.4	42.9	-176.6	0	0	0	0	114
1079	G	31.8	Very low	32.3	Very low	62 Å²	62	133.6 Å²	133.6	64%	0.639	73%	0.725	S	S	*	*			trans	122	140.3	134.6	0	0	0	0	0	117.8
1080	K	35.4	Very low	32.3	Very low	200 Å²	200	134.3 Å²	134.3	87%	0.87	73%	0.728	S	S	*	*			trans	73.8	139.1	147.4	-64.4	179.9	-177.9	177.9	0	117.5
1081	T	29.5	Very low	32.4	Very low	125 Å²	125	138.7 Å²	138.7	77%	0.767	74%	0.738	S	S	*	*			cis	156.5	169.4	-20.5	34.8	0	0	0	0	105.7
1082	A	33.9	Very low	32.3	Very low	93 Å²	93	141.3 Å²	141.3	77%	0.769	75%	0.745	S	S	*	*			trans	77	117.6	179.2	0	0	0	0	0	112.3
1083	A	34.8	Very low	32	Very low	99 Å²	99	146.2 Å²	146.2	82%	0.818	75%	0.753	S	S	*	*				98.4	157.2	71.7	0	0	0	0	0	109.5
1084	A	34.6	Very low	32	Very low	69 Å²	69	144.2 Å²	144.2	57%	0.57	75%	0.754	S	S	*	*			cis	-154.8	151.2	4.9	0	0	0	0	0	110.2
1085	E	35	Very low	32.1	Very low	160 Å²	160	145.5 Å²	145.5	75%	0.748	76%	0.761	S	S	*	*			trans	63.2	161.1	136.4	-61.2	-173.8	115.1	0	0	120.3
1086	Q	33.8	Very low	32	Very low	122 Å²	122	145.8 Å²	145.8	57%	0.57	77%	0.767	S	S	*	*			cis	-149.1	149.5	-21.4	-119.5	-169.4	61.5	0	0	111
1087	R	30.8	Very low	32.1	Very low	218 Å²	218	144.6 Å²	144.6	82%	0.823	77%	0.772	S	S	*	*			trans	17.9	133.5	141.9	-59.7	171.5	-179.7	162.2	-9.2	120.6
1088	G	33.7	Very low	31.9	Very low	75 Å²	75	143.4 Å²	143.4	77%	0.773	77%	0.769	S	S	*	*			trans	173.6	66.3	159	0	0	0	0	0	114.3
1089	R	33.1	Very low	32.2	Very low	224 Å²	224	141.5 Å²	141.5	85%	0.845	77%	0.768	S	S	*	*				43.6	119.1	97.8	-91.4	-169.2	172.2	-154.7	-0.6	116.2
1090	L	30.3	Very low	32.2	Very low	138 Å²	138	145 Å²	145	72%	0.723	77%	0.772	S	S	*	*			trans	54.5	113.4	136.1	-56.2	167.5	0	0	0	118.7
1091	R	34.1	Very low	32.3	Very low	242 Å²	242	145.8 Å²	145.8	91%	0.913	77%	0.771	S	S	*	*				-174.4	157.7	97.2	-104.2	168.9	178.1	169.7	-1.3	114.6
1092	N	29	Very low	32.7	Very low	154 Å²	154	146.9 Å²	146.9	82%	0.824	77%	0.772	S	S	*	*			trans	-73.8	159.7	162.4	-68.9	-47.5	0	0	0	111.2
1093	R	29.4	Very low	32.7	Very low	245 Å²	245	146.3 Å²	146.3	93%	0.925	76%	0.762	S	S	*	*			trans	82.7	151.8	140.5	-143.4	175.8	-178.2	118.9	-3.5	118.1
1094	A	32.5	Very low	32.8	Very low	78 Å²	78	148.5 Å²	148.5	65%	0.645	76%	0.76	S	S	*	*			trans	78.8	98.1	154.9	0	0	0	0	0	119.1
1095	N	29.5	Very low	33	Very low	140 Å²	140	153.9 Å²	153.9	75%	0.749	77%	0.773	S	S	*	*				61.7	128.3	111	-69.1	19.4	0	0	0	121.4
1096	F	27.7	Very low	32.9	Very low	182 Å²	182	150.5 Å²	150.5	80%	0.798	77%	0.767	S	S	*	*			trans	66.5	125.4	146.5	-76.1	-126	0	0	0	117.9
1097	I	33.1	Very low	33.1	Very low	168 Å²	168	152.4 Å²	152.4	86%	0.862	78%	0.776	S	S	*	*				-162.9	139	112.4	-97.1	152.9	0	0	0	108
1098	S	29.9	Very low	33.3	Very low	98 Å²	98	147.2 Å²	147.2	69%	0.685	77%	0.769	S	S	*	*			trans	-80.7	167.8	178.8	-54.6	0	0	0	0	112.4
1099	G	34.3	Very low	33.2	Very low	79 Å²	79	149.2 Å²	149.2	81%	0.814	77%	0.771	S	S	*	*			trans	-159	54.8	180	0	0	0	0	0	112.1
1100	D	32.8	Very low	33.3	Very low	137 Å²	137	142.4 Å²	142.4	73%	0.733	76%	0.763	S	S	*	*			trans	-68.3	145.2	179.7	-48.9	-86.3	0	0	0	112.3
1101	Y	36.3	Very low	33.5	Very low	215 Å²	215	141 Å²	141	84%	0.843	77%	0.765	S	S	*	*			trans	-156	86.3	164.7	-118.7	-80.2	0	0	0	113
1102	L	38.1	Very low	33.4	Very low	148 Å²	148	137.5 Å²	137.5	78%	0.775	76%	0.763	S	S	*	*			trans	65.3	158.4	152.9	-50.5	-178.5	0	0	0	116.4
1103	S	34.3	Very low	33.8	Very low	82 Å²	82	135.6 Å²	135.6	57%	0.573	76%	0.759	S	S	*	*			cis	-171.8	157.2	-19.5	-90.7	0	0	0	0	106.3
1104	D	36.3	Very low	33.9	Very low	145 Å²	145	129.2 Å²	129.2	78%	0.775	75%	0.752	S	S	*	*			cis	-165.3	-175.5	-18.6	-90.5	-33	0	0	0	105.6
1105	E	39.3	Very low	34.1	Very low	181 Å²	181	129.6 Å²	129.6	85%	0.846	76%	0.755	S	S	*	*			cis	-147	-88.5	14.1	-160.7	-177.6	170.5	0	0	113.2
1106	S	32.2	Very low	34.5	Very low	89 Å²	89	131.1 Å²	131.1	62%	0.622	76%	0.758	S	S	*	*			trans	-154.3	-179.8	-158.5	58.2	0	0	0	0	111.9
1107	E	38.8	Very low	34.7	Very low	162 Å²	162	127.7 Å²	127.7	76%	0.757	76%	0.755	S	S	*	*			cis	-152.8	152.4	28	-76.9	-160.3	100.5	0	0	115
1108	T	34.2	Very low	34.8	Very low	109 Å²	109	128.3 Å²	128.3	67%	0.669	75%	0.754	S	S	*	*			trans	62.2	125.7	140.5	61.6	0	0	0	0	121.7
1109	S	32	Very low	35.1	Very low	117 Å²	117	132.6 Å²	132.6	82%	0.818	76%	0.763	S	S	*	*				86.9	145.1	74.6	-58	0	0	0	0	114.3
1110	A	34.6	Very low	35.4	Very low	81 Å²	81	134.1 Å²	134.1	67%	0.669	76%	0.759	S	S	*	*			cis	-168.6	175.3	-14.2	0	0	0	0	0	110.8
1111	S	34.9	Very low	35.5	Very low	110 Å²	110	132 Å²	132	77%	0.769	76%	0.761	S	S	*	*			trans	69.3	155.2	152.3	68.2	0	0	0	0	120.4
1112	L	31.7	Very low	35.6	Very low	168 Å²	168	127.9 Å²	127.9	88%	0.88	75%	0.753	S	S	*	*			cis	-158.9	173.1	-25.5	-100.6	-180	0	0	0	107.7
1113	P	38	Very low	35.6	Very low	113 Å²	113	128.3 Å²	128.3	73%	0.734	75%	0.751	S	S	*	*			trans	-118	-173.3	-158.4	44.6	-38.4	0	0	0	117.5
1114	S	30.8	Very low	35.7	Very low	112 Å²	112	128.2 Å²	128.2	78%	0.783	75%	0.75	S	S	*	*			trans	95.1	130	147.1	-160.3	0	0	0	0	120.4
1115	A	38.3	Very low	35.6	Very low	85 Å²	85	128.2 Å²	128.2	70%	0.702	75%	0.746	S	S	*	*			trans	-178.5	125	131.7	0	0	0	0	0	113.8
1116	H	37.3	Very low	35.5	Very low	173 Å²	173	126.4 Å²	126.4	80%	0.801	74%	0.735	S	S	*	*			trans	37.9	128.9	143.8	-65.1	-82.1	0	0	0	122.9
1117	C	31.6	Very low	35.5	Very low	110 Å²	110	128.3 Å²	128.3	74%	0.743	73%	0.733	S	S	*	*				83.3	144.5	76.6	-132.9	0	0	0	0	112.3
1118	E	36.1	Very low	35.3	Very low	181 Å²	181	129.4 Å²	129.4	85%	0.846	73%	0.73	S	S	*	*			cis	-142.4	-173.9	32.3	-56.2	-174.6	95.8	0	0	115.4
1119	Q	34.3	Very low	35.1	Very low	187 Å²	187	130.5 Å²	130.5	87%	0.874	73%	0.731	S	S	*	*			trans	-105.8	-150	178.6	-55.3	-167.3	-55.5	0	0	111.1
1120	P	41.1	Very low	35.2	Very low	111 Å²	111	131.1 Å²	131.1	72%	0.721	73%	0.726	S	S	*	*			cis	-147.8	170.3	1.6	45.2	-24.7	0	0	0	121.6
1121	A	35.2	Very low	34.9	Very low	94 Å²	94	136.9 Å²	136.9	78%	0.777	73%	0.73	S	S	*	*			trans	64.2	167.8	149.1	0	0	0	0	0	119.2
1122	D	37.9	Very low	34.8	Very low	127 Å²	127	137.6 Å²	137.6	68%	0.679	72%	0.724	S	S	*	*			cis	-156.5	165.1	10.5	-161.5	10.3	0	0	0	113.8
1123	Q	39	Very low	34.8	Very low	158 Å²	158	137.7 Å²	137.7	74%	0.738	72%	0.718	S	S	*	*			trans	59.5	150.1	153.8	-85	177.9	76.5	0	0	121.4
1124	S	37.1	Very low	34.4	Very low	79 Å²	79	135.5 Å²	135.5	55%	0.552	72%	0.715	S	S	*	*			cis	-172.4	144.5	-20.5	-135.1	0	0	0	0	112
1125	Q	34	Very low	34.4	Very low	146 Å²	146	139.6 Å²	139.6	68%	0.682	72%	0.72	S	S	*	*			trans	60.8	156.9	143.1	-67.7	174.3	36.4	0	0	119
1126	K	35.4	Very low	34	Very low	142 Å²	142	139.6 Å²	139.6	62%	0.617	72%	0.719	S	S	*	*			cis	-165.3	-179.9	2.2	-115.7	165	-178.3	157.6	0	106.5
1127	F	32.6	Very low	33.8	Very low	130 Å²	130	138.6 Å²	138.6	57%	0.57	72%	0.719	S	S	*	*			cis	-165.2	154.5	3.5	-128.2	159.6	0	0	0	109.1
1128	R	34.7	Very low	33.7	Very low	184 Å²	184	141.1 Å²	141.1	69%	0.694	72%	0.72	S	S	*	*			trans	69.3	131.1	146.2	-71.8	162.8	-177.7	-178.7	-0.7	119.9
1129	D	30.1	Very low	33.5	Very low	132 Å²	132	137 Å²	137	71%	0.706	71%	0.712	S	S	*	*				71.6	137.8	57.7	-53.1	-49.5	0	0	0	111.9
1130	D	35.5	Very low	33.4	Very low	131 Å²	131	136.9 Å²	136.9	70%	0.701	71%	0.708	S	S	*	*			cis	-126.8	162.8	10.1	-85	-76.3	0	0	0	110.8
1131	R	28.3	Very low	32.9	Very low	202 Å²	202	138 Å²	138	76%	0.762	71%	0.713	S	S	*	*			cis	84.9	140.5	31.4	-145.7	-165.3	179.7	-169.4	1.7	114.7
1132	L	31.4	Very low	33	Very low	124 Å²	124	137.4 Å²	137.4	65%	0.649	71%	0.708	S	S	*	*			trans	71.8	147	169.3	-54.4	170.1	0	0	0	115.8
1133	K	31.8	Very low	33.1	Very low	171 Å²	171	136.7 Å²	136.7	74%	0.743	71%	0.71	S	S	*	*			cis	-140.6	163.4	-2.1	-97.7	134.6	-174.9	174.8	0	108.4
1134	G	28.9	Very low	32.9	Very low	66 Å²	66	137.6 Å²	137.6	68%	0.68	71%	0.714	S	S	*	*				64.2	131.9	89.5	0	0	0	0	0	112.7
1135	F	32.6	Very low	32.7	Very low	199 Å²	199	141.7 Å²	141.7	87%	0.873	73%	0.729	S	S	*	*			cis	-143.9	148.4	23.2	-71.7	-100.2	0	0	0	108.4
1136	A	29.1	Very low	32.6	Very low	84 Å²	84	139.5 Å²	139.5	69%	0.694	73%	0.726	S	S	*	*				77.6	100.5	52	0	0	0	0	0	115
1137	L	33.8	Very low	32.4	Very low	153 Å²	153	139.4 Å²	139.4	80%	0.801	73%	0.732	S	S	*	*			trans	-176.6	105.9	143.5	-119.6	67.8	0	0	0	106.4
1138	E	29.6	Very low	32.5	Very low	162 Å²	162	139 Å²	139	76%	0.757	74%	0.74	S	S	*	*				66.3	104	91.6	-66.1	-177.3	135.9	0	0	114.3
1139	S	30.6	Very low	32.5	Very low	96 Å²	96	136.2 Å²	136.2	67%	0.671	75%	0.746	S	S	*	*				108.5	153.7	107.3	70.8	0	0	0	0	111.6
1140	F	32.2	Very low	32.4	Very low	184 Å²	184	134.8 Å²	134.8	81%	0.807	75%	0.746	S	S	*	*			cis	-136.1	141.6	12.3	-96.2	-99	0	0	0	112.5
1141	V	32.1	Very low	32	Very low	134 Å²	134	133.4 Å²	133.4	81%	0.812	75%	0.746	S	S	*	*			trans	60.6	128.5	133.9	174.5	0	0	0	0	122.4
1142	A	35.9	Very low	32.1	Very low	82 Å²	82	134 Å²	134	68%	0.678	75%	0.748	S	S	*	*			trans	-108.3	-141.1	161.5	0	0	0	0	0	108.2
1143	P	41.4	Very low	31.9	Very low	112 Å²	112	134.8 Å²	134.8	73%	0.727	75%	0.753	S	S	*	*			cis	-100.8	177.5	-35.7	5.6	21	0	0	0	110.5
1144	E	32.9	Very low	32	Very low	176 Å²	176	130.6 Å²	130.6	82%	0.822	76%	0.759	S	S	*	*				59.6	123.9	60.5	-161.2	-176.6	-175.5	0	0	115.3
1145	L	33.2	Very low	32.1	Very low	165 Å²	165	133.1 Å²	133.1	86%	0.864	77%	0.766	S	S	*	*			trans	-168.9	161.4	139.9	-108.5	173.7	0	0	0	113
1146	T	32.6	Very low	32.4	Very low	100 Å²	100	128.1 Å²	128.1	61%	0.613	75%	0.753	S	S	*	*			trans	-78.9	172.5	-178.2	46.9	0	0	0	0	111.5
1147	D	31.2	Very low	32.5	Very low	141 Å²	141	132.4 Å²	132.4	75%	0.754	76%	0.759	S	S	*	*				-170.2	175	59.1	-118.9	-59.8	0	0	0	117.3
1148	V	33.8	Very low	32.4	Very low	121 Å²	121	133.1 Å²	133.1	73%	0.733	76%	0.758	S	S	*	*			trans	-90.7	153.9	-178.4	-139.1	0	0	0	0	110.7
1149	P	36.1	Very low	32.5	Very low	126 Å²	126	133.8 Å²	133.8	82%	0.818	76%	0.761	S	S	*	*				-153.7	165.5	84.2	39.8	-20.2	0	0	0	118.1
1150	S	27.2	Very low	32.6	Very low	102 Å²	102	133.2 Å²	133.2	71%	0.713	76%	0.763	S	S	*	*			trans	-55.6	151	162.8	169.7	0	0	0	0	114.9
1151	C	26.8	Very low	32.7	Very low	102 Å²	102	132.1 Å²	132.1	69%	0.689	76%	0.764	S	S	*	*				-178.4	132.1	125.4	-98.3	0	0	0	0	115.2
1152	R	31.6	Very low	32.5	Very low	213 Å²	213	131 Å²	131	80%	0.804	76%	0.762	S	S	*	*			trans	63.5	169.4	143.5	-61.1	-173.2	149	147.5	-2.1	119
1153	D	27.5	Very low	32.5	Very low	141 Å²	141	131.2 Å²	131.2	75%	0.754	76%	0.764	S	S	*	*			cis	-167.6	129.8	-38.3	-89.2	-29.3	0	0	0	103.5
1154	G	33.9	Very low	32.1	Very low	84 Å²	84	133.5 Å²	133.5	87%	0.866	77%	0.765	S	S	*	*			trans	168.4	123.8	178.9	0	0	0	0	0	116.5
1155	S	29.7	Very low	32.2	Very low	118 Å²	118	131 Å²	131	83%	0.825	76%	0.756	S	S	*	*			trans	-156.7	170.3	174	-133.4	0	0	0	0	107.3
1156	P	39.4	Very low	32.1	Very low	95 Å²	95	129.9 Å²	129.9	62%	0.617	75%	0.752	S	S	*	*			cis	-134.3	-178	-3	39	-19.9	0	0	0	114.6
1157	E	30.6	Very low	32.3	Very low	173 Å²	173	129.6 Å²	129.6	81%	0.808	76%	0.759	S	S	*	*			trans	56.7	140.3	138.6	-75.1	164.8	148.8	0	0	125.8
1158	E	32.1	Very low	32.4	Very low	168 Å²	168	130.6 Å²	130.6	79%	0.785	76%	0.759	S	S	*	*			trans	89	123.7	142.7	-83.5	-170.1	154.2	0	0	125.4
1159	E	31.3	Very low	32.2	Very low	177 Å²	177	131.3 Å²	131.3	83%	0.827	76%	0.755	S	S	*	*			trans	72.5	158.5	142.5	-69	-138.9	105.8	0	0	124
1160	A	33.1	Very low	32	Very low	84 Å²	84	131.2 Å²	131.2	69%	0.694	75%	0.747	S	S	*	*			trans	75.7	88.8	159.5	0	0	0	0	0	120.9
1161	L	33.5	Very low	32.3	Very low	161 Å²	161	133.6 Å²	133.6	84%	0.843	75%	0.75	S	S	*	*				65.3	119.5	123.7	-64	168.3	0	0	0	121.7
1162	S	28.6	Very low	32.5	Very low	109 Å²	109	133.4 Å²	133.4	76%	0.762	75%	0.75	S	S	*	*			trans	76.5	148.2	133	74.3	0	0	0	0	120.7
1163	A	36.5	Very low	32.4	Very low	87 Å²	87	127.2 Å²	127.2	72%	0.719	75%	0.745	S	S	*	*			trans	64.9	150.5	169.3	0	0	0	0	0	117.2
1164	Q	31.6	Very low	32.7	Very low	161 Å²	161	128.7 Å²	128.7	75%	0.752	75%	0.746	S	S	*	*			cis	-165.9	155.7	-34.9	-131.1	179.5	-81.5	0	0	109.3
1165	L	35	Very low	32.4	Very low	122 Å²	122	129 Å²	129	64%	0.639	74%	0.736	S	S	*	*			trans	64.4	112.8	155.7	-55	173.9	0	0	0	120.6
1166	D	32.7	Very low	32.4	Very low	143 Å²	143	134.5 Å²	134.5	77%	0.765	74%	0.738	S	S	*	*				72.3	150.8	114.9	-55.1	-6.2	0	0	0	124.5
1167	A	35.7	Very low	32.1	Very low	93 Å²	93	134.5 Å²	134.5	77%	0.769	74%	0.74	S	S	*	*			trans	72.9	148.7	147.9	0	0	0	0	0	120.2
1168	Q	32.9	Very low	32.3	Very low	162 Å²	162	133.8 Å²	133.8	76%	0.757	74%	0.741	S	S	*	*			cis	-157.6	175.6	-38.6	-145.1	176.1	-52.1	0	0	108.8
1169	E	30.8	Very low	32.4	Very low	137 Å²	137	129.2 Å²	129.2	64%	0.64	73%	0.731	S	S	*	*			trans	-41.4	146.6	171.3	-56	150.5	114.4	0	0	114.9
1170	N	32.4	Very low	32.8	Very low	124 Å²	124	127.9 Å²	127.9	66%	0.663	73%	0.73	S	S	*	*				177.5	127.1	101.8	-94	-59.3	0	0	0	116.3
1171	I	31.9	Very low	33	Very low	152 Å²	152	129.9 Å²	129.9	78%	0.779	73%	0.729	S	S	*	*				57.7	143.1	125.1	-66.2	176.5	0	0	0	122.3
1172	S	31.3	Very low	33.3	Very low	98 Å²	98	129.1 Å²	129.1	69%	0.685	72%	0.721	S	S	*	*			trans	85	90.3	154	-174.8	0	0	0	0	121.6
1173	A	29.1	Very low	33.7	Very low	83 Å²	83	131.7 Å²	131.7	69%	0.686	72%	0.719	S	S	*	*				51.8	157	106.5	0	0	0	0	0	124.2
1174	H	33.7	Very low	33.6	Very low	171 Å²	171	133.4 Å²	133.4	79%	0.792	72%	0.716	S	S	*	*			trans	84.8	94.6	157.6	-76.5	-64.7	0	0	0	123
1175	S	28.5	Very low	33.6	Very low	92 Å²	92	134.2 Å²	134.2	64%	0.643	72%	0.72	S	S	*	*				71.3	119.3	110.5	-59	0	0	0	0	124.1
1176	R	30.9	Very low	34.1	Very low	232 Å²	232	133 Å²	133	88%	0.875	72%	0.719	S	S	*	*				87.2	105.4	128.1	-73.8	179.1	173.8	179.1	-2.9	123.6
1177	S	31.4	Very low	34.1	Very low	95 Å²	95	135.7 Å²	135.7	66%	0.664	73%	0.727	S	S	*	*				87.9	150.5	107.1	76.2	0	0	0	0	124.4
1178	I	35.3	Very low	34.1	Very low	159 Å²	159	135 Å²	135	82%	0.815	73%	0.73	S	S	*	*			trans	82.6	139.6	156	-68.1	159.5	0	0	0	117.6
1179	A	35.3	Very low	34.3	Very low	71 Å²	71	132.5 Å²	132.5	59%	0.587	73%	0.73	S	S	*	*			cis	-171.2	179	-23.5	0	0	0	0	0	112.9
1180	D	37.9	Very low	34.5	Very low	150 Å²	150	134.5 Å²	134.5	80%	0.802	74%	0.739	S	S	*	*			trans	94.9	132.1	144	-58.9	-34.3	0	0	0	126.1
1181	D	38.4	Very low	34.5	Very low	126 Å²	126	133 Å²	133	67%	0.674	74%	0.744	S	S	*	*			trans	99.1	97.5	134.6	-86.7	-4.9	0	0	0	127.2
1182	Q	39.4	Very low	34.6	Very low	144 Å²	144	129.7 Å²	129.7	67%	0.673	74%	0.739	S	S	*	*				101.8	134.2	108.5	-91.8	179.7	59.6	0	0	126.8
1183	F	37.1	Very low	34.6	Very low	163 Å²	163	134.2 Å²	134.2	72%	0.715	75%	0.747	S	S	*	*			trans	103.5	119.6	141.1	-104.4	-107	0	0	0	125.3
1184	N	34.1	Very low	34.7	Very low	124 Å²	124	137.3 Å²	137.3	66%	0.663	75%	0.745	S	S	*	*			trans	52.6	128.4	155.3	-70.6	3	0	0	0	122.3
1185	Q	32.8	Very low	34.5	Very low	177 Å²	177	136 Å²	136	83%	0.827	74%	0.739	S	S	*	*			cis	70.1	154	32.7	-116.6	-165.9	82.1	0	0	114.2
1186	P	44.5	Very low	34.6	Very low	96 Å²	96	137 Å²	137	62%	0.623	74%	0.742	S	S	*	*			cis	-148.7	-170.7	1.2	41.4	-18.5	0	0	0	118.8
1187	E	32.1	Very low	34.7	Very low	200 Å²	200	130.7 Å²	130.7	94%	0.935	73%	0.733	S	S	*	*			trans	71.8	149.3	153.6	-52.8	-152.8	144.8	0	0	125.1
1188	G	36.2	Very low	34.6	Very low	80 Å²	80	134.5 Å²	134.5	83%	0.825	74%	0.743	S	S	*	*			trans	157.2	108.6	166.9	0	0	0	0	0	115.6
1189	S	37.6	Very low	34.3	Very low	108 Å²	108	136 Å²	136	76%	0.755	75%	0.747	S	S	*	*			trans	-79.3	177.9	178.6	62	0	0	0	0	113.4
1190	E	35.7	Very low	33.9	Very low	179 Å²	179	136.8 Å²	136.8	84%	0.836	76%	0.761	S	S	*	*			cis	-158.1	-172.2	18.2	-149.9	164.4	126.6	0	0	113.7
1191	A	31.5	Very low	33.4	Very low	92 Å²	92	133.1 Å²	133.1	76%	0.76	76%	0.759	S	S	*	*			trans	-70.2	-175.9	-179.6	0	0	0	0	0	113.9
1192	A	34.4	Very low	33	Very low	83 Å²	83	131.7 Å²	131.7	69%	0.686	77%	0.765	S	S	*	*			cis	-168.6	177.8	26.4	0	0	0	0	0	114.4
1193	F	31.1	Very low	32.6	Very low	193 Å²	193	135 Å²	135	85%	0.846	77%	0.772	S	S	*	*			trans	72.9	147.1	145.7	-119.8	-111.3	0	0	0	119.6
1194	F	31	Very low	32.2	Very low	148 Å²	148	136.8 Å²	136.8	65%	0.649	78%	0.78	S	S	*	*			cis	-157.2	163.1	-36.3	-166.5	-100.8	0	0	0	110.9
1195	E	30	Very low	32.4	Very low	144 Å²	144	137.1 Å²	137.1	67%	0.673	79%	0.792	S	S	*	*			trans	-50.4	162.6	-174.7	-131.3	172.9	146.6	0	0	121.2
1196	T	30.6	Very low	32.2	Very low	112 Å²	112	133.5 Å²	133.5	69%	0.687	79%	0.792	S	S	*	*			trans	89	131.3	145.4	26.8	0	0	0	0	125.6
1197	S	32.2	Very low	31.7	Very low	101 Å²	101	134.4 Å²	134.4	71%	0.706	80%	0.798	S	S	*	*			trans	79.7	99	137	-64.7	0	0	0	0	124
1198	M	30.4	Very low	31.4	Very low	174 Å²	174	129.3 Å²	129.3	86%	0.857	78%	0.784	S	S	*	*				59.3	129.4	119.4	-73.7	-176.5	140	0	0	123.6
1199	E	27.9	Very low	31.1	Very low	192 Å²	192	132.9 Å²	132.9	90%	0.897	79%	0.785	S	S	*	*			trans	65.5	97.4	152.6	-61.1	-165.3	151.2	0	0	121.3
1200	G	26.6	Very low	30.8	Very low	87 Å²	87	133.3 Å²	133.3	90%	0.897	79%	0.788	S	S	*	*				126.4	108.2	127.5	0	0	0	0	0	120
1201	G	27.6	Very low	30.4	Very low	73 Å²	73	130.5 Å²	130.5	75%	0.753	78%	0.782	S	S	*	*			trans	121.6	118.3	140.2	0	0	0	0	0	120
1202	A	29.3	Very low	30.2	Very low	96 Å²	96	132 Å²	132	79%	0.793	78%	0.778	S	S	*	*			trans	64.2	166.8	159.6	0	0	0	0	0	117
1203	Y	32	Very low	29.8	Very low	212 Å²	212	132 Å²	132	83%	0.831	77%	0.773	S	S	*	*			cis	-148	144.9	4.9	23.8	-97.7	0	0	0	112.7
1204	K	29.5	Very low	29.7	Very low	201 Å²	201	126.3 Å²	126.3	87%	0.874	75%	0.75	S	S	*	*			trans	17.7	121.5	156.8	-59.1	178.2	-179.2	178	0	121
1205	S	36.7	Very low	29.6	Very low	132 Å²	132	123.7 Å²	123.7	92%	0.923	75%	0.746	S	S	*	*			trans	-160.2	158.1	144.3	-81.6	0	0	0	0	110.3
1206	A	30.2	Very low	29.6	Very low	100 Å²	100	122 Å²	122	83%	0.826	75%	0.745	S	S	*	*			trans	-151	171.1	-168.2	0	0	0	0	0	110.8
1207	P	32.7	Very low	29.5	Very low	116 Å²	116	120.7 Å²	120.7	75%	0.753	75%	0.746	S	S	*	*			cis	-137	-158.2	10.4	45.1	-27.1	0	0	0	115.1
1208	S	26.8	Very low	29.5	Very low	92 Å²	92	123 Å²	123	64%	0.643	75%	0.746	S	S	*	*			trans	75.8	102.3	157.9	60	0	0	0	0	120.4
1209	N	29.8	Very low	29.6	Very low	155 Å²	155	121.4 Å²	121.4	83%	0.829	73%	0.734	S	S	*	*				56.6	72.5	128.2	-54.8	-9.2	0	0	0	116.4
1210	S	29.8	Very low	29.7	Very low	118 Å²	118	122.8 Å²	122.8	83%	0.825	73%	0.731	S	S	*	*				68.4	70	85.8	-168.7	0	0	0	0	113.1
1211	V	27.4	Very low	30.2	Very low	119 Å²	119	127 Å²	127	72%	0.721	73%	0.725	S	S	*	*			trans	-57.1	165.2	160.8	-68.6	0	0	0	0	112.6
1212	D	28.1	Very low	30.4	Very low	123 Å²	123	132 Å²	132	66%	0.658	73%	0.726	S	S	*	*			trans	68.6	111.7	147.2	-83.9	-50.3	0	0	0	122.2
1213	S	27.1	Very low	30.4	Very low	83 Å²	83	132.7 Å²	132.7	58%	0.58	73%	0.725	S	S	*	*				90	145.1	116.2	-76.2	0	0	0	0	122.6
1214	M	27.5	Very low	30.5	Very low	74 Å²	74	129.7 Å²	129.7	37%	0.365	72%	0.722	S	S	.	*			trans	74.6	92.4	149.4	-73.1	163.4	154.6	0	0	121.6	K37 E40	K37-M1214 HydrophobicContact CB-CE 4Å; K37-M1214 HydrophobicContact CB-SD 3.59Å; K37-M1214 VanDerWaalsContact CB-SD 3.59Å; K37-M1214 HydrophobicContact CD-CB 3.74Å; K37-M1214 HydrophobicContact CD-CG 4.26Å; K37-M1214 HydrophobicContact CD-SD 3.95Å; K37-M1214 HydrophobicContact CG-CB 4.19Å; K37-M1214 HydrophobicContact CG-CE 4Å; K37-M1214 HydrophobicContact CG-CG 4.15Å; K37-M1214 HydrophobicContact CG-SD 3.51Å; K37-M1214 VanDerWaalsContact CG-SD 3.51Å; K37-M1214 PolarHBondContact NZ-O 2.86Å; E40-M1214 HydrophobicContact CB-CE 4.42Å
1215	T	29.1	Very low	30.5	Very low	94 Å²	94	126.9 Å²	126.9	58%	0.577	71%	0.714	S	S	*	*				58.2	139	126.3	62.5	0	0	0	0	122.3	E33 K37	E33-T1215 WeakPolarHBondContact OE1-CB 3.31Å; E33-T1215 PolarHBondContact OE1-OG1 3.34Å; K37-T1215 WeakPolarHBondContact CE-OG1 3.34Å; K37-T1215 PolarHBondContact NZ-O 2.97Å; K37-T1215 PolarHBondContact NZ-OG1 2.97Å
1216	T	29.6	Very low	30.4	Very low	107 Å²	107	127.5 Å²	127.5	66%	0.656	71%	0.707	S	S	*	*				-161.1	165.8	129.5	24.8	0	0	0	0	110.1
1217	A	29	Very low	30.6	Very low	85 Å²	85	131.5 Å²	131.5	70%	0.702	70%	0.701	S	S	*	*			trans	55.4	103	166	0	0	0	0	0	118.8
1218	E	31.6	Very low	30.8	Very low	151 Å²	151	133.3 Å²	133.3	71%	0.706	70%	0.703	S	S	*	*				76.3	152.9	60.6	-65.7	-159.4	117.6	0	0	116.2
1219	K	32.6	Very low	31.2	Very low	139 Å²	139	134.7 Å²	134.7	60%	0.604	70%	0.702	S	S	*	*			cis	-156	153.1	6	-129.4	155	-178.1	136.2	0	109.3
1220	R	31.6	Very low	31.6	Very low	222 Å²	222	131.8 Å²	131.8	84%	0.838	69%	0.692	S	S	*	*			trans	76.1	145.1	164	-57.1	168.8	179.1	178.9	0.9	118.9
1221	K	36.1	Very low	31.8	Very low	175 Å²	175	127.9 Å²	127.9	76%	0.761	67%	0.67	S	S	*	*			cis	-167.6	128.1	-20	-118.5	-179.3	179.5	177	0	113.3
1222	K	32.6	Very low	32	Very low	178 Å²	178	129.7 Å²	129.7	77%	0.774	66%	0.664	S	S	*	*			trans	61.6	154.9	145.3	-67.6	-171.8	174.3	-163.1	0	122.4
1223	S	29.4	Very low	32.1	Very low	111 Å²	111	128.3 Å²	128.3	78%	0.776	66%	0.664	S	S	*	*			trans	72.6	134.7	-179.8	-84.1	0	0	0	0	117.4
1224	L	32.8	Very low	32.1	Very low	149 Å²	149	132.1 Å²	132.1	78%	0.78	68%	0.677	S	S	*	*			cis	-148.8	157.8	-4	-169.2	136.5	0	0	0	111
1225	M	30.2	Very low	32.3	Very low	141 Å²	141	132.9 Å²	132.9	70%	0.695	70%	0.696	S	S	*	*			trans	-81.7	136.3	-164	-164.3	105.8	146.3	0	0	115.5
1226	N	34.1	Very low	32.2	Very low	145 Å²	145	133.5 Å²	133.5	78%	0.775	70%	0.704	S	S	*	*			trans	156.8	106.5	132.5	-85.2	-0.9	0	0	0	114.3
1227	R	35.3	Very low	32.2	Very low	184 Å²	184	137.3 Å²	137.3	69%	0.694	71%	0.714	S	S	*	*			trans	157.3	149.4	165.4	-97.6	164.5	176.6	173.9	-6.3	107	S809	S809-R1227 PolarHBondContact OG-NH1 2.78Å; S809-R1227 PolarHBondContact OG-NH2 3.48Å
1228	L	37.4	Very low	32.2	Very low	155 Å²	155	136.5 Å²	136.5	81%	0.812	70%	0.703	S	S	*	*			cis	-135.9	-177.3	2.6	-62.4	88.5	0	0	0	110.7
1229	I	35.3	Very low	32.1	Very low	121 Å²	121	137.3 Å²	137.3	62%	0.621	71%	0.709	S	S	*	*			trans	-118	138.6	148.7	-68	178.6	0	0	0	107.3
1230	P	37.5	Very low	31.8	Very low	94 Å²	94	139.8 Å²	139.8	61%	0.61	73%	0.729	S	S	*	*			trans	-107.5	172.9	-158.4	41	-34.9	0	0	0	114.8	R764	R764-P1230 PolarHBondContact NE-O 2.62Å; R764-P1230 PolarHBondContact NH2-O 2.88Å
1231	G	32.8	Very low	31.7	Very low	35 Å²	35	131.6 Å²	131.6	36%	0.361	71%	0.714	S	S	.	*			trans	-167.8	136.7	176.8	0	0	0	0	0	119.7
1232	R	32.6	Very low	31.5	Very low	158 Å²	158	126.1 Å²	126.1	60%	0.596	69%	0.691	S	S	*	*			trans	61.5	90.6	169.1	-74.4	-172.4	163.2	-166.8	-11.3	118.8	Q766	Q766-R1232 PolarHBondContact O-NH1 3.45Å
1233	S	30.1	Very low	31.4	Very low	94 Å²	94	121 Å²	121	66%	0.657	68%	0.677	S	S	*	*				27.5	131.8	115.3	57.9	0	0	0	0	118.5
1234	N	27.1	Very low	31.5	Very low	162 Å²	162	116.9 Å²	116.9	87%	0.866	65%	0.646	S	S	*	*			cis	-132.3	-167.4	25.9	-84.2	-34.5	0	0	0	113.3
1235	A	31.7	Very low	31.5	Very low	91 Å²	91	114.7 Å²	114.7	75%	0.752	64%	0.638	S	S	*	*			trans	76.1	56.7	176.5	0	0	0	0	0	117.6
1236	S	26.7	Very low	31.5	Very low	106 Å²	106	112.8 Å²	112.8	74%	0.741	63%	0.634	S	S	*	*				27.1	130.9	129.4	58.6	0	0	0	0	122.1
1237	Q	29.1	Very low	31.3	Very low	187 Å²	187	111 Å²	111	87%	0.874	63%	0.628	S	S	*	*			trans	80.8	163.1	154.5	-61.4	178.1	15.8	0	0	119.5
1238	S	29.3	Very low	31.1	Very low	68 Å²	68	106.7 Å²	106.7	48%	0.476	63%	0.627	S	S	.	*			trans	64.2	99.2	-172.5	-163	0	0	0	0	114.7	C1243	S1238-C1243 WeakPolarHBondContact CB-SG 3.34Å; S1238-C1243 PolarHBondContact OG-SG 3.01Å
1239	M	29.4	Very low	31.1	Very low	169 Å²	169	104 Å²	104	83%	0.833	61%	0.613	S	S	*	*				70.6	153.2	68	-59.6	-76.4	-167.6	0	0	113.5	G1241	M1239-G1241 PolarHBondContact O-N 3.07Å
1240	N	27.9	Very low	31.3	Very low	190 Å²	190	103.1 Å²	103.1	100%	1.016	61%	0.606	S	S	*	*	S	Bend	trans	-74.6	70.2	173	-79.4	-61.2	0	0	0	111
1241	G	28.3	Very low	31.9	Very low	50 Å²	50	100.4 Å²	100.4	52%	0.515	59%	0.588	S	S	.	*	S	Bend	trans	-134	167	174	0	0	0	0	0	111.1	M1239 C1243	M1239-G1241 PolarHBondContact O-N 3.07Å; G1241-C1243 PolarHBondContact O-N 3.17Å; G1241-C1243 VanDerWaalsContact O-N 3.1Å
1242	M	32.5	Very low	32.5	Very low	60 Å²	60	100 Å²	100	30%	0.296	58%	0.584	S	S	.	*			trans	-80.6	87	178.5	-168.5	86	75.4	0	0	109.6	F1244 Y1355	M1242-F1244 HydrophobicContact CG-CE2 4.33Å; M1242-F1244 PolarHBondContact O-N 2.84Å; M1242-F1244 VanDerWaalsContact O-N 3.17Å; M1242-Y1355 HydrophobicContact CE-CE2 4.31Å
1243	C	29.5	Very low	32.8	Very low	70 Å²	70	95 Å²	95	47%	0.473	57%	0.571	S	S	.	*			trans	-71.7	107.5	175.8	-69.8	0	0	0	0	110.9	S1238 G1241	S1238-C1243 WeakPolarHBondContact CB-SG 3.34Å; S1238-C1243 PolarHBondContact OG-SG 3.01Å; G1241-C1243 PolarHBondContact O-N 3.17Å; G1241-C1243 VanDerWaalsContact O-N 3.1Å
1244	F	33	Very low	33	Very low	26 Å²	26	94.8 Å²	94.8	11%	0.114	57%	0.567	C	S	.	*			trans	-75.5	126.3	166.5	-78.9	-72.2	0	0	0	111.2	M1242 K1360 Q1395 M1415	M1242-F1244 HydrophobicContact CG-CE2 4.33Å; M1242-F1244 PolarHBondContact O-N 2.84Å; M1242-F1244 VanDerWaalsContact O-N 3.17Å; F1244-K1360 HydrophobicContact CB-CG 4.36Å; F1244-K1360 WeakPolarHBondContact O-CE 3.29Å; F1244-Q1395 HydrophobicContact CZ-CB 4.25Å; F1244-Q1395 HydrophobicContact CZ-CG 3.94Å; F1244-M1415 HydrophobicContact CD1-SD 3.91Å; F1244-M1415 HydrophobicContact CE1-CG 4.18Å; F1244-M1415 HydrophobicContact CE1-SD 3.28Å; F1244-M1415 WeakPolarHBondContact CE1-SD 3.41Å; F1244-M1415 HydrophobicContact CZ-CG 4.32Å; F1244-M1415 HydrophobicContact CZ-SD 3.84Å
1245	V	32	Very low	33.5	Very low	103 Å²	103	91 Å²	91	62%	0.624	55%	0.552	S	S	*	*			trans	-88.2	105.4	163.1	179	0	0	0	0	107.3	T1247	V1245-T1247 HydrophobicContact CG1-CG2 3.87Å
1246	V	31	Very low	33.8	Very low	101 Å²	101	94.4 Å²	94.4	61%	0.612	56%	0.557	S	S	*	*			trans	-94.4	113.7	165	-179.6	0	0	0	0	106.6
1247	T	30	Very low	34.1	Very low	106 Å²	106	97.1 Å²	97.1	65%	0.65	56%	0.562	S	S	*	*			trans	-124	153.1	169.8	41.8	0	0	0	0	108.7	V1245	V1245-T1247 HydrophobicContact CG1-CG2 3.87Å
1248	S	30.9	Very low	34.1	Very low	95 Å²	95	92.6 Å²	92.6	66%	0.664	55%	0.552	S	S	*	*	S	Bend	trans	-61.2	150.9	-147.3	-50.7	0	0	0	0	117.4	R1306	S1248-R1306 PolarHBondContact O-NH1 3.43Å
1249	D	37	Very low	34.2	Very low	98 Å²	98	95.9 Å²	95.9	52%	0.524	57%	0.571	S	S	.	*			trans	75.2	87.6	174.1	-40.6	-26.7	0	0	0	114.3	R1306	D1249-R1306 VanDerWaalsContact CB-CZ 3.44Å; D1249-R1306 IonicContact OD2-CZ 3.81Å; D1249-R1306 IonicContact OD2-NH1 3.78Å; D1249-R1306 PolarHBondContact OD2-NH1 3.35Å; D1249-R1306 IonicContact OD2-NH2 3.26Å; D1249-R1306 PolarHBondContact OD2-NH2 2.87Å
1250	E	38.4	Very low	34.2	Very low	102 Å²	102	95.8 Å²	95.8	48%	0.477	57%	0.569	S	S	.	*			trans	-68.2	134	170.3	-58.9	-165	138.5	0	0	110.8	K1417	E1250-K1417 IonicContact OE2-NZ 2.92Å; E1250-K1417 PolarHBondContact OE2-NZ 3.36Å
1251	V	52	Low	34.4	Very low	38 Å²	38	93.6 Å²	93.6	23%	0.23	56%	0.563	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-103	122.1	162.1	-111.4	0	0	0	0	108.8	V1295	V1251-V1295 HydrophobicContact CG1-CG2 4.33Å
1252	G	43.7	Very low	34.4	Very low	27 Å²	27	95.5 Å²	95.5	28%	0.278	57%	0.568	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-158.6	149.8	177.7	0	0	0	0	0	110.4	P1254	G1252-P1254 WeakPolarHBondContact O-CD 3.41Å
1253	V	39.1	Very low	34.4	Very low	53 Å²	53	101.1 Å²	101.1	32%	0.321	59%	0.591	S	S	.	*			trans	-66.6	121.2	-175.4	-175	0	0	0	0	110.2	V1295	V1253-V1295 HydrophobicContact CG2-CG1 3.8Å; V1253-V1295 WeakPolarHBondContact CG2-O 3.19Å
1254	P	34.7	Very low	34.4	Very low	89 Å²	89	104 Å²	104	58%	0.578	60%	0.602	S	S	*	*			trans	-81.6	130.5	172.8	32	-31.7	0	0	0	110.3	G1252 N1256	G1252-P1254 WeakPolarHBondContact O-CD 3.41Å; P1254-N1256 PolarHBondContact O-N 3.38Å
1255	P	38.5	Very low	34.5	Very low	83 Å²	83	111 Å²	111	54%	0.539	64%	0.639	S	S	.	*	T	Hydrogen-bonded Turn	trans	-75.9	105.5	173.7	29.7	-31.5	0	0	0	110.1
1256	N	36.2	Very low	34.5	Very low	161 Å²	161	112 Å²	112	86%	0.861	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	165.4	-3.9	143	-92.8	-57.5	0	0	0	116.4	P1254	P1254-N1256 PolarHBondContact O-N 3.38Å
1257	L	34	Very low	34.8	Very low	163 Å²	163	115.7 Å²	115.7	85%	0.853	65%	0.653	S	S	*	*			trans	-97.7	121.5	-171.9	-66.9	177.5	0	0	0	114.7
1258	S	30	Very low	35.2	Very low	93 Å²	93	118.7 Å²	118.7	65%	0.65	66%	0.659	S	S	*	*			trans	-79	150.9	168.7	53	0	0	0	0	112.1	Q1260	S1258-Q1260 PolarHBondContact O-N 3.1Å
1259	P	30.6	Very low	35.4	Very low	136 Å²	136	118.6 Å²	118.6	88%	0.883	66%	0.659	S	S	*	*	S	Bend	trans	-78.2	81.2	-173.3	32.5	-36.9	0	0	0	113.3
1260	Q	29.3	Very low	35.5	Very low	168 Å²	168	118.8 Å²	118.8	79%	0.785	67%	0.668	S	S	*	*			trans	-141.8	161.5	163.5	-71	-165.6	-17.2	0	0	110.6	S1258	S1258-Q1260 PolarHBondContact O-N 3.1Å
1261	T	31.4	Very low	35.5	Very low	144 Å²	144	123.5 Å²	123.5	88%	0.883	68%	0.681	S	S	*	*			trans	64.4	106.2	-175.6	61.4	0	0	0	0	116.2
1262	S	28.5	Very low	34.8	Very low	90 Å²	90	127.9 Å²	127.9	63%	0.629	70%	0.699	S	S	*	*			trans	-78.9	-172.8	154.8	53	0	0	0	0	111.1
1263	F	32.4	Very low	34.4	Very low	177 Å²	177	131.6 Å²	131.6	78%	0.776	72%	0.721	S	S	*	*			trans	101.6	107.1	167.8	-58.3	-70.4	0	0	0	118
1264	D	30.4	Very low	34.3	Very low	131 Å²	131	135.3 Å²	135.3	70%	0.701	74%	0.744	S	S	*	*				65.4	95	130	-52.2	-15	0	0	0	121
1265	I	33.9	Very low	34.3	Very low	174 Å²	174	137.8 Å²	137.8	89%	0.892	75%	0.752	S	S	*	*			trans	-117.8	105.2	134.7	-63.8	-177.9	0	0	0	108.1
1266	T	32.3	Very low	34	Very low	123 Å²	123	138.8 Å²	138.8	76%	0.755	76%	0.761	S	S	*	*			trans	-134.1	123	172.7	-72.4	0	0	0	0	109.4
1267	K	38.5	Very low	33.9	Very low	178 Å²	178	137.5 Å²	137.5	77%	0.774	75%	0.754	S	S	*	*			trans	158.2	140.1	170.2	-92.1	159.2	-178.4	178.2	0	105.7
1268	Q	36.8	Very low	33.8	Very low	169 Å²	169	138 Å²	138	79%	0.79	75%	0.752	S	S	*	*			cis	-155.3	156	-2.5	-106.1	153.1	-56.3	0	0	105.5
1269	S	36.2	Very low	34.1	Very low	93 Å²	93	139 Å²	139	65%	0.65	76%	0.76	S	S	*	*			cis	-163.7	147	5.2	45.9	0	0	0	0	111.9
1270	S	38	Very low	34.3	Very low	102 Å²	102	137.9 Å²	137.9	71%	0.713	76%	0.755	S	S	*	*			trans	58.2	148.5	140.7	58.4	0	0	0	0	121.9
1271	R	39.3	Very low	34.6	Very low	201 Å²	201	138.4 Å²	138.4	76%	0.758	76%	0.762	S	S	*	*			cis	-171.9	154.5	-10.2	-95.3	169.4	78.5	134.3	19.1	103.9
1272	E	37.3	Very low	34.9	Very low	131 Å²	131	136.9 Å²	136.9	61%	0.612	75%	0.752	S	S	*	*			cis	-155.1	153.4	-10.8	-97.6	155	169.4	0	0	105.1
1273	S	35.6	Very low	35.1	Very low	104 Å²	104	138.9 Å²	138.9	73%	0.727	76%	0.763	S	S	*	*			cis	93.6	94.1	33.7	-57	0	0	0	0	114.9
1274	T	36.4	Very low	34.9	Very low	132 Å²	132	140 Å²	140	81%	0.81	77%	0.767	S	S	*	*			trans	-175.4	122.7	136.1	34.9	0	0	0	0	107
1275	D	34.4	Very low	35.2	Very low	140 Å²	140	138.8 Å²	138.8	75%	0.749	77%	0.765	S	S	*	*				79.4	134.2	64.4	-81.7	-61.9	0	0	0	114.1
1276	S	32	Very low	35.5	Very low	105 Å²	105	139 Å²	139	73%	0.734	76%	0.762	S	S	*	*			cis	-164.8	-178.6	-4.4	-137.1	0	0	0	0	113.5
1277	N	33.8	Very low	35.7	Very low	133 Å²	133	141.1 Å²	141.1	71%	0.711	76%	0.763	S	S	*	*			trans	86.4	81.7	153.5	-149.4	1.4	0	0	0	122.1
1278	E	32.8	Very low	35.6	Very low	174 Å²	174	141.6 Å²	141.6	81%	0.813	77%	0.768	S	S	*	*				23.3	131.4	127.4	-43.4	-169.9	146.4	0	0	122.9
1279	S	35.5	Very low	36.3	Very low	115 Å²	115	135.1 Å²	135.1	80%	0.804	75%	0.747	S	S	*	*				179.8	105.1	121.7	-84.9	0	0	0	0	116.6
1280	S	34.5	Very low	37.3	Very low	112 Å²	112	134.3 Å²	134.3	78%	0.783	74%	0.741	S	S	*	*			trans	43.5	95.8	135.3	-59.4	0	0	0	0	123
1281	L	37.4	Very low	38.7	Very low	178 Å²	178	134.6 Å²	134.6	93%	0.932	73%	0.734	S	S	*	*			trans	-148.2	89.6	132.1	-84.5	-168.8	0	0	0	110.8
1282	V	35.8	Very low	39.9	Very low	113 Å²	113	126.5 Å²	126.5	69%	0.685	71%	0.713	S	S	*	*			trans	-133.1	118.1	179.6	179.9	0	0	0	0	112.2	K1284 V1285	V1282-K1284 PolarHBondContact O-N 3.43Å; V1282-K1284 VanDerWaalsContact O-N 3.12Å; V1282-V1285 HydrophobicContact CG1-CG2 4.39Å
1283	P	32.8	Very low	41.6	Very low	131 Å²	131	125.5 Å²	125.5	85%	0.851	71%	0.708	S	S	*	*			trans	-79.6	82.5	166.7	-14.7	31.9	0	0	0	112.2
1284	K	28.4	Very low	43.6	Very low	200 Å²	200	122.1 Å²	122.1	87%	0.87	68%	0.681	S	S	*	*			trans	41.5	94.8	167.4	-69.8	-163.2	170	-160.4	0	117.8	V1282	V1282-K1284 PolarHBondContact O-N 3.43Å; V1282-K1284 VanDerWaalsContact O-N 3.12Å
1285	V	37.5	Very low	45.5	Very low	107 Å²	107	117.3 Å²	117.3	65%	0.648	65%	0.651	S	S	*	*			trans	-60.8	142.1	147.3	175.6	0	0	0	0	108.8	V1282	V1282-V1285 HydrophobicContact CG1-CG2 4.39Å
1286	Q	39.2	Very low	47.5	Very low	177 Å²	177	118.4 Å²	118.4	83%	0.827	65%	0.651	S	S	*	*			trans	-72.9	138.9	173.2	-175.1	170.4	-8	0	0	109.5	Q1288	Q1286-Q1288 PolarHBondContact O-N 3.35Å
1287	E	37.3	Very low	49.9	Very low	168 Å²	168	114.8 Å²	114.8	79%	0.785	63%	0.631	S	S	*	*			trans	-44.9	122.2	-159.1	-74.8	120.2	152.7	0	0	115	G1289	E1287-G1289 PolarHBondContact O-N 2.98Å
1288	Q	37.5	Very low	52.6	Low	188 Å²	188	109.2 Å²	109.2	88%	0.879	60%	0.601	S	S	*	*			trans	-73.1	70.3	160.2	-75	-173.5	-22.3	0	0	108.8	Q1286	Q1286-Q1288 PolarHBondContact O-N 3.35Å
1289	G	49.9	Very low	55.4	Low	33 Å²	33	101 Å²	101	34%	0.34	56%	0.563	S	S	.	*			trans	-57.6	147.1	167.8	0	0	0	0	0	110.2	E1287 E1293	E1287-G1289 PolarHBondContact O-N 2.98Å; G1289-E1293 WeakPolarHBondContact CA-OE2 3.21Å
1290	S	58.5	Low	58.2	Low	77 Å²	77	98 Å²	98	54%	0.538	54%	0.54	S	S	.	.			trans	-61	161.4	178.2	74.8	0	0	0	0	110.8	G1292 E1293 F1294	S1290-G1292 PolarHBondContact O-N 2.86Å; S1290-G1292 VanDerWaalsContact O-N 3.09Å; S1290-G1292 PolarHBondContact OG-N 3.37Å; S1290-E1293 PolarHBondContact O-N 3.17Å; S1290-E1293 PolarHBondContact OG-N 3.08Å; S1290-F1294 PolarHBondContact O-N 2.69Å
1291	I	66.1	Low	60.9	Low	107 Å²	107	93 Å²	93	55%	0.549	51%	0.506	S	S	.	.	H	α-helix	trans	-58.2	-25.5	172.7	-163.4	168.7	0	0	0	111.9	V1295 I1309	I1291-V1295 WeakPolarHBondContact O-CB 3.43Å; I1291-V1295 VanDerWaalsContact O-CG2 3.26Å; I1291-V1295 WeakPolarHBondContact O-CG2 3.45Å; I1291-V1295 PolarHBondContact O-N 3.48Å; I1291-V1295 VanDerWaalsContact O-N 3.14Å; I1291-I1309 HydrophobicContact CD1-CD1 3.85Å; I1291-I1309 HydrophobicContact CG1-CD1 4.28Å
1292	G	65.7	Low	63.6	Low	31 Å²	31	84.5 Å²	84.5	32%	0.32	46%	0.462	S	S	.	.	H	α-helix	trans	-63.8	-50.7	169.2	0	0	0	0	0	112.6	S1290 F1294 V1295 E1296	S1290-G1292 PolarHBondContact O-N 2.86Å; S1290-G1292 VanDerWaalsContact O-N 3.09Å; S1290-G1292 PolarHBondContact OG-N 3.37Å; G1292-F1294 VanDerWaalsContact C-N 3.31Å; G1292-F1294 PolarHBondContact O-N 2.82Å; G1292-V1295 CarbonylContact O-C 3.58Å; G1292-V1295 WeakPolarHBondContact O-CA 3.28Å; G1292-V1295 PolarHBondContact O-N 2.91Å; G1292-E1296 WeakPolarHBondContact O-CG 3.37Å; G1292-E1296 PolarHBondContact O-N 3.3Å
1293	E	73.5	Confident	66.2	Low	111 Å²	111	79.2 Å²	79.2	52%	0.519	43%	0.43	S	S	.	.	H	α-helix	trans	-63.1	-36.1	178.6	-172.7	-178.7	173.6	0	0	112.4	G1289 S1290 G1297	G1289-E1293 WeakPolarHBondContact CA-OE2 3.21Å; S1290-E1293 PolarHBondContact O-N 3.17Å; S1290-E1293 PolarHBondContact OG-N 3.08Å; E1293-G1297 PolarHBondContact O-N 3.1Å
1294	F	77.6	Confident	68.7	Low	33 Å²	33	73.5 Å²	73.5	15%	0.145	39%	0.393	C	S	.	.	H	α-helix	trans	-59.3	-46.4	170.7	175.2	-89.4	0	0	0	111.5	S1290 G1292 G1297 L1298 V1304 A1308 I1309 Y1434	S1290-F1294 PolarHBondContact O-N 2.69Å; G1292-F1294 VanDerWaalsContact C-N 3.31Å; G1292-F1294 PolarHBondContact O-N 2.82Å; F1294-G1297 PolarHBondContact O-N 2.97Å; F1294-L1298 HydrophobicContact CE1-CD1 4.33Å; F1294-L1298 HydrophobicContact CE1-CD2 4.46Å; F1294-V1304 HydrophobicContact CE1-CG2 3.71Å; F1294-V1304 HydrophobicContact CZ-CG2 3.98Å; F1294-A1308 HydrophobicContact CZ-CB 4.12Å; F1294-I1309 HydrophobicContact CD1-CG1 4.09Å; F1294-I1309 HydrophobicContact CE1-CG1 3.77Å; F1294-I1309 HydrophobicContact CE2-CB 4.49Å; F1294-I1309 HydrophobicContact CE2-CG1 4.41Å; F1294-I1309 HydrophobicContact CZ-CB 4.46Å; F1294-I1309 HydrophobicContact CZ-CG1 3.95Å; F1294-Y1434 HydrophobicContact CE2-CE1 4.15Å; F1294-Y1434 WeakPolarHBondContact CE2-OH 3.34Å; F1294-Y1434 HydrophobicContact CZ-CE1 4.37Å
1295	V	76.4	Confident	71.3	Confident	30 Å²	30	65.2 Å²	65.2	18%	0.182	36%	0.364	C	S	.	.	H	α-helix	trans	-70.8	-44.1	-179.1	167.5	0	0	0	0	112.4	V1251 V1253 I1291 G1292 G1297 L1298	V1251-V1295 HydrophobicContact CG1-CG2 4.33Å; V1253-V1295 HydrophobicContact CG2-CG1 3.8Å; V1253-V1295 WeakPolarHBondContact CG2-O 3.19Å; I1291-V1295 WeakPolarHBondContact O-CB 3.43Å; I1291-V1295 VanDerWaalsContact O-CG2 3.26Å; I1291-V1295 WeakPolarHBondContact O-CG2 3.45Å; I1291-V1295 PolarHBondContact O-N 3.48Å; I1291-V1295 VanDerWaalsContact O-N 3.14Å; G1292-V1295 CarbonylContact O-C 3.58Å; G1292-V1295 WeakPolarHBondContact O-CA 3.28Å; G1292-V1295 PolarHBondContact O-N 2.91Å; V1295-G1297 PolarHBondContact O-N 2.92Å; V1295-L1298 WeakPolarHBondContact O-CB 3.25Å; V1295-L1298 PolarHBondContact O-N 3.47Å
1296	E	75.6	Confident	73.2	Confident	164 Å²	164	66.8 Å²	66.8	77%	0.766	36%	0.359	S	S	*	.	H	α-helix	trans	-59.6	-33.1	173.9	-74.4	179.6	-174.7	0	0	111.9	G1292 L1298	G1292-E1296 WeakPolarHBondContact O-CG 3.37Å; G1292-E1296 PolarHBondContact O-N 3.3Å; E1296-L1298 VanDerWaalsContact C-N 3.27Å; E1296-L1298 PolarHBondContact O-N 3.04Å
1297	G	83.1	Confident	75	Confident	29 Å²	29	62.5 Å²	62.5	30%	0.299	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.6	8.4	175.2	0	0	0	0	0	115.5	E1293 F1294 V1295 K1432	E1293-G1297 PolarHBondContact O-N 3.1Å; F1294-G1297 PolarHBondContact O-N 2.97Å; V1295-G1297 PolarHBondContact O-N 2.92Å; G1297-K1432 WeakPolarHBondContact O-CD 3.23Å; G1297-K1432 WeakPolarHBondContact O-CE 3.39Å; G1297-K1432 PolarHBondContact O-NZ 2.65Å
1298	L	90.5	Very high	77.1	Confident	15 Å²	15	54.9 Å²	54.9	8%	0.079	30%	0.304	C	S	.	.	S	Bend	trans	-89.3	154.9	174	-65.1	175.7	0	0	0	111.6	F1294 V1295 E1296 Q1302 V1304 Y1434	F1294-L1298 HydrophobicContact CE1-CD1 4.33Å; F1294-L1298 HydrophobicContact CE1-CD2 4.46Å; V1295-L1298 WeakPolarHBondContact O-CB 3.25Å; V1295-L1298 PolarHBondContact O-N 3.47Å; E1296-L1298 VanDerWaalsContact C-N 3.27Å; E1296-L1298 PolarHBondContact O-N 3.04Å; L1298-Q1302 HydrophobicContact CB-CB 4.21Å; L1298-Q1302 HydrophobicContact CB-CG 4.42Å; L1298-Q1302 HydrophobicContact CD2-CG 4.34Å; L1298-V1304 HydrophobicContact CD1-CG2 3.79Å; L1298-V1304 HydrophobicContact CD2-CG1 4.13Å; L1298-V1304 HydrophobicContact CD2-CG2 4.29Å; L1298-Y1434 HydrophobicContact CD2-CE2 4.22Å
1299	G	91.1	Very high	79	Confident	2 Å²	2	49.4 Å²	49.4	2%	0.021	28%	0.28	C	S	.	.	P	Polyproline II helix	trans	-68.7	159.3	176.3	0	0	0	0	0	113.2	G1301 Q1302 W1430	G1299-G1301 PolarHBondContact O-N 2.74Å; G1299-Q1302 VanDerWaalsContact N-OE1 3.09Å; G1299-Q1302 WeakPolarHBondContact O-CB 3.17Å; G1299-Q1302 PolarHBondContact O-N 3.03Å; G1299-W1430 WeakPolarHBondContact CA-O 3.35Å
1300	P	93.4	Very high	80.3	Confident	51 Å²	51	52.5 Å²	52.5	33%	0.331	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.4	121.9	178.7	-28.1	36	0	0	0	112.7	Q1302 L1421 V1427 Y1431	P1300-Q1302 PolarHBondContact O-N 3.16Å; P1300-L1421 HydrophobicContact CB-CD2 3.78Å; P1300-V1427 HydrophobicContact CB-CG1 3.74Å; P1300-V1427 HydrophobicContact CG-CG1 4.13Å; P1300-Y1431 VanDerWaalsContact O-CE1 3.29Å; P1300-Y1431 WeakPolarHBondContact O-CE1 3.47Å; P1300-Y1431 PolarHBondContact O-OH 3.41Å
1301	G	91.3	Very high	81.3	Confident	7 Å²	7	50.3 Å²	50.3	7%	0.072	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	66.2	10.8	-176.8	0	0	0	0	0	114.9	G1299 I1416 K1417	G1299-G1301 PolarHBondContact O-N 2.74Å; G1301-I1416 CarbonylContact O-C 3.55Å; G1301-I1416 WeakPolarHBondContact O-CA 3.31Å; G1301-K1417 PolarHBondContact O-N 3.19Å
1302	Q	94	Very high	82.3	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	134.9	174	179.2	163.9	1.5	0	0	110.5	L1298 G1299 P1300 V1304 M1415 Y1431 K1432	L1298-Q1302 HydrophobicContact CB-CB 4.21Å; L1298-Q1302 HydrophobicContact CB-CG 4.42Å; L1298-Q1302 HydrophobicContact CD2-CG 4.34Å; G1299-Q1302 VanDerWaalsContact N-OE1 3.09Å; G1299-Q1302 WeakPolarHBondContact O-CB 3.17Å; G1299-Q1302 PolarHBondContact O-N 3.03Å; P1300-Q1302 PolarHBondContact O-N 3.16Å; Q1302-V1304 HydrophobicContact CG-CG1 4.28Å; Q1302-M1415 WeakPolarHBondContact CA-O 3.46Å; Q1302-Y1431 HydrophobicContact CB-CD1 4.09Å; Q1302-Y1431 HydrophobicContact CB-CE1 4.44Å; Q1302-K1432 PolarHBondContact NE2-O 3.32Å
1303	V	90.3	Very high	83.4	Confident	3 Å²	3	51.3 Å²	51.3	2%	0.018	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	140.7	175.2	-68.1	0	0	0	0	110.2	L1393 M1415 K1417	V1303-L1393 HydrophobicContact CG2-CD2 3.82Å; V1303-M1415 HydrophobicContact CG2-CB 3.79Å; V1303-M1415 HydrophobicContact CG2-CE 4.36Å; V1303-M1415 PolarHBondContact N-O 3.5Å; V1303-K1417 HydrophobicContact CG1-CB 4.03Å; V1303-K1417 HydrophobicContact CG1-CD 4.06Å; V1303-K1417 HydrophobicContact CG2-CB 4.47Å
1304	V	87	Confident	84.3	Confident	10 Å²	10	47.5 Å²	47.5	6%	0.061	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	143	-179.7	-65.6	0	0	0	0	110.3	F1294 L1298 Q1302 A1308 Y1434	F1294-V1304 HydrophobicContact CE1-CG2 3.71Å; F1294-V1304 HydrophobicContact CZ-CG2 3.98Å; L1298-V1304 HydrophobicContact CD1-CG2 3.79Å; L1298-V1304 HydrophobicContact CD2-CG1 4.13Å; L1298-V1304 HydrophobicContact CD2-CG2 4.29Å; Q1302-V1304 HydrophobicContact CG-CG1 4.28Å; V1304-A1308 HydrophobicContact CB-CB 3.75Å; V1304-A1308 HydrophobicContact CG1-CB 4.32Å; V1304-A1308 HydrophobicContact CG2-CB 4.21Å; V1304-Y1434 HydrophobicContact CG1-CD2 4.01Å; V1304-Y1434 HydrophobicContact CG1-CE2 3.87Å
1305	G	82.3	Confident	85.1	Confident	26 Å²	26	46 Å²	46	27%	0.268	27%	0.273	S	S	.	.			trans	-74.6	157.9	172.2	0	0	0	0	0	111.4	Q1307 A1308	G1305-Q1307 VanDerWaalsContact CA-OE1 3.28Å; G1305-Q1307 PolarHBondContact O-N 3.27Å; G1305-A1308 WeakPolarHBondContact O-CB 3.29Å; G1305-A1308 PolarHBondContact O-N 2.61Å
1306	R	77	Confident	86	Confident	141 Å²	141	46.3 Å²	46.3	53%	0.532	27%	0.272	S	S	.	.	G	3₁₀ helix	trans	-50.6	-33.7	-179	-76	175.9	159.1	147.3	-4.5	114.1	S1248 D1249 A1308 I1309	S1248-R1306 PolarHBondContact O-NH1 3.43Å; D1249-R1306 VanDerWaalsContact CB-CZ 3.44Å; D1249-R1306 IonicContact OD2-CZ 3.81Å; D1249-R1306 IonicContact OD2-NH1 3.78Å; D1249-R1306 PolarHBondContact OD2-NH1 3.35Å; D1249-R1306 IonicContact OD2-NH2 3.26Å; D1249-R1306 PolarHBondContact OD2-NH2 2.87Å; R1306-A1308 PolarHBondContact O-N 2.86Å; R1306-I1309 WeakPolarHBondContact O-CB 3.49Å; R1306-I1309 WeakPolarHBondContact O-CG1 3.46Å; R1306-I1309 PolarHBondContact O-N 3.17Å; R1306-I1309 VanDerWaalsContact O-N 3.15Å
1307	Q	76.8	Confident	87.1	Confident	87 Å²	87	38.5 Å²	38.5	41%	0.407	24%	0.236	S	C	.	.	G	3₁₀ helix	trans	-62.8	-19.6	176.8	70.3	-84.7	45.6	0	0	114	G1305 I1309 S1311	G1305-Q1307 VanDerWaalsContact CA-OE1 3.28Å; G1305-Q1307 PolarHBondContact O-N 3.27Å; Q1307-I1309 VanDerWaalsContact C-N 3.29Å; Q1307-I1309 PolarHBondContact O-N 2.95Å; Q1307-S1311 PolarHBondContact O-N 2.62Å; Q1307-S1311 PolarHBondContact O-OG 3.31Å
1308	A	81.2	Confident	87.7	Confident	7 Å²	7	39 Å²	39	6%	0.058	23%	0.23	C	C	.	.	G	3₁₀ helix	trans	-69.8	-24.3	175.8	0	0	0	0	0	113.2	F1294 V1304 G1305 R1306 A1310 S1311 Y1434	F1294-A1308 HydrophobicContact CZ-CB 4.12Å; V1304-A1308 HydrophobicContact CB-CB 3.75Å; V1304-A1308 HydrophobicContact CG1-CB 4.32Å; V1304-A1308 HydrophobicContact CG2-CB 4.21Å; G1305-A1308 WeakPolarHBondContact O-CB 3.29Å; G1305-A1308 PolarHBondContact O-N 2.61Å; R1306-A1308 PolarHBondContact O-N 2.86Å; A1308-A1310 VanDerWaalsContact C-N 3.31Å; A1308-A1310 PolarHBondContact O-N 2.77Å; A1308-S1311 PolarHBondContact O-N 2.88Å; A1308-S1311 VanDerWaalsContact O-N 3.16Å; A1308-Y1434 HydrophobicContact CB-CD1 3.93Å; A1308-Y1434 HydrophobicContact CB-CE1 4.11Å; A1308-Y1434 HydrophobicContact CB-CG 4.16Å; A1308-Y1434 WeakPolarHBondContact O-CE1 3.44Å
1309	I	78.4	Confident	88.1	Confident	73 Å²	73	38.2 Å²	38.2	37%	0.374	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-38.4	179.2	-56.9	169	0	0	0	110.6	I1291 F1294 R1306 Q1307	I1291-I1309 HydrophobicContact CD1-CD1 3.85Å; I1291-I1309 HydrophobicContact CG1-CD1 4.28Å; F1294-I1309 HydrophobicContact CD1-CG1 4.09Å; F1294-I1309 HydrophobicContact CE1-CG1 3.77Å; F1294-I1309 HydrophobicContact CE2-CB 4.49Å; F1294-I1309 HydrophobicContact CE2-CG1 4.41Å; F1294-I1309 HydrophobicContact CZ-CB 4.46Å; F1294-I1309 HydrophobicContact CZ-CG1 3.95Å; R1306-I1309 WeakPolarHBondContact O-CB 3.49Å; R1306-I1309 WeakPolarHBondContact O-CG1 3.46Å; R1306-I1309 PolarHBondContact O-N 3.17Å; R1306-I1309 VanDerWaalsContact O-N 3.15Å; Q1307-I1309 VanDerWaalsContact C-N 3.29Å; Q1307-I1309 PolarHBondContact O-N 2.95Å
1310	A	76.1	Confident	88.4	Confident	98 Å²	98	38.7 Å²	38.7	81%	0.81	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.2	-1	175.5	0	0	0	0	0	113.7	A1308	A1308-A1310 VanDerWaalsContact C-N 3.31Å; A1308-A1310 PolarHBondContact O-N 2.77Å
1311	S	81	Confident	88.5	Confident	32 Å²	32	36.2 Å²	36.2	22%	0.224	21%	0.212	C	C	.	.	S	Bend	trans	-95.1	132.6	-177.5	-66.4	0	0	0	0	111.5	Q1307 A1308 C1313	Q1307-S1311 PolarHBondContact O-N 2.62Å; Q1307-S1311 PolarHBondContact O-OG 3.31Å; A1308-S1311 PolarHBondContact O-N 2.88Å; A1308-S1311 VanDerWaalsContact O-N 3.16Å; S1311-C1313 PolarHBondContact O-N 3.43Å
1312	P	85.5	Confident	88.7	Confident	98 Å²	98	36.2 Å²	36.2	64%	0.636	21%	0.211	S	C	*	.	P	Polyproline II helix	trans	-63.8	135.8	176.7	27	-34.3	0	0	0	111.1	L1314	P1312-L1314 HydrophobicContact CG-CD2 4.41Å; P1312-L1314 WeakPolarHBondContact O-CD2 3.34Å; P1312-L1314 PolarHBondContact O-N 2.96Å
1313	C	90.2	Very high	88.7	Confident	61 Å²	61	40.1 Å²	40.1	41%	0.412	23%	0.229	S	C	.	.	P	Polyproline II helix	trans	-65.4	122.5	172.7	-175.1	0	0	0	0	109.9	S1311 G1315	S1311-C1313 PolarHBondContact O-N 3.43Å; C1313-G1315 VanDerWaalsContact C-N 3.28Å; C1313-G1315 PolarHBondContact O-N 3.08Å; C1313-G1315 PolarHBondContact SG-O 3.32Å
1314	L	91.8	Very high	88.7	Confident	31 Å²	31	46.3 Å²	46.3	16%	0.162	25%	0.252	C	S	.	.			trans	-90.8	9.7	-174.3	-53.4	-178.4	0	0	0	113	P1312 A1339 I1411 L1433 Q1435	P1312-L1314 HydrophobicContact CG-CD2 4.41Å; P1312-L1314 WeakPolarHBondContact O-CD2 3.34Å; P1312-L1314 PolarHBondContact O-N 2.96Å; L1314-A1339 HydrophobicContact CB-CB 4.24Å; L1314-A1339 HydrophobicContact CD2-CB 4.37Å; L1314-A1339 PolarHBondContact O-N 2.94Å; L1314-I1411 VanDerWaalsContact CB-O 3.25Å; L1314-I1411 WeakPolarHBondContact CB-O 3.31Å; L1314-I1411 WeakPolarHBondContact CD1-O 3.42Å; L1314-L1433 PolarHBondContact N-O 2.73Å; L1314-Q1435 HydrophobicContact CD1-CB 4.1Å
1315	G	93.8	Very high	88.8	Confident	2 Å²	2	53.5 Å²	53.5	2%	0.021	29%	0.291	C	S	.	.			trans	130.9	177.2	-179.5	0	0	0	0	0	112	C1313 K1336 H1337 L1433	C1313-G1315 VanDerWaalsContact C-N 3.28Å; C1313-G1315 PolarHBondContact O-N 3.08Å; C1313-G1315 PolarHBondContact SG-O 3.32Å; G1315-K1336 WeakPolarHBondContact CA-O 3.31Å; G1315-H1337 WeakPolarHBondContact CA-O 3.3Å; G1315-L1433 VanDerWaalsContact O-CB 3.25Å; G1315-L1433 WeakPolarHBondContact O-CB 3.42Å; G1315-L1433 WeakPolarHBondContact O-CG 3.49Å; G1315-L1433 PolarHBondContact O-N 2.88Å
1316	E	96.1	Very high	89.1	Confident	36 Å²	36	54.3 Å²	54.3	17%	0.168	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	141.3	-179.2	-60.7	-175.4	160.3	0	0	110.7	A1335 K1336 W1430 Y1431 K1432	E1316-A1335 CarbonylContact O-C 3.55Å; E1316-A1335 WeakPolarHBondContact O-CA 3.44Å; E1316-A1335 VanDerWaalsContact O-CB 3.31Å; E1316-A1335 WeakPolarHBondContact O-CB 3.29Å; E1316-K1336 HydrophobicContact CB-CG 4.12Å; E1316-K1336 PolarHBondContact N-O 3.2Å; E1316-K1336 PolarHBondContact O-N 3.4Å; E1316-K1336 WeakPolarHBondContact OE2-CE 3.26Å; E1316-K1336 IonicContact OE2-NZ 3.44Å; E1316-K1336 PolarHBondContact OE2-NZ 3.08Å; E1316-W1430 HydrophobicContact CB-CE3 3.93Å; E1316-W1430 HydrophobicContact CB-CZ3 4.48Å; E1316-Y1431 CarbonylContact C-O 3.57Å; E1316-Y1431 WeakPolarHBondContact CA-O 3.47Å; E1316-K1432 HydrophobicContact CG-CG 4.02Å; E1316-K1432 VanDerWaalsContact OE1-CE 3.3Å; E1316-K1432 WeakPolarHBondContact OE1-CE 3.43Å; E1316-K1432 WeakPolarHBondContact OE1-CG 3.47Å
1317	I	97.4	Very high	89.8	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	133.8	-179.4	-170.1	168.1	0	0	0	111.4	L1319 V1332 A1335 V1352 V1396 V1398 W1430 Y1431 L1433	I1317-L1319 HydrophobicContact CD1-CD2 4.05Å; I1317-L1319 HydrophobicContact CG1-CD2 4.01Å; I1317-L1319 HydrophobicContact CG1-CG 4.43Å; I1317-L1319 HydrophobicContact CG2-CD1 4.49Å; I1317-L1319 HydrophobicContact CG2-CG 4.45Å; I1317-V1332 HydrophobicContact CD1-CG1 4.07Å; I1317-A1335 HydrophobicContact CB-CB 4.33Å; I1317-A1335 HydrophobicContact CG1-CB 4.34Å; I1317-V1352 HydrophobicContact CD1-CB 4.43Å; I1317-V1352 HydrophobicContact CD1-CG1 3.83Å; I1317-V1352 HydrophobicContact CD1-CG2 3.73Å; I1317-V1396 HydrophobicContact CD1-CG1 3.96Å; I1317-V1396 HydrophobicContact CG2-CG1 4.35Å; I1317-V1398 HydrophobicContact CD1-CG2 3.97Å; I1317-W1430 CarbonylContact O-C 3.54Å; I1317-W1430 WeakPolarHBondContact O-CA 3.46Å; I1317-Y1431 PolarHBondContact N-O 2.95Å; I1317-Y1431 PolarHBondContact O-N 2.97Å; I1317-L1433 HydrophobicContact CB-CD1 4.45Å; I1317-L1433 HydrophobicContact CB-CD2 4.47Å; I1317-L1433 HydrophobicContact CG2-CD2 3.87Å; I1317-L1433 HydrophobicContact CG2-CG 4.35Å
1318	F	97.6	Very high	90.7	Very high	38 Å²	38	45.4 Å²	45.4	17%	0.167	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	124.4	176.6	-165.2	-91.3	0	0	0	110.8	V1333 R1334 E1428 G1429 W1430	F1318-V1333 HydrophobicContact CD1-CB 3.92Å; F1318-V1333 HydrophobicContact CD1-CG1 4.39Å; F1318-V1333 HydrophobicContact CD1-CG2 3.92Å; F1318-V1333 HydrophobicContact CE1-CG2 4.44Å; F1318-V1333 PolarHBondContact O-N 3.26Å; F1318-V1333 VanDerWaalsContact O-N 3.15Å; F1318-R1334 HydrophobicContact CB-CG 4.05Å; F1318-R1334 PolarHBondContact N-O 3Å; F1318-E1428 HydrophobicContact CE1-CB 4.23Å; F1318-E1428 HydrophobicContact CZ-CB 3.84Å; F1318-G1429 WeakPolarHBondContact CA-O 3.39Å; F1318-G1429 WeakPolarHBondContact CD2-O 3.37Å; F1318-W1430 HydrophobicContact CB-CD2 4.03Å; F1318-W1430 HydrophobicContact CB-CE3 3.76Å; F1318-W1430 HydrophobicContact CB-CH2 4.05Å; F1318-W1430 HydrophobicContact CB-CZ2 4.29Å; F1318-W1430 HydrophobicContact CB-CZ3 3.76Å; F1318-W1430 AromaticContact CD2-CD1 3.82Å; F1318-W1430 AromaticContact CD2-CD2 3.72Å; F1318-W1430 HydrophobicContact CD2-CD2 3.72Å; F1318-W1430 AromaticContact CD2-CE2 3.64Å; F1318-W1430 HydrophobicContact CD2-CE3 4.34Å; F1318-W1430 AromaticContact CD2-CG 3.86Å; F1318-W1430 HydrophobicContact CD2-CG 3.86Å; F1318-W1430 HydrophobicContact CD2-CZ2 4.23Å; F1318-W1430 AromaticContact CD2-NE1 3.68Å; F1318-W1430 HydrophobicContact CG-CD2 4.38Å
1319	L	97.9	Very high	91.4	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	143.7	-177.4	-54.6	174	0	0	0	110.4	I1317 I1321 K1331 V1332 V1396 I1416 E1428 G1429 Y1431	I1317-L1319 HydrophobicContact CD1-CD2 4.05Å; I1317-L1319 HydrophobicContact CG1-CD2 4.01Å; I1317-L1319 HydrophobicContact CG1-CG 4.43Å; I1317-L1319 HydrophobicContact CG2-CD1 4.49Å; I1317-L1319 HydrophobicContact CG2-CG 4.45Å; L1319-I1321 HydrophobicContact CB-CG1 4.32Å; L1319-K1331 WeakPolarHBondContact CA-O 3.36Å; L1319-V1332 HydrophobicContact CD2-CB 4.3Å; L1319-V1332 HydrophobicContact CD2-CG1 4.23Å; L1319-V1332 HydrophobicContact CD2-CG2 4.02Å; L1319-V1396 HydrophobicContact CD1-CG1 4.26Å; L1319-V1396 HydrophobicContact CD1-CG2 3.85Å; L1319-I1416 HydrophobicContact CD1-CD1 3.79Å; L1319-E1428 WeakPolarHBondContact O-CA 3.46Å; L1319-G1429 PolarHBondContact N-O 3.29Å; L1319-G1429 PolarHBondContact O-N 3.29Å; L1319-Y1431 HydrophobicContact CB-CD2 4.07Å; L1319-Y1431 HydrophobicContact CB-CE2 3.88Å; L1319-Y1431 HydrophobicContact CD1-CD2 3.75Å; L1319-Y1431 HydrophobicContact CD1-CE2 4.05Å; L1319-Y1431 HydrophobicContact CD1-CG 4.26Å; L1319-Y1431 HydrophobicContact CG-CD2 3.95Å; L1319-Y1431 HydrophobicContact CG-CE2 4.25Å
1320	T	97	Very high	92.3	Very high	11 Å²	11	42.9 Å²	42.9	7%	0.067	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	128.8	158.7	-41.6	0	0	0	0	107.9	V1330 K1331 V1427 E1428	T1320-V1330 CarbonylContact O-C 3.6Å; T1320-V1330 WeakPolarHBondContact O-CA 3.43Å; T1320-K1331 PolarHBondContact N-O 2.88Å; T1320-K1331 PolarHBondContact O-N 3.45Å; T1320-V1427 CarbonylContact C-O 3.28Å; T1320-V1427 WeakPolarHBondContact CA-O 3.49Å; T1320-E1428 WeakPolarHBondContact CB-OE1 3.15Å; T1320-E1428 HydrophobicContact CG2-CG 3.74Å; T1320-E1428 WeakPolarHBondContact CG2-OE1 3.25Å; T1320-E1428 PolarHBondContact OG1-OE1 3.22Å
1321	I	96.9	Very high	93.3	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	127.5	177.9	-46.9	179.8	0	0	0	108.3	L1319 L1328 E1329 V1330 L1394 I1416 L1418 L1421 L1423 V1427	L1319-I1321 HydrophobicContact CB-CG1 4.32Å; I1321-L1328 HydrophobicContact CG2-CD1 3.81Å; I1321-E1329 WeakPolarHBondContact CA-O 3.47Å; I1321-V1330 HydrophobicContact CG2-CG2 4.43Å; I1321-L1394 HydrophobicContact CD1-CD2 4.02Å; I1321-I1416 HydrophobicContact CD1-CD1 3.96Å; I1321-I1416 HydrophobicContact CD1-CG2 4.36Å; I1321-L1418 HydrophobicContact CG2-CD2 4.33Å; I1321-L1421 HydrophobicContact CD1-CD1 4.33Å; I1321-L1423 HydrophobicContact CB-CD2 4.21Å; I1321-L1423 HydrophobicContact CG2-CD2 3.62Å; I1321-V1427 PolarHBondContact N-O 3.05Å; I1321-V1427 PolarHBondContact O-N 3.1Å
1322	S	95.2	Very high	94.1	Very high	7 Å²	7	40.9 Å²	40.9	5%	0.049	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	152.3	179.5	49.6	0	0	0	0	111.7	E1329	S1322-E1329 PolarHBondContact N-O 2.87Å; S1322-E1329 PolarHBondContact O-N 3.17Å
1323	E	93.1	Very high	94.7	Very high	82 Å²	82	37.3 Å²	37.3	38%	0.383	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	137.2	158.8	-176.7	179.7	175.8	0	0	110.4	G1326 N1327 Y1389 L1423	E1323-G1326 WeakPolarHBondContact OE1-CA 3.39Å; E1323-N1327 CarbonylContact C-O 3.54Å; E1323-N1327 WeakPolarHBondContact CA-O 3.25Å; E1323-Y1389 WeakPolarHBondContact CG-OH 3.35Å; E1323-Y1389 PolarHBondContact OE1-OH 3.2Å; E1323-Y1389 PolarHBondContact OE2-OH 2.87Å; E1323-L1423 HydrophobicContact CB-CB 4.35Å; E1323-L1423 PolarHBondContact N-O 3.28Å
1324	R	91.4	Very high	95	Very high	132 Å²	132	39.9 Å²	39.9	50%	0.498	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	128.5	161.8	-68.5	-161.9	-178.1	129.6	-1.6	111.5	G1326 N1327 E1329	R1324-G1326 PolarHBondContact O-N 2.91Å; R1324-N1327 PolarHBondContact N-O 2.92Å; R1324-N1327 WeakPolarHBondContact O-CB 3.27Å; R1324-N1327 PolarHBondContact O-N 2.84Å; R1324-N1327 PolarHBondContact O-ND2 2.93Å; R1324-N1327 VanDerWaalsContact O-ND2 3.1Å; R1324-E1329 HydrophobicContact CB-CG 4.31Å; R1324-E1329 WeakPolarHBondContact CD-OE1 3.27Å; R1324-E1329 IonicContact CZ-OE2 3.26Å; R1324-E1329 IonicContact NE-OE2 3.28Å; R1324-E1329 IonicContact NH1-OE1 2.73Å; R1324-E1329 IonicContact NH1-OE2 2.87Å; R1324-E1329 PolarHBondContact NH1-OE2 3.26Å
1325	N	89.3	Confident	95.2	Very high	162 Å²	162	38.4 Å²	38.4	87%	0.866	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	53	37.6	177.5	-52.1	-17.9	0	0	0	113	N1327	N1325-N1327 VanDerWaalsContact C-N 3.29Å; N1325-N1327 PolarHBondContact O-N 2.84Å; N1325-N1327 PolarHBondContact O-ND2 2.91Å
1326	G	87	Confident	95.3	Very high	42 Å²	42	40.4 Å²	40.4	43%	0.433	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	79.1	-1.6	-175.2	0	0	0	0	0	115.8	E1323 R1324	E1323-G1326 WeakPolarHBondContact OE1-CA 3.39Å; R1324-G1326 PolarHBondContact O-N 2.91Å
1327	N	92.5	Very high	95.1	Very high	42 Å²	42	44.8 Å²	44.8	23%	0.225	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	145.3	-179	-48	-84.8	0	0	0	110.9	E1323 R1324 N1325 E1329 I1384 F1385 T1386	E1323-N1327 CarbonylContact C-O 3.54Å; E1323-N1327 WeakPolarHBondContact CA-O 3.25Å; R1324-N1327 PolarHBondContact N-O 2.92Å; R1324-N1327 WeakPolarHBondContact O-CB 3.27Å; R1324-N1327 PolarHBondContact O-N 2.84Å; R1324-N1327 PolarHBondContact O-ND2 2.93Å; R1324-N1327 VanDerWaalsContact O-ND2 3.1Å; N1325-N1327 VanDerWaalsContact C-N 3.29Å; N1325-N1327 PolarHBondContact O-N 2.84Å; N1325-N1327 PolarHBondContact O-ND2 2.91Å; N1327-E1329 PolarHBondContact O-N 2.86Å; N1327-I1384 HydrophobicContact CB-CG2 3.79Å; N1327-F1385 WeakPolarHBondContact CA-O 3.34Å; N1327-F1385 WeakPolarHBondContact CB-O 3.43Å; N1327-T1386 WeakPolarHBondContact OD1-CG2 3.27Å
1328	L	95.5	Very high	94.8	Very high	0 Å²	0	45 Å²	45	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	110.2	170.8	-178.2	75.4	0	0	0	109.8	I1321 V1330 L1356 F1385 Y1389 L1394 L1418 L1423	I1321-L1328 HydrophobicContact CG2-CD1 3.81Å; L1328-V1330 HydrophobicContact CD2-CG2 4Å; L1328-V1330 HydrophobicContact CG-CG2 3.96Å; L1328-L1356 HydrophobicContact CD2-CD1 4.29Å; L1328-F1385 HydrophobicContact CB-CB 4.26Å; L1328-F1385 HydrophobicContact CD2-CD2 4.25Å; L1328-F1385 PolarHBondContact N-O 3.13Å; L1328-F1385 PolarHBondContact O-N 2.95Å; L1328-Y1389 HydrophobicContact CB-CD1 3.86Å; L1328-Y1389 HydrophobicContact CB-CG 3.96Å; L1328-Y1389 HydrophobicContact CD1-CD2 4.16Å; L1328-Y1389 HydrophobicContact CD1-CG 4.27Å; L1328-Y1389 HydrophobicContact CD2-CG 4.46Å; L1328-Y1389 HydrophobicContact CG-CG 4.46Å; L1328-L1394 HydrophobicContact CD2-CD1 4.02Å; L1328-L1418 HydrophobicContact CD1-CD1 4.43Å; L1328-L1418 HydrophobicContact CD2-CD1 3.63Å; L1328-L1423 HydrophobicContact CD1-CD1 3.83Å
1329	E	96	Very high	94.3	Very high	26 Å²	26	45.3 Å²	45.3	12%	0.121	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	120	171.7	-80	-165.5	-169	0	0	110.8	I1321 S1322 R1324 N1327 L1382 I1384	I1321-E1329 WeakPolarHBondContact CA-O 3.47Å; S1322-E1329 PolarHBondContact N-O 2.87Å; S1322-E1329 PolarHBondContact O-N 3.17Å; R1324-E1329 HydrophobicContact CB-CG 4.31Å; R1324-E1329 WeakPolarHBondContact CD-OE1 3.27Å; R1324-E1329 IonicContact CZ-OE2 3.26Å; R1324-E1329 IonicContact NE-OE2 3.28Å; R1324-E1329 IonicContact NH1-OE1 2.73Å; R1324-E1329 IonicContact NH1-OE2 2.87Å; R1324-E1329 PolarHBondContact NH1-OE2 3.26Å; N1327-E1329 PolarHBondContact O-N 2.86Å; E1329-L1382 HydrophobicContact CB-CD1 3.97Å; E1329-L1382 HydrophobicContact CG-CD1 4.21Å; E1329-I1384 HydrophobicContact CG-CG1 4.26Å
1330	V	97.1	Very high	93.6	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	102.2	176.8	-174.4	0	0	0	0	109.5	T1320 I1321 L1328 V1354 L1383 F1385 L1394	T1320-V1330 CarbonylContact O-C 3.6Å; T1320-V1330 WeakPolarHBondContact O-CA 3.43Å; I1321-V1330 HydrophobicContact CG2-CG2 4.43Å; L1328-V1330 HydrophobicContact CD2-CG2 4Å; L1328-V1330 HydrophobicContact CG-CG2 3.96Å; V1330-V1354 HydrophobicContact CG1-CG1 4.39Å; V1330-L1383 PolarHBondContact N-O 3.5Å; V1330-L1383 WeakPolarHBondContact O-CB 3.37Å; V1330-L1383 PolarHBondContact O-N 3.08Å; V1330-F1385 HydrophobicContact CB-CE2 4.27Å; V1330-F1385 HydrophobicContact CG2-CD2 4.05Å; V1330-F1385 HydrophobicContact CG2-CE2 3.85Å; V1330-L1394 HydrophobicContact CG1-CD2 4.16Å; V1330-L1394 HydrophobicContact CG2-CD1 4.35Å; V1330-L1394 HydrophobicContact CG2-CD2 3.84Å
1331	K	97.4	Very high	92.8	Very high	88 Å²	88	55.6 Å²	55.6	38%	0.383	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	112.2	176.1	-167.3	-171.9	176	-171.5	0	110	L1319 T1320 V1333 Q1381 L1382	L1319-K1331 WeakPolarHBondContact CA-O 3.36Å; T1320-K1331 PolarHBondContact N-O 2.88Å; T1320-K1331 PolarHBondContact O-N 3.45Å; K1331-V1333 HydrophobicContact CD-CG2 4.07Å; K1331-V1333 HydrophobicContact CG-CG2 4.08Å; K1331-V1333 PolarHBondContact O-N 3.22Å; K1331-Q1381 CarbonylContact C-O 3.5Å; K1331-Q1381 WeakPolarHBondContact CA-O 3.24Å; K1331-L1382 HydrophobicContact CB-CD1 4.03Å
1332	V	97.7	Very high	91.9	Very high	0 Å²	0	61.8 Å²	61.8	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	108	171.8	-174.1	0	0	0	0	108.2	I1317 L1319 V1352 V1354 T1368 F1379 D1380 Q1381 L1383	I1317-V1332 HydrophobicContact CD1-CG1 4.07Å; L1319-V1332 HydrophobicContact CD2-CB 4.3Å; L1319-V1332 HydrophobicContact CD2-CG1 4.23Å; L1319-V1332 HydrophobicContact CD2-CG2 4.02Å; V1332-V1352 HydrophobicContact CG1-CB 4.11Å; V1332-V1352 HydrophobicContact CG1-CG1 4.37Å; V1332-V1352 HydrophobicContact CG1-CG2 3.8Å; V1332-V1354 HydrophobicContact CG2-CG2 4.19Å; V1332-T1368 HydrophobicContact CB-CG2 3.8Å; V1332-T1368 HydrophobicContact CG1-CG2 3.89Å; V1332-T1368 HydrophobicContact CG2-CG2 4Å; V1332-F1379 HydrophobicContact CB-CB 4.44Å; V1332-F1379 HydrophobicContact CG1-CB 3.95Å; V1332-F1379 HydrophobicContact CG1-CD2 3.75Å; V1332-F1379 HydrophobicContact CG1-CG 3.95Å; V1332-F1379 WeakPolarHBondContact O-CB 3.37Å; V1332-D1380 PolarHBondContact O-N 3.28Å; V1332-D1380 VanDerWaalsContact O-N 3.13Å; V1332-Q1381 PolarHBondContact N-O 3.28Å; V1332-Q1381 PolarHBondContact O-N 3.17Å; V1332-L1383 HydrophobicContact CG2-CD1 3.79Å; V1332-L1383 HydrophobicContact CG2-CG 4.35Å
1333	V	97.1	Very high	91	Very high	23 Å²	23	65.6 Å²	65.6	14%	0.139	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	-64.9	-172.7	-175.2	0	0	0	0	111.2	F1318 K1331 F1379 D1380	F1318-V1333 HydrophobicContact CD1-CB 3.92Å; F1318-V1333 HydrophobicContact CD1-CG1 4.39Å; F1318-V1333 HydrophobicContact CD1-CG2 3.92Å; F1318-V1333 HydrophobicContact CE1-CG2 4.44Å; F1318-V1333 PolarHBondContact O-N 3.26Å; F1318-V1333 VanDerWaalsContact O-N 3.15Å; K1331-V1333 HydrophobicContact CD-CG2 4.07Å; K1331-V1333 HydrophobicContact CG-CG2 4.08Å; K1331-V1333 PolarHBondContact O-N 3.22Å; V1333-F1379 PolarHBondContact O-N 3.16Å; V1333-D1380 PolarHBondContact O-N 2.84Å
1334	R	96.8	Very high	90.2	Very high	116 Å²	116	62.2 Å²	62.2	44%	0.438	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.5	165.5	-178	60	173.1	171.2	168.5	-6.1	111.4	F1318 P1377 W1430	F1318-R1334 HydrophobicContact CB-CG 4.05Å; F1318-R1334 PolarHBondContact N-O 3Å; R1334-P1377 CarbonylContact C-O 3.59Å; R1334-P1377 VanDerWaalsContact CA-O 3.22Å; R1334-P1377 WeakPolarHBondContact CA-O 3.45Å; R1334-P1377 WeakPolarHBondContact CB-O 3.31Å; R1334-W1430 HydrophobicContact CG-CH2 3.98Å; R1334-W1430 HydrophobicContact CG-CZ3 4.48Å
1335	A	96.8	Very high	89.5	Confident	0 Å²	0	64.5 Å²	64.5	0%	0	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	166.3	159.9	0	0	0	0	0	110.4	E1316 I1317 L1338 E1376 P1377 F1379	E1316-A1335 CarbonylContact O-C 3.55Å; E1316-A1335 WeakPolarHBondContact O-CA 3.44Å; E1316-A1335 VanDerWaalsContact O-CB 3.31Å; E1316-A1335 WeakPolarHBondContact O-CB 3.29Å; I1317-A1335 HydrophobicContact CB-CB 4.33Å; I1317-A1335 HydrophobicContact CG1-CB 4.34Å; A1335-L1338 HydrophobicContact CB-CD1 4.11Å; A1335-L1338 HydrophobicContact CB-CD2 3.85Å; A1335-L1338 HydrophobicContact CB-CG 3.96Å; A1335-E1376 CarbonylContact O-C 3.56Å; A1335-E1376 VanDerWaalsContact O-CA 3.23Å; A1335-E1376 WeakPolarHBondContact O-CA 3.45Å; A1335-P1377 HydrophobicContact CB-CG 3.94Å; A1335-P1377 PolarHBondContact N-O 2.96Å; A1335-P1377 WeakPolarHBondContact O-CD 3.36Å; A1335-F1379 HydrophobicContact CB-CE2 4.21Å
1336	K	94.6	Very high	89.2	Confident	43 Å²	43	64.1 Å²	64.1	19%	0.187	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	163.3	171.8	63.4	177.6	166.1	141.7	0	110.8	G1315 E1316 L1338 P1375 E1376 W1430	G1315-K1336 WeakPolarHBondContact CA-O 3.31Å; E1316-K1336 HydrophobicContact CB-CG 4.12Å; E1316-K1336 PolarHBondContact N-O 3.2Å; E1316-K1336 PolarHBondContact O-N 3.4Å; E1316-K1336 WeakPolarHBondContact OE2-CE 3.26Å; E1316-K1336 IonicContact OE2-NZ 3.44Å; E1316-K1336 PolarHBondContact OE2-NZ 3.08Å; K1336-L1338 PolarHBondContact O-N 3.28Å; K1336-P1375 CarbonylContact C-O 3.6Å; K1336-E1376 HydrophobicContact CB-CG 4.08Å; K1336-E1376 VanDerWaalsContact CB-OE1 3.26Å; K1336-E1376 WeakPolarHBondContact CB-OE1 3.35Å; K1336-W1430 HydrophobicContact CB-CH2 4.2Å; K1336-W1430 HydrophobicContact CB-CZ3 4.28Å; K1336-W1430 HydrophobicContact CD-CE3 4.33Å; K1336-W1430 HydrophobicContact CD-CH2 3.63Å; K1336-W1430 HydrophobicContact CD-CZ2 3.96Å; K1336-W1430 HydrophobicContact CD-CZ3 3.85Å; K1336-W1430 HydrophobicContact CG-CE3 4.25Å; K1336-W1430 HydrophobicContact CG-CH2 3.73Å; K1336-W1430 HydrophobicContact CG-CZ3 3.57Å
1337	H	92.5	Very high	89.2	Confident	128 Å²	128	65.7 Å²	65.7	59%	0.593	33%	0.326	S	S	*	.	S	Bend	trans	52.9	27	175.9	-55.3	171.6	0	0	0	114.5	G1315 A1339 P1375	G1315-H1337 WeakPolarHBondContact CA-O 3.3Å; H1337-A1339 PolarHBondContact O-N 3.21Å; H1337-P1375 PolarHBondContact N-O 2.95Å
1338	L	92.4	Very high	88.9	Confident	6 Å²	6	63.9 Å²	63.9	3%	0.031	32%	0.317	C	S	.	.	P	Polyproline II helix	trans	-62.2	126.7	-177.2	-70.5	-169.6	0	0	0	111.7	A1335 K1336 R1340 Y1347 P1350 P1375 P1377 V1398 I1411 L1433	A1335-L1338 HydrophobicContact CB-CD1 4.11Å; A1335-L1338 HydrophobicContact CB-CD2 3.85Å; A1335-L1338 HydrophobicContact CB-CG 3.96Å; K1336-L1338 PolarHBondContact O-N 3.28Å; L1338-R1340 PolarHBondContact O-N 2.7Å; L1338-Y1347 WeakPolarHBondContact O-CE1 3.45Å; L1338-P1350 HydrophobicContact CD1-CB 4.13Å; L1338-P1350 HydrophobicContact CD1-CG 4.27Å; L1338-P1375 PolarHBondContact N-O 3.09Å; L1338-P1375 VanDerWaalsContact N-O 3.12Å; L1338-P1377 HydrophobicContact CD1-CG 3.54Å; L1338-P1377 HydrophobicContact CG-CG 4.41Å; L1338-V1398 HydrophobicContact CD1-CG1 3.99Å; L1338-V1398 HydrophobicContact CD2-CG1 4.33Å; L1338-I1411 HydrophobicContact CB-CG2 4.25Å; L1338-I1411 HydrophobicContact CD1-CD1 4.33Å; L1338-I1411 HydrophobicContact CD2-CG2 4.17Å; L1338-L1433 HydrophobicContact CD2-CD1 3.58Å
1339	A	86	Confident	88.8	Confident	44 Å²	44	65 Å²	65	36%	0.364	33%	0.325	S	S	.	.	P	Polyproline II helix	trans	-64.5	128.1	-179.4	0	0	0	0	0	112.6	L1314 H1337	L1314-A1339 HydrophobicContact CB-CB 4.24Å; L1314-A1339 HydrophobicContact CD2-CB 4.37Å; L1314-A1339 PolarHBondContact O-N 2.94Å; H1337-A1339 PolarHBondContact O-N 3.21Å
1340	R	83.6	Confident	88.7	Confident	125 Å²	125	63.8 Å²	63.8	47%	0.472	32%	0.319	S	S	.	.	P	Polyproline II helix	trans	-81.3	131.7	169.7	-176.3	-178.1	64.7	-178.5	-6.2	109.6	L1338 T1342 S1344 K1345 Y1347	L1338-R1340 PolarHBondContact O-N 2.7Å; R1340-T1342 PolarHBondContact O-N 2.83Å; R1340-S1344 VanDerWaalsContact CD-O 3.3Å; R1340-S1344 WeakPolarHBondContact CD-O 3.39Å; R1340-S1344 VanDerWaalsContact CG-OG 3.26Å; R1340-S1344 WeakPolarHBondContact CG-OG 3.43Å; R1340-S1344 PolarHBondContact NE-O 3.12Å; R1340-K1345 PolarHBondContact NH1-O 2.88Å; R1340-Y1347 HydrophobicContact CB-CD1 4Å; R1340-Y1347 HydrophobicContact CB-CE1 3.7Å; R1340-Y1347 HydrophobicContact CG-CD1 4.49Å
1341	R	79.9	Confident	88.6	Confident	101 Å²	101	65.1 Å²	65.1	38%	0.381	33%	0.325	S	S	.	.	P	Polyproline II helix	trans	-61.2	134	179.2	-162.6	-173.8	85	-126.9	0.9	110.3	S1344 Y1402 E1406	R1341-S1344 WeakPolarHBondContact O-CB 3.3Å; R1341-S1344 PolarHBondContact O-N 3.01Å; R1341-S1344 VanDerWaalsContact O-N 3.08Å; R1341-S1344 PolarHBondContact O-OG 2.98Å; R1341-Y1402 HydrophobicContact CB-CE2 4.27Å; R1341-Y1402 VanDerWaalsContact CB-OH 3.22Å; R1341-Y1402 WeakPolarHBondContact CB-OH 3.45Å; R1341-Y1402 PolarHBondContact N-OH 2.67Å; R1341-E1406 IonicContact CZ-OE2 3.14Å; R1341-E1406 IonicContact NH1-OE2 2.86Å; R1341-E1406 PolarHBondContact NH1-OE2 3.02Å; R1341-E1406 IonicContact NH2-OE2 3.73Å; R1341-E1406 PolarHBondContact NH2-OE2 3.32Å
1342	T	78.4	Confident	88.6	Confident	131 Å²	131	61 Å²	61	80%	0.804	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.7	138.7	174.8	39.3	0	0	0	0	111.6	R1340 S1344	R1340-T1342 PolarHBondContact O-N 2.83Å; T1342-S1344 VanDerWaalsContact C-N 3.28Å; T1342-S1344 PolarHBondContact O-N 3.04Å
1343	G	75.7	Confident	88.6	Confident	86 Å²	86	63.9 Å²	63.9	89%	0.887	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.3	-16.3	-174.5	0	0	0	0	0	116.3
1344	S	76.6	Confident	88.6	Confident	11 Å²	11	62.8 Å²	62.8	8%	0.077	31%	0.312	C	S	.	.			trans	-84.2	135.1	176.8	70.1	0	0	0	0	112	R1340 R1341 T1342 Y1402	R1340-S1344 VanDerWaalsContact CD-O 3.3Å; R1340-S1344 WeakPolarHBondContact CD-O 3.39Å; R1340-S1344 VanDerWaalsContact CG-OG 3.26Å; R1340-S1344 WeakPolarHBondContact CG-OG 3.43Å; R1340-S1344 PolarHBondContact NE-O 3.12Å; R1341-S1344 WeakPolarHBondContact O-CB 3.3Å; R1341-S1344 PolarHBondContact O-N 3.01Å; R1341-S1344 VanDerWaalsContact O-N 3.08Å; R1341-S1344 PolarHBondContact O-OG 2.98Å; T1342-S1344 VanDerWaalsContact C-N 3.28Å; T1342-S1344 PolarHBondContact O-N 3.04Å; S1344-Y1402 WeakPolarHBondContact OG-CE1 3.46Å
1345	K	77.5	Confident	88.6	Confident	180 Å²	180	58.9 Å²	58.9	78%	0.783	30%	0.298	S	S	*	.	S	Bend	trans	-76.7	-41.2	178	-70.9	-170.5	177.3	-174.6	0	112.3	R1340	R1340-K1345 PolarHBondContact NH1-O 2.88Å
1346	F	81.8	Confident	88.5	Confident	154 Å²	154	58.9 Å²	58.9	68%	0.675	30%	0.298	S	S	*	.	S	Bend	trans	-102.6	154.7	-175	-54.7	-75.5	0	0	0	111.6
1347	Y	86.4	Confident	88.4	Confident	75 Å²	75	56.9 Å²	56.9	29%	0.294	29%	0.289	S	S	.	.	P	Polyproline II helix	trans	-65.3	146.4	163.1	-73.2	-86.6	0	0	0	110.2	L1338 R1340 R1373 P1375	L1338-Y1347 WeakPolarHBondContact O-CE1 3.45Å; R1340-Y1347 HydrophobicContact CB-CD1 4Å; R1340-Y1347 HydrophobicContact CB-CE1 3.7Å; R1340-Y1347 HydrophobicContact CG-CD1 4.49Å; Y1347-R1373 WeakPolarHBondContact O-CD 2.92Å; Y1347-R1373 PolarHBondContact O-NH1 2.91Å; Y1347-P1375 HydrophobicContact CD1-CB 4.39Å; Y1347-P1375 HydrophobicContact CE1-CB 3.76Å; Y1347-P1375 HydrophobicContact CE1-CG 4.44Å; Y1347-P1375 HydrophobicContact CE2-CB 4.45Å; Y1347-P1375 HydrophobicContact CE2-CG 4.28Å
1348	P	87.6	Confident	88.3	Confident	5 Å²	5	53.8 Å²	53.8	3%	0.032	28%	0.277	C	S	.	.	P	Polyproline II helix	trans	-69.1	166.2	170.4	30.8	-33.1	0	0	0	110.4	P1350 Y1402 I1411	P1348-P1350 VanDerWaalsContact O-CD 3.28Å; P1348-P1350 WeakPolarHBondContact O-CD 3.42Å; P1348-Y1402 HydrophobicContact CB-CD1 4.03Å; P1348-Y1402 HydrophobicContact CB-CD2 3.93Å; P1348-Y1402 HydrophobicContact CB-CE1 3.88Å; P1348-Y1402 HydrophobicContact CB-CE2 3.77Å; P1348-Y1402 HydrophobicContact CB-CG 4.03Å; P1348-Y1402 HydrophobicContact CG-CE1 4.11Å; P1348-Y1402 HydrophobicContact CG-CE2 4.03Å; P1348-I1411 HydrophobicContact CG-CD1 3.79Å
1349	S	91.9	Very high	87.5	Confident	23 Å²	23	60.7 Å²	60.7	16%	0.161	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	108.2	160.7	-72.1	0	0	0	0	107.7	L1370 R1373 D1401	S1349-L1370 WeakPolarHBondContact O-CD2 3.38Å; S1349-R1373 VanDerWaalsContact OG-CG 3.25Å; S1349-R1373 WeakPolarHBondContact OG-CG 3.43Å; S1349-R1373 PolarHBondContact OG-NE 2.69Å; S1349-D1401 PolarHBondContact N-O 3.13Å; S1349-D1401 WeakPolarHBondContact O-CB 3.44Å; S1349-D1401 PolarHBondContact O-N 3.24Å
1350	P	94.5	Very high	87	Confident	1 Å²	1	64.9 Å²	64.9	1%	0.006	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	152.5	-175.1	32.6	-28.6	0	0	0	110.7	L1338 P1348 A1371 A1372 P1377 F1379 V1398 V1399 I1411	L1338-P1350 HydrophobicContact CD1-CB 4.13Å; L1338-P1350 HydrophobicContact CD1-CG 4.27Å; P1348-P1350 VanDerWaalsContact O-CD 3.28Å; P1348-P1350 WeakPolarHBondContact O-CD 3.42Å; P1350-A1371 HydrophobicContact CG-CB 4.26Å; P1350-A1371 PolarHBondContact O-N 3.39Å; P1350-A1372 VanDerWaalsContact CD-O 3.27Å; P1350-A1372 WeakPolarHBondContact CD-O 3.09Å; P1350-P1377 HydrophobicContact CB-CG 4.47Å; P1350-P1377 HydrophobicContact CG-CB 3.45Å; P1350-P1377 VanDerWaalsContact CG-CB 3.45Å; P1350-P1377 HydrophobicContact CG-CG 3.58Å; P1350-F1379 HydrophobicContact CB-CZ 4.33Å; P1350-F1379 HydrophobicContact CG-CE1 4.47Å; P1350-F1379 HydrophobicContact CG-CZ 4.22Å; P1350-V1398 HydrophobicContact CB-CG1 4.31Å; P1350-V1399 CarbonylContact C-O 3.56Å; P1350-V1399 WeakPolarHBondContact CA-O 3.5Å; P1350-I1411 HydrophobicContact CB-CD1 4.26Å
1351	Y	96.1	Very high	87	Confident	28 Å²	28	61.9 Å²	61.9	11%	0.11	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	151.9	164.8	69.4	-74	0	0	0	108.9	K1353 G1369 L1370 V1399 K1408	Y1351-K1353 HydrophobicContact CD2-CG 4.43Å; Y1351-K1353 HydrophobicContact CE2-CG 3.96Å; Y1351-G1369 WeakPolarHBondContact CB-O 3.39Å; Y1351-L1370 HydrophobicContact CD1-CD2 3.7Å; Y1351-L1370 HydrophobicContact CG-CD2 4.21Å; Y1351-V1399 HydrophobicContact CD1-CB 4.21Å; Y1351-V1399 VanDerWaalsContact CD1-O 3.24Å; Y1351-V1399 WeakPolarHBondContact CD1-O 3.21Å; Y1351-V1399 HydrophobicContact CE1-CB 3.67Å; Y1351-V1399 HydrophobicContact CE1-CG1 3.61Å; Y1351-V1399 HydrophobicContact CE2-CB 4.4Å; Y1351-V1399 PolarHBondContact N-O 2.79Å; Y1351-V1399 PolarHBondContact O-N 3.22Å; Y1351-K1408 HydrophobicContact CE1-CD 4.16Å
1352	V	97.2	Very high	87.6	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	137.1	-176.8	-170.5	0	0	0	0	108.5	I1317 V1332 V1354 K1367 T1368 F1379 V1396 T1397 V1398	I1317-V1352 HydrophobicContact CD1-CB 4.43Å; I1317-V1352 HydrophobicContact CD1-CG1 3.83Å; I1317-V1352 HydrophobicContact CD1-CG2 3.73Å; V1332-V1352 HydrophobicContact CG1-CB 4.11Å; V1332-V1352 HydrophobicContact CG1-CG1 4.37Å; V1332-V1352 HydrophobicContact CG1-CG2 3.8Å; V1352-V1354 HydrophobicContact CG1-CG2 4.17Å; V1352-K1367 CarbonylContact O-C 3.58Å; V1352-K1367 WeakPolarHBondContact O-CA 2.95Å; V1352-K1367 WeakPolarHBondContact O-CB 3.47Å; V1352-T1368 HydrophobicContact CB-CG2 4.06Å; V1352-T1368 PolarHBondContact N-OG1 3.14Å; V1352-T1368 PolarHBondContact O-N 3.44Å; V1352-F1379 HydrophobicContact CG2-CD1 4.3Å; V1352-F1379 HydrophobicContact CG2-CD2 4.17Å; V1352-F1379 HydrophobicContact CG2-CE1 3.9Å; V1352-F1379 HydrophobicContact CG2-CE2 3.74Å; V1352-F1379 HydrophobicContact CG2-CG 4.45Å; V1352-F1379 HydrophobicContact CG2-CZ 3.59Å; V1352-V1396 HydrophobicContact CG1-CG1 3.68Å; V1352-T1397 WeakPolarHBondContact CA-O 3.43Å; V1352-V1398 HydrophobicContact CG2-CG2 4.26Å
1353	K	96.9	Very high	88.2	Confident	61 Å²	61	56.2 Å²	56.2	27%	0.265	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	140.4	162.8	-55	-178.7	-168.5	166.7	0	108.1	Y1351 Y1355 A1366 K1367 T1397	Y1351-K1353 HydrophobicContact CD2-CG 4.43Å; Y1351-K1353 HydrophobicContact CE2-CG 3.96Å; K1353-Y1355 HydrophobicContact CB-CD2 4.36Å; K1353-Y1355 HydrophobicContact CB-CE2 3.75Å; K1353-Y1355 HydrophobicContact CD-CE2 3.98Å; K1353-Y1355 WeakPolarHBondContact CD-OH 3.45Å; K1353-Y1355 PolarHBondContact NZ-OH 2.77Å; K1353-A1366 WeakPolarHBondContact CA-O 3.33Å; K1353-K1367 HydrophobicContact CG-CB 4.44Å; K1353-T1397 PolarHBondContact N-O 2.85Å; K1353-T1397 PolarHBondContact O-N 2.87Å
1354	V	97.2	Very high	89.1	Confident	0 Å²	0	53 Å²	53	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	123.8	174.3	-178.7	0	0	0	0	107.2	V1330 V1332 V1352 K1365 A1366 L1383 F1385 L1394 Q1395 V1396	V1330-V1354 HydrophobicContact CG1-CG1 4.39Å; V1332-V1354 HydrophobicContact CG2-CG2 4.19Å; V1352-V1354 HydrophobicContact CG1-CG2 4.17Å; V1354-K1365 CarbonylContact O-C 3.46Å; V1354-K1365 WeakPolarHBondContact O-CA 3.49Å; V1354-A1366 PolarHBondContact N-O 2.92Å; V1354-A1366 PolarHBondContact O-N 3.16Å; V1354-L1383 HydrophobicContact CB-CD1 4.08Å; V1354-L1383 HydrophobicContact CG2-CD1 3.7Å; V1354-F1385 HydrophobicContact CB-CE2 4.41Å; V1354-F1385 HydrophobicContact CB-CZ 3.95Å; V1354-F1385 HydrophobicContact CG1-CE2 3.87Å; V1354-F1385 HydrophobicContact CG1-CZ 3.68Å; V1354-L1394 HydrophobicContact CG1-CD1 3.45Å; V1354-L1394 VanDerWaalsContact CG1-CD1 3.45Å; V1354-L1394 HydrophobicContact CG1-CD2 4.1Å; V1354-L1394 HydrophobicContact CG1-CG 3.7Å; V1354-Q1395 WeakPolarHBondContact CA-O 3.47Å; V1354-V1396 HydrophobicContact CG1-CG2 4.35Å; V1354-V1396 HydrophobicContact CG2-CG1 4.39Å; V1354-V1396 HydrophobicContact CG2-CG2 4.34Å
1355	Y	96.6	Very high	90	Very high	35 Å²	35	60.3 Å²	60.3	14%	0.137	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	130.7	179.5	-57.4	-91.1	0	0	0	109	M1242 K1353 V1362 A1364 K1365 L1394 Q1395	M1242-Y1355 HydrophobicContact CE-CE2 4.31Å; K1353-Y1355 HydrophobicContact CB-CD2 4.36Å; K1353-Y1355 HydrophobicContact CB-CE2 3.75Å; K1353-Y1355 HydrophobicContact CD-CE2 3.98Å; K1353-Y1355 WeakPolarHBondContact CD-OH 3.45Å; K1353-Y1355 PolarHBondContact NZ-OH 2.77Å; Y1355-V1362 HydrophobicContact CD1-CG1 3.82Å; Y1355-V1362 HydrophobicContact CD1-CG2 4.23Å; Y1355-A1364 WeakPolarHBondContact CA-O 3.26Å; Y1355-K1365 HydrophobicContact CD1-CB 3.67Å; Y1355-K1365 HydrophobicContact CE1-CB 4.06Å; Y1355-L1394 CarbonylContact O-C 3.46Å; Y1355-L1394 WeakPolarHBondContact O-CA 3.35Å; Y1355-Q1395 PolarHBondContact N-O 2.93Å; Y1355-Q1395 PolarHBondContact O-N 3.28Å
1356	L	95.9	Very high	91	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	114.3	168.2	-177.9	65.3	0	0	0	107.7	L1328 V1363 A1364 F1385 E1387 R1392 L1394 L1418	L1328-L1356 HydrophobicContact CD2-CD1 4.29Å; L1356-V1363 PolarHBondContact O-N 3.47Å; L1356-A1364 HydrophobicContact CB-CB 4.3Å; L1356-A1364 PolarHBondContact N-O 3.14Å; L1356-A1364 PolarHBondContact O-N 2.82Å; L1356-F1385 HydrophobicContact CB-CD1 4.35Å; L1356-F1385 HydrophobicContact CB-CE1 4.48Å; L1356-F1385 HydrophobicContact CD2-CB 4.48Å; L1356-E1387 HydrophobicContact CD2-CB 4.01Å; L1356-R1392 HydrophobicContact CD1-CB 3.81Å; L1356-R1392 HydrophobicContact CG-CB 4.45Å; L1356-L1394 HydrophobicContact CD1-CD1 4.34Å; L1356-L1418 HydrophobicContact CD1-CD1 3.6Å
1357	C	92.5	Very high	91.6	Very high	1 Å²	1	52.7 Å²	52.7	1%	0.007	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	127.5	-169.5	-62.5	0	0	0	0	111.4	S1361 R1392 L1393	C1357-S1361 CarbonylContact C-O 3.56Å; C1357-S1361 WeakPolarHBondContact CA-O 3.4Å; C1357-R1392 VanDerWaalsContact O-CB 3.32Å; C1357-R1392 WeakPolarHBondContact O-CB 3.47Å; C1357-L1393 HydrophobicContact CB-CB 4.34Å; C1357-L1393 PolarHBondContact N-O 2.81Å; C1357-L1393 PolarHBondContact O-N 3.3Å
1358	N	89.2	Confident	92.1	Very high	63 Å²	63	49.4 Å²	49.4	34%	0.337	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	97.8	165.7	-165.6	77.1	0	0	0	107.3	K1360 S1361 V1363 R1392	N1358-K1360 PolarHBondContact O-N 2.99Å; N1358-S1361 PolarHBondContact N-O 2.79Å; N1358-S1361 PolarHBondContact O-N 3.49Å; N1358-S1361 PolarHBondContact O-OG 2.88Å; N1358-V1363 HydrophobicContact CB-CG2 3.68Å; N1358-R1392 HydrophobicContact CB-CG 4.24Å; N1358-R1392 PolarHBondContact OD1-NE 3.1Å
1359	E	76.9	Confident	92.4	Very high	150 Å²	150	50.9 Å²	50.9	70%	0.701	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.9	-107.4	-168.4	-57.1	176.2	-176.3	0	0	112.2
1360	K	75.4	Confident	92.4	Very high	132 Å²	132	54.7 Å²	54.7	57%	0.574	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.8	-4.7	-178.5	-61.1	172.1	-176.1	172.7	0	113.4	F1244 N1358	F1244-K1360 HydrophobicContact CB-CG 4.36Å; F1244-K1360 WeakPolarHBondContact O-CE 3.29Å; N1358-K1360 PolarHBondContact O-N 2.99Å
1361	S	83.9	Confident	92.4	Very high	62 Å²	62	55.2 Å²	55.2	43%	0.434	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	129.1	-176.8	67.4	0	0	0	0	111.7	C1357 N1358 V1363	C1357-S1361 CarbonylContact C-O 3.56Å; C1357-S1361 WeakPolarHBondContact CA-O 3.4Å; N1358-S1361 PolarHBondContact N-O 2.79Å; N1358-S1361 PolarHBondContact O-N 3.49Å; N1358-S1361 PolarHBondContact O-OG 2.88Å; S1361-V1363 PolarHBondContact O-N 3.17Å
1362	V	91.6	Very high	92.2	Very high	59 Å²	59	57.1 Å²	57.1	36%	0.358	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	113.9	174.3	175.5	0	0	0	0	108.5	Y1355 K1365	Y1355-V1362 HydrophobicContact CD1-CG1 3.82Å; Y1355-V1362 HydrophobicContact CD1-CG2 4.23Å; V1362-K1365 HydrophobicContact CG1-CB 4.38Å
1363	V	91.8	Very high	91.9	Very high	55 Å²	55	62.4 Å²	62.4	33%	0.333	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	-53.2	176.8	-173.6	0	0	0	0	109.9	L1356 N1358 S1361 E1387	L1356-V1363 PolarHBondContact O-N 3.47Å; N1358-V1363 HydrophobicContact CB-CG2 3.68Å; S1361-V1363 PolarHBondContact O-N 3.17Å; V1363-E1387 HydrophobicContact CG1-CB 4.15Å; V1363-E1387 HydrophobicContact CG1-CG 4.06Å
1364	A	94.4	Very high	91.7	Very high	18 Å²	18	61.7 Å²	61.7	15%	0.149	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	159.4	178.5	0	0	0	0	0	112.4	Y1355 L1356 F1385 E1387	Y1355-A1364 WeakPolarHBondContact CA-O 3.26Å; L1356-A1364 HydrophobicContact CB-CB 4.3Å; L1356-A1364 PolarHBondContact N-O 3.14Å; L1356-A1364 PolarHBondContact O-N 2.82Å; A1364-F1385 HydrophobicContact CB-CD1 3.63Å; A1364-F1385 HydrophobicContact CB-CE1 4.1Å; A1364-E1387 HydrophobicContact CB-CG 3.84Å
1365	K	95.6	Very high	91.4	Very high	164 Å²	164	63.7 Å²	63.7	71%	0.713	34%	0.342	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-147.2	125.4	-178.2	68.8	-152.6	175	-151.9	0	111.4	V1354 Y1355 V1362	V1354-K1365 CarbonylContact O-C 3.46Å; V1354-K1365 WeakPolarHBondContact O-CA 3.49Å; Y1355-K1365 HydrophobicContact CD1-CB 3.67Å; Y1355-K1365 HydrophobicContact CE1-CB 4.06Å; V1362-K1365 HydrophobicContact CG1-CB 4.38Å
1366	A	96.7	Very high	91.3	Very high	24 Å²	24	66.9 Å²	66.9	20%	0.198	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	167.8	173.3	0	0	0	0	0	110.3	K1353 V1354 L1383 F1385	K1353-A1366 WeakPolarHBondContact CA-O 3.33Å; V1354-A1366 PolarHBondContact N-O 2.92Å; V1354-A1366 PolarHBondContact O-N 3.16Å; A1366-L1383 HydrophobicContact CB-CB 3.84Å; A1366-L1383 HydrophobicContact CB-CD1 3.92Å; A1366-L1383 HydrophobicContact CB-CD2 4.18Å; A1366-L1383 HydrophobicContact CB-CG 4.19Å; A1366-F1385 HydrophobicContact CB-CE1 3.78Å; A1366-F1385 HydrophobicContact CB-CE2 4.31Å; A1366-F1385 HydrophobicContact CB-CZ 3.54Å
1367	K	95.9	Very high	91.3	Very high	150 Å²	150	66.9 Å²	66.9	65%	0.652	36%	0.358	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-152.4	150.9	178.1	67.2	-178.5	-178.3	-179.2	0	111.2	V1352 K1353 L1383	V1352-K1367 CarbonylContact O-C 3.58Å; V1352-K1367 WeakPolarHBondContact O-CA 2.95Å; V1352-K1367 WeakPolarHBondContact O-CB 3.47Å; K1353-K1367 HydrophobicContact CG-CB 4.44Å; K1367-L1383 WeakPolarHBondContact O-CD2 3.36Å
1368	T	96.8	Very high	91.4	Very high	6 Å²	6	75.2 Å²	75.2	4%	0.037	39%	0.39	C	S	.	.			trans	-79.7	165.4	165.8	69.7	0	0	0	0	111.1	V1332 V1352 F1379 Q1381	V1332-T1368 HydrophobicContact CB-CG2 3.8Å; V1332-T1368 HydrophobicContact CG1-CG2 3.89Å; V1332-T1368 HydrophobicContact CG2-CG2 4Å; V1352-T1368 HydrophobicContact CB-CG2 4.06Å; V1352-T1368 PolarHBondContact N-OG1 3.14Å; V1352-T1368 PolarHBondContact O-N 3.44Å; T1368-F1379 HydrophobicContact CG2-CB 4.25Å; T1368-F1379 HydrophobicContact CG2-CD1 4.31Å; T1368-F1379 HydrophobicContact CG2-CG 4.42Å; T1368-Q1381 VanDerWaalsContact CA-OE1 3.3Å; T1368-Q1381 HydrophobicContact CG2-CB 4.15Å
1369	G	93.2	Very high	91.8	Very high	37 Å²	37	72.8 Å²	72.8	38%	0.381	38%	0.376	S	S	.	.			trans	-64	174.9	154.8	0	0	0	0	0	112.7	Y1351	Y1351-G1369 WeakPolarHBondContact CB-O 3.39Å
1370	L	93	Very high	92.7	Very high	102 Å²	102	69.2 Å²	69.2	53%	0.534	36%	0.362	S	S	.	.			trans	-76	132.1	175.2	-70	164	0	0	0	110.5	S1349 Y1351 D1401	S1349-L1370 WeakPolarHBondContact O-CD2 3.38Å; Y1351-L1370 HydrophobicContact CD1-CD2 3.7Å; Y1351-L1370 HydrophobicContact CG-CD2 4.21Å; L1370-D1401 HydrophobicContact CD2-CB 3.91Å
1371	A	94.3	Very high	93.7	Very high	13 Å²	13	66 Å²	66	11%	0.107	35%	0.349	C	S	.	.			trans	-94.3	175.8	171.7	0	0	0	0	0	112.3	P1350 P1377 R1378 F1379	P1350-A1371 HydrophobicContact CG-CB 4.26Å; P1350-A1371 PolarHBondContact O-N 3.39Å; A1371-P1377 HydrophobicContact CB-CB 3.69Å; A1371-R1378 WeakPolarHBondContact CB-O 3.43Å; A1371-F1379 HydrophobicContact CB-CD1 3.71Å; A1371-F1379 HydrophobicContact CB-CE1 3.49Å; A1371-F1379 VanDerWaalsContact CB-CE1 3.49Å; A1371-F1379 HydrophobicContact CB-CZ 4.22Å
1372	A	91.2	Very high	94.3	Very high	67 Å²	67	67.1 Å²	67.1	55%	0.554	35%	0.35	S	S	*	.			trans	-63.3	157.5	178.3	0	0	0	0	0	113	P1350 T1374	P1350-A1372 VanDerWaalsContact CD-O 3.27Å; P1350-A1372 WeakPolarHBondContact CD-O 3.09Å; A1372-T1374 VanDerWaalsContact C-N 3.32Å; A1372-T1374 HydrophobicContact CB-CG2 4.05Å; A1372-T1374 PolarHBondContact O-N 2.65Å
1373	R	91	Very high	94.5	Very high	111 Å²	111	65.1 Å²	65.1	42%	0.419	34%	0.336	S	S	.	.	S	Bend	trans	-82.5	71.9	-178.4	-64.6	-168.2	168	-136.3	5.8	112.1	Y1347 S1349 D1401 Y1402	Y1347-R1373 WeakPolarHBondContact O-CD 2.92Å; Y1347-R1373 PolarHBondContact O-NH1 2.91Å; S1349-R1373 VanDerWaalsContact OG-CG 3.25Å; S1349-R1373 WeakPolarHBondContact OG-CG 3.43Å; S1349-R1373 PolarHBondContact OG-NE 2.69Å; R1373-D1401 PolarHBondContact NH2-O 3.41Å; R1373-Y1402 PolarHBondContact NH1-O 2.83Å; R1373-Y1402 PolarHBondContact NH2-O 2.78Å
1374	T	92.2	Very high	94.7	Very high	46 Å²	46	66.9 Å²	66.9	28%	0.282	34%	0.343	S	S	.	.	S	Bend	trans	-136.4	151.9	-175.7	165.7	0	0	0	0	109.8	A1372 E1376 P1377	A1372-T1374 VanDerWaalsContact C-N 3.32Å; A1372-T1374 HydrophobicContact CB-CG2 4.05Å; A1372-T1374 PolarHBondContact O-N 2.65Å; T1374-E1376 VanDerWaalsContact CG2-O 3.31Å; T1374-E1376 WeakPolarHBondContact CG2-O 3.19Å; T1374-E1376 PolarHBondContact O-N 2.86Å; T1374-E1376 PolarHBondContact OG1-N 3.31Å; T1374-P1377 HydrophobicContact CG2-CB 4.33Å
1375	P	91.9	Very high	94.8	Very high	43 Å²	43	66.4 Å²	66.4	28%	0.279	34%	0.338	S	S	.	.	S	Bend	trans	-61.9	-18.6	166.9	26.6	-35.3	0	0	0	113.2	K1336 H1337 L1338 Y1347 P1377	K1336-P1375 CarbonylContact C-O 3.6Å; H1337-P1375 PolarHBondContact N-O 2.95Å; L1338-P1375 PolarHBondContact N-O 3.09Å; L1338-P1375 VanDerWaalsContact N-O 3.12Å; Y1347-P1375 HydrophobicContact CD1-CB 4.39Å; Y1347-P1375 HydrophobicContact CE1-CB 3.76Å; Y1347-P1375 HydrophobicContact CE1-CG 4.44Å; Y1347-P1375 HydrophobicContact CE2-CB 4.45Å; Y1347-P1375 HydrophobicContact CE2-CG 4.28Å; P1375-P1377 VanDerWaalsContact C-CD 3.47Å; P1375-P1377 WeakPolarHBondContact O-CD 3.35Å
1376	E	94	Very high	94.7	Very high	101 Å²	101	63.4 Å²	63.4	47%	0.472	33%	0.334	S	S	.	.	S	Bend	trans	-119.1	71.8	178.1	-55.5	-153.6	127.6	0	0	112.2	A1335 K1336 T1374	A1335-E1376 CarbonylContact O-C 3.56Å; A1335-E1376 VanDerWaalsContact O-CA 3.23Å; A1335-E1376 WeakPolarHBondContact O-CA 3.45Å; K1336-E1376 HydrophobicContact CB-CG 4.08Å; K1336-E1376 VanDerWaalsContact CB-OE1 3.26Å; K1336-E1376 WeakPolarHBondContact CB-OE1 3.35Å; T1374-E1376 VanDerWaalsContact CG2-O 3.31Å; T1374-E1376 WeakPolarHBondContact CG2-O 3.19Å; T1374-E1376 PolarHBondContact O-N 2.86Å; T1374-E1376 PolarHBondContact OG1-N 3.31Å
1377	P	95.4	Very high	94.4	Very high	0 Å²	0	66.1 Å²	66.1	0%	0	34%	0.342	C	S	.	.			trans	-75.5	139.8	-179.7	32.9	-37.8	0	0	0	111.8	R1334 A1335 L1338 P1350 A1371 T1374 P1375 F1379	R1334-P1377 CarbonylContact C-O 3.59Å; R1334-P1377 VanDerWaalsContact CA-O 3.22Å; R1334-P1377 WeakPolarHBondContact CA-O 3.45Å; R1334-P1377 WeakPolarHBondContact CB-O 3.31Å; A1335-P1377 HydrophobicContact CB-CG 3.94Å; A1335-P1377 PolarHBondContact N-O 2.96Å; A1335-P1377 WeakPolarHBondContact O-CD 3.36Å; L1338-P1377 HydrophobicContact CD1-CG 3.54Å; L1338-P1377 HydrophobicContact CG-CG 4.41Å; P1350-P1377 HydrophobicContact CB-CG 4.47Å; P1350-P1377 HydrophobicContact CG-CB 3.45Å; P1350-P1377 VanDerWaalsContact CG-CB 3.45Å; P1350-P1377 HydrophobicContact CG-CG 3.58Å; A1371-P1377 HydrophobicContact CB-CB 3.69Å; T1374-P1377 HydrophobicContact CG2-CB 4.33Å; P1375-P1377 VanDerWaalsContact C-CD 3.47Å; P1375-P1377 WeakPolarHBondContact O-CD 3.35Å; P1377-F1379 HydrophobicContact CB-CE1 4.42Å; P1377-F1379 HydrophobicContact CB-CE2 4.15Å; P1377-F1379 HydrophobicContact CB-CZ 3.86Å; P1377-F1379 HydrophobicContact CG-CE2 3.82Å; P1377-F1379 HydrophobicContact CG-CZ 3.69Å
1378	R	95.6	Very high	94.1	Very high	177 Å²	177	62.3 Å²	62.3	67%	0.668	33%	0.333	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.1	137.3	170.5	-168.5	165.7	173.5	-177.9	-12.3	110.1	A1371 D1380	A1371-R1378 WeakPolarHBondContact CB-O 3.43Å; R1378-D1380 VanDerWaalsContact CG-OD1 3.29Å; R1378-D1380 WeakPolarHBondContact CG-OD1 3.49Å; R1378-D1380 IonicContact CZ-OD1 3.32Å; R1378-D1380 IonicContact CZ-OD2 3.89Å; R1378-D1380 IonicContact NE-OD1 2.71Å; R1378-D1380 PolarHBondContact NE-OD1 3.34Å; R1378-D1380 IonicContact NE-OD2 3.21Å; R1378-D1380 PolarHBondContact NE-OD2 3.34Å; R1378-D1380 IonicContact NH2-OD1 2.71Å; R1378-D1380 IonicContact NH2-OD2 2.59Å; R1378-D1380 PolarHBondContact NH2-OD2 3.25Å
1379	F	96.5	Very high	93.9	Very high	11 Å²	11	62.7 Å²	62.7	5%	0.048	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	-42.3	-174.8	-58.2	-77.2	0	0	0	112.1	V1332 V1333 A1335 P1350 V1352 T1368 A1371 P1377 Q1381	V1332-F1379 HydrophobicContact CB-CB 4.44Å; V1332-F1379 HydrophobicContact CG1-CB 3.95Å; V1332-F1379 HydrophobicContact CG1-CD2 3.75Å; V1332-F1379 HydrophobicContact CG1-CG 3.95Å; V1332-F1379 WeakPolarHBondContact O-CB 3.37Å; V1333-F1379 PolarHBondContact O-N 3.16Å; A1335-F1379 HydrophobicContact CB-CE2 4.21Å; P1350-F1379 HydrophobicContact CB-CZ 4.33Å; P1350-F1379 HydrophobicContact CG-CE1 4.47Å; P1350-F1379 HydrophobicContact CG-CZ 4.22Å; V1352-F1379 HydrophobicContact CG2-CD1 4.3Å; V1352-F1379 HydrophobicContact CG2-CD2 4.17Å; V1352-F1379 HydrophobicContact CG2-CE1 3.9Å; V1352-F1379 HydrophobicContact CG2-CE2 3.74Å; V1352-F1379 HydrophobicContact CG2-CG 4.45Å; V1352-F1379 HydrophobicContact CG2-CZ 3.59Å; T1368-F1379 HydrophobicContact CG2-CB 4.25Å; T1368-F1379 HydrophobicContact CG2-CD1 4.31Å; T1368-F1379 HydrophobicContact CG2-CG 4.42Å; A1371-F1379 HydrophobicContact CB-CD1 3.71Å; A1371-F1379 HydrophobicContact CB-CE1 3.49Å; A1371-F1379 VanDerWaalsContact CB-CE1 3.49Å; A1371-F1379 HydrophobicContact CB-CZ 4.22Å; P1377-F1379 HydrophobicContact CB-CE1 4.42Å; P1377-F1379 HydrophobicContact CB-CE2 4.15Å; P1377-F1379 HydrophobicContact CB-CZ 3.86Å; P1377-F1379 HydrophobicContact CG-CE2 3.82Å; P1377-F1379 HydrophobicContact CG-CZ 3.69Å; F1379-Q1381 WeakPolarHBondContact O-CG 3.37Å; F1379-Q1381 PolarHBondContact O-N 3.13Å; F1379-Q1381 VanDerWaalsContact O-N 3.16Å; F1379-Q1381 PolarHBondContact O-NE2 3.17Å
1380	D	95.7	Very high	93.5	Very high	75 Å²	75	66.2 Å²	66.2	40%	0.401	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	44.7	40.4	-179.3	-70.2	5.5	0	0	0	115	V1332 V1333 R1378	V1332-D1380 PolarHBondContact O-N 3.28Å; V1332-D1380 VanDerWaalsContact O-N 3.13Å; V1333-D1380 PolarHBondContact O-N 2.84Å; R1378-D1380 VanDerWaalsContact CG-OD1 3.29Å; R1378-D1380 WeakPolarHBondContact CG-OD1 3.49Å; R1378-D1380 IonicContact CZ-OD1 3.32Å; R1378-D1380 IonicContact CZ-OD2 3.89Å; R1378-D1380 IonicContact NE-OD1 2.71Å; R1378-D1380 PolarHBondContact NE-OD1 3.34Å; R1378-D1380 IonicContact NE-OD2 3.21Å; R1378-D1380 PolarHBondContact NE-OD2 3.34Å; R1378-D1380 IonicContact NH2-OD1 2.71Å; R1378-D1380 IonicContact NH2-OD2 2.59Å; R1378-D1380 PolarHBondContact NH2-OD2 3.25Å
1381	Q	96.2	Very high	93.1	Very high	65 Å²	65	68.5 Å²	68.5	30%	0.304	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	126.1	-171.9	-86.6	158.8	79.2	0	0	112.7	K1331 V1332 T1368 F1379	K1331-Q1381 CarbonylContact C-O 3.5Å; K1331-Q1381 WeakPolarHBondContact CA-O 3.24Å; V1332-Q1381 PolarHBondContact N-O 3.28Å; V1332-Q1381 PolarHBondContact O-N 3.17Å; T1368-Q1381 VanDerWaalsContact CA-OE1 3.3Å; T1368-Q1381 HydrophobicContact CG2-CB 4.15Å; F1379-Q1381 WeakPolarHBondContact O-CG 3.37Å; F1379-Q1381 PolarHBondContact O-N 3.13Å; F1379-Q1381 VanDerWaalsContact O-N 3.16Å; F1379-Q1381 PolarHBondContact O-NE2 3.17Å
1382	L	96.6	Very high	93	Very high	86 Å²	86	70 Å²	70	45%	0.45	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	127.1	171.7	-173.3	63.9	0	0	0	110.2	E1329 K1331 I1384	E1329-L1382 HydrophobicContact CB-CD1 3.97Å; E1329-L1382 HydrophobicContact CG-CD1 4.21Å; K1331-L1382 HydrophobicContact CB-CD1 4.03Å; L1382-I1384 HydrophobicContact CD2-CD1 4.07Å; L1382-I1384 HydrophobicContact CD2-CG1 4.12Å; L1382-I1384 HydrophobicContact CG-CD1 4.47Å; L1382-I1384 HydrophobicContact CG-CG1 4Å
1383	L	96.9	Very high	93.1	Very high	16 Å²	16	68.5 Å²	68.5	8%	0.084	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	121.1	173.2	-52.8	179.8	0	0	0	107.4	V1330 V1332 V1354 A1366 K1367 F1385	V1330-L1383 PolarHBondContact N-O 3.5Å; V1330-L1383 WeakPolarHBondContact O-CB 3.37Å; V1330-L1383 PolarHBondContact O-N 3.08Å; V1332-L1383 HydrophobicContact CG2-CD1 3.79Å; V1332-L1383 HydrophobicContact CG2-CG 4.35Å; V1354-L1383 HydrophobicContact CB-CD1 4.08Å; V1354-L1383 HydrophobicContact CG2-CD1 3.7Å; A1366-L1383 HydrophobicContact CB-CB 3.84Å; A1366-L1383 HydrophobicContact CB-CD1 3.92Å; A1366-L1383 HydrophobicContact CB-CD2 4.18Å; A1366-L1383 HydrophobicContact CB-CG 4.19Å; K1367-L1383 WeakPolarHBondContact O-CD2 3.36Å; L1383-F1385 HydrophobicContact CB-CE2 4.36Å
1384	I	96.2	Very high	93.3	Very high	93 Å²	93	63.2 Å²	63.2	48%	0.477	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	132.6	-176.4	-51.8	176.5	0	0	0	108.6	N1327 E1329 L1382	N1327-I1384 HydrophobicContact CB-CG2 3.79Å; E1329-I1384 HydrophobicContact CG-CG1 4.26Å; L1382-I1384 HydrophobicContact CD2-CD1 4.07Å; L1382-I1384 HydrophobicContact CD2-CG1 4.12Å; L1382-I1384 HydrophobicContact CG-CD1 4.47Å; L1382-I1384 HydrophobicContact CG-CG1 4Å
1385	F	95.5	Very high	93.4	Very high	7 Å²	7	61 Å²	61	3%	0.031	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	120.4	173.9	-58.7	-90.8	0	0	0	109.7	N1327 L1328 V1330 V1354 L1356 A1364 A1366 L1383 E1387 L1394	N1327-F1385 WeakPolarHBondContact CA-O 3.34Å; N1327-F1385 WeakPolarHBondContact CB-O 3.43Å; L1328-F1385 HydrophobicContact CB-CB 4.26Å; L1328-F1385 HydrophobicContact CD2-CD2 4.25Å; L1328-F1385 PolarHBondContact N-O 3.13Å; L1328-F1385 PolarHBondContact O-N 2.95Å; V1330-F1385 HydrophobicContact CB-CE2 4.27Å; V1330-F1385 HydrophobicContact CG2-CD2 4.05Å; V1330-F1385 HydrophobicContact CG2-CE2 3.85Å; V1354-F1385 HydrophobicContact CB-CE2 4.41Å; V1354-F1385 HydrophobicContact CB-CZ 3.95Å; V1354-F1385 HydrophobicContact CG1-CE2 3.87Å; V1354-F1385 HydrophobicContact CG1-CZ 3.68Å; L1356-F1385 HydrophobicContact CB-CD1 4.35Å; L1356-F1385 HydrophobicContact CB-CE1 4.48Å; L1356-F1385 HydrophobicContact CD2-CB 4.48Å; A1364-F1385 HydrophobicContact CB-CD1 3.63Å; A1364-F1385 HydrophobicContact CB-CE1 4.1Å; A1366-F1385 HydrophobicContact CB-CE1 3.78Å; A1366-F1385 HydrophobicContact CB-CE2 4.31Å; A1366-F1385 HydrophobicContact CB-CZ 3.54Å; L1383-F1385 HydrophobicContact CB-CE2 4.36Å; F1385-E1387 VanDerWaalsContact C-N 3.33Å; F1385-L1394 HydrophobicContact CE2-CD1 4.4Å
1386	T	93.5	Very high	93.7	Very high	102 Å²	102	59 Å²	59	63%	0.626	29%	0.291	S	S	*	.			trans	-86	-5.4	177.7	53	0	0	0	0	113.2	N1327	N1327-T1386 WeakPolarHBondContact OD1-CG2 3.27Å
1387	E	91.5	Very high	93.8	Very high	81 Å²	81	54.6 Å²	54.6	38%	0.379	27%	0.271	S	S	.	.	S	Bend	trans	-81.4	148.1	179.8	-60.2	-56.4	139.5	0	0	111	L1356 V1363 A1364 F1385 Y1389	L1356-E1387 HydrophobicContact CD2-CB 4.01Å; V1363-E1387 HydrophobicContact CG1-CB 4.15Å; V1363-E1387 HydrophobicContact CG1-CG 4.06Å; A1364-E1387 HydrophobicContact CB-CG 3.84Å; F1385-E1387 VanDerWaalsContact C-N 3.33Å; E1387-Y1389 PolarHBondContact O-N 3.27Å
1388	P	89.7	Confident	93.8	Very high	70 Å²	70	54.6 Å²	54.6	46%	0.455	27%	0.271	S	S	.	.			trans	-57.3	138.7	172.1	22.1	-30.4	0	0	0	110.5	R1392	P1388-R1392 VanDerWaalsContact O-CD 3.29Å; P1388-R1392 WeakPolarHBondContact O-CD 3.33Å; P1388-R1392 PolarHBondContact O-NH1 3.24Å
1389	Y	91.1	Very high	93.7	Very high	13 Å²	13	46.6 Å²	46.6	5%	0.051	24%	0.242	C	C	.	.			trans	-126.9	-3.5	-169.2	59.1	-89.4	0	0	0	113	E1323 L1328 E1387 N1391 R1392 L1418 L1423	E1323-Y1389 WeakPolarHBondContact CG-OH 3.35Å; E1323-Y1389 PolarHBondContact OE1-OH 3.2Å; E1323-Y1389 PolarHBondContact OE2-OH 2.87Å; L1328-Y1389 HydrophobicContact CB-CD1 3.86Å; L1328-Y1389 HydrophobicContact CB-CG 3.96Å; L1328-Y1389 HydrophobicContact CD1-CD2 4.16Å; L1328-Y1389 HydrophobicContact CD1-CG 4.27Å; L1328-Y1389 HydrophobicContact CD2-CG 4.46Å; L1328-Y1389 HydrophobicContact CG-CG 4.46Å; E1387-Y1389 PolarHBondContact O-N 3.27Å; Y1389-N1391 PolarHBondContact O-N 3.11Å; Y1389-R1392 WeakPolarHBondContact O-CB 3.17Å; Y1389-R1392 PolarHBondContact O-N 3.35Å; Y1389-R1392 VanDerWaalsContact O-N 3.17Å; Y1389-L1418 HydrophobicContact CD2-CD1 4.45Å; Y1389-L1423 HydrophobicContact CD2-CD1 3.86Å; Y1389-L1423 HydrophobicContact CE2-CD1 3.7Å
1390	Q	86.2	Confident	93.5	Very high	112 Å²	112	46.1 Å²	46.1	52%	0.523	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.8	133.4	177.5	-62.8	76.8	7.5	0	0	109.9	R1392	Q1390-R1392 PolarHBondContact O-N 3.45Å; Q1390-R1392 VanDerWaalsContact O-N 3.11Å
1391	N	84.4	Confident	93.2	Very high	149 Å²	149	44 Å²	44	80%	0.797	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.1	20.9	-173.4	-72.9	-3.4	0	0	0	116.5	Y1389	Y1389-N1391 PolarHBondContact O-N 3.11Å
1392	R	91.6	Very high	92.7	Very high	46 Å²	46	41.8 Å²	41.8	17%	0.174	22%	0.218	C	C	.	.			trans	-100.2	158.7	177.8	-70.6	176.1	177.3	177.1	-4.3	113.1	L1356 C1357 N1358 P1388 Y1389 Q1390 L1418	L1356-R1392 HydrophobicContact CD1-CB 3.81Å; L1356-R1392 HydrophobicContact CG-CB 4.45Å; C1357-R1392 VanDerWaalsContact O-CB 3.32Å; C1357-R1392 WeakPolarHBondContact O-CB 3.47Å; N1358-R1392 HydrophobicContact CB-CG 4.24Å; N1358-R1392 PolarHBondContact OD1-NE 3.1Å; P1388-R1392 VanDerWaalsContact O-CD 3.29Å; P1388-R1392 WeakPolarHBondContact O-CD 3.33Å; P1388-R1392 PolarHBondContact O-NH1 3.24Å; Y1389-R1392 WeakPolarHBondContact O-CB 3.17Å; Y1389-R1392 PolarHBondContact O-N 3.35Å; Y1389-R1392 VanDerWaalsContact O-N 3.17Å; Q1390-R1392 PolarHBondContact O-N 3.45Å; Q1390-R1392 VanDerWaalsContact O-N 3.11Å; R1392-L1418 WeakPolarHBondContact O-CB 3.35Å; R1392-L1418 WeakPolarHBondContact O-CG 3.11Å; R1392-L1418 PolarHBondContact O-N 2.98Å
1393	L	93.2	Very high	91.9	Very high	34 Å²	34	38.8 Å²	38.8	18%	0.178	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	132.3	175.8	-77.4	161.9	0	0	0	109.8	V1303 C1357 I1416 K1417	V1303-L1393 HydrophobicContact CG2-CD2 3.82Å; C1357-L1393 HydrophobicContact CB-CB 4.34Å; C1357-L1393 PolarHBondContact N-O 2.81Å; C1357-L1393 PolarHBondContact O-N 3.3Å; L1393-I1416 CarbonylContact C-O 3.58Å; L1393-I1416 WeakPolarHBondContact CA-O 3.25Å; L1393-K1417 HydrophobicContact CD2-CB 3.96Å; L1393-K1417 HydrophobicContact CD2-CG 4.24Å
1394	L	95.3	Very high	90.6	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	103.9	171.1	-164.8	75.1	0	0	0	108.5	I1321 L1328 V1330 V1354 Y1355 L1356 F1385 V1396 I1416 L1418	I1321-L1394 HydrophobicContact CD1-CD2 4.02Å; L1328-L1394 HydrophobicContact CD2-CD1 4.02Å; V1330-L1394 HydrophobicContact CG1-CD2 4.16Å; V1330-L1394 HydrophobicContact CG2-CD1 4.35Å; V1330-L1394 HydrophobicContact CG2-CD2 3.84Å; V1354-L1394 HydrophobicContact CG1-CD1 3.45Å; V1354-L1394 VanDerWaalsContact CG1-CD1 3.45Å; V1354-L1394 HydrophobicContact CG1-CD2 4.1Å; V1354-L1394 HydrophobicContact CG1-CG 3.7Å; Y1355-L1394 CarbonylContact O-C 3.46Å; Y1355-L1394 WeakPolarHBondContact O-CA 3.35Å; L1356-L1394 HydrophobicContact CD1-CD1 4.34Å; F1385-L1394 HydrophobicContact CE2-CD1 4.4Å; L1394-V1396 HydrophobicContact CD2-CG2 4.42Å; L1394-V1396 HydrophobicContact CG-CG2 4.4Å; L1394-I1416 HydrophobicContact CB-CB 4.28Å; L1394-I1416 PolarHBondContact N-O 3.43Å; L1394-I1416 PolarHBondContact O-N 2.73Å; L1394-L1418 HydrophobicContact CB-CD1 4.28Å; L1394-L1418 HydrophobicContact CB-CD2 3.97Å; L1394-L1418 HydrophobicContact CB-CG 4.14Å; L1394-L1418 HydrophobicContact CD2-CD2 4.31Å
1395	Q	95	Very high	88.9	Confident	1 Å²	1	55.3 Å²	55.3	1%	0.005	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	117.9	175.8	-175	-170	21.8	0	0	109.5	F1244 V1354 Y1355 V1413 N1436	F1244-Q1395 HydrophobicContact CZ-CB 4.25Å; F1244-Q1395 HydrophobicContact CZ-CG 3.94Å; V1354-Q1395 WeakPolarHBondContact CA-O 3.47Å; Y1355-Q1395 PolarHBondContact N-O 2.93Å; Y1355-Q1395 PolarHBondContact O-N 3.28Å; Q1395-V1413 HydrophobicContact CG-CG1 3.69Å; Q1395-N1436 PolarHBondContact NE2-OD1 3.42Å
1396	V	96.8	Very high	87.5	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	116.1	-179	-178.3	0	0	0	0	108.6	I1317 L1319 V1352 V1354 L1394 V1413 A1414 I1416	I1317-V1396 HydrophobicContact CD1-CG1 3.96Å; I1317-V1396 HydrophobicContact CG2-CG1 4.35Å; L1319-V1396 HydrophobicContact CD1-CG1 4.26Å; L1319-V1396 HydrophobicContact CD1-CG2 3.85Å; V1352-V1396 HydrophobicContact CG1-CG1 3.68Å; V1354-V1396 HydrophobicContact CG1-CG2 4.35Å; V1354-V1396 HydrophobicContact CG2-CG1 4.39Å; V1354-V1396 HydrophobicContact CG2-CG2 4.34Å; L1394-V1396 HydrophobicContact CD2-CG2 4.42Å; L1394-V1396 HydrophobicContact CG-CG2 4.4Å; V1396-V1413 CarbonylContact O-C 3.56Å; V1396-V1413 VanDerWaalsContact O-CA 3.32Å; V1396-V1413 WeakPolarHBondContact O-CA 3.42Å; V1396-A1414 PolarHBondContact N-O 2.82Å; V1396-A1414 PolarHBondContact O-N 3.46Å; V1396-I1416 HydrophobicContact CG2-CD1 4.04Å
1397	T	96.2	Very high	86.6	Confident	8 Å²	8	63.5 Å²	63.5	5%	0.049	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	115	-171.6	-51.9	0	0	0	0	110.6	V1352 K1353 V1399 L1410 V1413	V1352-T1397 WeakPolarHBondContact CA-O 3.43Å; K1353-T1397 PolarHBondContact N-O 2.85Å; K1353-T1397 PolarHBondContact O-N 2.87Å; T1397-V1399 HydrophobicContact CG2-CG2 3.86Å; T1397-L1410 HydrophobicContact CG2-CD1 3.45Å; T1397-L1410 VanDerWaalsContact CG2-CD1 3.45Å; T1397-V1413 HydrophobicContact CG2-CG2 4.28Å
1398	V	96	Very high	86.3	Confident	0 Å²	0	64.8 Å²	64.8	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	125.2	175.4	-172	0	0	0	0	109.6	I1317 L1338 P1350 V1352 I1411 G1412 L1433	I1317-V1398 HydrophobicContact CD1-CG2 3.97Å; L1338-V1398 HydrophobicContact CD1-CG1 3.99Å; L1338-V1398 HydrophobicContact CD2-CG1 4.33Å; P1350-V1398 HydrophobicContact CB-CG1 4.31Å; V1352-V1398 HydrophobicContact CG2-CG2 4.26Å; V1398-I1411 HydrophobicContact CB-CB 4.36Å; V1398-I1411 HydrophobicContact CG1-CB 4.23Å; V1398-I1411 HydrophobicContact CG1-CD1 4.21Å; V1398-I1411 PolarHBondContact O-N 3.13Å; V1398-G1412 PolarHBondContact N-O 3.26Å; V1398-G1412 PolarHBondContact O-N 3.28Å; V1398-L1433 HydrophobicContact CB-CD1 4.21Å; V1398-L1433 HydrophobicContact CG2-CD1 3.58Å; V1398-L1433 HydrophobicContact CG2-CD2 3.9Å; V1398-L1433 HydrophobicContact CG2-CG 4.42Å
1399	V	93.1	Very high	86.1	Confident	10 Å²	10	62.5 Å²	62.5	6%	0.061	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	126.3	-173.9	-175	0	0	0	0	110.1	P1350 Y1351 T1397 K1408 S1409	P1350-V1399 CarbonylContact C-O 3.56Å; P1350-V1399 WeakPolarHBondContact CA-O 3.5Å; Y1351-V1399 HydrophobicContact CD1-CB 4.21Å; Y1351-V1399 VanDerWaalsContact CD1-O 3.24Å; Y1351-V1399 WeakPolarHBondContact CD1-O 3.21Å; Y1351-V1399 HydrophobicContact CE1-CB 3.67Å; Y1351-V1399 HydrophobicContact CE1-CG1 3.61Å; Y1351-V1399 HydrophobicContact CE2-CB 4.4Å; Y1351-V1399 PolarHBondContact N-O 2.79Å; Y1351-V1399 PolarHBondContact O-N 3.22Å; T1397-V1399 HydrophobicContact CG2-CG2 3.86Å; V1399-K1408 HydrophobicContact CG1-CB 4.05Å; V1399-S1409 CarbonylContact C-O 3.48Å; V1399-S1409 WeakPolarHBondContact CA-O 3.47Å; V1399-S1409 VanDerWaalsContact CG1-O 3.26Å; V1399-S1409 WeakPolarHBondContact CG1-O 3.12Å
1400	G	91.9	Very high	86.1	Confident	0 Å²	0	65.7 Å²	65.7	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	126.2	179.2	0	0	0	0	0	112.8	K1408 S1409	G1400-K1408 CarbonylContact O-C 3.54Å; G1400-K1408 WeakPolarHBondContact O-CA 3.45Å; G1400-S1409 PolarHBondContact N-O 2.82Å; G1400-S1409 PolarHBondContact O-N 3.28Å
1401	D	89.7	Confident	86.3	Confident	32 Å²	32	60.8 Å²	60.8	17%	0.171	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	104.8	167.2	-160.7	-37	0	0	0	110.6	S1349 L1370 R1373 G1403 K1408	S1349-D1401 PolarHBondContact N-O 3.13Å; S1349-D1401 WeakPolarHBondContact O-CB 3.44Å; S1349-D1401 PolarHBondContact O-N 3.24Å; L1370-D1401 HydrophobicContact CD2-CB 3.91Å; R1373-D1401 PolarHBondContact NH2-O 3.41Å; D1401-G1403 VanDerWaalsContact C-N 3.27Å; D1401-G1403 PolarHBondContact O-N 3.32Å; D1401-G1403 PolarHBondContact OD1-N 3.11Å; D1401-K1408 HydrophobicContact CB-CG 4.38Å; D1401-K1408 WeakPolarHBondContact OD2-CE 3.49Å; D1401-K1408 IonicContact OD2-NZ 3.19Å; D1401-K1408 PolarHBondContact OD2-NZ 3.43Å
1402	Y	86	Confident	86.7	Confident	18 Å²	18	53.7 Å²	53.7	7%	0.071	24%	0.243	C	C	.	.			trans	-73.5	-18.1	178.7	-77	-84.7	0	0	0	112.9	R1341 S1344 P1348 R1373	R1341-Y1402 HydrophobicContact CB-CE2 4.27Å; R1341-Y1402 VanDerWaalsContact CB-OH 3.22Å; R1341-Y1402 WeakPolarHBondContact CB-OH 3.45Å; R1341-Y1402 PolarHBondContact N-OH 2.67Å; S1344-Y1402 WeakPolarHBondContact OG-CE1 3.46Å; P1348-Y1402 HydrophobicContact CB-CD1 4.03Å; P1348-Y1402 HydrophobicContact CB-CD2 3.93Å; P1348-Y1402 HydrophobicContact CB-CE1 3.88Å; P1348-Y1402 HydrophobicContact CB-CE2 3.77Å; P1348-Y1402 HydrophobicContact CB-CG 4.03Å; P1348-Y1402 HydrophobicContact CG-CE1 4.11Å; P1348-Y1402 HydrophobicContact CG-CE2 4.03Å; R1373-Y1402 PolarHBondContact NH1-O 2.83Å; R1373-Y1402 PolarHBondContact NH2-O 2.78Å
1403	G	79.3	Confident	86.9	Confident	22 Å²	22	52 Å²	52	23%	0.227	24%	0.238	C	C	.	.			trans	113.8	-177.4	-179	0	0	0	0	0	113.4	D1401 M1405 E1406	D1401-G1403 VanDerWaalsContact C-N 3.27Å; D1401-G1403 PolarHBondContact O-N 3.32Å; D1401-G1403 PolarHBondContact OD1-N 3.11Å; G1403-M1405 PolarHBondContact O-N 2.95Å; G1403-E1406 PolarHBondContact O-N 3.21Å
1404	R	71.1	Confident	87	Confident	267 Å²	267	50.5 Å²	50.5	100%	1.008	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.2	-19.9	-161.4	-156.4	-174.9	-166.4	-176.9	9.3	117.1
1405	M	59	Low	86.9	Confident	189 Å²	189	52.6 Å²	52.6	93%	0.931	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-102.9	-16.7	-175.3	-162.9	173.3	-67.9	0	0	113.4	G1403	G1403-M1405 PolarHBondContact O-N 2.95Å
1406	E	68	Low	86.9	Confident	82 Å²	82	52.6 Å²	52.6	38%	0.383	24%	0.24	S	C	.	.	S	Bend	trans	-114.4	155.8	-175.3	-75.7	-161	-121.2	0	0	112.1	R1341 G1403	R1341-E1406 IonicContact CZ-OE2 3.14Å; R1341-E1406 IonicContact NH1-OE2 2.86Å; R1341-E1406 PolarHBondContact NH1-OE2 3.02Å; R1341-E1406 IonicContact NH2-OE2 3.73Å; R1341-E1406 PolarHBondContact NH2-OE2 3.32Å; G1403-E1406 PolarHBondContact O-N 3.21Å
1407	R	72.9	Confident	86.7	Confident	200 Å²	200	55.5 Å²	55.5	76%	0.755	25%	0.253	S	S	*	.	P	Polyproline II helix	trans	-76.5	147.4	174.5	-65.9	-176.9	-179.3	176.7	1.1	109.9	S1409	R1407-S1409 PolarHBondContact O-N 3.22Å
1408	K	85.9	Confident	86.5	Confident	108 Å²	108	55.3 Å²	55.3	47%	0.47	25%	0.252	S	S	.	.	P	Polyproline II helix	trans	-60.5	128.4	167.7	-61.9	-179.5	-178.2	-108.7	0	108.9	Y1351 V1399 G1400 D1401	Y1351-K1408 HydrophobicContact CE1-CD 4.16Å; V1399-K1408 HydrophobicContact CG1-CB 4.05Å; G1400-K1408 CarbonylContact O-C 3.54Å; G1400-K1408 WeakPolarHBondContact O-CA 3.45Å; D1401-K1408 HydrophobicContact CB-CG 4.38Å; D1401-K1408 WeakPolarHBondContact OD2-CE 3.49Å; D1401-K1408 IonicContact OD2-NZ 3.19Å; D1401-K1408 PolarHBondContact OD2-NZ 3.43Å
1409	S	85.3	Confident	86.1	Confident	21 Å²	21	57.5 Å²	57.5	15%	0.147	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	149.7	176	80.6	0	0	0	0	110.7	V1399 G1400 R1407	V1399-S1409 CarbonylContact C-O 3.48Å; V1399-S1409 WeakPolarHBondContact CA-O 3.47Å; V1399-S1409 VanDerWaalsContact CG1-O 3.26Å; V1399-S1409 WeakPolarHBondContact CG1-O 3.12Å; G1400-S1409 PolarHBondContact N-O 2.82Å; G1400-S1409 PolarHBondContact O-N 3.28Å; R1407-S1409 PolarHBondContact O-N 3.22Å
1410	L	90.9	Very high	85.6	Confident	80 Å²	80	60.2 Å²	60.2	42%	0.419	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.7	144	153	-175.7	60.4	0	0	0	108.4	T1397 V1413 N1436	T1397-L1410 HydrophobicContact CG2-CD1 3.45Å; T1397-L1410 VanDerWaalsContact CG2-CD1 3.45Å; L1410-V1413 HydrophobicContact CD1-CG2 3.86Å; L1410-V1413 HydrophobicContact CD2-CG2 4.17Å; L1410-N1436 HydrophobicContact CD2-CB 4.09Å
1411	I	91.2	Very high	85.5	Confident	10 Å²	10	61.5 Å²	61.5	5%	0.051	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	-42.1	165.6	-57.7	-178.9	0	0	0	108.9	L1314 L1338 P1348 P1350 V1398	L1314-I1411 VanDerWaalsContact CB-O 3.25Å; L1314-I1411 WeakPolarHBondContact CB-O 3.31Å; L1314-I1411 WeakPolarHBondContact CD1-O 3.42Å; L1338-I1411 HydrophobicContact CB-CG2 4.25Å; L1338-I1411 HydrophobicContact CD1-CD1 4.33Å; L1338-I1411 HydrophobicContact CD2-CG2 4.17Å; P1348-I1411 HydrophobicContact CG-CD1 3.79Å; P1350-I1411 HydrophobicContact CB-CD1 4.26Å; V1398-I1411 HydrophobicContact CB-CB 4.36Å; V1398-I1411 HydrophobicContact CG1-CB 4.23Å; V1398-I1411 HydrophobicContact CG1-CD1 4.21Å; V1398-I1411 PolarHBondContact O-N 3.13Å
1412	G	93.2	Very high	85.4	Confident	0 Å²	0	63.9 Å²	63.9	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	177.4	175.5	170.2	0	0	0	0	0	113.3	V1398 Y1434	V1398-G1412 PolarHBondContact N-O 3.26Å; V1398-G1412 PolarHBondContact O-N 3.28Å; G1412-Y1434 CarbonylContact C-O 3.56Å; G1412-Y1434 WeakPolarHBondContact CA-O 3.44Å
1413	V	94.8	Very high	85.6	Confident	11 Å²	11	63.5 Å²	63.5	7%	0.067	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	140.4	-175.1	-175.2	0	0	0	0	110.2	Q1395 V1396 T1397 L1410 Y1434 N1436	Q1395-V1413 HydrophobicContact CG-CG1 3.69Å; V1396-V1413 CarbonylContact O-C 3.56Å; V1396-V1413 VanDerWaalsContact O-CA 3.32Å; V1396-V1413 WeakPolarHBondContact O-CA 3.42Å; T1397-V1413 HydrophobicContact CG2-CG2 4.28Å; L1410-V1413 HydrophobicContact CD1-CG2 3.86Å; L1410-V1413 HydrophobicContact CD2-CG2 4.17Å; V1413-Y1434 PolarHBondContact N-O 2.66Å; V1413-Y1434 PolarHBondContact O-N 2.66Å; V1413-N1436 HydrophobicContact CG2-CB 4.08Å
1414	A	95.4	Very high	86	Confident	2 Å²	2	66.8 Å²	66.8	2%	0.017	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	145.7	159.8	0	0	0	0	0	109.4	V1396 L1433	V1396-A1414 PolarHBondContact N-O 2.82Å; V1396-A1414 PolarHBondContact O-N 3.46Å; A1414-L1433 HydrophobicContact CB-CD2 4.22Å
1415	M	93.5	Very high	86.7	Confident	44 Å²	44	60.4 Å²	60.4	22%	0.217	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	133.5	171.3	-61.5	-172.8	-65.1	0	0	108.9	F1244 Q1302 V1303	F1244-M1415 HydrophobicContact CD1-SD 3.91Å; F1244-M1415 HydrophobicContact CE1-CG 4.18Å; F1244-M1415 HydrophobicContact CE1-SD 3.28Å; F1244-M1415 WeakPolarHBondContact CE1-SD 3.41Å; F1244-M1415 HydrophobicContact CZ-CG 4.32Å; F1244-M1415 HydrophobicContact CZ-SD 3.84Å; Q1302-M1415 WeakPolarHBondContact CA-O 3.46Å; V1303-M1415 HydrophobicContact CG2-CB 3.79Å; V1303-M1415 HydrophobicContact CG2-CE 4.36Å; V1303-M1415 PolarHBondContact N-O 3.5Å
1416	I	94.6	Very high	88.2	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	122.3	-175.8	-49.5	166.9	0	0	0	108.6	G1301 L1319 I1321 L1393 L1394 V1396 L1418 L1421 Y1431	G1301-I1416 CarbonylContact O-C 3.55Å; G1301-I1416 WeakPolarHBondContact O-CA 3.31Å; L1319-I1416 HydrophobicContact CD1-CD1 3.79Å; I1321-I1416 HydrophobicContact CD1-CD1 3.96Å; I1321-I1416 HydrophobicContact CD1-CG2 4.36Å; L1393-I1416 CarbonylContact C-O 3.58Å; L1393-I1416 WeakPolarHBondContact CA-O 3.25Å; L1394-I1416 HydrophobicContact CB-CB 4.28Å; L1394-I1416 PolarHBondContact N-O 3.43Å; L1394-I1416 PolarHBondContact O-N 2.73Å; V1396-I1416 HydrophobicContact CG2-CD1 4.04Å; I1416-L1418 PolarHBondContact O-N 3.15Å; I1416-L1421 HydrophobicContact CG2-CD1 3.95Å; I1416-Y1431 HydrophobicContact CB-CE1 4.43Å; I1416-Y1431 HydrophobicContact CD1-CD1 3.45Å; I1416-Y1431 VanDerWaalsContact CD1-CD1 3.45Å; I1416-Y1431 HydrophobicContact CD1-CD2 4.4Å; I1416-Y1431 HydrophobicContact CD1-CE1 3.36Å; I1416-Y1431 HydrophobicContact CD1-CE2 4.34Å; I1416-Y1431 HydrophobicContact CD1-CG 3.99Å; I1416-Y1431 HydrophobicContact CG1-CD1 3.62Å; I1416-Y1431 HydrophobicContact CG1-CE1 3.59Å; I1416-Y1431 HydrophobicContact CG2-CE1 3.96Å
1417	K	92.8	Very high	89.5	Confident	61 Å²	61	52 Å²	52	27%	0.265	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	102.3	-176.2	-166.9	166.3	176.4	-179.2	0	109	E1250 G1301 V1303 L1393 G1419 H1420	E1250-K1417 IonicContact OE2-NZ 2.92Å; E1250-K1417 PolarHBondContact OE2-NZ 3.36Å; G1301-K1417 PolarHBondContact O-N 3.19Å; V1303-K1417 HydrophobicContact CG1-CB 4.03Å; V1303-K1417 HydrophobicContact CG1-CD 4.06Å; V1303-K1417 HydrophobicContact CG2-CB 4.47Å; L1393-K1417 HydrophobicContact CD2-CB 3.96Å; L1393-K1417 HydrophobicContact CD2-CG 4.24Å; K1417-G1419 PolarHBondContact O-N 2.99Å; K1417-H1420 WeakPolarHBondContact CD-NE2 3.38Å; K1417-H1420 VanDerWaalsContact CE-NE2 3.34Å; K1417-H1420 WeakPolarHBondContact CE-NE2 3.44Å; K1417-H1420 WeakPolarHBondContact O-CB 3.44Å; K1417-H1420 PolarHBondContact O-N 3.29Å
1418	L	92.7	Very high	90.5	Very high	5 Å²	5	47.6 Å²	47.6	3%	0.026	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-64.7	-26.3	-169	-62.1	176.5	0	0	0	113.1	I1321 L1328 L1356 Y1389 R1392 L1394 I1416 H1420 L1421 L1423	I1321-L1418 HydrophobicContact CG2-CD2 4.33Å; L1328-L1418 HydrophobicContact CD1-CD1 4.43Å; L1328-L1418 HydrophobicContact CD2-CD1 3.63Å; L1356-L1418 HydrophobicContact CD1-CD1 3.6Å; Y1389-L1418 HydrophobicContact CD2-CD1 4.45Å; R1392-L1418 WeakPolarHBondContact O-CB 3.35Å; R1392-L1418 WeakPolarHBondContact O-CG 3.11Å; R1392-L1418 PolarHBondContact O-N 2.98Å; L1394-L1418 HydrophobicContact CB-CD1 4.28Å; L1394-L1418 HydrophobicContact CB-CD2 3.97Å; L1394-L1418 HydrophobicContact CB-CG 4.14Å; L1394-L1418 HydrophobicContact CD2-CD2 4.31Å; I1416-L1418 PolarHBondContact O-N 3.15Å; L1418-H1420 PolarHBondContact O-N 3.33Å; L1418-L1421 HydrophobicContact CD2-CD1 4.38Å; L1418-L1421 PolarHBondContact O-N 3.32Å; L1418-L1423 HydrophobicContact CB-CD1 4.39Å; L1418-L1423 HydrophobicContact CD2-CD1 4.46Å
1419	G	86.4	Confident	90.9	Very high	45 Å²	45	42.8 Å²	42.8	46%	0.464	24%	0.24	S	C	.	.	G	3₁₀ helix	trans	-67.7	-6.3	172.4	0	0	0	0	0	115.2	K1417	K1417-G1419 PolarHBondContact O-N 2.99Å
1420	H	83.5	Confident	91.4	Very high	68 Å²	68	45.4 Å²	45.4	32%	0.315	25%	0.247	S	C	.	.	G	3₁₀ helix	trans	-99.8	8.6	173.5	-69.1	-151.3	0	0	0	112.4	K1417 L1418	K1417-H1420 WeakPolarHBondContact CD-NE2 3.38Å; K1417-H1420 VanDerWaalsContact CE-NE2 3.34Å; K1417-H1420 WeakPolarHBondContact CE-NE2 3.44Å; K1417-H1420 WeakPolarHBondContact O-CB 3.44Å; K1417-H1420 PolarHBondContact O-N 3.29Å; L1418-H1420 PolarHBondContact O-N 3.33Å
1421	L	89.2	Confident	91.7	Very high	26 Å²	26	41.6 Å²	41.6	14%	0.136	23%	0.227	C	C	.	.	S	Bend	trans	-120.4	133.6	-174.7	-67.8	-176.8	0	0	0	113.1	P1300 I1321 I1416 L1418 L1423 V1427	P1300-L1421 HydrophobicContact CB-CD2 3.78Å; I1321-L1421 HydrophobicContact CD1-CD1 4.33Å; I1416-L1421 HydrophobicContact CG2-CD1 3.95Å; L1418-L1421 HydrophobicContact CD2-CD1 4.38Å; L1418-L1421 PolarHBondContact O-N 3.32Å; L1421-L1423 VanDerWaalsContact C-N 3.33Å; L1421-L1423 HydrophobicContact CB-CD2 3.87Å; L1421-L1423 HydrophobicContact CB-CG 3.96Å; L1421-L1423 HydrophobicContact CD1-CD2 4.13Å; L1421-L1423 PolarHBondContact O-N 2.87Å; L1421-V1427 HydrophobicContact CB-CG2 4.46Å; L1421-V1427 HydrophobicContact CD1-CG1 4.44Å; L1421-V1427 HydrophobicContact CD2-CG1 3.99Å; L1421-V1427 HydrophobicContact CD2-CG2 4.42Å
1422	D	87.8	Confident	91.9	Very high	82 Å²	82	43 Å²	43	44%	0.439	23%	0.233	S	C	.	.			trans	-76.1	83.9	165.5	176.8	19.2	0	0	0	110.2	S1424 K1425	D1422-S1424 PolarHBondContact O-N 3.27Å; D1422-S1424 VanDerWaalsContact OD1-CB 3.3Å; D1422-S1424 WeakPolarHBondContact OD1-CB 3.24Å; D1422-S1424 PolarHBondContact OD1-N 3.44Å; D1422-S1424 PolarHBondContact OD1-OG 3.01Å; D1422-S1424 PolarHBondContact OD2-OG 3.43Å; D1422-K1425 PolarHBondContact O-N 3.31Å; D1422-K1425 IonicContact OD2-NZ 3.63Å; D1422-K1425 PolarHBondContact OD2-NZ 3.26Å
1423	L	90.5	Very high	92	Very high	11 Å²	11	43 Å²	43	6%	0.058	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-1.2	-178.9	-63.8	177.4	0	0	0	114.1	I1321 E1323 L1328 Y1389 L1418 L1421 K1425 V1427	I1321-L1423 HydrophobicContact CB-CD2 4.21Å; I1321-L1423 HydrophobicContact CG2-CD2 3.62Å; E1323-L1423 HydrophobicContact CB-CB 4.35Å; E1323-L1423 PolarHBondContact N-O 3.28Å; L1328-L1423 HydrophobicContact CD1-CD1 3.83Å; Y1389-L1423 HydrophobicContact CD2-CD1 3.86Å; Y1389-L1423 HydrophobicContact CE2-CD1 3.7Å; L1418-L1423 HydrophobicContact CB-CD1 4.39Å; L1418-L1423 HydrophobicContact CD2-CD1 4.46Å; L1421-L1423 VanDerWaalsContact C-N 3.33Å; L1421-L1423 HydrophobicContact CB-CD2 3.87Å; L1421-L1423 HydrophobicContact CB-CG 3.96Å; L1421-L1423 HydrophobicContact CD1-CD2 4.13Å; L1421-L1423 PolarHBondContact O-N 2.87Å; L1423-K1425 CarbonylContact C-O 3.44Å; L1423-K1425 PolarHBondContact O-N 3.22Å; L1423-V1427 HydrophobicContact CD2-CG2 4.33Å
1424	S	86.6	Confident	91.9	Very high	90 Å²	90	43.2 Å²	43.2	63%	0.629	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-19.2	169.4	75.5	0	0	0	0	112.3	D1422	D1422-S1424 PolarHBondContact O-N 3.27Å; D1422-S1424 VanDerWaalsContact OD1-CB 3.3Å; D1422-S1424 WeakPolarHBondContact OD1-CB 3.24Å; D1422-S1424 PolarHBondContact OD1-N 3.44Å; D1422-S1424 PolarHBondContact OD1-OG 3.01Å; D1422-S1424 PolarHBondContact OD2-OG 3.43Å
1425	K	86.7	Confident	91.4	Very high	134 Å²	134	47.4 Å²	47.4	58%	0.583	25%	0.252	S	S	*	.	S	Bend	trans	-117.5	160.2	174	-57.5	-179.8	-165.7	91.6	0	109.5	D1422 L1423 V1427	D1422-K1425 PolarHBondContact O-N 3.31Å; D1422-K1425 IonicContact OD2-NZ 3.63Å; D1422-K1425 PolarHBondContact OD2-NZ 3.26Å; L1423-K1425 CarbonylContact C-O 3.44Å; L1423-K1425 PolarHBondContact O-N 3.22Å; K1425-V1427 PolarHBondContact O-N 2.97Å; K1425-V1427 VanDerWaalsContact O-N 3.12Å
1426	S	91.4	Very high	90.2	Very high	69 Å²	69	47.7 Å²	47.7	48%	0.483	25%	0.254	S	S	.	.			trans	-73.2	101.2	170.7	52.8	0	0	0	0	110.8	E1428	S1426-E1428 PolarHBondContact O-N 3.44Å
1427	V	93.9	Very high	87.9	Confident	25 Å²	25	51.1 Å²	51.1	15%	0.152	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	109.5	171.8	-179.6	0	0	0	0	108.3	P1300 T1320 I1321 L1421 L1423 K1425	P1300-V1427 HydrophobicContact CB-CG1 3.74Å; P1300-V1427 HydrophobicContact CG-CG1 4.13Å; T1320-V1427 CarbonylContact C-O 3.28Å; T1320-V1427 WeakPolarHBondContact CA-O 3.49Å; I1321-V1427 PolarHBondContact N-O 3.05Å; I1321-V1427 PolarHBondContact O-N 3.1Å; L1421-V1427 HydrophobicContact CB-CG2 4.46Å; L1421-V1427 HydrophobicContact CD1-CG1 4.44Å; L1421-V1427 HydrophobicContact CD2-CG1 3.99Å; L1421-V1427 HydrophobicContact CD2-CG2 4.42Å; L1423-V1427 HydrophobicContact CD2-CG2 4.33Å; K1425-V1427 PolarHBondContact O-N 2.97Å; K1425-V1427 VanDerWaalsContact O-N 3.12Å
1428	E	94.5	Very high	87.6	Confident	107 Å²	107	50.7 Å²	50.7	50%	0.5	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	135.5	173.5	-58.4	-148.3	140.1	0	0	110.7	F1318 L1319 T1320 S1426	F1318-E1428 HydrophobicContact CE1-CB 4.23Å; F1318-E1428 HydrophobicContact CZ-CB 3.84Å; L1319-E1428 WeakPolarHBondContact O-CA 3.46Å; T1320-E1428 WeakPolarHBondContact CB-OE1 3.15Å; T1320-E1428 HydrophobicContact CG2-CG 3.74Å; T1320-E1428 WeakPolarHBondContact CG2-OE1 3.25Å; T1320-E1428 PolarHBondContact OG1-OE1 3.22Å; S1426-E1428 PolarHBondContact O-N 3.44Å
1429	G	94.2	Very high	87.3	Confident	8 Å²	8	53.1 Å²	53.1	8%	0.082	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-166	157.7	-177.7	0	0	0	0	0	114.7	F1318 L1319 Y1431	F1318-G1429 WeakPolarHBondContact CA-O 3.39Å; F1318-G1429 WeakPolarHBondContact CD2-O 3.37Å; L1319-G1429 PolarHBondContact N-O 3.29Å; L1319-G1429 PolarHBondContact O-N 3.29Å; G1429-Y1431 WeakPolarHBondContact O-CD2 3.38Å; G1429-Y1431 WeakPolarHBondContact O-CE2 3.48Å
1430	W	96.4	Very high	87.4	Confident	75 Å²	75	53.5 Å²	53.5	28%	0.284	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	136.3	163.3	-72.1	104.5	0	0	0	109.5	G1299 E1316 I1317 F1318 R1334 K1336	G1299-W1430 WeakPolarHBondContact CA-O 3.35Å; E1316-W1430 HydrophobicContact CB-CE3 3.93Å; E1316-W1430 HydrophobicContact CB-CZ3 4.48Å; I1317-W1430 CarbonylContact O-C 3.54Å; I1317-W1430 WeakPolarHBondContact O-CA 3.46Å; F1318-W1430 HydrophobicContact CB-CD2 4.03Å; F1318-W1430 HydrophobicContact CB-CE3 3.76Å; F1318-W1430 HydrophobicContact CB-CH2 4.05Å; F1318-W1430 HydrophobicContact CB-CZ2 4.29Å; F1318-W1430 HydrophobicContact CB-CZ3 3.76Å; F1318-W1430 AromaticContact CD2-CD1 3.82Å; F1318-W1430 AromaticContact CD2-CD2 3.72Å; F1318-W1430 HydrophobicContact CD2-CD2 3.72Å; F1318-W1430 AromaticContact CD2-CE2 3.64Å; F1318-W1430 HydrophobicContact CD2-CE3 4.34Å; F1318-W1430 AromaticContact CD2-CG 3.86Å; F1318-W1430 HydrophobicContact CD2-CG 3.86Å; F1318-W1430 HydrophobicContact CD2-CZ2 4.23Å; F1318-W1430 AromaticContact CD2-NE1 3.68Å; F1318-W1430 HydrophobicContact CG-CD2 4.38Å; R1334-W1430 HydrophobicContact CG-CH2 3.98Å; R1334-W1430 HydrophobicContact CG-CZ3 4.48Å; K1336-W1430 HydrophobicContact CB-CH2 4.2Å; K1336-W1430 HydrophobicContact CB-CZ3 4.28Å; K1336-W1430 HydrophobicContact CD-CE3 4.33Å; K1336-W1430 HydrophobicContact CD-CH2 3.63Å; K1336-W1430 HydrophobicContact CD-CZ2 3.96Å; K1336-W1430 HydrophobicContact CD-CZ3 3.85Å; K1336-W1430 HydrophobicContact CG-CE3 4.25Å; K1336-W1430 HydrophobicContact CG-CH2 3.73Å; K1336-W1430 HydrophobicContact CG-CZ3 3.57Å
1431	Y	96.9	Very high	87.6	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	126.4	179.9	-65.2	-93.9	0	0	0	109	P1300 Q1302 E1316 I1317 L1319 I1416 G1429	P1300-Y1431 VanDerWaalsContact O-CE1 3.29Å; P1300-Y1431 WeakPolarHBondContact O-CE1 3.47Å; P1300-Y1431 PolarHBondContact O-OH 3.41Å; Q1302-Y1431 HydrophobicContact CB-CD1 4.09Å; Q1302-Y1431 HydrophobicContact CB-CE1 4.44Å; E1316-Y1431 CarbonylContact C-O 3.57Å; E1316-Y1431 WeakPolarHBondContact CA-O 3.47Å; I1317-Y1431 PolarHBondContact N-O 2.95Å; I1317-Y1431 PolarHBondContact O-N 2.97Å; L1319-Y1431 HydrophobicContact CB-CD2 4.07Å; L1319-Y1431 HydrophobicContact CB-CE2 3.88Å; L1319-Y1431 HydrophobicContact CD1-CD2 3.75Å; L1319-Y1431 HydrophobicContact CD1-CE2 4.05Å; L1319-Y1431 HydrophobicContact CD1-CG 4.26Å; L1319-Y1431 HydrophobicContact CG-CD2 3.95Å; L1319-Y1431 HydrophobicContact CG-CE2 4.25Å; I1416-Y1431 HydrophobicContact CB-CE1 4.43Å; I1416-Y1431 HydrophobicContact CD1-CD1 3.45Å; I1416-Y1431 VanDerWaalsContact CD1-CD1 3.45Å; I1416-Y1431 HydrophobicContact CD1-CD2 4.4Å; I1416-Y1431 HydrophobicContact CD1-CE1 3.36Å; I1416-Y1431 HydrophobicContact CD1-CE2 4.34Å; I1416-Y1431 HydrophobicContact CD1-CG 3.99Å; I1416-Y1431 HydrophobicContact CG1-CD1 3.62Å; I1416-Y1431 HydrophobicContact CG1-CE1 3.59Å; I1416-Y1431 HydrophobicContact CG2-CE1 3.96Å; G1429-Y1431 WeakPolarHBondContact O-CD2 3.38Å; G1429-Y1431 WeakPolarHBondContact O-CE2 3.48Å
1432	K	95	Very high	87.5	Confident	40 Å²	40	54.3 Å²	54.3	17%	0.174	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	135.9	-179.2	-76.8	178.8	177.8	161.1	0	110.7	G1297 Q1302 E1316 Y1434	G1297-K1432 WeakPolarHBondContact O-CD 3.23Å; G1297-K1432 WeakPolarHBondContact O-CE 3.39Å; G1297-K1432 PolarHBondContact O-NZ 2.65Å; Q1302-K1432 PolarHBondContact NE2-O 3.32Å; E1316-K1432 HydrophobicContact CG-CG 4.02Å; E1316-K1432 VanDerWaalsContact OE1-CE 3.3Å; E1316-K1432 WeakPolarHBondContact OE1-CE 3.43Å; E1316-K1432 WeakPolarHBondContact OE1-CG 3.47Å; K1432-Y1434 HydrophobicContact CB-CD2 4.38Å; K1432-Y1434 HydrophobicContact CB-CE2 3.51Å; K1432-Y1434 WeakPolarHBondContact CD-OH 3.37Å
1433	L	94.8	Very high	87.5	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	30%	0.296	C	S	.	.			trans	-100	123.6	-179.1	-60.1	170	0	0	0	109.9	L1314 G1315 I1317 L1338 V1398 A1414	L1314-L1433 PolarHBondContact N-O 2.73Å; G1315-L1433 VanDerWaalsContact O-CB 3.25Å; G1315-L1433 WeakPolarHBondContact O-CB 3.42Å; G1315-L1433 WeakPolarHBondContact O-CG 3.49Å; G1315-L1433 PolarHBondContact O-N 2.88Å; I1317-L1433 HydrophobicContact CB-CD1 4.45Å; I1317-L1433 HydrophobicContact CB-CD2 4.47Å; I1317-L1433 HydrophobicContact CG2-CD2 3.87Å; I1317-L1433 HydrophobicContact CG2-CG 4.35Å; L1338-L1433 HydrophobicContact CD2-CD1 3.58Å; V1398-L1433 HydrophobicContact CB-CD1 4.21Å; V1398-L1433 HydrophobicContact CG2-CD1 3.58Å; V1398-L1433 HydrophobicContact CG2-CD2 3.9Å; V1398-L1433 HydrophobicContact CG2-CG 4.42Å; A1414-L1433 HydrophobicContact CB-CD2 4.22Å
1434	Y	92.7	Very high	87.3	Confident	15 Å²	15	55.4 Å²	55.4	6%	0.059	31%	0.313	C	S	.	.	B	Isolated β-bridge	trans	-113	168.8	177.7	-63.3	-87.7	0	0	0	110.9	F1294 L1298 V1304 A1308 G1412 V1413 K1432	F1294-Y1434 HydrophobicContact CE2-CE1 4.15Å; F1294-Y1434 WeakPolarHBondContact CE2-OH 3.34Å; F1294-Y1434 HydrophobicContact CZ-CE1 4.37Å; L1298-Y1434 HydrophobicContact CD2-CE2 4.22Å; V1304-Y1434 HydrophobicContact CG1-CD2 4.01Å; V1304-Y1434 HydrophobicContact CG1-CE2 3.87Å; A1308-Y1434 HydrophobicContact CB-CD1 3.93Å; A1308-Y1434 HydrophobicContact CB-CE1 4.11Å; A1308-Y1434 HydrophobicContact CB-CG 4.16Å; A1308-Y1434 WeakPolarHBondContact O-CE1 3.44Å; G1412-Y1434 CarbonylContact C-O 3.56Å; G1412-Y1434 WeakPolarHBondContact CA-O 3.44Å; V1413-Y1434 PolarHBondContact N-O 2.66Å; V1413-Y1434 PolarHBondContact O-N 2.66Å; K1432-Y1434 HydrophobicContact CB-CD2 4.38Å; K1432-Y1434 HydrophobicContact CB-CE2 3.51Å; K1432-Y1434 WeakPolarHBondContact CD-OH 3.37Å
1435	Q	84.6	Confident	87.3	Confident	90 Å²	90	52.8 Å²	52.8	42%	0.421	29%	0.289	S	S	.	.			trans	-63.5	147.1	165.2	-166.5	156.3	-54.2	0	0	108.8	Y807 L1314 G1437	Y807-Q1435 VanDerWaalsContact CD1-NE2 3.33Å; L1314-Q1435 HydrophobicContact CD1-CB 4.1Å; Q1435-G1437 PolarHBondContact O-N 3.47Å; Q1435-G1437 VanDerWaalsContact O-N 3.15Å
1436	N	68.1	Low	87.4	Confident	51 Å²	51	46 Å²	46	27%	0.273	26%	0.264	S	S	.	.			trans	-68.2	116.8	172.3	-156.6	108.6	0	0	0	107.6	Q1395 L1410 V1413	Q1395-N1436 PolarHBondContact NE2-OD1 3.42Å; L1410-N1436 HydrophobicContact CD2-CB 4.09Å; V1413-N1436 HydrophobicContact CG2-CB 4.08Å
1437	G	46.3	Very low	87	Confident	72 Å²	72	43.9 Å²	43.9	74%	0.742	24%	0.244	S	C	*	.			trans	-73.9	0	170.7	0	0	0	0	0	113	Q1435	Q1435-G1437 PolarHBondContact O-N 3.47Å; Q1435-G1437 VanDerWaalsContact O-N 3.15Å

Retrieved 1,437 of 1,437 residues in 551 ms (Link to these results)

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