A0A087YMQ6_POEFO Loading...

Synemin, intermediate filament protein

AlphaFold DB , UniProt , Accession A0A087YMQ6, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,003 aa.

						>A0A087YMQ6_POEFO|A0A087YMQ6
MLPFKRTFDREKQQLQELNSRLAQYLSRTKQLEQENAHLIAEINKLKRGSGTAEWEQRYKADMKDLRRMVGQISFEKSQAEMEREKLWRELQTVRSLCSEQTEACRDISGELKGCEQELQQAHKINSDLQQRLLQLESEYKRLEDAHRHETAKLRHQVESRVVPIITQTYHGPPVVSVEEVQEYARGLSEGWIETFEMYQQKVEEMEQSIKADQARLCDLQKEKMLYASELGKLRTEAEKQGQVQMRLEEELMHMQDKFRVDLSEHQLIIEQLEHERNILAEAMEEKMREHQHLLQVKMDLGMEVATYRTLLESERVGMQGANRRMTQHQRERIIDIKVPAQHYSPRTSTLTSRRHIDMRYASPTNLRRPPVTSSGSISPSRVIPISVAGRARHQSPASRRDMISFNKARAATSVPTTSTEIGQDKNKISKPAQKTVAEEKTMRFKQLPYESKASFSPETKSVRVVSPPAKSIAQTVTESKRQVSNEKEKSYAQDELKDKEKAEPIIEKKILDSVSVEEIIEKVIKPAGLEAKACSSGDSKVRYHVEKSEQEDGTTKTQIVLESKFEEEMDVSEDSALEEFLSQGVKKVSLEDIEDTATGTMIKNLLSSLQGGENMENKSVNVEIIEEPIESFSDEELEAEIKRTSSSYEPSRYFQIEEMENVTHEYEEDKSDDNATVASKRGADQPSGGSVHVQEFSRENKSPNVSCEQEQEFHEYFVSTPDENLSEPEDGGGIMSYGHYGIVDDLSDERYYQDESLPQRKVIVEESEEYKYKSSNHSSPKESFPECIIEEEVRVSPIVQESMLEFLREDSLEPKEQLKGALETLQSSVSGPLREELAFLTKVSSESPENVAIKKVEQSSGNGTMTIVAELNVSQTLEDSGLLEEGDDISEEQIMKALKSSNLDLEKAFQGGAGSGYSIRVSKEEGVAYAEGFEGFGSIEESASKIIEKHIKLEPSEKSFTFQMEEQGDHGEESSEQSQLFENPEKFSTEKRVATVYLERPL
					

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	53.8	Low	65.7	Low	237 Å²	237	144.5 Å²	144.5	100%	1.167	67%	0.672	S	S	*	*				0	157.3	0	-75.3	-61.6	-167.2	0	0	108.4
2	L	47	Very low	67.5	Low	168 Å²	168	142.3 Å²	142.3	88%	0.88	66%	0.659	S	S	*	*			trans	72.7	155.7	-167	-51	166.4	0	0	0	113.5
3	P	55.6	Low	69	Low	88 Å²	88	141.5 Å²	141.5	57%	0.571	66%	0.656	S	S	*	*	S	Bend		-123	-7.8	-64.8	33.1	-20.9	0	0	0	114	K5 R6	P3-K5 VanDerWaalsContact C-N 3.3Å; P3-K5 PolarHBondContact O-N 3.15Å; P3-R6 PolarHBondContact O-N 3.21Å; P3-R6 VanDerWaalsContact O-N 3.13Å
4	F	54.8	Low	70.4	Confident	173 Å²	173	138.6 Å²	138.6	76%	0.759	64%	0.643	S	S	*	*	H	α-helix	trans	-54.6	-29.8	-164.8	-110.5	-88.3	0	0	0	116.8	T7 F8	F4-T7 PolarHBondContact O-OG1 2.81Å; F4-F8 PolarHBondContact O-N 3.36Å
5	K	59.1	Low	71.7	Confident	168 Å²	168	136.1 Å²	136.1	73%	0.73	64%	0.635	S	S	*	*	H	α-helix	trans	-71.3	-34	-177.8	-146.1	171.6	-173.9	179.2	0	112.1	P3 D9	P3-K5 VanDerWaalsContact C-N 3.3Å; P3-K5 PolarHBondContact O-N 3.15Å; K5-D9 WeakPolarHBondContact O-CB 3.22Å; K5-D9 PolarHBondContact O-N 3.44Å
6	R	61.3	Low	72.8	Confident	221 Å²	221	135.6 Å²	135.6	83%	0.834	63%	0.633	S	S	*	*	H	α-helix	trans	-74.1	-26.5	178.4	-73.4	-177.6	176.1	162.6	-2.1	113.5	P3 R10	P3-R6 PolarHBondContact O-N 3.21Å; P3-R6 VanDerWaalsContact O-N 3.13Å; R6-R10 VanDerWaalsContact O-CB 3.28Å; R6-R10 WeakPolarHBondContact O-CB 3.46Å; R6-R10 PolarHBondContact O-N 2.9Å
7	T	68.1	Low	73.9	Confident	61 Å²	61	135.5 Å²	135.5	37%	0.374	63%	0.632	S	S	.	*	H	α-helix	trans	-73.7	-47.9	172.8	52.5	0	0	0	0	109.9	F4 D9 R10 E11	F4-T7 PolarHBondContact O-OG1 2.81Å; T7-D9 PolarHBondContact O-N 3.19Å; T7-R10 WeakPolarHBondContact O-CB 3.33Å; T7-R10 PolarHBondContact O-N 2.9Å; T7-R10 VanDerWaalsContact O-N 3.14Å; T7-E11 WeakPolarHBondContact CB-OE1 3.46Å; T7-E11 WeakPolarHBondContact O-CB 3.36Å; T7-E11 VanDerWaalsContact O-CG 3.32Å; T7-E11 WeakPolarHBondContact O-CG 3.34Å; T7-E11 PolarHBondContact O-N 2.96Å
8	F	75.4	Confident	75	Confident	133 Å²	133	134.1 Å²	134.1	58%	0.583	63%	0.629	S	S	*	*	H	α-helix	trans	-60.2	-44.4	177.2	-171.5	-96	0	0	0	113.5	F4 R10 E11 K12	F4-F8 PolarHBondContact O-N 3.36Å; F8-R10 VanDerWaalsContact C-N 3.29Å; F8-R10 PolarHBondContact O-N 2.58Å; F8-E11 PolarHBondContact O-N 3.02Å; F8-K12 WeakPolarHBondContact O-CB 3.25Å; F8-K12 PolarHBondContact O-N 3.1Å
9	D	80	Confident	76	Confident	76 Å²	76	132.2 Å²	132.2	41%	0.406	62%	0.623	S	S	.	*	H	α-helix	trans	-65.2	-32.7	177.4	-72.9	-38.4	0	0	0	112.1	K5 T7 Q13	K5-D9 WeakPolarHBondContact O-CB 3.22Å; K5-D9 PolarHBondContact O-N 3.44Å; T7-D9 PolarHBondContact O-N 3.19Å; D9-Q13 WeakPolarHBondContact O-CG 3.45Å; D9-Q13 PolarHBondContact O-N 3Å; D9-Q13 VanDerWaalsContact O-N 3.09Å
10	R	82.3	Confident	76.8	Confident	165 Å²	165	128.5 Å²	128.5	62%	0.623	61%	0.613	S	S	*	*	H	α-helix	trans	-72.6	-47.3	174.5	175.3	179.7	173.7	159.9	3.8	112.2	R6 T7 F8 K12 Q13 Q14	R6-R10 VanDerWaalsContact O-CB 3.28Å; R6-R10 WeakPolarHBondContact O-CB 3.46Å; R6-R10 PolarHBondContact O-N 2.9Å; T7-R10 WeakPolarHBondContact O-CB 3.33Å; T7-R10 PolarHBondContact O-N 2.9Å; T7-R10 VanDerWaalsContact O-N 3.14Å; F8-R10 VanDerWaalsContact C-N 3.29Å; F8-R10 PolarHBondContact O-N 2.58Å; R10-K12 VanDerWaalsContact C-N 3.27Å; R10-K12 PolarHBondContact O-N 2.86Å; R10-Q13 WeakPolarHBondContact O-CB 3.42Å; R10-Q13 PolarHBondContact O-N 3.09Å; R10-Q13 VanDerWaalsContact O-N 3.11Å; R10-Q14 WeakPolarHBondContact O-CG 3.41Å; R10-Q14 PolarHBondContact O-N 3.35Å
11	E	84.8	Confident	77.7	Confident	100 Å²	100	129 Å²	129	47%	0.467	61%	0.609	S	S	.	*	H	α-helix	trans	-59	-41.6	175.6	-73.4	156.3	-151.4	0	0	110.6	T7 F8 Q14 L15	T7-E11 WeakPolarHBondContact CB-OE1 3.46Å; T7-E11 WeakPolarHBondContact O-CB 3.36Å; T7-E11 VanDerWaalsContact O-CG 3.32Å; T7-E11 WeakPolarHBondContact O-CG 3.34Å; T7-E11 PolarHBondContact O-N 2.96Å; F8-E11 PolarHBondContact O-N 3.02Å; E11-Q14 PolarHBondContact O-N 3.44Å; E11-L15 WeakPolarHBondContact O-CB 3.36Å; E11-L15 VanDerWaalsContact O-CG 3.32Å; E11-L15 WeakPolarHBondContact O-CG 3.45Å; E11-L15 PolarHBondContact O-N 3.42Å
12	K	87.8	Confident	79.6	Confident	118 Å²	118	122 Å²	122	51%	0.513	58%	0.576	S	S	.	*	H	α-helix	trans	-60.8	-42.8	172.6	-179	-178.4	174.7	-174.1	0	112.4	F8 R10 L15 Q16	F8-K12 WeakPolarHBondContact O-CB 3.25Å; F8-K12 PolarHBondContact O-N 3.1Å; R10-K12 VanDerWaalsContact C-N 3.27Å; R10-K12 PolarHBondContact O-N 2.86Å; K12-L15 PolarHBondContact O-N 3.46Å; K12-Q16 VanDerWaalsContact O-CB 3.31Å; K12-Q16 WeakPolarHBondContact O-CB 3.4Å; K12-Q16 PolarHBondContact O-N 2.89Å
13	Q	87.4	Confident	81.9	Confident	132 Å²	132	116.7 Å²	116.7	62%	0.617	56%	0.556	S	S	*	*	H	α-helix	trans	-63.8	-44.5	174.5	-77.4	173.5	-11.5	0	0	111.7	D9 R10 L15 Q16 E17	D9-Q13 WeakPolarHBondContact O-CG 3.45Å; D9-Q13 PolarHBondContact O-N 3Å; D9-Q13 VanDerWaalsContact O-N 3.09Å; R10-Q13 WeakPolarHBondContact O-CB 3.42Å; R10-Q13 PolarHBondContact O-N 3.09Å; R10-Q13 VanDerWaalsContact O-N 3.11Å; Q13-L15 VanDerWaalsContact C-N 3.35Å; Q13-L15 PolarHBondContact O-N 3.19Å; Q13-Q16 PolarHBondContact O-N 2.9Å; Q13-Q16 VanDerWaalsContact O-N 3.11Å; Q13-E17 WeakPolarHBondContact O-CB 3.25Å; Q13-E17 PolarHBondContact O-N 3.33Å
14	Q	88	Confident	83.7	Confident	101 Å²	101	118.9 Å²	118.9	47%	0.472	56%	0.558	S	S	.	*	H	α-helix	trans	-64.4	-37.3	176.8	-68.1	-177.5	-104.1	0	0	112.1	R10 E11 L18	R10-Q14 WeakPolarHBondContact O-CG 3.41Å; R10-Q14 PolarHBondContact O-N 3.35Å; E11-Q14 PolarHBondContact O-N 3.44Å; Q14-L18 VanDerWaalsContact O-CB 3.29Å; Q14-L18 WeakPolarHBondContact O-CB 3.47Å; Q14-L18 PolarHBondContact O-N 2.72Å
15	L	89.9	Confident	85.8	Confident	100 Å²	100	116.9 Å²	116.9	52%	0.524	55%	0.547	S	S	.	.	H	α-helix	trans	-68.3	-34.1	171.5	-73.8	170.5	0	0	0	112.2	E11 K12 Q13 N19	E11-L15 WeakPolarHBondContact O-CB 3.36Å; E11-L15 VanDerWaalsContact O-CG 3.32Å; E11-L15 WeakPolarHBondContact O-CG 3.45Å; E11-L15 PolarHBondContact O-N 3.42Å; K12-L15 PolarHBondContact O-N 3.46Å; Q13-L15 VanDerWaalsContact C-N 3.35Å; Q13-L15 PolarHBondContact O-N 3.19Å; L15-N19 VanDerWaalsContact O-CB 3.3Å; L15-N19 WeakPolarHBondContact O-CB 3.48Å; L15-N19 PolarHBondContact O-N 3.19Å; L15-N19 PolarHBondContact O-ND2 3.03Å
16	Q	89.1	Confident	87.5	Confident	129 Å²	129	114.1 Å²	114.1	60%	0.603	54%	0.539	S	S	*	.	H	α-helix	trans	-72.4	-35.1	176.7	-171.1	170.3	-11.1	0	0	112	K12 Q13 S20	K12-Q16 VanDerWaalsContact O-CB 3.31Å; K12-Q16 WeakPolarHBondContact O-CB 3.4Å; K12-Q16 PolarHBondContact O-N 2.89Å; Q13-Q16 PolarHBondContact O-N 2.9Å; Q13-Q16 VanDerWaalsContact O-N 3.11Å; Q16-S20 WeakPolarHBondContact O-CB 3.15Å; Q16-S20 PolarHBondContact O-N 3.32Å; Q16-S20 PolarHBondContact O-OG 3.15Å
17	E	92.2	Very high	89.1	Confident	134 Å²	134	107.4 Å²	107.4	63%	0.626	53%	0.526	S	S	*	.	H	α-helix	trans	-69.8	-42	171.2	-173.8	179.9	-174.3	0	0	112	Q13 N19 S20 R21	Q13-E17 WeakPolarHBondContact O-CB 3.25Å; Q13-E17 PolarHBondContact O-N 3.33Å; E17-N19 VanDerWaalsContact C-N 3.34Å; E17-N19 PolarHBondContact O-N 3.19Å; E17-S20 PolarHBondContact O-N 3.03Å; E17-S20 PolarHBondContact O-OG 3.5Å; E17-R21 WeakPolarHBondContact O-CB 3.33Å; E17-R21 PolarHBondContact O-N 3.36Å
18	L	94.1	Very high	90.5	Very high	109 Å²	109	109.7 Å²	109.7	57%	0.571	53%	0.528	S	S	*	.	H	α-helix	trans	-62.4	-42	173.5	-175.9	63.8	0	0	0	111.2	Q14 L22	Q14-L18 VanDerWaalsContact O-CB 3.29Å; Q14-L18 WeakPolarHBondContact O-CB 3.47Å; Q14-L18 PolarHBondContact O-N 2.72Å; L18-L22 VanDerWaalsContact O-CB 3.24Å; L18-L22 WeakPolarHBondContact O-CB 3.15Å; L18-L22 PolarHBondContact O-N 3.29Å
19	N	92.6	Very high	91.5	Very high	98 Å²	98	106.7 Å²	106.7	52%	0.524	52%	0.52	S	S	.	.	H	α-helix	trans	-69.3	-35.6	176	-82.1	-64.7	0	0	0	113	L15 E17 L22 A23	L15-N19 VanDerWaalsContact O-CB 3.3Å; L15-N19 WeakPolarHBondContact O-CB 3.48Å; L15-N19 PolarHBondContact O-N 3.19Å; L15-N19 PolarHBondContact O-ND2 3.03Å; E17-N19 VanDerWaalsContact C-N 3.34Å; E17-N19 PolarHBondContact O-N 3.19Å; N19-L22 PolarHBondContact O-N 3.41Å; N19-A23 WeakPolarHBondContact O-CB 3.19Å; N19-A23 PolarHBondContact O-N 2.65Å
20	S	92.4	Very high	92.2	Very high	59 Å²	59	109 Å²	109	41%	0.413	53%	0.527	S	S	.	.	H	α-helix	trans	-69.2	-39.7	175.5	70.9	0	0	0	0	111.5	Q16 E17 A23 Q24	Q16-S20 WeakPolarHBondContact O-CB 3.15Å; Q16-S20 PolarHBondContact O-N 3.32Å; Q16-S20 PolarHBondContact O-OG 3.15Å; E17-S20 PolarHBondContact O-N 3.03Å; E17-S20 PolarHBondContact O-OG 3.5Å; S20-A23 PolarHBondContact O-N 3.48Å; S20-Q24 WeakPolarHBondContact O-CG 3.49Å; S20-Q24 PolarHBondContact O-N 3.36Å
21	R	95.1	Very high	92.9	Very high	140 Å²	140	105.1 Å²	105.1	53%	0.528	52%	0.516	S	S	.	.	H	α-helix	trans	-65.5	-39.1	172.3	-174.8	172.5	176.2	174.6	-3.9	112.3	E17 Q24 Y25	E17-R21 WeakPolarHBondContact O-CB 3.33Å; E17-R21 PolarHBondContact O-N 3.36Å; R21-Q24 PolarHBondContact O-N 2.89Å; R21-Y25 HydrophobicContact CG-CD2 4.05Å; R21-Y25 HydrophobicContact CG-CE2 3.59Å; R21-Y25 PolarHBondContact NE-OH 2.69Å; R21-Y25 VanDerWaalsContact NE-OH 3.09Å; R21-Y25 PolarHBondContact NH2-OH 3.2Å; R21-Y25 VanDerWaalsContact O-CD2 3.28Å; R21-Y25 WeakPolarHBondContact O-CD2 3.23Å; R21-Y25 PolarHBondContact O-N 3.2Å
22	L	94.8	Very high	93.5	Very high	90 Å²	90	103.7 Å²	103.7	47%	0.471	51%	0.511	S	S	.	.	H	α-helix	trans	-65.9	-39.7	173.5	-176.8	128.2	0	0	0	111.8	L18 N19 Y25 L26	L18-L22 VanDerWaalsContact O-CB 3.24Å; L18-L22 WeakPolarHBondContact O-CB 3.15Å; L18-L22 PolarHBondContact O-N 3.29Å; N19-L22 PolarHBondContact O-N 3.41Å; L22-Y25 PolarHBondContact O-N 3.42Å; L22-L26 HydrophobicContact CD2-CD1 3.67Å; L22-L26 HydrophobicContact CD2-CG 4.42Å; L22-L26 HydrophobicContact CG-CD1 4.32Å; L22-L26 WeakPolarHBondContact O-CB 3.44Å; L22-L26 WeakPolarHBondContact O-CG 3.31Å; L22-L26 PolarHBondContact O-N 3.29Å
23	A	94.3	Very high	93.9	Very high	56 Å²	56	103.8 Å²	103.8	46%	0.463	51%	0.513	S	S	.	.	H	α-helix	trans	-64.1	-39	173.3	0	0	0	0	0	112.2	N19 S20 S27	N19-A23 WeakPolarHBondContact O-CB 3.19Å; N19-A23 PolarHBondContact O-N 2.65Å; S20-A23 PolarHBondContact O-N 3.48Å; A23-S27 WeakPolarHBondContact O-CB 3.47Å; A23-S27 PolarHBondContact O-N 2.79Å
24	Q	95.2	Very high	94.3	Very high	133 Å²	133	103.2 Å²	103.2	62%	0.621	51%	0.511	S	S	*	.	H	α-helix	trans	-62.8	-44.6	171.8	-72.5	171.5	6.9	0	0	111.8	S20 R21 S27 R28	S20-Q24 WeakPolarHBondContact O-CG 3.49Å; S20-Q24 PolarHBondContact O-N 3.36Å; R21-Q24 PolarHBondContact O-N 2.89Å; Q24-S27 PolarHBondContact O-N 2.62Å; Q24-R28 PolarHBondContact O-N 2.93Å
25	Y	97.1	Very high	94.7	Very high	132 Å²	132	102 Å²	102	52%	0.518	51%	0.505	S	S	.	.	H	α-helix	trans	-62.5	-48.1	175.4	-72.8	-45.5	0	0	0	112.1	R21 L22 S27 R28 T29	R21-Y25 HydrophobicContact CG-CD2 4.05Å; R21-Y25 HydrophobicContact CG-CE2 3.59Å; R21-Y25 PolarHBondContact NE-OH 2.69Å; R21-Y25 VanDerWaalsContact NE-OH 3.09Å; R21-Y25 PolarHBondContact NH2-OH 3.2Å; R21-Y25 VanDerWaalsContact O-CD2 3.28Å; R21-Y25 WeakPolarHBondContact O-CD2 3.23Å; R21-Y25 PolarHBondContact O-N 3.2Å; L22-Y25 PolarHBondContact O-N 3.42Å; Y25-S27 VanDerWaalsContact C-N 3.28Å; Y25-S27 PolarHBondContact O-N 2.85Å; Y25-R28 PolarHBondContact O-N 3.31Å; Y25-R28 VanDerWaalsContact O-N 3.11Å; Y25-T29 PolarHBondContact O-N 3.02Å; Y25-T29 PolarHBondContact O-OG1 2.98Å; Y25-T29 VanDerWaalsContact O-OG1 3.08Å
26	L	96	Very high	94.9	Very high	109 Å²	109	101.3 Å²	101.3	57%	0.571	50%	0.502	S	S	*	.	H	α-helix	trans	-60	-37.6	175.8	-71.3	173.3	0	0	0	112.2	L22 K30	L22-L26 HydrophobicContact CD2-CD1 3.67Å; L22-L26 HydrophobicContact CD2-CG 4.42Å; L22-L26 HydrophobicContact CG-CD1 4.32Å; L22-L26 WeakPolarHBondContact O-CB 3.44Å; L22-L26 WeakPolarHBondContact O-CG 3.31Å; L22-L26 PolarHBondContact O-N 3.29Å; L26-K30 VanDerWaalsContact O-CB 3.32Å; L26-K30 WeakPolarHBondContact O-CB 3.49Å; L26-K30 PolarHBondContact O-N 2.91Å
27	S	94.6	Very high	95.3	Very high	80 Å²	80	98 Å²	98	56%	0.559	50%	0.496	S	S	*	.	H	α-helix	trans	-66	-40	174.2	-166.9	0	0	0	0	112.3	A23 Q24 Y25 Q31	A23-S27 WeakPolarHBondContact O-CB 3.47Å; A23-S27 PolarHBondContact O-N 2.79Å; Q24-S27 PolarHBondContact O-N 2.62Å; Y25-S27 VanDerWaalsContact C-N 3.28Å; Y25-S27 PolarHBondContact O-N 2.85Å; S27-Q31 WeakPolarHBondContact O-CB 3.3Å; S27-Q31 PolarHBondContact O-N 3.04Å
28	R	96.5	Very high	95.5	Very high	110 Å²	110	97.7 Å²	97.7	42%	0.415	50%	0.495	S	S	.	.	H	α-helix	trans	-73.4	-37	177.3	-175.2	58.1	-178.6	142.8	8.5	112	Q24 Y25 Q31 L32 E35	Q24-R28 PolarHBondContact O-N 2.93Å; Y25-R28 PolarHBondContact O-N 3.31Å; Y25-R28 VanDerWaalsContact O-N 3.11Å; R28-Q31 VanDerWaalsContact NH1-NE2 3.18Å; R28-Q31 PolarHBondContact O-N 3.26Å; R28-L32 HydrophobicContact CG-CD1 4.13Å; R28-L32 WeakPolarHBondContact O-CB 3.41Å; R28-L32 WeakPolarHBondContact O-CG 3.35Å; R28-L32 PolarHBondContact O-N 3.35Å; R28-E35 IonicContact CZ-OE2 3.81Å; R28-E35 IonicContact NH1-OE1 3.52Å; R28-E35 IonicContact NH1-OE2 3.06Å; R28-E35 PolarHBondContact NH1-OE2 3.06Å; R28-E35 IonicContact NH2-OE2 3.71Å
29	T	96.9	Very high	95.6	Very high	69 Å²	69	96.8 Å²	96.8	42%	0.423	49%	0.49	S	S	.	.	H	α-helix	trans	-60.5	-48.8	171.2	-58.3	0	0	0	0	110.3	Y25 Q31 L32 E33	Y25-T29 PolarHBondContact O-N 3.02Å; Y25-T29 PolarHBondContact O-OG1 2.98Å; Y25-T29 VanDerWaalsContact O-OG1 3.08Å; T29-Q31 VanDerWaalsContact C-N 3.31Å; T29-Q31 PolarHBondContact O-N 3.15Å; T29-L32 CarbonylContact O-C 3.53Å; T29-L32 WeakPolarHBondContact O-CB 3.41Å; T29-L32 PolarHBondContact O-N 3.42Å; T29-L32 VanDerWaalsContact O-N 3.09Å; T29-E33 HydrophobicContact CG2-CG 4.4Å; T29-E33 WeakPolarHBondContact O-CG 3.44Å; T29-E33 PolarHBondContact O-N 2.69Å
30	K	95.3	Very high	95.7	Very high	125 Å²	125	96.8 Å²	96.8	54%	0.543	49%	0.489	S	S	.	.	H	α-helix	trans	-61	-37.9	176.8	-174.6	176.5	179.4	-179.3	0	112.9	L26 E33 Q34	L26-K30 VanDerWaalsContact O-CB 3.32Å; L26-K30 WeakPolarHBondContact O-CB 3.49Å; L26-K30 PolarHBondContact O-N 2.91Å; K30-E33 PolarHBondContact O-N 2.87Å; K30-Q34 VanDerWaalsContact O-CG 3.31Å; K30-Q34 WeakPolarHBondContact O-CG 3.38Å; K30-Q34 PolarHBondContact O-N 3.19Å
31	Q	96.7	Very high	95.6	Very high	83 Å²	83	96.8 Å²	96.8	39%	0.388	49%	0.493	S	S	.	.	H	α-helix	trans	-63.9	-45.8	172.8	-171.8	-170.2	-2.2	0	0	111.1	S27 R28 T29 E33 Q34 E35	S27-Q31 WeakPolarHBondContact O-CB 3.3Å; S27-Q31 PolarHBondContact O-N 3.04Å; R28-Q31 VanDerWaalsContact NH1-NE2 3.18Å; R28-Q31 PolarHBondContact O-N 3.26Å; T29-Q31 VanDerWaalsContact C-N 3.31Å; T29-Q31 PolarHBondContact O-N 3.15Å; Q31-E33 VanDerWaalsContact C-N 3.32Å; Q31-E33 PolarHBondContact O-N 3.37Å; Q31-Q34 PolarHBondContact O-N 2.84Å; Q31-E35 HydrophobicContact CG-CG 4.44Å; Q31-E35 WeakPolarHBondContact CG-OE1 3.37Å; Q31-E35 PolarHBondContact NE2-OE1 2.79Å; Q31-E35 WeakPolarHBondContact O-CB 3.25Å; Q31-E35 WeakPolarHBondContact O-CG 3.49Å; Q31-E35 PolarHBondContact O-N 3.35Å
32	L	97	Very high	95.4	Very high	70 Å²	70	94.5 Å²	94.5	37%	0.366	49%	0.488	S	S	.	.	H	α-helix	trans	-65.2	-32	176.7	-74.7	166.4	0	0	0	112.8	R28 T29 N36	R28-L32 HydrophobicContact CG-CD1 4.13Å; R28-L32 WeakPolarHBondContact O-CB 3.41Å; R28-L32 WeakPolarHBondContact O-CG 3.35Å; R28-L32 PolarHBondContact O-N 3.35Å; T29-L32 CarbonylContact O-C 3.53Å; T29-L32 WeakPolarHBondContact O-CB 3.41Å; T29-L32 PolarHBondContact O-N 3.42Å; T29-L32 VanDerWaalsContact O-N 3.09Å; L32-N36 VanDerWaalsContact O-CB 3.23Å; L32-N36 WeakPolarHBondContact O-CB 3.32Å; L32-N36 PolarHBondContact O-N 3.44Å; L32-N36 PolarHBondContact O-ND2 3.47Å
33	E	95.8	Very high	95.1	Very high	120 Å²	120	94.2 Å²	94.2	56%	0.561	49%	0.486	S	S	*	.	H	α-helix	trans	-66.6	-40.8	171.5	-73.8	167.9	173	0	0	111.1	T29 K30 Q31 A37	T29-E33 HydrophobicContact CG2-CG 4.4Å; T29-E33 WeakPolarHBondContact O-CG 3.44Å; T29-E33 PolarHBondContact O-N 2.69Å; K30-E33 PolarHBondContact O-N 2.87Å; Q31-E33 VanDerWaalsContact C-N 3.32Å; Q31-E33 PolarHBondContact O-N 3.37Å; E33-A37 WeakPolarHBondContact O-CB 3.41Å; E33-A37 PolarHBondContact O-N 3.21Å
34	Q	96	Very high	94.6	Very high	121 Å²	121	95.7 Å²	95.7	57%	0.565	49%	0.486	S	S	*	.	H	α-helix	trans	-69.4	-42.4	175.5	-71.8	175.7	-34.9	0	0	112.1	K30 Q31 A37 H38	K30-Q34 VanDerWaalsContact O-CG 3.31Å; K30-Q34 WeakPolarHBondContact O-CG 3.38Å; K30-Q34 PolarHBondContact O-N 3.19Å; Q31-Q34 PolarHBondContact O-N 2.84Å; Q34-A37 PolarHBondContact O-N 3.4Å; Q34-H38 PolarHBondContact O-N 3.32Å
35	E	96.5	Very high	94.2	Very high	74 Å²	74	97.3 Å²	97.3	35%	0.346	49%	0.491	S	S	.	.	H	α-helix	trans	-61.7	-47.5	174.2	-73.2	166.5	178.6	0	0	110.4	R28 Q31 H38 L39	R28-E35 IonicContact CZ-OE2 3.81Å; R28-E35 IonicContact NH1-OE1 3.52Å; R28-E35 IonicContact NH1-OE2 3.06Å; R28-E35 PolarHBondContact NH1-OE2 3.06Å; R28-E35 IonicContact NH2-OE2 3.71Å; Q31-E35 HydrophobicContact CG-CG 4.44Å; Q31-E35 WeakPolarHBondContact CG-OE1 3.37Å; Q31-E35 PolarHBondContact NE2-OE1 2.79Å; Q31-E35 WeakPolarHBondContact O-CB 3.25Å; Q31-E35 WeakPolarHBondContact O-CG 3.49Å; Q31-E35 PolarHBondContact O-N 3.35Å; E35-H38 PolarHBondContact O-N 3.44Å; E35-L39 WeakPolarHBondContact O-CG 3.42Å; E35-L39 PolarHBondContact O-N 2.78Å
36	N	95.8	Very high	93.4	Very high	87 Å²	87	96.4 Å²	96.4	47%	0.465	50%	0.495	S	S	.	.	H	α-helix	trans	-64.2	-41.1	174.5	-81.5	-57.7	0	0	0	112.8	L32 H38 L39 I40	L32-N36 VanDerWaalsContact O-CB 3.23Å; L32-N36 WeakPolarHBondContact O-CB 3.32Å; L32-N36 PolarHBondContact O-N 3.44Å; L32-N36 PolarHBondContact O-ND2 3.47Å; N36-H38 VanDerWaalsContact C-N 3.31Å; N36-H38 PolarHBondContact O-N 2.94Å; N36-L39 PolarHBondContact O-N 3.38Å; N36-I40 WeakPolarHBondContact O-CB 3.16Å; N36-I40 WeakPolarHBondContact O-CD1 3.31Å; N36-I40 WeakPolarHBondContact O-CG1 2.92Å; N36-I40 PolarHBondContact O-N 2.86Å
37	A	96.3	Very high	92.5	Very high	59 Å²	59	98.3 Å²	98.3	49%	0.488	50%	0.499	S	S	.	.	H	α-helix	trans	-62.4	-38.9	177.5	0	0	0	0	0	111.8	E33 Q34 A41	E33-A37 WeakPolarHBondContact O-CB 3.41Å; E33-A37 PolarHBondContact O-N 3.21Å; Q34-A37 PolarHBondContact O-N 3.4Å; A37-A41 WeakPolarHBondContact O-CB 3.15Å; A37-A41 PolarHBondContact O-N 2.94Å
38	H	95.9	Very high	91.4	Very high	127 Å²	127	105.1 Å²	105.1	59%	0.588	51%	0.512	S	S	*	.	H	α-helix	trans	-65.8	-47.8	173.2	-170.1	-46.8	0	0	0	111.6	Q34 E35 N36 I40 A41 E42	Q34-H38 PolarHBondContact O-N 3.32Å; E35-H38 PolarHBondContact O-N 3.44Å; N36-H38 VanDerWaalsContact C-N 3.31Å; N36-H38 PolarHBondContact O-N 2.94Å; H38-I40 VanDerWaalsContact C-N 3.34Å; H38-I40 PolarHBondContact O-N 2.82Å; H38-A41 PolarHBondContact O-N 2.9Å; H38-E42 IonicContact CE1-OE2 3.67Å; H38-E42 IonicContact ND1-OE2 3.68Å; H38-E42 WeakPolarHBondContact O-CB 3.21Å; H38-E42 PolarHBondContact O-N 2.83Å
39	L	96.2	Very high	89.9	Confident	91 Å²	91	103.2 Å²	103.2	48%	0.476	53%	0.527	S	S	.	.	H	α-helix	trans	-62.7	-39.9	178.8	-71.1	170	0	0	0	111.9	E35 N36 E42 I43	E35-L39 WeakPolarHBondContact O-CG 3.42Å; E35-L39 PolarHBondContact O-N 2.78Å; N36-L39 PolarHBondContact O-N 3.38Å; L39-E42 PolarHBondContact O-N 2.87Å; L39-I43 WeakPolarHBondContact O-CB 3.49Å; L39-I43 WeakPolarHBondContact O-CD1 3.41Å; L39-I43 WeakPolarHBondContact O-CG1 3.44Å; L39-I43 PolarHBondContact O-N 3.1Å
40	I	94.4	Very high	88.3	Confident	97 Å²	97	103 Å²	103	50%	0.497	53%	0.528	S	S	.	.	H	α-helix	trans	-64.8	-42.2	174.5	-70.3	164.8	0	0	0	110.7	N36 H38 E42 N44	N36-I40 WeakPolarHBondContact O-CB 3.16Å; N36-I40 WeakPolarHBondContact O-CD1 3.31Å; N36-I40 WeakPolarHBondContact O-CG1 2.92Å; N36-I40 PolarHBondContact O-N 2.86Å; H38-I40 VanDerWaalsContact C-N 3.34Å; H38-I40 PolarHBondContact O-N 2.82Å; I40-E42 VanDerWaalsContact C-N 3.34Å; I40-N44 VanDerWaalsContact O-CB 3.25Å; I40-N44 WeakPolarHBondContact O-CB 3.38Å; I40-N44 PolarHBondContact O-N 3.35Å; I40-N44 PolarHBondContact O-ND2 3.17Å
41	A	91.8	Very high	86.9	Confident	60 Å²	60	98 Å²	98	50%	0.496	51%	0.512	S	S	.	.	H	α-helix	trans	-63.8	-39.5	175.6	0	0	0	0	0	112.1	A37 H38 N44 K45	A37-A41 WeakPolarHBondContact O-CB 3.15Å; A37-A41 PolarHBondContact O-N 2.94Å; H38-A41 PolarHBondContact O-N 2.9Å; A41-N44 PolarHBondContact O-N 3.25Å; A41-K45 WeakPolarHBondContact O-CB 3.37Å; A41-K45 PolarHBondContact O-N 3.37Å
42	E	91.4	Very high	85.6	Confident	91 Å²	91	97.5 Å²	97.5	43%	0.425	52%	0.515	S	S	.	.	H	α-helix	trans	-70.8	-45.2	178	-175.1	160.4	-153.5	0	0	112.4	H38 L39 I40 N44 K45 L46	H38-E42 IonicContact CE1-OE2 3.67Å; H38-E42 IonicContact ND1-OE2 3.68Å; H38-E42 WeakPolarHBondContact O-CB 3.21Å; H38-E42 PolarHBondContact O-N 2.83Å; L39-E42 PolarHBondContact O-N 2.87Å; I40-E42 VanDerWaalsContact C-N 3.34Å; E42-N44 VanDerWaalsContact C-N 3.29Å; E42-N44 PolarHBondContact O-N 3.35Å; E42-K45 WeakPolarHBondContact O-CB 3.46Å; E42-K45 PolarHBondContact O-N 2.59Å; E42-K45 VanDerWaalsContact O-N 3.12Å; E42-L46 HydrophobicContact CG-CD1 4.25Å; E42-L46 WeakPolarHBondContact O-CB 3.36Å; E42-L46 WeakPolarHBondContact O-CG 3.21Å; E42-L46 PolarHBondContact O-N 3.01Å
43	I	87.5	Confident	84.5	Confident	84 Å²	84	97.4 Å²	97.4	43%	0.431	52%	0.524	S	S	.	.	H	α-helix	trans	-57.8	-42.6	171.5	-70.9	163.8	0	0	0	110.5	L39 L46 K47	L39-I43 WeakPolarHBondContact O-CB 3.49Å; L39-I43 WeakPolarHBondContact O-CD1 3.41Å; L39-I43 WeakPolarHBondContact O-CG1 3.44Å; L39-I43 PolarHBondContact O-N 3.1Å; I43-L46 PolarHBondContact O-N 2.97Å; I43-K47 HydrophobicContact CG2-CD 4.08Å; I43-K47 HydrophobicContact CG2-CG 4.45Å; I43-K47 WeakPolarHBondContact O-CB 3.42Å; I43-K47 VanDerWaalsContact O-CG 3.31Å; I43-K47 WeakPolarHBondContact O-CG 3.49Å; I43-K47 PolarHBondContact O-N 3.45Å
44	N	84.7	Confident	83.7	Confident	87 Å²	87	97.9 Å²	97.9	47%	0.465	53%	0.526	S	S	.	.	H	α-helix	trans	-70.2	-30.8	177.3	-74.3	-31.4	0	0	0	113.1	I40 A41 E42 R48	I40-N44 VanDerWaalsContact O-CB 3.25Å; I40-N44 WeakPolarHBondContact O-CB 3.38Å; I40-N44 PolarHBondContact O-N 3.35Å; I40-N44 PolarHBondContact O-ND2 3.17Å; A41-N44 PolarHBondContact O-N 3.25Å; E42-N44 VanDerWaalsContact C-N 3.29Å; E42-N44 PolarHBondContact O-N 3.35Å; N44-R48 WeakPolarHBondContact O-CB 3.38Å; N44-R48 PolarHBondContact O-N 3.32Å
45	K	84.9	Confident	83	Confident	167 Å²	167	98.7 Å²	98.7	73%	0.726	52%	0.524	S	S	*	.	H	α-helix	trans	-68.8	-46.1	171.6	-174.1	-175.1	176.8	-170.4	0	110.7	A41 E42 R48 G49	A41-K45 WeakPolarHBondContact O-CB 3.37Å; A41-K45 PolarHBondContact O-N 3.37Å; E42-K45 WeakPolarHBondContact O-CB 3.46Å; E42-K45 PolarHBondContact O-N 2.59Å; E42-K45 VanDerWaalsContact O-N 3.12Å; K45-R48 CarbonylContact O-C 3.59Å; K45-R48 PolarHBondContact O-N 3.49Å; K45-R48 VanDerWaalsContact O-N 3.14Å; K45-G49 PolarHBondContact O-N 3.01Å
46	L	80.9	Confident	82.4	Confident	113 Å²	113	100 Å²	100	59%	0.592	53%	0.53	S	S	*	.	H	α-helix	trans	-64.6	-41.1	177.1	-69.7	170.6	0	0	0	111.9	E42 I43 R48 G49 S50	E42-L46 HydrophobicContact CG-CD1 4.25Å; E42-L46 WeakPolarHBondContact O-CB 3.36Å; E42-L46 WeakPolarHBondContact O-CG 3.21Å; E42-L46 PolarHBondContact O-N 3.01Å; I43-L46 PolarHBondContact O-N 2.97Å; L46-R48 PolarHBondContact O-N 3.28Å; L46-G49 PolarHBondContact O-N 2.81Å; L46-S50 WeakPolarHBondContact O-CB 3.26Å; L46-S50 PolarHBondContact O-N 3.32Å
47	K	77.4	Confident	82.1	Confident	150 Å²	150	102.8 Å²	102.8	65%	0.652	54%	0.54	S	S	*	.	H	α-helix	trans	-68	-11.4	173.2	-75	-177.1	176.4	-172.4	0	114.8	I43	I43-K47 HydrophobicContact CG2-CD 4.08Å; I43-K47 HydrophobicContact CG2-CG 4.45Å; I43-K47 WeakPolarHBondContact O-CB 3.42Å; I43-K47 VanDerWaalsContact O-CG 3.31Å; I43-K47 WeakPolarHBondContact O-CG 3.49Å; I43-K47 PolarHBondContact O-N 3.45Å
48	R	71.1	Confident	81.8	Confident	222 Å²	222	107 Å²	107	84%	0.838	54%	0.544	S	S	*	.	H	α-helix	trans	-109	-22.1	177	-165.4	177.7	-63	-157.8	-0.9	113.1	N44 K45 L46	N44-R48 WeakPolarHBondContact O-CB 3.38Å; N44-R48 PolarHBondContact O-N 3.32Å; K45-R48 CarbonylContact O-C 3.59Å; K45-R48 PolarHBondContact O-N 3.49Å; K45-R48 VanDerWaalsContact O-N 3.14Å; L46-R48 PolarHBondContact O-N 3.28Å
49	G	65.4	Low	81.6	Confident	71 Å²	71	108.3 Å²	108.3	73%	0.732	55%	0.545	S	S	*	.	H	α-helix	trans	-95.8	-18.8	173.7	0	0	0	0	0	114.1	K45 L46	K45-G49 PolarHBondContact O-N 3.01Å; L46-G49 PolarHBondContact O-N 2.81Å
50	S	63.5	Low	81.4	Confident	65 Å²	65	110 Å²	110	46%	0.455	55%	0.548	S	S	.	.	S	Bend	trans	-79.7	121.2	161.8	-173.2	0	0	0	0	108.1	L46 T52	L46-S50 WeakPolarHBondContact O-CB 3.26Å; L46-S50 PolarHBondContact O-N 3.32Å; S50-T52 PolarHBondContact O-N 3.34Å
51	G	65.2	Low	81.4	Confident	20 Å²	20	107.4 Å²	107.4	21%	0.206	54%	0.541	C	S	.	.			trans	-70.9	36.6	-176.6	0	0	0	0	0	114.5	A53 E54 W55	G51-A53 PolarHBondContact O-N 3.04Å; G51-E54 WeakPolarHBondContact O-CA 3.4Å; G51-E54 WeakPolarHBondContact O-CB 3.33Å; G51-E54 PolarHBondContact O-N 3.36Å; G51-W55 PolarHBondContact O-N 3.2Å
52	T	69	Low	81.7	Confident	71 Å²	71	108.1 Å²	108.1	44%	0.436	54%	0.537	S	S	.	.	H	α-helix	trans	-58.5	-34.8	-175.3	61.9	0	0	0	0	112.2	S50 E56	S50-T52 PolarHBondContact O-N 3.34Å; T52-E56 WeakPolarHBondContact O-CB 3.48Å; T52-E56 WeakPolarHBondContact O-CG 3.47Å; T52-E56 PolarHBondContact O-N 3.24Å
53	A	74.1	Confident	81.9	Confident	68 Å²	68	108.5 Å²	108.5	56%	0.562	54%	0.54	S	S	*	.	H	α-helix	trans	-67.2	-35.5	174.3	0	0	0	0	0	112.8	G51 Q57	G51-A53 PolarHBondContact O-N 3.04Å; A53-Q57 VanDerWaalsContact O-CB 3.32Å; A53-Q57 WeakPolarHBondContact O-CB 3.28Å; A53-Q57 PolarHBondContact O-N 2.61Å
54	E	79.7	Confident	82.4	Confident	131 Å²	131	110.8 Å²	110.8	61%	0.612	55%	0.547	S	S	*	.	H	α-helix	trans	-73.6	-43.3	177.9	-60.6	173.7	170.9	0	0	110.7	G51 Q57 R58	G51-E54 WeakPolarHBondContact O-CA 3.4Å; G51-E54 WeakPolarHBondContact O-CB 3.33Å; G51-E54 PolarHBondContact O-N 3.36Å; E54-Q57 PolarHBondContact O-N 3.23Å; E54-R58 WeakPolarHBondContact O-CG 3.46Å; E54-R58 PolarHBondContact O-N 3.02Å
55	W	81.2	Confident	83	Confident	137 Å²	137	109.6 Å²	109.6	52%	0.519	54%	0.54	S	S	.	.	H	α-helix	trans	-63.8	-43.5	172.4	-67.8	115.8	0	0	0	112	G51 Q57 R58 Y59	G51-W55 PolarHBondContact O-N 3.2Å; W55-Q57 PolarHBondContact O-N 2.62Å; W55-R58 PolarHBondContact O-N 3.42Å; W55-Y59 HydrophobicContact CB-CD2 4.44Å; W55-Y59 HydrophobicContact CB-CE2 4.24Å; W55-Y59 WeakPolarHBondContact O-CD2 3.32Å; W55-Y59 PolarHBondContact O-N 3.19Å
56	E	84.9	Confident	83.6	Confident	102 Å²	102	106.8 Å²	106.8	48%	0.477	53%	0.533	S	S	.	.	H	α-helix	trans	-58.9	-36	171.3	-88.2	-170.4	-122.5	0	0	112.5	T52 K60	T52-E56 WeakPolarHBondContact O-CB 3.48Å; T52-E56 WeakPolarHBondContact O-CG 3.47Å; T52-E56 PolarHBondContact O-N 3.24Å; E56-K60 WeakPolarHBondContact O-CB 3.31Å; E56-K60 WeakPolarHBondContact O-CD 3.4Å; E56-K60 WeakPolarHBondContact O-CE 3.32Å; E56-K60 WeakPolarHBondContact O-CG 3.34Å; E56-K60 PolarHBondContact O-N 2.71Å; E56-K60 IonicContact OE2-NZ 2.67Å; E56-K60 PolarHBondContact OE2-NZ 3.18Å
57	Q	88.6	Confident	84.4	Confident	145 Å²	145	109.7 Å²	109.7	68%	0.678	54%	0.536	S	S	*	.	H	α-helix	trans	-74.1	-39.3	177.9	-176	169.2	-18.3	0	0	111.8	A53 E54 W55 K60 A61	A53-Q57 VanDerWaalsContact O-CB 3.32Å; A53-Q57 WeakPolarHBondContact O-CB 3.28Å; A53-Q57 PolarHBondContact O-N 2.61Å; E54-Q57 PolarHBondContact O-N 3.23Å; W55-Q57 PolarHBondContact O-N 2.62Å; Q57-K60 PolarHBondContact O-N 2.64Å; Q57-A61 PolarHBondContact O-N 3.47Å
58	R	89.9	Confident	85.4	Confident	147 Å²	147	110.2 Å²	110.2	56%	0.555	53%	0.534	S	S	*	.	H	α-helix	trans	-59.8	-58.6	171.5	-71.8	175.9	-175.8	-139.6	-0.8	110.6	E54 W55 K60 A61 D62	E54-R58 WeakPolarHBondContact O-CG 3.46Å; E54-R58 PolarHBondContact O-N 3.02Å; W55-R58 PolarHBondContact O-N 3.42Å; R58-K60 PolarHBondContact O-N 3.28Å; R58-A61 CarbonylContact O-C 3.54Å; R58-A61 WeakPolarHBondContact O-CA 3.43Å; R58-A61 WeakPolarHBondContact O-CB 3.24Å; R58-A61 PolarHBondContact O-N 2.67Å; R58-D62 VanDerWaalsContact C-OD2 3.25Å; R58-D62 PolarHBondContact O-N 3.32Å; R58-D62 VanDerWaalsContact O-OD1 3.14Å
59	Y	91.3	Very high	86.7	Confident	155 Å²	155	105.3 Å²	105.3	61%	0.608	52%	0.522	S	S	*	.	H	α-helix	trans	-56.7	-27	178.1	-67.9	-52.4	0	0	0	114.2	W55 D62 M63	W55-Y59 HydrophobicContact CB-CD2 4.44Å; W55-Y59 HydrophobicContact CB-CE2 4.24Å; W55-Y59 WeakPolarHBondContact O-CD2 3.32Å; W55-Y59 PolarHBondContact O-N 3.19Å; Y59-D62 WeakPolarHBondContact CA-OD2 3.36Å; Y59-D62 PolarHBondContact N-OD2 2.92Å; Y59-M63 WeakPolarHBondContact O-CB 3.4Å; Y59-M63 PolarHBondContact O-N 2.88Å
60	K	93	Very high	88.2	Confident	126 Å²	126	106.3 Å²	106.3	55%	0.548	51%	0.513	S	S	.	.	H	α-helix	trans	-79.3	-28.7	173.1	-72.6	164.3	-157.8	165.1	0	113.2	E56 Q57 R58 K64	E56-K60 WeakPolarHBondContact O-CB 3.31Å; E56-K60 WeakPolarHBondContact O-CD 3.4Å; E56-K60 WeakPolarHBondContact O-CE 3.32Å; E56-K60 WeakPolarHBondContact O-CG 3.34Å; E56-K60 PolarHBondContact O-N 2.71Å; E56-K60 IonicContact OE2-NZ 2.67Å; E56-K60 PolarHBondContact OE2-NZ 3.18Å; Q57-K60 PolarHBondContact O-N 2.64Å; R58-K60 PolarHBondContact O-N 3.28Å; K60-K64 WeakPolarHBondContact O-CB 3.24Å; K60-K64 PolarHBondContact O-N 3.2Å
61	A	94.9	Very high	89.9	Confident	43 Å²	43	105.1 Å²	105.1	36%	0.355	51%	0.512	S	S	.	.	H	α-helix	trans	-71.8	-52.2	167.7	0	0	0	0	0	110.2	Q57 R58 M63 K64 D65	Q57-A61 PolarHBondContact O-N 3.47Å; R58-A61 CarbonylContact O-C 3.54Å; R58-A61 WeakPolarHBondContact O-CA 3.43Å; R58-A61 WeakPolarHBondContact O-CB 3.24Å; R58-A61 PolarHBondContact O-N 2.67Å; A61-M63 VanDerWaalsContact C-N 3.33Å; A61-M63 PolarHBondContact O-N 2.75Å; A61-K64 CarbonylContact O-C 3.52Å; A61-K64 WeakPolarHBondContact O-CA 3.27Å; A61-K64 VanDerWaalsContact O-CB 3.28Å; A61-K64 WeakPolarHBondContact O-CB 3.47Å; A61-K64 PolarHBondContact O-N 2.88Å; A61-D65 PolarHBondContact O-N 3.28Å
62	D	96.4	Very high	91.5	Very high	75 Å²	75	109 Å²	109	40%	0.401	52%	0.524	S	S	.	.	H	α-helix	trans	-52.9	-49.3	177.8	-45.7	-25.9	0	0	0	110.9	R58 Y59 K64 D65 L66	R58-D62 VanDerWaalsContact C-OD2 3.25Å; R58-D62 PolarHBondContact O-N 3.32Å; R58-D62 VanDerWaalsContact O-OD1 3.14Å; Y59-D62 WeakPolarHBondContact CA-OD2 3.36Å; Y59-D62 PolarHBondContact N-OD2 2.92Å; D62-K64 VanDerWaalsContact C-N 3.3Å; D62-K64 PolarHBondContact O-N 3.41Å; D62-D65 PolarHBondContact O-N 2.86Å; D62-D65 VanDerWaalsContact O-N 3.15Å; D62-L66 WeakPolarHBondContact O-CB 3.33Å; D62-L66 VanDerWaalsContact O-CD1 3.3Å; D62-L66 WeakPolarHBondContact O-CD1 3.45Å; D62-L66 PolarHBondContact O-N 2.82Å
63	M	96.3	Very high	92.8	Very high	100 Å²	100	110 Å²	110	49%	0.493	53%	0.526	S	S	.	.	H	α-helix	trans	-64.4	-28.7	175.5	172.6	60.8	70	0	0	113.5	Y59 A61 R67	Y59-M63 WeakPolarHBondContact O-CB 3.4Å; Y59-M63 PolarHBondContact O-N 2.88Å; A61-M63 VanDerWaalsContact C-N 3.33Å; A61-M63 PolarHBondContact O-N 2.75Å; M63-R67 WeakPolarHBondContact O-CB 3.39Å; M63-R67 VanDerWaalsContact O-CD 3.24Å; M63-R67 WeakPolarHBondContact O-CD 3.31Å; M63-R67 WeakPolarHBondContact O-CG 3.34Å; M63-R67 PolarHBondContact O-N 3.42Å; M63-R67 HydrophobicContact SD-CG 4.34Å; M63-R67 PolarHBondContact SD-NE 2.88Å
64	K	97	Very high	93.9	Very high	132 Å²	132	110 Å²	110	57%	0.574	52%	0.522	S	S	*	.	H	α-helix	trans	-72.9	-38.4	173.1	-176.2	-161.1	171.8	-156.5	0	110.5	K60 A61 D62 R67 R68	K60-K64 WeakPolarHBondContact O-CB 3.24Å; K60-K64 PolarHBondContact O-N 3.2Å; A61-K64 CarbonylContact O-C 3.52Å; A61-K64 WeakPolarHBondContact O-CA 3.27Å; A61-K64 VanDerWaalsContact O-CB 3.28Å; A61-K64 WeakPolarHBondContact O-CB 3.47Å; A61-K64 PolarHBondContact O-N 2.88Å; D62-K64 VanDerWaalsContact C-N 3.3Å; D62-K64 PolarHBondContact O-N 3.41Å; K64-R67 WeakPolarHBondContact O-CB 3.22Å; K64-R67 PolarHBondContact O-N 2.94Å; K64-R68 PolarHBondContact O-N 2.97Å
65	D	97.6	Very high	94.8	Very high	61 Å²	61	110 Å²	110	33%	0.326	52%	0.52	S	S	.	.	H	α-helix	trans	-84.2	-32.3	-173.6	-65.4	-30.9	0	0	0	112.5	A61 D62 R67 R68 M69	A61-D65 PolarHBondContact O-N 3.28Å; D62-D65 PolarHBondContact O-N 2.86Å; D62-D65 VanDerWaalsContact O-N 3.15Å; D65-R67 VanDerWaalsContact C-N 3.32Å; D65-R67 PolarHBondContact O-N 3.31Å; D65-R68 WeakPolarHBondContact O-CB 3.45Å; D65-R68 PolarHBondContact O-N 2.87Å; D65-R68 IonicContact OD1-CZ 3.5Å; D65-R68 VanDerWaalsContact OD1-CZ 3.29Å; D65-R68 IonicContact OD1-NE 2.76Å; D65-R68 PolarHBondContact OD1-NE 2.96Å; D65-R68 VanDerWaalsContact OD1-NE 3.1Å; D65-R68 IonicContact OD1-NH2 3.15Å; D65-R68 PolarHBondContact OD1-NH2 3.27Å; D65-R68 IonicContact OD2-NH2 2.66Å; D65-M69 WeakPolarHBondContact O-CB 3.48Å; D65-M69 PolarHBondContact O-N 3.03Å
66	L	97.8	Very high	95.7	Very high	109 Å²	109	107.9 Å²	107.9	57%	0.571	52%	0.516	S	S	*	.	H	α-helix	trans	-59.2	-41.6	162	-93.1	68.7	0	0	0	111.4	D62 R68 M69 V70	D62-L66 WeakPolarHBondContact O-CB 3.33Å; D62-L66 VanDerWaalsContact O-CD1 3.3Å; D62-L66 WeakPolarHBondContact O-CD1 3.45Å; D62-L66 PolarHBondContact O-N 2.82Å; L66-R68 VanDerWaalsContact C-N 3.34Å; L66-M69 PolarHBondContact O-N 3.48Å; L66-V70 WeakPolarHBondContact O-CB 3.46Å; L66-V70 VanDerWaalsContact O-CG2 3.31Å; L66-V70 WeakPolarHBondContact O-CG2 3.39Å; L66-V70 PolarHBondContact O-N 3.5Å
67	R	97.8	Very high	96.3	Very high	173 Å²	173	108.8 Å²	108.8	65%	0.653	52%	0.519	S	S	*	.	H	α-helix	trans	-66	-36.1	174.5	-74.5	169.4	-170.6	-128.6	-2.9	112.6	M63 K64 D65 G71	M63-R67 WeakPolarHBondContact O-CB 3.39Å; M63-R67 VanDerWaalsContact O-CD 3.24Å; M63-R67 WeakPolarHBondContact O-CD 3.31Å; M63-R67 WeakPolarHBondContact O-CG 3.34Å; M63-R67 PolarHBondContact O-N 3.42Å; M63-R67 HydrophobicContact SD-CG 4.34Å; M63-R67 PolarHBondContact SD-NE 2.88Å; K64-R67 WeakPolarHBondContact O-CB 3.22Å; K64-R67 PolarHBondContact O-N 2.94Å; D65-R67 VanDerWaalsContact C-N 3.32Å; D65-R67 PolarHBondContact O-N 3.31Å; R67-G71 PolarHBondContact O-N 2.91Å
68	R	98.1	Very high	96.6	Very high	161 Å²	161	105.1 Å²	105.1	61%	0.608	51%	0.509	S	S	*	.	H	α-helix	trans	-62.6	-48.6	174.3	-162.1	-157.3	-55.2	-151.6	11.5	110.4	K64 D65 L66 G71 Q72	K64-R68 PolarHBondContact O-N 2.97Å; D65-R68 WeakPolarHBondContact O-CB 3.45Å; D65-R68 PolarHBondContact O-N 2.87Å; D65-R68 IonicContact OD1-CZ 3.5Å; D65-R68 VanDerWaalsContact OD1-CZ 3.29Å; D65-R68 IonicContact OD1-NE 2.76Å; D65-R68 PolarHBondContact OD1-NE 2.96Å; D65-R68 VanDerWaalsContact OD1-NE 3.1Å; D65-R68 IonicContact OD1-NH2 3.15Å; D65-R68 PolarHBondContact OD1-NH2 3.27Å; D65-R68 IonicContact OD2-NH2 2.66Å; L66-R68 VanDerWaalsContact C-N 3.34Å; R68-G71 PolarHBondContact O-N 2.9Å; R68-Q72 PolarHBondContact O-N 2.72Å
69	M	98.1	Very high	97	Very high	119 Å²	119	102.5 Å²	102.5	59%	0.586	50%	0.503	S	S	*	.	H	α-helix	trans	-62.8	-44.8	177.5	-176.6	-177.4	-73.5	0	0	112.2	D65 L66 G71 Q72 I73	D65-M69 WeakPolarHBondContact O-CB 3.48Å; D65-M69 PolarHBondContact O-N 3.03Å; L66-M69 PolarHBondContact O-N 3.48Å; M69-G71 VanDerWaalsContact C-N 3.3Å; M69-G71 PolarHBondContact O-N 2.9Å; M69-Q72 PolarHBondContact O-N 3.39Å; M69-I73 HydrophobicContact CG-CD1 3.79Å; M69-I73 HydrophobicContact CG-CG1 4.49Å; M69-I73 WeakPolarHBondContact O-CB 3.41Å; M69-I73 WeakPolarHBondContact O-CG1 3.07Å; M69-I73 PolarHBondContact O-N 3.46Å
70	V	98.3	Very high	97.3	Very high	92 Å²	92	97.6 Å²	97.6	56%	0.558	50%	0.495	S	S	*	.	H	α-helix	trans	-62	-38.6	173.9	168.7	0	0	0	0	111.4	L66 S74	L66-V70 WeakPolarHBondContact O-CB 3.46Å; L66-V70 VanDerWaalsContact O-CG2 3.31Å; L66-V70 WeakPolarHBondContact O-CG2 3.39Å; L66-V70 PolarHBondContact O-N 3.5Å; V70-S74 VanDerWaalsContact O-CB 3.26Å; V70-S74 WeakPolarHBondContact O-CB 3.45Å; V70-S74 PolarHBondContact O-N 3.41Å; V70-S74 PolarHBondContact O-OG 2.84Å
71	G	98.1	Very high	97.5	Very high	41 Å²	41	95.4 Å²	95.4	42%	0.423	49%	0.486	S	S	.	.	H	α-helix	trans	-63	-45.2	173.8	0	0	0	0	0	112.7	R67 R68 M69 S74 F75	R67-G71 PolarHBondContact O-N 2.91Å; R68-G71 PolarHBondContact O-N 2.9Å; M69-G71 VanDerWaalsContact C-N 3.3Å; M69-G71 PolarHBondContact O-N 2.9Å; G71-S74 PolarHBondContact O-N 3.26Å; G71-F75 PolarHBondContact O-N 3.01Å
72	Q	98.4	Very high	97.6	Very high	100 Å²	100	99.3 Å²	99.3	47%	0.467	50%	0.499	S	S	.	.	H	α-helix	trans	-61.2	-52.7	177	-175.5	63	27.1	0	0	111.6	R68 M69 S74 F75 E76	R68-Q72 PolarHBondContact O-N 2.72Å; M69-Q72 PolarHBondContact O-N 3.39Å; Q72-S74 PolarHBondContact O-N 3.3Å; Q72-F75 WeakPolarHBondContact O-CB 3.5Å; Q72-F75 PolarHBondContact O-N 3.06Å; Q72-E76 VanDerWaalsContact CG-OE1 3.28Å; Q72-E76 WeakPolarHBondContact CG-OE1 3.32Å; Q72-E76 PolarHBondContact NE2-OE1 3.2Å; Q72-E76 WeakPolarHBondContact O-CG 3.26Å; Q72-E76 PolarHBondContact O-N 3.03Å
73	I	98.1	Very high	97.6	Very high	92 Å²	92	100.2 Å²	100.2	47%	0.472	50%	0.501	S	S	.	.	H	α-helix	trans	-61.5	-33.7	177.8	-66.4	168.2	0	0	0	111.3	M69 K77	M69-I73 HydrophobicContact CG-CD1 3.79Å; M69-I73 HydrophobicContact CG-CG1 4.49Å; M69-I73 WeakPolarHBondContact O-CB 3.41Å; M69-I73 WeakPolarHBondContact O-CG1 3.07Å; M69-I73 PolarHBondContact O-N 3.46Å; I73-K77 WeakPolarHBondContact O-CB 3.45Å; I73-K77 PolarHBondContact O-N 3.4Å
74	S	97.4	Very high	97.7	Very high	69 Å²	69	101.4 Å²	101.4	48%	0.483	50%	0.499	S	S	.	.	H	α-helix	trans	-69.2	-34.8	175.3	-59.4	0	0	0	0	112.6	V70 G71 Q72 S78	V70-S74 VanDerWaalsContact O-CB 3.26Å; V70-S74 WeakPolarHBondContact O-CB 3.45Å; V70-S74 PolarHBondContact O-N 3.41Å; V70-S74 PolarHBondContact O-OG 2.84Å; G71-S74 PolarHBondContact O-N 3.26Å; Q72-S74 PolarHBondContact O-N 3.3Å; S74-S78 WeakPolarHBondContact O-CB 3.23Å; S74-S78 PolarHBondContact O-N 2.69Å
75	F	98.4	Very high	97.7	Very high	131 Å²	131	99.9 Å²	99.9	58%	0.575	50%	0.495	S	S	*	.	H	α-helix	trans	-70.2	-50.6	174.2	176.3	-93.1	0	0	0	111.2	G71 Q72 K77 S78 Q79	G71-F75 PolarHBondContact O-N 3.01Å; Q72-F75 WeakPolarHBondContact O-CB 3.5Å; Q72-F75 PolarHBondContact O-N 3.06Å; F75-K77 VanDerWaalsContact C-N 3.3Å; F75-K77 PolarHBondContact O-N 2.91Å; F75-S78 WeakPolarHBondContact O-CB 3.31Å; F75-S78 PolarHBondContact O-N 3.23Å; F75-Q79 PolarHBondContact O-N 2.96Å
76	E	98.3	Very high	97.7	Very high	92 Å²	92	101 Å²	101	43%	0.43	50%	0.496	S	S	.	.	H	α-helix	trans	-57.3	-43.4	176.5	-70.1	163.2	174.4	0	0	111.4	Q72 Q79 A80	Q72-E76 VanDerWaalsContact CG-OE1 3.28Å; Q72-E76 WeakPolarHBondContact CG-OE1 3.32Å; Q72-E76 PolarHBondContact NE2-OE1 3.2Å; Q72-E76 WeakPolarHBondContact O-CG 3.26Å; Q72-E76 PolarHBondContact O-N 3.03Å; E76-Q79 PolarHBondContact O-N 3.23Å; E76-A80 WeakPolarHBondContact O-CB 3.49Å; E76-A80 PolarHBondContact O-N 3.21Å
77	K	97.7	Very high	97.7	Very high	122 Å²	122	101 Å²	101	53%	0.53	50%	0.496	S	S	.	.	H	α-helix	trans	-59.4	-47.9	172.2	179.7	-175.8	167.1	-174.3	0	111.7	I73 F75 Q79 A80 E81	I73-K77 WeakPolarHBondContact O-CB 3.45Å; I73-K77 PolarHBondContact O-N 3.4Å; F75-K77 VanDerWaalsContact C-N 3.3Å; F75-K77 PolarHBondContact O-N 2.91Å; K77-Q79 VanDerWaalsContact C-N 3.25Å; K77-Q79 PolarHBondContact O-N 3.22Å; K77-A80 PolarHBondContact O-N 3.08Å; K77-E81 WeakPolarHBondContact CE-OE1 3.47Å; K77-E81 WeakPolarHBondContact CE-OE2 3.33Å; K77-E81 HydrophobicContact CG-CG 4.43Å; K77-E81 IonicContact NZ-OE1 3.13Å; K77-E81 PolarHBondContact NZ-OE1 3.45Å; K77-E81 WeakPolarHBondContact O-CB 3.31Å; K77-E81 WeakPolarHBondContact O-CG 3.32Å; K77-E81 PolarHBondContact O-N 2.96Å
78	S	95.8	Very high	97.7	Very high	67 Å²	67	100 Å²	100	47%	0.469	49%	0.493	S	S	.	.	H	α-helix	trans	-65	-30.5	-179.6	-173.1	0	0	0	0	112.5	S74 F75 M82	S74-S78 WeakPolarHBondContact O-CB 3.23Å; S74-S78 PolarHBondContact O-N 2.69Å; F75-S78 WeakPolarHBondContact O-CB 3.31Å; F75-S78 PolarHBondContact O-N 3.23Å; S78-M82 PolarHBondContact O-N 2.84Å
79	Q	98.2	Very high	97.6	Very high	92 Å²	92	99.4 Å²	99.4	43%	0.43	49%	0.49	S	S	.	.	H	α-helix	trans	-69	-51.6	172.2	177.2	177.9	-19.4	0	0	110.6	F75 E76 K77 E81 M82 E83	F75-Q79 PolarHBondContact O-N 2.96Å; E76-Q79 PolarHBondContact O-N 3.23Å; K77-Q79 VanDerWaalsContact C-N 3.25Å; K77-Q79 PolarHBondContact O-N 3.22Å; Q79-E81 VanDerWaalsContact C-N 3.27Å; Q79-E81 PolarHBondContact O-N 3.38Å; Q79-M82 WeakPolarHBondContact O-CA 3.43Å; Q79-M82 WeakPolarHBondContact O-CB 3.41Å; Q79-M82 PolarHBondContact O-N 3.49Å; Q79-E83 HydrophobicContact CG-CG 4.5Å; Q79-E83 WeakPolarHBondContact CG-OE1 3.39Å; Q79-E83 PolarHBondContact NE2-OE1 3.04Å; Q79-E83 WeakPolarHBondContact O-CG 3.49Å; Q79-E83 PolarHBondContact O-N 2.97Å
80	A	96.8	Very high	97.6	Very high	53 Å²	53	97.6 Å²	97.6	44%	0.438	48%	0.481	S	S	.	.	H	α-helix	trans	-61	-33.9	177.8	0	0	0	0	0	112.9	E76 K77 R84	E76-A80 WeakPolarHBondContact O-CB 3.49Å; E76-A80 PolarHBondContact O-N 3.21Å; K77-A80 PolarHBondContact O-N 3.08Å; A80-R84 VanDerWaalsContact O-CB 3.25Å; A80-R84 WeakPolarHBondContact O-CB 3.5Å; A80-R84 PolarHBondContact O-N 3.4Å
81	E	97.3	Very high	97.5	Very high	79 Å²	79	97.1 Å²	97.1	37%	0.369	47%	0.474	S	S	.	.	H	α-helix	trans	-66.6	-36	172.7	-77.5	177.8	153.3	0	0	112.2	K77 Q79 E85	K77-E81 WeakPolarHBondContact CE-OE1 3.47Å; K77-E81 WeakPolarHBondContact CE-OE2 3.33Å; K77-E81 HydrophobicContact CG-CG 4.43Å; K77-E81 IonicContact NZ-OE1 3.13Å; K77-E81 PolarHBondContact NZ-OE1 3.45Å; K77-E81 WeakPolarHBondContact O-CB 3.31Å; K77-E81 WeakPolarHBondContact O-CG 3.32Å; K77-E81 PolarHBondContact O-N 2.96Å; Q79-E81 VanDerWaalsContact C-N 3.27Å; Q79-E81 PolarHBondContact O-N 3.38Å; E81-E85 WeakPolarHBondContact O-CG 3.47Å; E81-E85 PolarHBondContact O-N 2.98Å; E81-E85 VanDerWaalsContact O-N 3.17Å
82	M	97.2	Very high	97.5	Very high	126 Å²	126	99.6 Å²	99.6	62%	0.621	48%	0.475	S	S	*	.	H	α-helix	trans	-71.5	-41.1	174.5	-170.7	-172.6	-56.9	0	0	112.3	S78 Q79 E85 K86	S78-M82 PolarHBondContact O-N 2.84Å; Q79-M82 WeakPolarHBondContact O-CA 3.43Å; Q79-M82 WeakPolarHBondContact O-CB 3.41Å; Q79-M82 PolarHBondContact O-N 3.49Å; M82-E85 CarbonylContact O-C 3.57Å; M82-E85 PolarHBondContact O-N 3.34Å; M82-E85 VanDerWaalsContact O-N 3.13Å; M82-K86 PolarHBondContact O-N 2.98Å
83	E	97.6	Very high	97.4	Very high	94 Å²	94	98.8 Å²	98.8	44%	0.439	48%	0.477	S	S	.	.	H	α-helix	trans	-64.6	-42.8	176	-71.9	168.1	-172.9	0	0	111.1	Q79 E85 K86 L87	Q79-E83 HydrophobicContact CG-CG 4.5Å; Q79-E83 WeakPolarHBondContact CG-OE1 3.39Å; Q79-E83 PolarHBondContact NE2-OE1 3.04Å; Q79-E83 WeakPolarHBondContact O-CG 3.49Å; Q79-E83 PolarHBondContact O-N 2.97Å; E83-E85 PolarHBondContact O-N 3.47Å; E83-K86 WeakPolarHBondContact O-CB 3.38Å; E83-K86 PolarHBondContact O-N 3.32Å; E83-K86 VanDerWaalsContact O-N 3.14Å; E83-L87 WeakPolarHBondContact O-CG 3.39Å; E83-L87 PolarHBondContact O-N 3.22Å
84	R	97.6	Very high	97.2	Very high	124 Å²	124	98.2 Å²	98.2	47%	0.468	48%	0.478	S	S	.	.	H	α-helix	trans	-55.7	-38.8	169.5	-178.7	-168.3	60.6	70.6	7.8	111.8	A80 W88	A80-R84 VanDerWaalsContact O-CB 3.25Å; A80-R84 WeakPolarHBondContact O-CB 3.5Å; A80-R84 PolarHBondContact O-N 3.4Å; R84-W88 VanDerWaalsContact O-CB 3.22Å; R84-W88 WeakPolarHBondContact O-CB 3.48Å; R84-W88 PolarHBondContact O-N 3.32Å
85	E	97.6	Very high	97.2	Very high	101 Å²	101	102 Å²	102	47%	0.472	48%	0.481	S	S	.	.	H	α-helix	trans	-78.8	-23.8	178	-75.5	177.4	-169.6	0	0	114.1	E81 M82 E83 R89	E81-E85 WeakPolarHBondContact O-CG 3.47Å; E81-E85 PolarHBondContact O-N 2.98Å; E81-E85 VanDerWaalsContact O-N 3.17Å; M82-E85 CarbonylContact O-C 3.57Å; M82-E85 PolarHBondContact O-N 3.34Å; M82-E85 VanDerWaalsContact O-N 3.13Å; E83-E85 PolarHBondContact O-N 3.47Å; E85-R89 WeakPolarHBondContact O-CG 3.28Å; E85-R89 PolarHBondContact O-N 3.04Å; E85-R89 PolarHBondContact O-NE 3.12Å
86	K	97.5	Very high	96.9	Very high	83 Å²	83	98.5 Å²	98.5	36%	0.361	47%	0.474	S	S	.	.	H	α-helix	trans	-64.8	-58.9	164.3	174.8	-174.5	170.9	-171.2	0	109.6	M82 E83 W88 R89 E90 E958	M82-K86 PolarHBondContact O-N 2.98Å; E83-K86 WeakPolarHBondContact O-CB 3.38Å; E83-K86 PolarHBondContact O-N 3.32Å; E83-K86 VanDerWaalsContact O-N 3.14Å; K86-W88 VanDerWaalsContact C-N 3.3Å; K86-W88 PolarHBondContact O-N 3.43Å; K86-R89 PolarHBondContact O-N 2.92Å; K86-R89 VanDerWaalsContact O-N 3.08Å; K86-E90 WeakPolarHBondContact CE-OE1 3.3Å; K86-E90 WeakPolarHBondContact CG-OE1 3.33Å; K86-E90 WeakPolarHBondContact O-CG 3.48Å; K86-E90 PolarHBondContact O-N 3.12Å; K86-E958 IonicContact NZ-OE1 2.93Å
87	L	97.1	Very high	96.9	Very high	109 Å²	109	99.1 Å²	99.1	57%	0.571	48%	0.479	S	S	*	.	H	α-helix	trans	-59.7	-36.2	-178.3	-67	170.5	0	0	0	112.8	E83 E90 L91	E83-L87 WeakPolarHBondContact O-CG 3.39Å; E83-L87 PolarHBondContact O-N 3.22Å; L87-E90 PolarHBondContact O-N 2.93Å; L87-L91 VanDerWaalsContact O-CB 3.26Å; L87-L91 WeakPolarHBondContact O-CB 3.48Å; L87-L91 PolarHBondContact O-N 3.48Å
88	W	97.3	Very high	96.7	Very high	153 Å²	153	96.3 Å²	96.3	58%	0.58	47%	0.474	S	S	*	.	H	α-helix	trans	-67.2	-38	176.7	-173.7	89	0	0	0	112.8	R84 K86 Q92	R84-W88 VanDerWaalsContact O-CB 3.22Å; R84-W88 WeakPolarHBondContact O-CB 3.48Å; R84-W88 PolarHBondContact O-N 3.32Å; K86-W88 VanDerWaalsContact C-N 3.3Å; K86-W88 PolarHBondContact O-N 3.43Å; W88-Q92 WeakPolarHBondContact O-CB 3.43Å; W88-Q92 PolarHBondContact O-N 3.38Å
89	R	97.3	Very high	96.6	Very high	148 Å²	148	96.4 Å²	96.4	56%	0.558	48%	0.475	S	S	*	.	H	α-helix	trans	-68.2	-43.7	173.9	-75.1	176.2	-71.1	132.5	-7.1	111.3	E85 K86 Q92 T93	E85-R89 WeakPolarHBondContact O-CG 3.28Å; E85-R89 PolarHBondContact O-N 3.04Å; E85-R89 PolarHBondContact O-NE 3.12Å; K86-R89 PolarHBondContact O-N 2.92Å; K86-R89 VanDerWaalsContact O-N 3.08Å; R89-Q92 PolarHBondContact O-N 3.23Å; R89-Q92 VanDerWaalsContact O-N 3.16Å; R89-T93 PolarHBondContact O-N 3.01Å; R89-T93 PolarHBondContact O-OG1 3.36Å
90	E	97.6	Very high	96.4	Very high	82 Å²	82	96.9 Å²	96.9	38%	0.383	48%	0.477	S	S	.	.	H	α-helix	trans	-60.1	-48.8	176.8	-71.8	164.1	-179.2	0	0	110.8	K86 L87 Q92 T93 V94	K86-E90 WeakPolarHBondContact CE-OE1 3.3Å; K86-E90 WeakPolarHBondContact CG-OE1 3.33Å; K86-E90 WeakPolarHBondContact O-CG 3.48Å; K86-E90 PolarHBondContact O-N 3.12Å; L87-E90 PolarHBondContact O-N 2.93Å; E90-Q92 VanDerWaalsContact C-N 3.28Å; E90-Q92 PolarHBondContact O-N 3.25Å; E90-T93 WeakPolarHBondContact CA-OG1 3.4Å; E90-T93 PolarHBondContact O-N 2.61Å; E90-T93 VanDerWaalsContact O-N 3.1Å; E90-T93 PolarHBondContact O-OG1 2.99Å; E90-V94 WeakPolarHBondContact O-CG2 3.37Å; E90-V94 PolarHBondContact O-N 3.39Å
91	L	97.2	Very high	96.4	Very high	81 Å²	81	100.3 Å²	100.3	42%	0.424	48%	0.484	S	S	.	.	H	α-helix	trans	-56.1	-39.6	172.8	178.3	63.4	0	0	0	112.7	L87 R95	L87-L91 VanDerWaalsContact O-CB 3.26Å; L87-L91 WeakPolarHBondContact O-CB 3.48Å; L87-L91 PolarHBondContact O-N 3.48Å; L91-R95 WeakPolarHBondContact O-CB 3.48Å; L91-R95 VanDerWaalsContact O-CG 3.25Å; L91-R95 WeakPolarHBondContact O-CG 3.49Å; L91-R95 PolarHBondContact O-N 3.07Å
92	Q	96.8	Very high	96.2	Very high	93 Å²	93	101 Å²	101	44%	0.435	49%	0.494	S	S	.	.	H	α-helix	trans	-70.6	-35.8	177.7	-171.8	60.6	22.2	0	0	112.3	W88 R89 E90 R95 S96	W88-Q92 WeakPolarHBondContact O-CB 3.43Å; W88-Q92 PolarHBondContact O-N 3.38Å; R89-Q92 PolarHBondContact O-N 3.23Å; R89-Q92 VanDerWaalsContact O-N 3.16Å; E90-Q92 VanDerWaalsContact C-N 3.28Å; E90-Q92 PolarHBondContact O-N 3.25Å; Q92-R95 PolarHBondContact O-N 2.92Å; Q92-S96 PolarHBondContact O-N 3.42Å; Q92-S96 VanDerWaalsContact O-N 3.11Å
93	T	96.3	Very high	95.9	Very high	84 Å²	84	99.4 Å²	99.4	52%	0.515	49%	0.485	S	S	.	.	H	α-helix	trans	-67.4	-43.1	172.7	53	0	0	0	0	112.3	R89 E90 R95 S96 L97	R89-T93 PolarHBondContact O-N 3.01Å; R89-T93 PolarHBondContact O-OG1 3.36Å; E90-T93 WeakPolarHBondContact CA-OG1 3.4Å; E90-T93 PolarHBondContact O-N 2.61Å; E90-T93 VanDerWaalsContact O-N 3.1Å; E90-T93 PolarHBondContact O-OG1 2.99Å; T93-R95 VanDerWaalsContact C-N 3.3Å; T93-R95 PolarHBondContact O-N 2.88Å; T93-S96 WeakPolarHBondContact O-CB 3.49Å; T93-S96 PolarHBondContact O-N 2.98Å; T93-S96 VanDerWaalsContact O-N 3.12Å; T93-L97 WeakPolarHBondContact O-CG 3.47Å; T93-L97 PolarHBondContact O-N 3.49Å
94	V	94.8	Very high	95.7	Very high	80 Å²	80	97.3 Å²	97.3	49%	0.485	48%	0.484	S	S	.	.	H	α-helix	trans	-60	-41.3	174.6	172.6	0	0	0	0	110.8	E90 S96 L97 C98	E90-V94 WeakPolarHBondContact O-CG2 3.37Å; E90-V94 PolarHBondContact O-N 3.39Å; V94-S96 VanDerWaalsContact C-N 3.33Å; V94-S96 PolarHBondContact O-N 2.87Å; V94-L97 PolarHBondContact O-N 2.83Å; V94-C98 WeakPolarHBondContact O-CB 3.24Å; V94-C98 PolarHBondContact O-N 2.74Å; V94-C98 PolarHBondContact O-SG 3.33Å
95	R	95.9	Very high	95.6	Very high	147 Å²	147	95 Å²	95	56%	0.555	49%	0.485	S	S	*	.	H	α-helix	trans	-62.7	-35.7	175	-76.7	169.5	173.9	-177.2	-2.7	113.6	L91 Q92 T93 S99	L91-R95 WeakPolarHBondContact O-CB 3.48Å; L91-R95 VanDerWaalsContact O-CG 3.25Å; L91-R95 WeakPolarHBondContact O-CG 3.49Å; L91-R95 PolarHBondContact O-N 3.07Å; Q92-R95 PolarHBondContact O-N 2.92Å; T93-R95 VanDerWaalsContact C-N 3.3Å; T93-R95 PolarHBondContact O-N 2.88Å; R95-S99 WeakPolarHBondContact O-CB 3.27Å; R95-S99 PolarHBondContact O-N 2.83Å; R95-S99 VanDerWaalsContact O-N 3.1Å
96	S	93.9	Very high	95.5	Very high	59 Å²	59	96.5 Å²	96.5	41%	0.413	49%	0.487	S	S	.	.	H	α-helix	trans	-63.7	-53.7	173.2	-155.5	0	0	0	0	110.3	Q92 T93 V94 C98 S99 E100	Q92-S96 PolarHBondContact O-N 3.42Å; Q92-S96 VanDerWaalsContact O-N 3.11Å; T93-S96 WeakPolarHBondContact O-CB 3.49Å; T93-S96 PolarHBondContact O-N 2.98Å; T93-S96 VanDerWaalsContact O-N 3.12Å; V94-S96 VanDerWaalsContact C-N 3.33Å; V94-S96 PolarHBondContact O-N 2.87Å; S96-C98 VanDerWaalsContact C-N 3.34Å; S96-C98 PolarHBondContact O-N 3.02Å; S96-S99 WeakPolarHBondContact O-CA 3.38Å; S96-S99 VanDerWaalsContact O-CB 3.31Å; S96-S99 WeakPolarHBondContact O-CB 3.45Å; S96-S99 PolarHBondContact O-N 2.69Å; S96-E100 VanDerWaalsContact CB-OE1 3.3Å; S96-E100 WeakPolarHBondContact CB-OE1 3.48Å; S96-E100 WeakPolarHBondContact O-CG 3.22Å; S96-E100 PolarHBondContact O-N 3.28Å; S96-E100 PolarHBondContact OG-OE1 3.02Å
97	L	96.8	Very high	95.4	Very high	105 Å²	105	96 Å²	96	55%	0.55	49%	0.488	S	S	.	.	H	α-helix	trans	-58.8	-40.9	-179.9	-66.5	170.6	0	0	0	112.7	T93 V94 E100 Q101	T93-L97 WeakPolarHBondContact O-CG 3.47Å; T93-L97 PolarHBondContact O-N 3.49Å; V94-L97 PolarHBondContact O-N 2.83Å; L97-E100 PolarHBondContact O-N 3.09Å; L97-Q101 VanDerWaalsContact O-CB 3.28Å; L97-Q101 WeakPolarHBondContact O-CB 3.43Å; L97-Q101 PolarHBondContact O-N 2.87Å
98	C	94.8	Very high	95.3	Very high	62 Å²	62	95.9 Å²	95.9	42%	0.419	49%	0.487	S	S	.	.	H	α-helix	trans	-64.7	-38.8	173.4	-67.8	0	0	0	0	112.2	V94 S96 Q101 T102	V94-C98 WeakPolarHBondContact O-CB 3.24Å; V94-C98 PolarHBondContact O-N 2.74Å; V94-C98 PolarHBondContact O-SG 3.33Å; S96-C98 VanDerWaalsContact C-N 3.34Å; S96-C98 PolarHBondContact O-N 3.02Å; C98-Q101 PolarHBondContact O-N 3Å; C98-T102 WeakPolarHBondContact O-CG2 3.45Å; C98-T102 PolarHBondContact O-N 3.33Å; C98-T102 PolarHBondContact O-OG1 2.93Å
99	S	92.7	Very high	95.2	Very high	70 Å²	70	90.8 Å²	90.8	49%	0.49	47%	0.474	S	S	.	.	H	α-helix	trans	-63.9	-49	175.5	-168.2	0	0	0	0	110.9	R95 S96 Q101 T102 E103	R95-S99 WeakPolarHBondContact O-CB 3.27Å; R95-S99 PolarHBondContact O-N 2.83Å; R95-S99 VanDerWaalsContact O-N 3.1Å; S96-S99 WeakPolarHBondContact O-CA 3.38Å; S96-S99 VanDerWaalsContact O-CB 3.31Å; S96-S99 WeakPolarHBondContact O-CB 3.45Å; S96-S99 PolarHBondContact O-N 2.69Å; S99-Q101 VanDerWaalsContact C-N 3.32Å; S99-Q101 PolarHBondContact O-N 3.11Å; S99-T102 PolarHBondContact O-N 3.39Å; S99-T102 VanDerWaalsContact O-N 3.16Å; S99-T102 PolarHBondContact O-OG1 3.41Å; S99-E103 PolarHBondContact O-N 3.42Å
100	E	95.3	Very high	95.2	Very high	101 Å²	101	85.8 Å²	85.8	47%	0.472	47%	0.469	S	S	.	.	H	α-helix	trans	-58.8	-41.1	176.5	-68.1	157.7	-131.4	0	0	111.5	S96 L97 E103 A104	S96-E100 VanDerWaalsContact CB-OE1 3.3Å; S96-E100 WeakPolarHBondContact CB-OE1 3.48Å; S96-E100 WeakPolarHBondContact O-CG 3.22Å; S96-E100 PolarHBondContact O-N 3.28Å; S96-E100 PolarHBondContact OG-OE1 3.02Å; L97-E100 PolarHBondContact O-N 3.09Å; E100-E103 PolarHBondContact O-N 2.92Å; E100-A104 WeakPolarHBondContact O-CB 3.17Å; E100-A104 PolarHBondContact O-N 3.34Å
101	Q	95.6	Very high	95.2	Very high	126 Å²	126	88.4 Å²	88.4	59%	0.589	48%	0.481	S	S	*	.	H	α-helix	trans	-64.6	-43.9	173.8	-173.6	-176.5	7.4	0	0	112	L97 C98 S99 E103 A104 C105	L97-Q101 VanDerWaalsContact O-CB 3.28Å; L97-Q101 WeakPolarHBondContact O-CB 3.43Å; L97-Q101 PolarHBondContact O-N 2.87Å; C98-Q101 PolarHBondContact O-N 3Å; S99-Q101 VanDerWaalsContact C-N 3.32Å; S99-Q101 PolarHBondContact O-N 3.11Å; Q101-E103 VanDerWaalsContact C-N 3.29Å; Q101-E103 PolarHBondContact O-N 3.31Å; Q101-A104 PolarHBondContact O-N 3.02Å; Q101-C105 WeakPolarHBondContact O-CB 3.13Å; Q101-C105 PolarHBondContact O-N 3.11Å; Q101-C105 PolarHBondContact O-SG 3.07Å
102	T	92.5	Very high	95.2	Very high	94 Å²	94	90.3 Å²	90.3	58%	0.577	49%	0.491	S	S	*	.	H	α-helix	trans	-66.6	-31.5	177.1	57.8	0	0	0	0	112.8	C98 S99 R106	C98-T102 WeakPolarHBondContact O-CG2 3.45Å; C98-T102 PolarHBondContact O-N 3.33Å; C98-T102 PolarHBondContact O-OG1 2.93Å; S99-T102 PolarHBondContact O-N 3.39Å; S99-T102 VanDerWaalsContact O-N 3.16Å; S99-T102 PolarHBondContact O-OG1 3.41Å; T102-R106 VanDerWaalsContact O-CB 3.27Å; T102-R106 WeakPolarHBondContact O-CB 3.39Å; T102-R106 PolarHBondContact O-N 3.07Å
103	E	92.7	Very high	95.2	Very high	92 Å²	92	90.9 Å²	90.9	43%	0.43	49%	0.492	S	S	.	.	H	α-helix	trans	-66.8	-50.5	172.1	-178.2	130.3	-107.5	0	0	110.9	S99 E100 Q101 C105 R106 D107	S99-E103 PolarHBondContact O-N 3.42Å; E100-E103 PolarHBondContact O-N 2.92Å; Q101-E103 VanDerWaalsContact C-N 3.29Å; Q101-E103 PolarHBondContact O-N 3.31Å; E103-C105 PolarHBondContact O-N 3.13Å; E103-R106 WeakPolarHBondContact O-CB 3.19Å; E103-R106 PolarHBondContact O-N 3.38Å; E103-R106 VanDerWaalsContact O-N 3.16Å; E103-R106 IonicContact OE1-CZ 2.67Å; E103-R106 IonicContact OE1-NH1 3.63Å; E103-R106 PolarHBondContact OE1-NH1 2.87Å; E103-R106 IonicContact OE1-NH2 3.64Å; E103-R106 PolarHBondContact OE1-NH2 3.37Å; E103-D107 VanDerWaalsContact O-CG 3.28Å; E103-D107 PolarHBondContact O-N 3.03Å
104	A	93.4	Very high	95.3	Very high	50 Å²	50	88.2 Å²	88.2	41%	0.413	48%	0.482	S	S	.	.	H	α-helix	trans	-59.1	-44.2	175.4	0	0	0	0	0	112.8	E100 Q101 R106 D107 I108	E100-A104 WeakPolarHBondContact O-CB 3.17Å; E100-A104 PolarHBondContact O-N 3.34Å; Q101-A104 PolarHBondContact O-N 3.02Å; A104-R106 PolarHBondContact O-N 3.44Å; A104-D107 PolarHBondContact O-N 2.87Å; A104-I108 WeakPolarHBondContact O-CB 3.37Å; A104-I108 VanDerWaalsContact O-CG1 3.29Å; A104-I108 WeakPolarHBondContact O-CG1 3.24Å; A104-I108 PolarHBondContact O-N 2.71Å
105	C	94	Very high	95.4	Very high	74 Å²	74	88 Å²	88	50%	0.5	48%	0.483	S	S	.	.	H	α-helix	trans	-63.8	-37.8	175.7	-73.1	0	0	0	0	112.6	Q101 E103 S109	Q101-C105 WeakPolarHBondContact O-CB 3.13Å; Q101-C105 PolarHBondContact O-N 3.11Å; Q101-C105 PolarHBondContact O-SG 3.07Å; E103-C105 PolarHBondContact O-N 3.13Å; C105-S109 WeakPolarHBondContact O-CB 3.41Å; C105-S109 PolarHBondContact O-N 2.69Å
106	R	95.4	Very high	95.5	Very high	133 Å²	133	85.9 Å²	85.9	50%	0.502	48%	0.479	S	S	.	.	H	α-helix	trans	-63.7	-43.3	174.4	179.6	-160.5	71.3	-150	-0.1	110.9	T102 E103 A104 S109 G110	T102-R106 VanDerWaalsContact O-CB 3.27Å; T102-R106 WeakPolarHBondContact O-CB 3.39Å; T102-R106 PolarHBondContact O-N 3.07Å; E103-R106 WeakPolarHBondContact O-CB 3.19Å; E103-R106 PolarHBondContact O-N 3.38Å; E103-R106 VanDerWaalsContact O-N 3.16Å; E103-R106 IonicContact OE1-CZ 2.67Å; E103-R106 IonicContact OE1-NH1 3.63Å; E103-R106 PolarHBondContact OE1-NH1 2.87Å; E103-R106 IonicContact OE1-NH2 3.64Å; E103-R106 PolarHBondContact OE1-NH2 3.37Å; A104-R106 PolarHBondContact O-N 3.44Å; R106-S109 CarbonylContact O-C 3.56Å; R106-S109 WeakPolarHBondContact O-CB 3.4Å; R106-S109 PolarHBondContact O-N 2.66Å; R106-G110 PolarHBondContact O-N 3.26Å
107	D	95.4	Very high	95.7	Very high	74 Å²	74	88.3 Å²	88.3	40%	0.396	48%	0.484	S	S	.	.	H	α-helix	trans	-74.9	-42.9	-174	-66.4	-9.7	0	0	0	111.3	E103 A104 S109 G110 E111	E103-D107 VanDerWaalsContact O-CG 3.28Å; E103-D107 PolarHBondContact O-N 3.03Å; A104-D107 PolarHBondContact O-N 2.87Å; D107-S109 VanDerWaalsContact C-N 3.27Å; D107-S109 PolarHBondContact O-N 2.65Å; D107-G110 CarbonylContact O-C 3.53Å; D107-G110 VanDerWaalsContact O-CA 3.32Å; D107-G110 WeakPolarHBondContact O-CA 3.41Å; D107-G110 PolarHBondContact O-N 3.5Å; D107-E111 PolarHBondContact O-N 2.94Å
108	I	95.9	Very high	95.7	Very high	106 Å²	106	89.7 Å²	89.7	54%	0.544	49%	0.488	S	S	.	.	H	α-helix	trans	-58.7	-39.2	168.4	-66.7	165.9	0	0	0	110.9	A104 G110 E111 L112	A104-I108 WeakPolarHBondContact O-CB 3.37Å; A104-I108 VanDerWaalsContact O-CG1 3.29Å; A104-I108 WeakPolarHBondContact O-CG1 3.24Å; A104-I108 PolarHBondContact O-N 2.71Å; I108-G110 PolarHBondContact O-N 2.95Å; I108-E111 PolarHBondContact O-N 2.81Å; I108-L112 WeakPolarHBondContact O-CB 3.29Å; I108-L112 PolarHBondContact O-N 3.37Å
109	S	96	Very high	95.9	Very high	45 Å²	45	91.4 Å²	91.4	32%	0.315	49%	0.492	S	S	.	.	H	α-helix	trans	-69.6	-20.3	174.2	-162.2	0	0	0	0	113.1	C105 R106 D107 K113	C105-S109 WeakPolarHBondContact O-CB 3.41Å; C105-S109 PolarHBondContact O-N 2.69Å; R106-S109 CarbonylContact O-C 3.56Å; R106-S109 WeakPolarHBondContact O-CB 3.4Å; R106-S109 PolarHBondContact O-N 2.66Å; D107-S109 VanDerWaalsContact C-N 3.27Å; D107-S109 PolarHBondContact O-N 2.65Å; S109-K113 VanDerWaalsContact O-CG 3.23Å; S109-K113 WeakPolarHBondContact O-CG 3.5Å; S109-K113 PolarHBondContact O-NZ 2.91Å; S109-K113 PolarHBondContact OG-NZ 2.82Å
110	G	96.6	Very high	96.2	Very high	43 Å²	43	93.2 Å²	93.2	44%	0.443	49%	0.493	S	S	.	.	H	α-helix	trans	-76.4	-48.9	170.2	0	0	0	0	0	111.6	R106 D107 I108 K113 G114	R106-G110 PolarHBondContact O-N 3.26Å; D107-G110 CarbonylContact O-C 3.53Å; D107-G110 VanDerWaalsContact O-CA 3.32Å; D107-G110 WeakPolarHBondContact O-CA 3.41Å; D107-G110 PolarHBondContact O-N 3.5Å; I108-G110 PolarHBondContact O-N 2.95Å; G110-K113 PolarHBondContact O-N 3.23Å; G110-G114 PolarHBondContact O-N 2.72Å
111	E	97.8	Very high	96.3	Very high	138 Å²	138	93.9 Å²	93.9	65%	0.645	50%	0.496	S	S	*	.	H	α-helix	trans	-59.2	-47.4	175.9	-68.6	-177.4	167.3	0	0	111.6	D107 I108 K113 G114 C115	D107-E111 PolarHBondContact O-N 2.94Å; I108-E111 PolarHBondContact O-N 2.81Å; E111-K113 VanDerWaalsContact C-N 3.31Å; E111-K113 PolarHBondContact O-N 3.04Å; E111-G114 CarbonylContact O-C 3.56Å; E111-G114 VanDerWaalsContact O-CA 3.31Å; E111-G114 WeakPolarHBondContact O-CA 3.21Å; E111-G114 PolarHBondContact O-N 2.82Å; E111-C115 PolarHBondContact O-N 2.82Å; E111-C115 PolarHBondContact O-SG 3.44Å
112	L	96.9	Very high	96.4	Very high	120 Å²	120	90.3 Å²	90.3	63%	0.628	49%	0.488	S	S	*	.	H	α-helix	trans	-57.4	-41.8	176.9	-180	61.4	0	0	0	112.3	I108 G114 C115 E116	I108-L112 WeakPolarHBondContact O-CB 3.29Å; I108-L112 PolarHBondContact O-N 3.37Å; L112-G114 VanDerWaalsContact C-N 3.3Å; L112-G114 PolarHBondContact O-N 2.98Å; L112-C115 PolarHBondContact O-N 3.34Å; L112-E116 WeakPolarHBondContact O-CB 3.47Å; L112-E116 PolarHBondContact O-N 2.97Å
113	K	97.6	Very high	96.7	Very high	105 Å²	105	91.2 Å²	91.2	46%	0.457	49%	0.486	S	S	.	.	H	α-helix	trans	-69.7	-26.9	174.8	-71.7	-179.5	-163.6	86.1	0	112.7	S109 G110 E111 Q117	S109-K113 VanDerWaalsContact O-CG 3.23Å; S109-K113 WeakPolarHBondContact O-CG 3.5Å; S109-K113 PolarHBondContact O-NZ 2.91Å; S109-K113 PolarHBondContact OG-NZ 2.82Å; G110-K113 PolarHBondContact O-N 3.23Å; E111-K113 VanDerWaalsContact C-N 3.31Å; E111-K113 PolarHBondContact O-N 3.04Å; K113-Q117 VanDerWaalsContact O-CG 3.28Å; K113-Q117 WeakPolarHBondContact O-CG 3.16Å; K113-Q117 PolarHBondContact O-N 3.16Å; K113-Q117 VanDerWaalsContact O-N 3.15Å; K113-Q117 PolarHBondContact O-NE2 2.92Å
114	G	96.5	Very high	97	Very high	29 Å²	29	93.4 Å²	93.4	30%	0.299	49%	0.494	S	S	.	.	H	α-helix	trans	-65.6	-54.6	169.4	0	0	0	0	0	110.9	G110 E111 L112 E116 Q117 E118	G110-G114 PolarHBondContact O-N 2.72Å; E111-G114 CarbonylContact O-C 3.56Å; E111-G114 VanDerWaalsContact O-CA 3.31Å; E111-G114 WeakPolarHBondContact O-CA 3.21Å; E111-G114 PolarHBondContact O-N 2.82Å; L112-G114 VanDerWaalsContact C-N 3.3Å; L112-G114 PolarHBondContact O-N 2.98Å; G114-E116 VanDerWaalsContact C-N 3.29Å; G114-E116 PolarHBondContact O-N 3.26Å; G114-Q117 WeakPolarHBondContact O-CB 3.48Å; G114-Q117 PolarHBondContact O-N 3Å; G114-Q117 VanDerWaalsContact O-N 3.07Å; G114-E118 WeakPolarHBondContact O-CG 3.46Å; G114-E118 PolarHBondContact O-N 2.82Å
115	C	97.6	Very high	97.2	Very high	75 Å²	75	95.9 Å²	95.9	51%	0.507	50%	0.499	S	S	.	.	H	α-helix	trans	-59.2	-37.1	176.7	-63	0	0	0	0	112.6	E111 L112 E118 L119	E111-C115 PolarHBondContact O-N 2.82Å; E111-C115 PolarHBondContact O-SG 3.44Å; L112-C115 PolarHBondContact O-N 3.34Å; C115-E118 PolarHBondContact O-N 2.84Å; C115-L119 VanDerWaalsContact O-CB 3.27Å; C115-L119 WeakPolarHBondContact O-CB 3.43Å; C115-L119 PolarHBondContact O-N 3.23Å
116	E	97.9	Very high	97.4	Very high	103 Å²	103	94.5 Å²	94.5	48%	0.481	49%	0.487	S	S	.	.	H	α-helix	trans	-62.8	-45	173.4	-163.2	-160.6	155.5	0	0	111.6	L112 G114 E118 L119 Q120	L112-E116 WeakPolarHBondContact O-CB 3.47Å; L112-E116 PolarHBondContact O-N 2.97Å; G114-E116 VanDerWaalsContact C-N 3.29Å; G114-E116 PolarHBondContact O-N 3.26Å; E116-E118 PolarHBondContact O-N 2.86Å; E116-L119 PolarHBondContact O-N 3.4Å; E116-Q120 WeakPolarHBondContact O-CB 3.49Å; E116-Q120 VanDerWaalsContact O-CG 3.28Å; E116-Q120 WeakPolarHBondContact O-CG 3.27Å; E116-Q120 PolarHBondContact O-N 2.83Å; E116-Q120 PolarHBondContact OE1-NE2 3.19Å
117	Q	98.1	Very high	97.5	Very high	110 Å²	110	91.4 Å²	91.4	51%	0.514	49%	0.485	S	S	.	.	H	α-helix	trans	-65.8	-36.1	176.3	-75.6	167.7	61.1	0	0	112.5	K113 G114 Q121	K113-Q117 VanDerWaalsContact O-CG 3.28Å; K113-Q117 WeakPolarHBondContact O-CG 3.16Å; K113-Q117 PolarHBondContact O-N 3.16Å; K113-Q117 VanDerWaalsContact O-N 3.15Å; K113-Q117 PolarHBondContact O-NE2 2.92Å; G114-Q117 WeakPolarHBondContact O-CB 3.48Å; G114-Q117 PolarHBondContact O-N 3Å; G114-Q117 VanDerWaalsContact O-N 3.07Å; Q117-Q121 WeakPolarHBondContact O-CB 3.23Å; Q117-Q121 VanDerWaalsContact O-CG 3.24Å; Q117-Q121 WeakPolarHBondContact O-CG 3.24Å; Q117-Q121 PolarHBondContact O-N 2.97Å; Q117-Q121 PolarHBondContact O-NE2 3.5Å
118	E	98.2	Very high	97.6	Very high	133 Å²	133	91.8 Å²	91.8	62%	0.621	49%	0.487	S	S	*	.	H	α-helix	trans	-67.7	-41.5	173.9	-70.8	-175.9	164.2	0	0	111.4	G114 C115 E116 Q121 A122	G114-E118 WeakPolarHBondContact O-CG 3.46Å; G114-E118 PolarHBondContact O-N 2.82Å; C115-E118 PolarHBondContact O-N 2.84Å; E116-E118 PolarHBondContact O-N 2.86Å; E118-Q121 PolarHBondContact O-N 3.08Å; E118-A122 WeakPolarHBondContact O-CB 3.31Å; E118-A122 PolarHBondContact O-N 2.9Å
119	L	98.3	Very high	97.7	Very high	98 Å²	98	92 Å²	92	51%	0.513	49%	0.489	S	S	.	.	H	α-helix	trans	-63.3	-44.1	174.4	-179.6	60.9	0	0	0	111.9	C115 E116 Q121 A122 H123	C115-L119 VanDerWaalsContact O-CB 3.27Å; C115-L119 WeakPolarHBondContact O-CB 3.43Å; C115-L119 PolarHBondContact O-N 3.23Å; E116-L119 PolarHBondContact O-N 3.4Å; L119-Q121 VanDerWaalsContact C-N 3.34Å; L119-Q121 PolarHBondContact O-N 3.27Å; L119-A122 PolarHBondContact O-N 3.12Å; L119-H123 PolarHBondContact O-CD2 2.71Å; L119-H123 PolarHBondContact O-N 3.48Å
120	Q	98.3	Very high	97.8	Very high	109 Å²	109	95.2 Å²	95.2	51%	0.509	50%	0.499	S	S	.	.	H	α-helix	trans	-61.4	-40.6	174	-72	177.4	19.1	0	0	111.7	E116 K124	E116-Q120 WeakPolarHBondContact O-CB 3.49Å; E116-Q120 VanDerWaalsContact O-CG 3.28Å; E116-Q120 WeakPolarHBondContact O-CG 3.27Å; E116-Q120 PolarHBondContact O-N 2.83Å; E116-Q120 PolarHBondContact OE1-NE2 3.19Å; Q120-K124 PolarHBondContact O-N 2.65Å
121	Q	98.2	Very high	97.9	Very high	115 Å²	115	98.8 Å²	98.8	54%	0.537	50%	0.504	S	S	.	.	H	α-helix	trans	-65.2	-43	174	-76.3	169.6	89.2	0	0	112	Q117 E118 L119 K124 I125	Q117-Q121 WeakPolarHBondContact O-CB 3.23Å; Q117-Q121 VanDerWaalsContact O-CG 3.24Å; Q117-Q121 WeakPolarHBondContact O-CG 3.24Å; Q117-Q121 PolarHBondContact O-N 2.97Å; Q117-Q121 PolarHBondContact O-NE2 3.5Å; E118-Q121 PolarHBondContact O-N 3.08Å; L119-Q121 VanDerWaalsContact C-N 3.34Å; L119-Q121 PolarHBondContact O-N 3.27Å; Q121-K124 PolarHBondContact O-N 2.87Å; Q121-I125 VanDerWaalsContact O-CG1 3.31Å; Q121-I125 WeakPolarHBondContact O-CG1 3.41Å; Q121-I125 PolarHBondContact O-N 2.87Å
122	A	97.4	Very high	97.9	Very high	51 Å²	51	98.9 Å²	98.9	42%	0.421	50%	0.498	S	S	.	.	H	α-helix	trans	-63.1	-42.6	176.3	0	0	0	0	0	111.9	E118 L119 K124 I125 N126	E118-A122 WeakPolarHBondContact O-CB 3.31Å; E118-A122 PolarHBondContact O-N 2.9Å; L119-A122 PolarHBondContact O-N 3.12Å; A122-K124 VanDerWaalsContact C-N 3.35Å; A122-K124 PolarHBondContact O-N 3.38Å; A122-I125 PolarHBondContact O-N 2.84Å; A122-N126 VanDerWaalsContact O-CB 3.27Å; A122-N126 WeakPolarHBondContact O-CB 3.29Å; A122-N126 PolarHBondContact O-N 3.4Å
123	H	98.3	Very high	98	Very high	113 Å²	113	97.9 Å²	97.9	52%	0.523	49%	0.493	S	S	.	.	H	α-helix	trans	-61	-41.1	173.2	-80.3	-58.6	0	0	0	112.5	L119 N126 S127	L119-H123 PolarHBondContact O-CD2 2.71Å; L119-H123 PolarHBondContact O-N 3.48Å; H123-N126 PolarHBondContact O-N 3.1Å; H123-S127 WeakPolarHBondContact O-CB 3.45Å; H123-S127 PolarHBondContact O-N 3.08Å; H123-S127 PolarHBondContact O-OG 3.32Å
124	K	98.4	Very high	98	Very high	138 Å²	138	98.1 Å²	98.1	60%	0.6	50%	0.499	S	S	*	.	H	α-helix	trans	-63.1	-49.9	174.7	-175.8	-176.9	174.1	-175.3	0	111.6	Q120 Q121 A122 N126 S127 D128	Q120-K124 PolarHBondContact O-N 2.65Å; Q121-K124 PolarHBondContact O-N 2.87Å; A122-K124 VanDerWaalsContact C-N 3.35Å; A122-K124 PolarHBondContact O-N 3.38Å; K124-N126 VanDerWaalsContact C-N 3.3Å; K124-N126 PolarHBondContact O-N 3.47Å; K124-S127 WeakPolarHBondContact O-CB 3.47Å; K124-S127 PolarHBondContact O-N 2.94Å; K124-S127 VanDerWaalsContact O-N 3.08Å; K124-D128 PolarHBondContact O-N 2.87Å
125	I	98.1	Very high	98.1	Very high	101 Å²	101	100 Å²	100	52%	0.518	50%	0.5	S	S	.	.	H	α-helix	trans	-60	-41.4	179	-68.7	164.1	0	0	0	110.8	Q121 A122 D128 L129	Q121-I125 VanDerWaalsContact O-CG1 3.31Å; Q121-I125 WeakPolarHBondContact O-CG1 3.41Å; Q121-I125 PolarHBondContact O-N 2.87Å; A122-I125 PolarHBondContact O-N 2.84Å; I125-D128 PolarHBondContact O-N 2.91Å; I125-L129 HydrophobicContact CG2-CD1 3.96Å; I125-L129 HydrophobicContact CG2-CG 4.43Å; I125-L129 WeakPolarHBondContact O-CB 3.32Å; I125-L129 VanDerWaalsContact O-CG 3.24Å; I125-L129 WeakPolarHBondContact O-CG 3.42Å; I125-L129 PolarHBondContact O-N 3.35Å
126	N	98.2	Very high	98.1	Very high	46 Å²	46	101.6 Å²	101.6	25%	0.246	50%	0.503	C	S	.	.	H	α-helix	trans	-62.8	-41.9	175.1	-165	-23.2	0	0	0	111.4	A122 H123 K124 L129 Q130 I507	A122-N126 VanDerWaalsContact O-CB 3.27Å; A122-N126 WeakPolarHBondContact O-CB 3.29Å; A122-N126 PolarHBondContact O-N 3.4Å; H123-N126 PolarHBondContact O-N 3.1Å; K124-N126 VanDerWaalsContact C-N 3.3Å; K124-N126 PolarHBondContact O-N 3.47Å; N126-L129 PolarHBondContact O-N 2.92Å; N126-Q130 WeakPolarHBondContact O-CB 3.41Å; N126-Q130 VanDerWaalsContact O-CG 3.28Å; N126-Q130 WeakPolarHBondContact O-CG 3.14Å; N126-Q130 PolarHBondContact O-N 2.83Å; N126-Q130 PolarHBondContact OD1-NE2 3.34Å; N126-I507 WeakPolarHBondContact ND2-CD1 3.5Å
127	S	98.3	Very high	98.2	Very high	67 Å²	67	100.6 Å²	100.6	47%	0.469	50%	0.498	S	S	.	.	H	α-helix	trans	-63	-44.5	175.1	-55.1	0	0	0	0	112.5	H123 K124 L129 Q130 Q131	H123-S127 WeakPolarHBondContact O-CB 3.45Å; H123-S127 PolarHBondContact O-N 3.08Å; H123-S127 PolarHBondContact O-OG 3.32Å; K124-S127 WeakPolarHBondContact O-CB 3.47Å; K124-S127 PolarHBondContact O-N 2.94Å; K124-S127 VanDerWaalsContact O-N 3.08Å; S127-L129 VanDerWaalsContact C-N 3.33Å; S127-L129 PolarHBondContact O-N 3.32Å; S127-Q130 PolarHBondContact O-N 3.11Å; S127-Q131 PolarHBondContact O-N 3.36Å
128	D	98	Very high	98.2	Very high	82 Å²	82	98.7 Å²	98.7	44%	0.439	50%	0.497	S	S	.	.	H	α-helix	trans	-62.5	-39.8	176.1	-68.3	-24.4	0	0	0	111	K124 I125 R132	K124-D128 PolarHBondContact O-N 2.87Å; I125-D128 PolarHBondContact O-N 2.91Å; D128-R132 WeakPolarHBondContact O-CB 3.29Å; D128-R132 PolarHBondContact O-N 3.03Å
129	L	97.9	Very high	98.1	Very high	111 Å²	111	96.7 Å²	96.7	58%	0.581	49%	0.488	S	S	*	.	H	α-helix	trans	-68.1	-42	175	-73.3	170.8	0	0	0	112.7	I125 N126 S127 R132 L133	I125-L129 HydrophobicContact CG2-CD1 3.96Å; I125-L129 HydrophobicContact CG2-CG 4.43Å; I125-L129 WeakPolarHBondContact O-CB 3.32Å; I125-L129 VanDerWaalsContact O-CG 3.24Å; I125-L129 WeakPolarHBondContact O-CG 3.42Å; I125-L129 PolarHBondContact O-N 3.35Å; N126-L129 PolarHBondContact O-N 2.92Å; S127-L129 VanDerWaalsContact C-N 3.33Å; S127-L129 PolarHBondContact O-N 3.32Å; L129-R132 PolarHBondContact O-N 2.96Å; L129-R132 VanDerWaalsContact O-N 3.16Å; L129-L133 PolarHBondContact O-N 2.97Å
130	Q	98.1	Very high	98.1	Very high	112 Å²	112	99.3 Å²	99.3	52%	0.523	49%	0.492	S	S	.	.	H	α-helix	trans	-61.9	-43.2	174.2	-74	174.6	28.9	0	0	111.2	N126 S127 R132 L133 L134	N126-Q130 WeakPolarHBondContact O-CB 3.41Å; N126-Q130 VanDerWaalsContact O-CG 3.28Å; N126-Q130 WeakPolarHBondContact O-CG 3.14Å; N126-Q130 PolarHBondContact O-N 2.83Å; N126-Q130 PolarHBondContact OD1-NE2 3.34Å; S127-Q130 PolarHBondContact O-N 3.11Å; Q130-R132 VanDerWaalsContact C-N 3.28Å; Q130-R132 PolarHBondContact O-N 3.46Å; Q130-L133 PolarHBondContact O-N 2.92Å; Q130-L134 WeakPolarHBondContact O-CG 3.31Å; Q130-L134 PolarHBondContact O-N 2.77Å
131	Q	98.3	Very high	98.1	Very high	118 Å²	118	99.3 Å²	99.3	55%	0.551	49%	0.49	S	S	*	.	H	α-helix	trans	-60.5	-40.1	173.6	-165.9	-172.6	21.2	0	0	111.2	S127 L134 Q135	S127-Q131 PolarHBondContact O-N 3.36Å; Q131-L134 PolarHBondContact O-N 2.65Å; Q131-Q135 VanDerWaalsContact O-CG 3.3Å; Q131-Q135 WeakPolarHBondContact O-CG 2.89Å; Q131-Q135 PolarHBondContact O-N 3.27Å
132	R	98	Very high	98.1	Very high	140 Å²	140	101.4 Å²	101.4	53%	0.528	49%	0.493	S	S	.	.	H	α-helix	trans	-69	-34.6	177.9	-168.7	57.5	176.1	159.6	7	113	D128 L129 Q130 Q135 L136	D128-R132 WeakPolarHBondContact O-CB 3.29Å; D128-R132 PolarHBondContact O-N 3.03Å; L129-R132 PolarHBondContact O-N 2.96Å; L129-R132 VanDerWaalsContact O-N 3.16Å; Q130-R132 VanDerWaalsContact C-N 3.28Å; Q130-R132 PolarHBondContact O-N 3.46Å; R132-Q135 VanDerWaalsContact CD-OE1 3.26Å; R132-Q135 PolarHBondContact O-N 2.72Å; R132-L136 WeakPolarHBondContact O-CB 3.31Å; R132-L136 PolarHBondContact O-N 3.37Å
133	L	98.4	Very high	98.1	Very high	100 Å²	100	104.2 Å²	104.2	52%	0.524	50%	0.5	S	S	.	.	H	α-helix	trans	-64.4	-48	172.8	-172.1	158.4	0	0	0	110.7	L129 Q130 Q135 L136 E137	L129-L133 PolarHBondContact O-N 2.97Å; Q130-L133 PolarHBondContact O-N 2.92Å; L133-Q135 VanDerWaalsContact C-N 3.33Å; L133-Q135 PolarHBondContact O-N 3.45Å; L133-L136 PolarHBondContact O-N 2.79Å; L133-L136 VanDerWaalsContact O-N 3.13Å; L133-E137 HydrophobicContact CD2-CG 4.21Å; L133-E137 PolarHBondContact O-N 2.96Å
134	L	98.2	Very high	98.1	Very high	110 Å²	110	102.8 Å²	102.8	58%	0.576	49%	0.494	S	S	*	.	H	α-helix	trans	-62.2	-37.5	176.6	-69.6	171.2	0	0	0	112.7	Q130 Q131 S138	Q130-L134 WeakPolarHBondContact O-CG 3.31Å; Q130-L134 PolarHBondContact O-N 2.77Å; Q131-L134 PolarHBondContact O-N 2.65Å; L134-S138 PolarHBondContact O-N 2.93Å; L134-S138 VanDerWaalsContact O-N 3.07Å
135	Q	98.3	Very high	98.1	Very high	68 Å²	68	99.3 Å²	99.3	32%	0.318	48%	0.482	S	S	.	.	H	α-helix	trans	-59.2	-51.1	170.4	-74.3	168.9	13.1	0	0	111	Q131 R132 L133 E137 S138 E139	Q131-Q135 VanDerWaalsContact O-CG 3.3Å; Q131-Q135 WeakPolarHBondContact O-CG 2.89Å; Q131-Q135 PolarHBondContact O-N 3.27Å; R132-Q135 VanDerWaalsContact CD-OE1 3.26Å; R132-Q135 PolarHBondContact O-N 2.72Å; L133-Q135 VanDerWaalsContact C-N 3.33Å; L133-Q135 PolarHBondContact O-N 3.45Å; Q135-E137 PolarHBondContact O-N 3.36Å; Q135-S138 PolarHBondContact O-N 3.47Å; Q135-S138 VanDerWaalsContact O-N 3.07Å; Q135-S138 PolarHBondContact O-OG 3.02Å; Q135-E139 PolarHBondContact O-N 3.44Å
136	L	98.2	Very high	98	Very high	108 Å²	108	96.4 Å²	96.4	57%	0.565	47%	0.473	S	S	*	.	H	α-helix	trans	-64.4	-37.9	-177.7	-170.5	65.6	0	0	0	112.4	R132 L133 S138 E139 Y140	R132-L136 WeakPolarHBondContact O-CB 3.31Å; R132-L136 PolarHBondContact O-N 3.37Å; L133-L136 PolarHBondContact O-N 2.79Å; L133-L136 VanDerWaalsContact O-N 3.13Å; L136-S138 VanDerWaalsContact C-N 3.35Å; L136-E139 PolarHBondContact O-N 3.08Å; L136-Y140 WeakPolarHBondContact O-CB 3.38Å; L136-Y140 PolarHBondContact O-N 2.94Å
137	E	98.4	Very high	97.9	Very high	83 Å²	83	99.5 Å²	99.5	39%	0.388	49%	0.486	S	S	.	.	H	α-helix	trans	-59.8	-42.7	170	-86.1	-161.7	-155.2	0	0	112.5	L133 Q135 E139 Y140 K141	L133-E137 HydrophobicContact CD2-CG 4.21Å; L133-E137 PolarHBondContact O-N 2.96Å; Q135-E137 PolarHBondContact O-N 3.36Å; E137-E139 VanDerWaalsContact C-N 3.34Å; E137-Y140 PolarHBondContact O-N 3.36Å; E137-K141 WeakPolarHBondContact O-CB 3.27Å; E137-K141 WeakPolarHBondContact O-CD 3.45Å; E137-K141 VanDerWaalsContact O-CG 3.31Å; E137-K141 WeakPolarHBondContact O-CG 3.26Å; E137-K141 PolarHBondContact O-N 3.14Å; E137-K141 IonicContact OE2-NZ 2.72Å; E137-K141 PolarHBondContact OE2-NZ 3.27Å
138	S	97.8	Very high	97.9	Very high	70 Å²	70	101.9 Å²	101.9	49%	0.49	48%	0.484	S	S	.	.	H	α-helix	trans	-67.4	-36.8	179.3	79.8	0	0	0	0	111.8	L134 Q135 L136 R142	L134-S138 PolarHBondContact O-N 2.93Å; L134-S138 VanDerWaalsContact O-N 3.07Å; Q135-S138 PolarHBondContact O-N 3.47Å; Q135-S138 VanDerWaalsContact O-N 3.07Å; Q135-S138 PolarHBondContact O-OG 3.02Å; L136-S138 VanDerWaalsContact C-N 3.35Å; S138-R142 VanDerWaalsContact O-CB 3.23Å; S138-R142 WeakPolarHBondContact O-CB 3.48Å; S138-R142 PolarHBondContact O-N 2.87Å
139	E	97.9	Very high	97.8	Very high	91 Å²	91	104.5 Å²	104.5	43%	0.425	49%	0.494	S	S	.	.	H	α-helix	trans	-67.3	-42	173.3	-72.4	-178.4	-169.2	0	0	111.7	Q135 L136 E137 R142 L143	Q135-E139 PolarHBondContact O-N 3.44Å; L136-E139 PolarHBondContact O-N 3.08Å; E137-E139 VanDerWaalsContact C-N 3.34Å; E139-R142 PolarHBondContact O-N 3.02Å; E139-L143 WeakPolarHBondContact O-CB 3.31Å; E139-L143 PolarHBondContact O-N 3.47Å
140	Y	97.8	Very high	97.7	Very high	153 Å²	153	105 Å²	105	60%	0.6	49%	0.493	S	S	*	.	H	α-helix	trans	-60.9	-52	174.6	177.5	-90.4	0	0	0	111.5	L136 E137 R142 L143 E144	L136-Y140 WeakPolarHBondContact O-CB 3.38Å; L136-Y140 PolarHBondContact O-N 2.94Å; E137-Y140 PolarHBondContact O-N 3.36Å; Y140-R142 VanDerWaalsContact C-N 3.33Å; Y140-R142 PolarHBondContact O-N 3.26Å; Y140-L143 PolarHBondContact O-N 3.5Å; Y140-L143 VanDerWaalsContact O-N 3.07Å; Y140-E144 PolarHBondContact O-N 2.76Å
141	K	98.1	Very high	97.6	Very high	108 Å²	108	101.5 Å²	101.5	47%	0.47	48%	0.479	S	S	.	.	H	α-helix	trans	-58.6	-44.1	178.4	-73.9	161.1	179.2	162.2	0	111.1	E137 L143 E144 D145	E137-K141 WeakPolarHBondContact O-CB 3.27Å; E137-K141 WeakPolarHBondContact O-CD 3.45Å; E137-K141 VanDerWaalsContact O-CG 3.31Å; E137-K141 WeakPolarHBondContact O-CG 3.26Å; E137-K141 PolarHBondContact O-N 3.14Å; E137-K141 IonicContact OE2-NZ 2.72Å; E137-K141 PolarHBondContact OE2-NZ 3.27Å; K141-L143 VanDerWaalsContact C-N 3.34Å; K141-L143 PolarHBondContact O-N 3.17Å; K141-E144 PolarHBondContact O-N 3.47Å; K141-D145 WeakPolarHBondContact O-CB 3.19Å; K141-D145 PolarHBondContact O-N 3.37Å
142	R	97.7	Very high	97.4	Very high	159 Å²	159	97.7 Å²	97.7	60%	0.6	47%	0.468	S	S	*	.	H	α-helix	trans	-61.8	-37.7	174.5	-173.5	-169	63.7	71.8	1.8	112.8	S138 E139 Y140 A146	S138-R142 VanDerWaalsContact O-CB 3.23Å; S138-R142 WeakPolarHBondContact O-CB 3.48Å; S138-R142 PolarHBondContact O-N 2.87Å; E139-R142 PolarHBondContact O-N 3.02Å; Y140-R142 VanDerWaalsContact C-N 3.33Å; Y140-R142 PolarHBondContact O-N 3.26Å; R142-A146 VanDerWaalsContact O-CB 3.31Å; R142-A146 WeakPolarHBondContact O-CB 3.45Å; R142-A146 PolarHBondContact O-N 3.36Å
143	L	98.1	Very high	97.3	Very high	110 Å²	110	98.8 Å²	98.8	58%	0.576	48%	0.477	S	S	*	.	H	α-helix	trans	-73.7	-40.2	178.4	-174.8	64.1	0	0	0	111.8	E139 Y140 K141 A146 H147	E139-L143 WeakPolarHBondContact O-CB 3.31Å; E139-L143 PolarHBondContact O-N 3.47Å; Y140-L143 PolarHBondContact O-N 3.5Å; Y140-L143 VanDerWaalsContact O-N 3.07Å; K141-L143 VanDerWaalsContact C-N 3.34Å; K141-L143 PolarHBondContact O-N 3.17Å; L143-A146 PolarHBondContact O-N 2.96Å; L143-H147 WeakPolarHBondContact O-CB 3.36Å; L143-H147 PolarHBondContact O-N 2.92Å
144	E	98.1	Very high	97	Very high	83 Å²	83	98.8 Å²	98.8	39%	0.388	48%	0.477	S	S	.	.	H	α-helix	trans	-63.2	-46	174.2	-157.8	-137.3	139.7	0	0	110.6	Y140 K141 A146 H147 R148	Y140-E144 PolarHBondContact O-N 2.76Å; K141-E144 PolarHBondContact O-N 3.47Å; E144-A146 PolarHBondContact O-N 3.34Å; E144-H147 PolarHBondContact O-N 3.21Å; E144-R148 WeakPolarHBondContact O-CB 3.36Å; E144-R148 PolarHBondContact O-N 2.67Å; E144-R148 IonicContact OE1-CZ 3.36Å; E144-R148 IonicContact OE1-NE 2.64Å; E144-R148 IonicContact OE1-NH2 3.19Å; E144-R148 PolarHBondContact OE1-NH2 3.02Å; E144-R148 IonicContact OE2-NH2 3.32Å; E144-R148 PolarHBondContact OE2-NH2 2.99Å
145	D	97.4	Very high	96.7	Very high	66 Å²	66	102.1 Å²	102.1	35%	0.353	48%	0.482	S	S	.	.	H	α-helix	trans	-58.8	-46.7	173.4	-78.3	-19.5	0	0	0	111.5	K141 H147 R148 H149	K141-D145 WeakPolarHBondContact O-CB 3.19Å; K141-D145 PolarHBondContact O-N 3.37Å; D145-H147 PolarHBondContact O-N 2.86Å; D145-R148 WeakPolarHBondContact O-CB 3.26Å; D145-R148 PolarHBondContact O-N 3.28Å; D145-R148 IonicContact OD1-CZ 2.67Å; D145-R148 IonicContact OD1-NH1 2.71Å; D145-R148 PolarHBondContact OD1-NH1 3.14Å; D145-R148 IonicContact OD1-NH2 3.51Å; D145-R148 PolarHBondContact OD1-NH2 3.1Å; D145-H149 PolarHBondContact O-N 2.83Å; D145-H149 PolarHBondContact O-ND1 2.9Å
146	A	97.2	Very high	96.2	Very high	39 Å²	39	105.5 Å²	105.5	32%	0.322	50%	0.497	S	S	.	.	H	α-helix	trans	-59.3	-46.4	177	0	0	0	0	0	111.5	R142 L143 E144 R148 H149 E150	R142-A146 VanDerWaalsContact O-CB 3.31Å; R142-A146 WeakPolarHBondContact O-CB 3.45Å; R142-A146 PolarHBondContact O-N 3.36Å; L143-A146 PolarHBondContact O-N 2.96Å; E144-A146 PolarHBondContact O-N 3.34Å; A146-R148 VanDerWaalsContact C-N 3.32Å; A146-R148 PolarHBondContact O-N 2.99Å; A146-H149 PolarHBondContact O-N 2.89Å; A146-E150 WeakPolarHBondContact O-CG 3.31Å; A146-E150 PolarHBondContact O-N 2.87Å
147	H	96.8	Very high	95.7	Very high	112 Å²	112	104.8 Å²	104.8	52%	0.519	49%	0.491	S	S	.	.	H	α-helix	trans	-62.9	-36.9	175.3	-175.6	69	0	0	0	112.5	L143 E144 D145 E150 T151	L143-H147 WeakPolarHBondContact O-CB 3.36Å; L143-H147 PolarHBondContact O-N 2.92Å; E144-H147 PolarHBondContact O-N 3.21Å; D145-H147 PolarHBondContact O-N 2.86Å; H147-E150 PolarHBondContact O-N 3.07Å; H147-T151 WeakPolarHBondContact NE2-CG2 3.44Å; H147-T151 WeakPolarHBondContact O-CB 3.46Å; H147-T151 WeakPolarHBondContact O-CG2 3.23Å; H147-T151 PolarHBondContact O-N 3.48Å; H147-T151 PolarHBondContact O-OG1 3.07Å
148	R	97	Very high	95.1	Very high	116 Å²	116	105.4 Å²	105.4	44%	0.438	50%	0.5	S	S	.	.	H	α-helix	trans	-65.2	-38.1	175.2	-148.5	-176.9	-55.5	118.1	-0.6	111.5	E144 D145 A146 T151 A152	E144-R148 WeakPolarHBondContact O-CB 3.36Å; E144-R148 PolarHBondContact O-N 2.67Å; E144-R148 IonicContact OE1-CZ 3.36Å; E144-R148 IonicContact OE1-NE 2.64Å; E144-R148 IonicContact OE1-NH2 3.19Å; E144-R148 PolarHBondContact OE1-NH2 3.02Å; E144-R148 IonicContact OE2-NH2 3.32Å; E144-R148 PolarHBondContact OE2-NH2 2.99Å; D145-R148 WeakPolarHBondContact O-CB 3.26Å; D145-R148 PolarHBondContact O-N 3.28Å; D145-R148 IonicContact OD1-CZ 2.67Å; D145-R148 IonicContact OD1-NH1 2.71Å; D145-R148 PolarHBondContact OD1-NH1 3.14Å; D145-R148 IonicContact OD1-NH2 3.51Å; D145-R148 PolarHBondContact OD1-NH2 3.1Å; A146-R148 VanDerWaalsContact C-N 3.32Å; A146-R148 PolarHBondContact O-N 2.99Å; R148-T151 PolarHBondContact O-OG1 2.88Å; R148-A152 VanDerWaalsContact O-CB 3.23Å; R148-A152 WeakPolarHBondContact O-CB 3.4Å; R148-A152 PolarHBondContact O-N 2.95Å
149	H	96.4	Very high	94.2	Very high	138 Å²	138	108.9 Å²	108.9	64%	0.639	51%	0.509	S	S	*	.	H	α-helix	trans	-69.9	-42.1	173.4	-73.4	85.8	0	0	0	112.4	D145 A146 A152 K153	D145-H149 PolarHBondContact O-N 2.83Å; D145-H149 PolarHBondContact O-ND1 2.9Å; A146-H149 PolarHBondContact O-N 2.89Å; H149-A152 PolarHBondContact O-N 2.85Å; H149-K153 VanDerWaalsContact O-CB 3.31Å; H149-K153 WeakPolarHBondContact O-CB 3.44Å; H149-K153 PolarHBondContact O-N 3.11Å
150	E	95.9	Very high	93.1	Very high	122 Å²	122	108.6 Å²	108.6	57%	0.57	52%	0.517	S	S	*	.	H	α-helix	trans	-66.3	-45.3	177.5	-74.3	-172.5	161.1	0	0	112.4	A146 H147 A152 K153 L154	A146-E150 WeakPolarHBondContact O-CG 3.31Å; A146-E150 PolarHBondContact O-N 2.87Å; H147-E150 PolarHBondContact O-N 3.07Å; E150-A152 VanDerWaalsContact C-N 3.33Å; E150-A152 PolarHBondContact O-N 3.47Å; E150-K153 WeakPolarHBondContact O-CB 3.18Å; E150-K153 PolarHBondContact O-N 3.19Å; E150-L154 WeakPolarHBondContact O-CB 3.23Å; E150-L154 WeakPolarHBondContact O-CG 3.19Å; E150-L154 PolarHBondContact O-N 3.05Å
151	T	95.1	Very high	91.8	Very high	37 Å²	37	110.1 Å²	110.1	23%	0.227	52%	0.521	C	S	.	.	H	α-helix	trans	-65.1	-36.5	175.5	52.3	0	0	0	0	111.9	H147 R148 R155	H147-T151 WeakPolarHBondContact NE2-CG2 3.44Å; H147-T151 WeakPolarHBondContact O-CB 3.46Å; H147-T151 WeakPolarHBondContact O-CG2 3.23Å; H147-T151 PolarHBondContact O-N 3.48Å; H147-T151 PolarHBondContact O-OG1 3.07Å; R148-T151 PolarHBondContact O-OG1 2.88Å; T151-R155 WeakPolarHBondContact O-CB 3.28Å; T151-R155 VanDerWaalsContact O-CG 3.25Å; T151-R155 WeakPolarHBondContact O-CG 3.46Å; T151-R155 PolarHBondContact O-N 3.48Å
152	A	94.4	Very high	89.6	Confident	39 Å²	39	110 Å²	110	32%	0.322	53%	0.53	S	S	.	.	H	α-helix	trans	-63.2	-44.2	170.4	0	0	0	0	0	112.1	R148 H149 E150 R155 H156	R148-A152 VanDerWaalsContact O-CB 3.23Å; R148-A152 WeakPolarHBondContact O-CB 3.4Å; R148-A152 PolarHBondContact O-N 2.95Å; H149-A152 PolarHBondContact O-N 2.85Å; E150-A152 VanDerWaalsContact C-N 3.33Å; E150-A152 PolarHBondContact O-N 3.47Å; A152-R155 PolarHBondContact O-N 3.19Å; A152-H156 PolarHBondContact O-N 2.76Å; A152-H156 PolarHBondContact O-ND1 3.47Å
153	K	95.3	Very high	87.5	Confident	163 Å²	163	107.2 Å²	107.2	71%	0.709	53%	0.53	S	S	*	.	H	α-helix	trans	-62.7	-42.8	176.7	-178.9	-177	177.1	-174.3	0	111.9	H149 E150 H156 Q157	H149-K153 VanDerWaalsContact O-CB 3.31Å; H149-K153 WeakPolarHBondContact O-CB 3.44Å; H149-K153 PolarHBondContact O-N 3.11Å; E150-K153 WeakPolarHBondContact O-CB 3.18Å; E150-K153 PolarHBondContact O-N 3.19Å; K153-H156 PolarHBondContact O-N 2.93Å; K153-Q157 WeakPolarHBondContact O-CB 3.45Å; K153-Q157 PolarHBondContact O-N 3.13Å
154	L	93.4	Very high	85.1	Confident	100 Å²	100	106.8 Å²	106.8	52%	0.524	53%	0.534	S	S	.	.	H	α-helix	trans	-65.5	-41.1	175.5	-73	169.9	0	0	0	111.7	E150 Q157 V158	E150-L154 WeakPolarHBondContact O-CB 3.23Å; E150-L154 WeakPolarHBondContact O-CG 3.19Å; E150-L154 PolarHBondContact O-N 3.05Å; L154-Q157 PolarHBondContact O-N 2.98Å; L154-V158 WeakPolarHBondContact O-CG2 3.31Å; L154-V158 PolarHBondContact O-N 3.18Å
155	R	90.8	Very high	82.8	Confident	180 Å²	180	110.8 Å²	110.8	68%	0.679	56%	0.556	S	S	*	*	H	α-helix	trans	-59.2	-48.8	172.7	-75.2	170.2	-175.9	171	3.4	111.6	T151 A152 Q157 V158 E159	T151-R155 WeakPolarHBondContact O-CB 3.28Å; T151-R155 VanDerWaalsContact O-CG 3.25Å; T151-R155 WeakPolarHBondContact O-CG 3.46Å; T151-R155 PolarHBondContact O-N 3.48Å; A152-R155 PolarHBondContact O-N 3.19Å; R155-Q157 VanDerWaalsContact C-N 3.29Å; R155-Q157 PolarHBondContact O-N 3.43Å; R155-V158 PolarHBondContact O-N 3.34Å; R155-E159 WeakPolarHBondContact O-CB 3.24Å; R155-E159 PolarHBondContact O-N 3Å
156	H	88.6	Confident	80.2	Confident	138 Å²	138	114.3 Å²	114.3	64%	0.639	57%	0.574	S	S	*	*	H	α-helix	trans	-60.7	-36.8	174.4	-74.9	83.4	0	0	0	112.5	A152 K153 E159 S160	A152-H156 PolarHBondContact O-N 2.76Å; A152-H156 PolarHBondContact O-ND1 3.47Å; K153-H156 PolarHBondContact O-N 2.93Å; H156-E159 PolarHBondContact O-N 3.08Å; H156-S160 WeakPolarHBondContact O-CB 3.42Å; H156-S160 PolarHBondContact O-N 2.84Å; H156-S160 PolarHBondContact O-OG 3.15Å
157	Q	88.4	Confident	77.8	Confident	93 Å²	93	117.8 Å²	117.8	44%	0.435	59%	0.591	S	S	.	*	H	α-helix	trans	-68	-39.1	176.4	-167.1	178	42.1	0	0	112	K153 L154 R155 S160 R161	K153-Q157 WeakPolarHBondContact O-CB 3.45Å; K153-Q157 PolarHBondContact O-N 3.13Å; L154-Q157 PolarHBondContact O-N 2.98Å; R155-Q157 VanDerWaalsContact C-N 3.29Å; R155-Q157 PolarHBondContact O-N 3.43Å; Q157-S160 WeakPolarHBondContact CA-OG 3.49Å; Q157-S160 PolarHBondContact O-OG 3.44Å; Q157-R161 WeakPolarHBondContact O-CG 3.37Å; Q157-R161 PolarHBondContact O-N 2.97Å
158	V	85.2	Confident	75.1	Confident	96 Å²	96	121.4 Å²	121.4	58%	0.582	61%	0.608	S	S	*	*	H	α-helix	trans	-63.1	-50.3	171.5	170.9	0	0	0	0	110.4	L154 R155 S160 R161 V162	L154-V158 WeakPolarHBondContact O-CG2 3.31Å; L154-V158 PolarHBondContact O-N 3.18Å; R155-V158 PolarHBondContact O-N 3.34Å; V158-S160 VanDerWaalsContact C-N 3.32Å; V158-S160 PolarHBondContact O-N 3.47Å; V158-R161 CarbonylContact O-C 3.49Å; V158-R161 WeakPolarHBondContact O-CA 3.49Å; V158-R161 WeakPolarHBondContact O-CB 3.16Å; V158-R161 PolarHBondContact O-N 3.42Å; V158-V162 WeakPolarHBondContact O-CG2 3.45Å; V158-V162 PolarHBondContact O-N 2.98Å; V158-V162 VanDerWaalsContact O-N 3.09Å
159	E	78.1	Confident	72.2	Confident	144 Å²	144	121 Å²	121	67%	0.673	62%	0.618	S	S	*	*	H	α-helix	trans	-53.2	-48	177.2	-156.5	76.1	-131	0	0	111.1	R155 H156 R161 V162	R155-E159 WeakPolarHBondContact O-CB 3.24Å; R155-E159 PolarHBondContact O-N 3Å; H156-E159 PolarHBondContact O-N 3.08Å; E159-R161 PolarHBondContact O-N 2.99Å; E159-V162 PolarHBondContact O-N 3.34Å
160	S	75.3	Confident	69.4	Low	84 Å²	84	125.7 Å²	125.7	59%	0.587	63%	0.632	S	S	*	*	H	α-helix	trans	-64.7	-18.6	176.4	73.3	0	0	0	0	114.6	H156 Q157 V158	H156-S160 WeakPolarHBondContact O-CB 3.42Å; H156-S160 PolarHBondContact O-N 2.84Å; H156-S160 PolarHBondContact O-OG 3.15Å; Q157-S160 WeakPolarHBondContact CA-OG 3.49Å; Q157-S160 PolarHBondContact O-OG 3.44Å; V158-S160 VanDerWaalsContact C-N 3.32Å; V158-S160 PolarHBondContact O-N 3.47Å
161	R	69.6	Low	66.9	Low	185 Å²	185	127.6 Å²	127.6	70%	0.698	64%	0.641	S	S	*	*	H	α-helix	trans	-93.9	-7.4	174.2	-74.3	176	173.6	-165.6	-0.6	112.9	Q157 V158 E159 V163	Q157-R161 WeakPolarHBondContact O-CG 3.37Å; Q157-R161 PolarHBondContact O-N 2.97Å; V158-R161 CarbonylContact O-C 3.49Å; V158-R161 WeakPolarHBondContact O-CA 3.49Å; V158-R161 WeakPolarHBondContact O-CB 3.16Å; V158-R161 PolarHBondContact O-N 3.42Å; E159-R161 PolarHBondContact O-N 2.99Å; R161-V163 PolarHBondContact O-N 2.85Å
162	V	52.6	Low	64.7	Low	106 Å²	106	128.6 Å²	128.6	64%	0.642	66%	0.659	S	S	*	*			trans	-78.3	60.8	168.7	-169.8	0	0	0	0	109.9	V158 E159	V158-V162 WeakPolarHBondContact O-CG2 3.45Å; V158-V162 PolarHBondContact O-N 2.98Å; V158-V162 VanDerWaalsContact O-N 3.09Å; E159-V162 PolarHBondContact O-N 3.34Å
163	V	54	Low	62.4	Low	100 Å²	100	132.8 Å²	132.8	61%	0.606	68%	0.682	S	S	*	*			trans	-88.4	135.7	160	178.7	0	0	0	0	106.7	R161 I165	R161-V163 PolarHBondContact O-N 2.85Å; V163-I165 PolarHBondContact O-N 3.01Å
164	P	48.3	Very low	60.3	Low	101 Å²	101	129.3 Å²	129.3	66%	0.656	68%	0.677	S	S	*	*			trans	-56.7	126.3	177.1	22.5	-33.7	0	0	0	110.7	I166	P164-I166 VanDerWaalsContact C-N 3.28Å; P164-I166 PolarHBondContact O-N 2.93Å
165	I	49	Very low	58.6	Low	168 Å²	168	131.5 Å²	131.5	86%	0.862	69%	0.694	S	S	*	*			trans	-73.7	80.7	-173.6	-54.7	177	0	0	0	110	V163 T167	V163-I165 PolarHBondContact O-N 3.01Å; I165-T167 PolarHBondContact O-N 3.39Å; I165-T167 VanDerWaalsContact O-N 3.15Å
166	I	43.1	Very low	57	Low	140 Å²	140	127.2 Å²	127.2	72%	0.718	69%	0.687	S	S	*	*			trans	-82.1	89.3	170.4	-60.2	179.4	0	0	0	108.2	P164 Q168	P164-I166 VanDerWaalsContact C-N 3.28Å; P164-I166 PolarHBondContact O-N 2.93Å; I166-Q168 PolarHBondContact O-N 3.28Å
167	T	46.8	Very low	55.8	Low	112 Å²	112	122.7 Å²	122.7	69%	0.687	67%	0.671	S	S	*	*			trans	37.1	76.5	153.6	59.2	0	0	0	0	116.4	I165 T169	I165-T167 PolarHBondContact O-N 3.39Å; I165-T167 VanDerWaalsContact O-N 3.15Å; T167-T169 PolarHBondContact O-N 2.93Å
168	Q	39	Very low	54.6	Low	188 Å²	188	123.2 Å²	123.2	88%	0.879	68%	0.68	S	S	*	*			trans	-70.9	108	155	-76.7	-169.7	-6.1	0	0	108.7	I166 Y170	I166-Q168 PolarHBondContact O-N 3.28Å; Q168-Y170 PolarHBondContact O-N 3.22Å
169	T	37.3	Very low	54	Low	106 Å²	106	124.2 Å²	124.2	65%	0.65	68%	0.679	S	S	*	*			trans	-66	125	172.2	36.3	0	0	0	0	110.2	T167 H171	T167-T169 PolarHBondContact O-N 2.93Å; T169-H171 PolarHBondContact O-N 3.41Å
170	Y	37.6	Very low	54	Low	237 Å²	237	121.8 Å²	121.8	93%	0.929	67%	0.667	S	S	*	*			trans	-58.9	99.6	165.7	-88.1	-95.8	0	0	0	109.6	Q168	Q168-Y170 PolarHBondContact O-N 3.22Å
171	H	41.9	Very low	54	Low	163 Å²	163	122 Å²	122	76%	0.755	67%	0.665	S	S	*	*	P	Polyproline II helix	trans	-76.3	134.5	159	-80.2	-87	0	0	0	108.5	T169	T169-H171 PolarHBondContact O-N 3.41Å
172	G	49.3	Very low	54.5	Low	58 Å²	58	119.3 Å²	119.3	60%	0.598	66%	0.66	S	S	*	*	P	Polyproline II helix	trans	-62.1	162.8	173.4	0	0	0	0	0	111.7
173	P	47.6	Very low	55.9	Low	126 Å²	126	119.5 Å²	119.5	82%	0.818	65%	0.654	S	S	*	*	P	Polyproline II helix	trans	-57.2	133	-173.3	23.7	-34.2	0	0	0	111.2
174	P	51.4	Low	57.4	Low	91 Å²	91	123 Å²	123	59%	0.591	66%	0.658	S	S	*	*	P	Polyproline II helix	trans	-64.8	164.2	171.1	30	-34.7	0	0	0	110.4	V176	P174-V176 PolarHBondContact O-N 3.48Å
175	V	57.2	Low	59.1	Low	146 Å²	146	120.9 Å²	120.9	89%	0.885	65%	0.649	S	S	*	*			trans	-68.5	105.1	168.3	177.3	0	0	0	0	107.2	S177	V175-S177 PolarHBondContact O-N 2.88Å
176	V	57.7	Low	60.9	Low	90 Å²	90	118.7 Å²	118.7	55%	0.545	63%	0.629	S	S	.	*			trans	-52.8	124.4	-173	-172.9	0	0	0	0	110.3	P174 E180 V181	P174-V176 PolarHBondContact O-N 3.48Å; V176-E180 VanDerWaalsContact CA-OE2 3.25Å; V176-E180 WeakPolarHBondContact CA-OE2 3.31Å; V176-E180 HydrophobicContact CG1-CB 3.77Å; V176-V181 HydrophobicContact CG1-CG2 3.72Å
177	S	62.9	Low	63	Low	43 Å²	43	113.7 Å²	113.7	30%	0.301	61%	0.613	S	S	.	*			trans	-78	161.5	-179.4	97.3	0	0	0	0	111.1	V175 E179 E180 V181	V175-S177 PolarHBondContact O-N 2.88Å; S177-E179 WeakPolarHBondContact CB-OE2 3.24Å; S177-E179 PolarHBondContact O-N 3.07Å; S177-E179 PolarHBondContact OG-N 2.95Å; S177-E179 PolarHBondContact OG-OE2 2.83Å; S177-E180 PolarHBondContact N-OE2 3.15Å; S177-E180 PolarHBondContact O-N 3.18Å; S177-E180 PolarHBondContact OG-N 2.99Å; S177-V181 PolarHBondContact O-N 2.99Å
178	V	62.5	Low	65	Low	103 Å²	103	112.7 Å²	112.7	62%	0.624	60%	0.603	S	S	*	*	H	α-helix	trans	-64.9	-31.4	180	177.9	0	0	0	0	110.6	V181 Q182	V178-V181 PolarHBondContact O-N 3.12Å; V178-Q182 WeakPolarHBondContact O-CG 3.47Å; V178-Q182 PolarHBondContact O-N 3.28Å
179	E	73.8	Confident	67.4	Low	118 Å²	118	106.5 Å²	106.5	55%	0.551	58%	0.58	S	S	*	*	H	α-helix	trans	-63.3	-48.1	174.2	-56.6	72.9	-162.6	0	0	111.2	S177 V181 Q182 E183	S177-E179 WeakPolarHBondContact CB-OE2 3.24Å; S177-E179 PolarHBondContact O-N 3.07Å; S177-E179 PolarHBondContact OG-N 2.95Å; S177-E179 PolarHBondContact OG-OE2 2.83Å; E179-V181 VanDerWaalsContact C-N 3.3Å; E179-V181 PolarHBondContact O-N 2.89Å; E179-Q182 CarbonylContact O-C 3.46Å; E179-Q182 WeakPolarHBondContact O-CA 3.36Å; E179-Q182 WeakPolarHBondContact O-CB 3.45Å; E179-Q182 PolarHBondContact O-N 3.16Å; E179-E183 WeakPolarHBondContact O-CG 3.39Å; E179-E183 PolarHBondContact O-N 2.87Å
180	E	76.1	Confident	70	Confident	92 Å²	92	105.8 Å²	105.8	43%	0.43	57%	0.569	S	S	.	*	H	α-helix	trans	-60.6	-37.4	178.1	-68	175.9	141.5	0	0	112.4	V176 S177 E183 Y184	V176-E180 VanDerWaalsContact CA-OE2 3.25Å; V176-E180 WeakPolarHBondContact CA-OE2 3.31Å; V176-E180 HydrophobicContact CG1-CB 3.77Å; S177-E180 PolarHBondContact N-OE2 3.15Å; S177-E180 PolarHBondContact O-N 3.18Å; S177-E180 PolarHBondContact OG-N 2.99Å; E180-E183 PolarHBondContact O-N 2.87Å; E180-Y184 PolarHBondContact O-N 2.85Å
181	V	76.6	Confident	72.6	Confident	88 Å²	88	95.8 Å²	95.8	53%	0.533	54%	0.539	S	S	.	.	H	α-helix	trans	-67.1	-38	173.3	-178	0	0	0	0	111.4	V176 S177 V178 E179 A185	V176-V181 HydrophobicContact CG1-CG2 3.72Å; S177-V181 PolarHBondContact O-N 2.99Å; V178-V181 PolarHBondContact O-N 3.12Å; E179-V181 VanDerWaalsContact C-N 3.3Å; E179-V181 PolarHBondContact O-N 2.89Å; V181-A185 VanDerWaalsContact O-CB 3.31Å; V181-A185 WeakPolarHBondContact O-CB 3.42Å; V181-A185 PolarHBondContact O-N 3.22Å
182	Q	79.3	Confident	75	Confident	129 Å²	129	96.6 Å²	96.6	60%	0.603	54%	0.535	S	S	*	.	H	α-helix	trans	-67.6	-39.2	174.7	-76.5	-177.8	-14.3	0	0	112.4	V178 E179 A185 R186	V178-Q182 WeakPolarHBondContact O-CG 3.47Å; V178-Q182 PolarHBondContact O-N 3.28Å; E179-Q182 CarbonylContact O-C 3.46Å; E179-Q182 WeakPolarHBondContact O-CA 3.36Å; E179-Q182 WeakPolarHBondContact O-CB 3.45Å; E179-Q182 PolarHBondContact O-N 3.16Å; Q182-A185 PolarHBondContact O-N 3.49Å; Q182-R186 VanDerWaalsContact O-CB 3.32Å; Q182-R186 WeakPolarHBondContact O-CB 3.33Å; Q182-R186 PolarHBondContact O-N 2.88Å
183	E	82.9	Confident	77.1	Confident	111 Å²	111	98.2 Å²	98.2	52%	0.519	53%	0.529	S	S	.	.	H	α-helix	trans	-68.4	-39	177.2	-64.1	-149.6	121.4	0	0	111.9	E179 E180 R186 G187	E179-E183 WeakPolarHBondContact O-CG 3.39Å; E179-E183 PolarHBondContact O-N 2.87Å; E180-E183 PolarHBondContact O-N 2.87Å; E183-R186 VanDerWaalsContact CD-NH2 3.32Å; E183-R186 PolarHBondContact O-N 3.32Å; E183-R186 IonicContact OE1-CZ 3.53Å; E183-R186 IonicContact OE1-NH1 2.78Å; E183-R186 IonicContact OE1-NH2 3.62Å; E183-R186 PolarHBondContact OE1-NH2 3.4Å; E183-G187 PolarHBondContact O-N 3.4Å
184	Y	84.2	Confident	79.4	Confident	173 Å²	173	98.6 Å²	98.6	68%	0.678	52%	0.52	S	S	*	.	H	α-helix	trans	-64.6	-42.9	172.1	-176.3	-93.3	0	0	0	112.1	E180 R186 G187 L188	E180-Y184 PolarHBondContact O-N 2.85Å; Y184-R186 VanDerWaalsContact C-N 3.34Å; Y184-R186 PolarHBondContact O-N 2.86Å; Y184-G187 PolarHBondContact O-N 2.88Å; Y184-L188 WeakPolarHBondContact O-CB 3.39Å; Y184-L188 PolarHBondContact O-N 2.94Å
185	A	83.9	Confident	81.4	Confident	56 Å²	56	97.2 Å²	97.2	46%	0.463	51%	0.51	S	S	.	.	H	α-helix	trans	-63.9	-39	175.8	0	0	0	0	0	112.2	V181 Q182 S189	V181-A185 VanDerWaalsContact O-CB 3.31Å; V181-A185 WeakPolarHBondContact O-CB 3.42Å; V181-A185 PolarHBondContact O-N 3.22Å; Q182-A185 PolarHBondContact O-N 3.49Å; A185-S189 PolarHBondContact O-N 3.32Å; A185-S189 PolarHBondContact O-OG 2.91Å
186	R	86.9	Confident	83.2	Confident	122 Å²	122	96.8 Å²	96.8	46%	0.46	50%	0.496	S	S	.	.	H	α-helix	trans	-61.7	-56.3	173.4	179.5	-174.4	63.6	-155	-12.2	110.8	Q182 E183 Y184 L188 S189 E190	Q182-R186 VanDerWaalsContact O-CB 3.32Å; Q182-R186 WeakPolarHBondContact O-CB 3.33Å; Q182-R186 PolarHBondContact O-N 2.88Å; E183-R186 VanDerWaalsContact CD-NH2 3.32Å; E183-R186 PolarHBondContact O-N 3.32Å; E183-R186 IonicContact OE1-CZ 3.53Å; E183-R186 IonicContact OE1-NH1 2.78Å; E183-R186 IonicContact OE1-NH2 3.62Å; E183-R186 PolarHBondContact OE1-NH2 3.4Å; Y184-R186 VanDerWaalsContact C-N 3.34Å; Y184-R186 PolarHBondContact O-N 2.86Å; R186-L188 VanDerWaalsContact C-N 3.27Å; R186-L188 PolarHBondContact O-N 3.32Å; R186-S189 CarbonylContact O-C 3.53Å; R186-S189 WeakPolarHBondContact O-CA 3.32Å; R186-S189 WeakPolarHBondContact O-CB 3.46Å; R186-S189 PolarHBondContact O-N 3.5Å; R186-S189 PolarHBondContact O-OG 3Å; R186-E190 WeakPolarHBondContact CD-OE1 3.38Å; R186-E190 VanDerWaalsContact CG-CD 3.5Å; R186-E190 HydrophobicContact CG-CG 4.28Å; R186-E190 VanDerWaalsContact CG-OE1 3.22Å; R186-E190 WeakPolarHBondContact CG-OE1 3.05Å; R186-E190 IonicContact NE-OE1 2.76Å; R186-E190 WeakPolarHBondContact O-CG 3.3Å; R186-E190 PolarHBondContact O-N 3.07Å
187	G	88.8	Confident	85	Confident	36 Å²	36	97.9 Å²	97.9	37%	0.371	50%	0.496	S	S	.	.	H	α-helix	trans	-60.5	-34.7	-178.7	0	0	0	0	0	113.3	E183 Y184 E190 G191	E183-G187 PolarHBondContact O-N 3.4Å; Y184-G187 PolarHBondContact O-N 2.88Å; G187-E190 WeakPolarHBondContact CA-OE2 3.32Å; G187-G191 PolarHBondContact O-N 3.49Å
188	L	87.9	Confident	86.6	Confident	90 Å²	90	100.1 Å²	100.1	47%	0.471	50%	0.502	S	S	.	.	H	α-helix	trans	-65.4	-42.3	171.3	-172.6	65.4	0	0	0	111.5	Y184 R186 W192	Y184-L188 WeakPolarHBondContact O-CB 3.39Å; Y184-L188 PolarHBondContact O-N 2.94Å; R186-L188 VanDerWaalsContact C-N 3.27Å; R186-L188 PolarHBondContact O-N 3.32Å; L188-W192 PolarHBondContact O-N 2.89Å
189	S	89.3	Confident	88.2	Confident	58 Å²	58	102.7 Å²	102.7	41%	0.406	50%	0.502	S	S	.	.	H	α-helix	trans	-68.3	-35.8	176.6	70.7	0	0	0	0	113.4	A185 R186 W192 I193	A185-S189 PolarHBondContact O-N 3.32Å; A185-S189 PolarHBondContact O-OG 2.91Å; R186-S189 CarbonylContact O-C 3.53Å; R186-S189 WeakPolarHBondContact O-CA 3.32Å; R186-S189 WeakPolarHBondContact O-CB 3.46Å; R186-S189 PolarHBondContact O-N 3.5Å; R186-S189 PolarHBondContact O-OG 3Å; S189-W192 PolarHBondContact O-N 3.18Å; S189-I193 WeakPolarHBondContact O-CG1 3.36Å; S189-I193 PolarHBondContact O-N 2.93Å
190	E	91.7	Very high	89.3	Confident	91 Å²	91	101.5 Å²	101.5	43%	0.425	50%	0.497	S	S	.	.	H	α-helix	trans	-63.2	-48.2	174.2	-72	163.6	165.4	0	0	110	R186 G187 W192 I193 E194	R186-E190 WeakPolarHBondContact CD-OE1 3.38Å; R186-E190 VanDerWaalsContact CG-CD 3.5Å; R186-E190 HydrophobicContact CG-CG 4.28Å; R186-E190 VanDerWaalsContact CG-OE1 3.22Å; R186-E190 WeakPolarHBondContact CG-OE1 3.05Å; R186-E190 IonicContact NE-OE1 2.76Å; R186-E190 WeakPolarHBondContact O-CG 3.3Å; R186-E190 PolarHBondContact O-N 3.07Å; G187-E190 WeakPolarHBondContact CA-OE2 3.32Å; E190-W192 VanDerWaalsContact C-N 3.32Å; E190-W192 PolarHBondContact O-N 3.15Å; E190-I193 WeakPolarHBondContact O-CA 3.5Å; E190-I193 WeakPolarHBondContact O-CB 3.35Å; E190-I193 PolarHBondContact O-N 2.93Å; E190-E194 WeakPolarHBondContact O-CG 3.22Å; E190-E194 PolarHBondContact O-N 3.04Å
191	G	91.8	Very high	90.3	Very high	28 Å²	28	102.6 Å²	102.6	29%	0.289	50%	0.502	S	S	.	.	H	α-helix	trans	-63	-30.5	174.1	0	0	0	0	0	114.8	G187 T195	G187-G191 PolarHBondContact O-N 3.49Å; G191-T195 WeakPolarHBondContact O-CB 3.47Å; G191-T195 WeakPolarHBondContact O-CG2 3.46Å; G191-T195 PolarHBondContact O-N 3.41Å; G191-T195 VanDerWaalsContact O-N 3.09Å; G191-T195 PolarHBondContact O-OG1 2.92Å
192	W	92.3	Very high	91.3	Very high	180 Å²	180	103.3 Å²	103.3	68%	0.682	50%	0.497	S	S	*	.	H	α-helix	trans	-70.2	-32.7	170.5	-85.4	111.5	0	0	0	112.7	L188 S189 E190 T195 F196	L188-W192 PolarHBondContact O-N 2.89Å; S189-W192 PolarHBondContact O-N 3.18Å; E190-W192 VanDerWaalsContact C-N 3.32Å; E190-W192 PolarHBondContact O-N 3.15Å; W192-T195 PolarHBondContact O-OG1 3.03Å; W192-F196 VanDerWaalsContact O-CB 3.26Å; W192-F196 WeakPolarHBondContact O-CB 3.4Å; W192-F196 PolarHBondContact O-N 2.63Å; W192-F196 VanDerWaalsContact O-N 3.11Å
193	I	95.1	Very high	92.1	Very high	91 Å²	91	100.7 Å²	100.7	47%	0.467	49%	0.49	S	S	.	.	H	α-helix	trans	-71.6	-51.7	174.3	-68.6	162.1	0	0	0	109.8	S189 E190 T195 F196 E197	S189-I193 WeakPolarHBondContact O-CG1 3.36Å; S189-I193 PolarHBondContact O-N 2.93Å; E190-I193 WeakPolarHBondContact O-CA 3.5Å; E190-I193 WeakPolarHBondContact O-CB 3.35Å; E190-I193 PolarHBondContact O-N 2.93Å; I193-T195 VanDerWaalsContact C-N 3.3Å; I193-T195 PolarHBondContact O-N 2.97Å; I193-F196 WeakPolarHBondContact O-CB 3.49Å; I193-F196 PolarHBondContact O-N 3Å; I193-E197 HydrophobicContact CG2-CG 4.21Å; I193-E197 WeakPolarHBondContact CG2-OE1 3.48Å; I193-E197 WeakPolarHBondContact O-CB 3.39Å; I193-E197 WeakPolarHBondContact O-CG 3.45Å; I193-E197 PolarHBondContact O-N 3.32Å
194	E	94.4	Very high	92.8	Very high	135 Å²	135	99.8 Å²	99.8	63%	0.631	49%	0.486	S	S	*	.	H	α-helix	trans	-55.1	-43.4	178.4	-70.5	176.3	173.6	0	0	112.3	E190 M198	E190-E194 WeakPolarHBondContact O-CG 3.22Å; E190-E194 PolarHBondContact O-N 3.04Å; E194-M198 VanDerWaalsContact O-CB 3.31Å; E194-M198 WeakPolarHBondContact O-CB 3.29Å; E194-M198 PolarHBondContact O-N 3.5Å
195	T	94	Very high	93.4	Very high	62 Å²	62	95 Å²	95	38%	0.38	47%	0.47	S	S	.	.	H	α-helix	trans	-71.3	-34.7	176.7	50.8	0	0	0	0	112.9	G191 W192 I193 Y199	G191-T195 WeakPolarHBondContact O-CB 3.47Å; G191-T195 WeakPolarHBondContact O-CG2 3.46Å; G191-T195 PolarHBondContact O-N 3.41Å; G191-T195 VanDerWaalsContact O-N 3.09Å; G191-T195 PolarHBondContact O-OG1 2.92Å; W192-T195 PolarHBondContact O-OG1 3.03Å; I193-T195 VanDerWaalsContact C-N 3.3Å; I193-T195 PolarHBondContact O-N 2.97Å; T195-Y199 WeakPolarHBondContact O-CD2 3.32Å; T195-Y199 PolarHBondContact O-N 2.88Å
196	F	95.1	Very high	94.1	Very high	136 Å²	136	96.8 Å²	96.8	60%	0.596	47%	0.47	S	S	*	.	H	α-helix	trans	-66.2	-44.4	173.2	179.2	-90.8	0	0	0	111.9	W192 I193 Y199 Q200	W192-F196 VanDerWaalsContact O-CB 3.26Å; W192-F196 WeakPolarHBondContact O-CB 3.4Å; W192-F196 PolarHBondContact O-N 2.63Å; W192-F196 VanDerWaalsContact O-N 3.11Å; I193-F196 WeakPolarHBondContact O-CB 3.49Å; I193-F196 PolarHBondContact O-N 3Å; F196-Y199 PolarHBondContact O-N 2.9Å; F196-Q200 WeakPolarHBondContact O-CB 3.36Å; F196-Q200 PolarHBondContact O-N 3.18Å
197	E	95.7	Very high	94.5	Very high	114 Å²	114	95.7 Å²	95.7	53%	0.533	47%	0.47	S	S	.	.	H	α-helix	trans	-62.7	-41.8	176.3	-72	179	171	0	0	111.4	I193 Y199 Q200 Q201	I193-E197 HydrophobicContact CG2-CG 4.21Å; I193-E197 WeakPolarHBondContact CG2-OE1 3.48Å; I193-E197 WeakPolarHBondContact O-CB 3.39Å; I193-E197 WeakPolarHBondContact O-CG 3.45Å; I193-E197 PolarHBondContact O-N 3.32Å; E197-Y199 PolarHBondContact O-N 3.24Å; E197-Q200 PolarHBondContact O-N 3.13Å; E197-Q201 WeakPolarHBondContact O-CB 3.25Å; E197-Q201 PolarHBondContact O-N 3.22Å
198	M	95.9	Very high	94.9	Very high	89 Å²	89	99.8 Å²	99.8	44%	0.438	48%	0.479	S	S	.	.	H	α-helix	trans	-59.5	-45.3	172	179	-77.4	-56.8	0	0	112	E194 K202	E194-M198 VanDerWaalsContact O-CB 3.31Å; E194-M198 WeakPolarHBondContact O-CB 3.29Å; E194-M198 PolarHBondContact O-N 3.5Å; M198-K202 WeakPolarHBondContact O-CB 3.45Å; M198-K202 PolarHBondContact O-N 2.69Å
199	Y	97	Very high	95.3	Very high	158 Å²	158	98.4 Å²	98.4	62%	0.62	48%	0.477	S	S	*	.	H	α-helix	trans	-65.7	-39	175.4	-80.3	-59.9	0	0	0	112.5	T195 F196 E197 K202 V203	T195-Y199 WeakPolarHBondContact O-CD2 3.32Å; T195-Y199 PolarHBondContact O-N 2.88Å; F196-Y199 PolarHBondContact O-N 2.9Å; E197-Y199 PolarHBondContact O-N 3.24Å; Y199-K202 PolarHBondContact O-N 2.79Å; Y199-V203 WeakPolarHBondContact O-CG2 3.44Å; Y199-V203 PolarHBondContact O-N 2.96Å
200	Q	97.1	Very high	95.7	Very high	93 Å²	93	99.9 Å²	99.9	44%	0.435	48%	0.48	S	S	.	.	H	α-helix	trans	-63.1	-51	176	-176.7	-178.5	-35.6	0	0	110.7	F196 E197 K202 V203 E204	F196-Q200 WeakPolarHBondContact O-CB 3.36Å; F196-Q200 PolarHBondContact O-N 3.18Å; E197-Q200 PolarHBondContact O-N 3.13Å; Q200-K202 VanDerWaalsContact C-N 3.27Å; Q200-K202 PolarHBondContact O-N 2.95Å; Q200-V203 PolarHBondContact O-N 3.37Å; Q200-V203 VanDerWaalsContact O-N 3.1Å; Q200-E204 WeakPolarHBondContact CG-OE1 3.28Å; Q200-E204 PolarHBondContact NE2-OE1 2.95Å; Q200-E204 WeakPolarHBondContact O-CG 3.23Å; Q200-E204 PolarHBondContact O-N 3.12Å
201	Q	97.1	Very high	95.9	Very high	115 Å²	115	101 Å²	101	54%	0.537	48%	0.483	S	S	.	.	H	α-helix	trans	-56.2	-43.3	175.4	-176.1	-174.4	-33.9	0	0	110.9	E197 V203 E204 E205	E197-Q201 WeakPolarHBondContact O-CB 3.25Å; E197-Q201 PolarHBondContact O-N 3.22Å; Q201-V203 VanDerWaalsContact C-N 3.32Å; Q201-V203 PolarHBondContact O-N 3.39Å; Q201-E204 PolarHBondContact O-N 3.1Å; Q201-E205 HydrophobicContact CG-CG 4.46Å; Q201-E205 PolarHBondContact NE2-OE1 2.85Å; Q201-E205 WeakPolarHBondContact O-CB 3.46Å; Q201-E205 WeakPolarHBondContact O-CG 3.29Å; Q201-E205 PolarHBondContact O-N 3.49Å
202	K	97.3	Very high	96.2	Very high	102 Å²	102	102.5 Å²	102.5	44%	0.443	49%	0.493	S	S	.	.	H	α-helix	trans	-64.4	-35.3	178.8	-162.3	70	-136.1	166.5	0	112.7	M198 Y199 Q200 E205 M206	M198-K202 WeakPolarHBondContact O-CB 3.45Å; M198-K202 PolarHBondContact O-N 2.69Å; Y199-K202 PolarHBondContact O-N 2.79Å; Q200-K202 VanDerWaalsContact C-N 3.27Å; Q200-K202 PolarHBondContact O-N 2.95Å; K202-E205 WeakPolarHBondContact CE-OE2 3.22Å; K202-E205 IonicContact NZ-OE2 3.72Å; K202-E205 PolarHBondContact NZ-OE2 3.06Å; K202-M206 WeakPolarHBondContact O-CE 3.46Å; K202-M206 WeakPolarHBondContact O-CG 3.45Å; K202-M206 PolarHBondContact O-N 2.9Å; K202-M206 VanDerWaalsContact O-N 3.12Å
203	V	96.9	Very high	96.3	Very high	75 Å²	75	98.2 Å²	98.2	46%	0.455	48%	0.483	S	S	.	.	H	α-helix	trans	-69.3	-42.7	172.3	170.4	0	0	0	0	111.2	Y199 Q200 Q201 E205 M206 E207	Y199-V203 WeakPolarHBondContact O-CG2 3.44Å; Y199-V203 PolarHBondContact O-N 2.96Å; Q200-V203 PolarHBondContact O-N 3.37Å; Q200-V203 VanDerWaalsContact O-N 3.1Å; Q201-V203 VanDerWaalsContact C-N 3.32Å; Q201-V203 PolarHBondContact O-N 3.39Å; V203-E205 PolarHBondContact O-N 3.23Å; V203-M206 HydrophobicContact CG2-CE 4.12Å; V203-M206 PolarHBondContact O-N 3.24Å; V203-E207 WeakPolarHBondContact O-CB 3.47Å; V203-E207 PolarHBondContact O-N 3.32Å
204	E	97.1	Very high	96.4	Very high	91 Å²	91	99.4 Å²	99.4	43%	0.425	49%	0.487	S	S	.	.	H	α-helix	trans	-63.6	-38.4	176.6	-71.6	-178.8	-153.1	0	0	112.3	Q200 Q201 E207 Q208	Q200-E204 WeakPolarHBondContact CG-OE1 3.28Å; Q200-E204 PolarHBondContact NE2-OE1 2.95Å; Q200-E204 WeakPolarHBondContact O-CG 3.23Å; Q200-E204 PolarHBondContact O-N 3.12Å; Q201-E204 PolarHBondContact O-N 3.1Å; E204-E207 PolarHBondContact O-N 3.41Å; E204-Q208 WeakPolarHBondContact O-CB 3.35Å; E204-Q208 WeakPolarHBondContact O-CG 3.43Å; E204-Q208 PolarHBondContact O-N 3.03Å; E204-Q208 PolarHBondContact O-NE2 3.39Å
205	E	97.2	Very high	96.5	Very high	73 Å²	73	95.4 Å²	95.4	34%	0.341	48%	0.477	S	S	.	.	H	α-helix	trans	-62	-46.6	171.8	-76.3	173.4	-163.9	0	0	112.1	Q201 K202 V203 Q208 S209	Q201-E205 HydrophobicContact CG-CG 4.46Å; Q201-E205 PolarHBondContact NE2-OE1 2.85Å; Q201-E205 WeakPolarHBondContact O-CB 3.46Å; Q201-E205 WeakPolarHBondContact O-CG 3.29Å; Q201-E205 PolarHBondContact O-N 3.49Å; K202-E205 WeakPolarHBondContact CE-OE2 3.22Å; K202-E205 IonicContact NZ-OE2 3.72Å; K202-E205 PolarHBondContact NZ-OE2 3.06Å; V203-E205 PolarHBondContact O-N 3.23Å; E205-Q208 PolarHBondContact O-N 3.1Å; E205-S209 PolarHBondContact O-N 3.48Å
206	M	96.8	Very high	96.7	Very high	93 Å²	93	100.6 Å²	100.6	46%	0.458	49%	0.49	S	S	.	.	H	α-helix	trans	-65.9	-37.9	176.7	-72.2	-174.7	-62	0	0	112.1	K202 V203 Q208 S209 I210	K202-M206 WeakPolarHBondContact O-CE 3.46Å; K202-M206 WeakPolarHBondContact O-CG 3.45Å; K202-M206 PolarHBondContact O-N 2.9Å; K202-M206 VanDerWaalsContact O-N 3.12Å; V203-M206 HydrophobicContact CG2-CE 4.12Å; V203-M206 PolarHBondContact O-N 3.24Å; M206-Q208 VanDerWaalsContact C-N 3.32Å; M206-S209 PolarHBondContact O-N 3.14Å; M206-S209 PolarHBondContact O-OG 3.44Å; M206-S209 VanDerWaalsContact O-OG 3.08Å; M206-I210 WeakPolarHBondContact O-CB 3.37Å; M206-I210 WeakPolarHBondContact O-CD1 3.49Å; M206-I210 WeakPolarHBondContact O-CG1 3.42Å; M206-I210 PolarHBondContact O-N 3.23Å
207	E	96.6	Very high	96.8	Very high	100 Å²	100	99.5 Å²	99.5	47%	0.467	49%	0.489	S	S	.	.	H	α-helix	trans	-63.4	-38.9	172.4	-86.8	-157.3	-158.7	0	0	112	V203 E204 K211	V203-E207 WeakPolarHBondContact O-CB 3.47Å; V203-E207 PolarHBondContact O-N 3.32Å; E204-E207 PolarHBondContact O-N 3.41Å; E207-K211 WeakPolarHBondContact O-CB 3.48Å; E207-K211 WeakPolarHBondContact O-CD 3.29Å; E207-K211 WeakPolarHBondContact O-CE 3.27Å; E207-K211 WeakPolarHBondContact O-CG 3.49Å; E207-K211 PolarHBondContact O-N 3.32Å; E207-K211 WeakPolarHBondContact OE2-CE 3.35Å; E207-K211 IonicContact OE2-NZ 2.65Å; E207-K211 PolarHBondContact OE2-NZ 3.36Å
208	Q	97.1	Very high	96.9	Very high	122 Å²	122	97.3 Å²	97.3	57%	0.57	49%	0.486	S	S	*	.	H	α-helix	trans	-67.2	-43.1	176.3	-75.1	171.8	56.8	0	0	111.7	E204 E205 M206 K211 A212	E204-Q208 WeakPolarHBondContact O-CB 3.35Å; E204-Q208 WeakPolarHBondContact O-CG 3.43Å; E204-Q208 PolarHBondContact O-N 3.03Å; E204-Q208 PolarHBondContact O-NE2 3.39Å; E205-Q208 PolarHBondContact O-N 3.1Å; M206-Q208 VanDerWaalsContact C-N 3.32Å; Q208-K211 PolarHBondContact O-N 3.03Å; Q208-A212 PolarHBondContact O-N 3.03Å
209	S	96.3	Very high	96.9	Very high	60 Å²	60	96.4 Å²	96.4	42%	0.42	48%	0.483	S	S	.	.	H	α-helix	trans	-64.2	-43.5	175.9	73.7	0	0	0	0	111.6	E205 M206 K211 A212 D213	E205-S209 PolarHBondContact O-N 3.48Å; M206-S209 PolarHBondContact O-N 3.14Å; M206-S209 PolarHBondContact O-OG 3.44Å; M206-S209 VanDerWaalsContact O-OG 3.08Å; S209-K211 VanDerWaalsContact C-N 3.29Å; S209-K211 PolarHBondContact O-N 3.27Å; S209-A212 WeakPolarHBondContact O-CB 3.38Å; S209-A212 PolarHBondContact O-N 2.98Å; S209-A212 VanDerWaalsContact O-N 3.11Å; S209-D213 PolarHBondContact O-N 2.91Å
210	I	96.9	Very high	96.9	Very high	90 Å²	90	92.6 Å²	92.6	46%	0.462	47%	0.473	S	S	.	.	H	α-helix	trans	-60.2	-38.3	175.4	-70.6	165.5	0	0	0	111.6	M206 Q214	M206-I210 WeakPolarHBondContact O-CB 3.37Å; M206-I210 WeakPolarHBondContact O-CD1 3.49Å; M206-I210 WeakPolarHBondContact O-CG1 3.42Å; M206-I210 PolarHBondContact O-N 3.23Å; I210-Q214 WeakPolarHBondContact O-CB 3.34Å; I210-Q214 VanDerWaalsContact O-CG 3.24Å; I210-Q214 WeakPolarHBondContact O-CG 3.45Å; I210-Q214 PolarHBondContact O-N 2.96Å
211	K	97.1	Very high	96.9	Very high	113 Å²	113	94.1 Å²	94.1	49%	0.491	48%	0.48	S	S	.	.	H	α-helix	trans	-67.8	-38.1	175.6	-70.9	158.3	-161.9	166.9	0	111.7	E207 Q208 S209 A215	E207-K211 WeakPolarHBondContact O-CB 3.48Å; E207-K211 WeakPolarHBondContact O-CD 3.29Å; E207-K211 WeakPolarHBondContact O-CE 3.27Å; E207-K211 WeakPolarHBondContact O-CG 3.49Å; E207-K211 PolarHBondContact O-N 3.32Å; E207-K211 WeakPolarHBondContact OE2-CE 3.35Å; E207-K211 IonicContact OE2-NZ 2.65Å; E207-K211 PolarHBondContact OE2-NZ 3.36Å; Q208-K211 PolarHBondContact O-N 3.03Å; S209-K211 VanDerWaalsContact C-N 3.29Å; S209-K211 PolarHBondContact O-N 3.27Å; K211-A215 PolarHBondContact O-N 3.04Å
212	A	96.8	Very high	96.8	Very high	61 Å²	61	94 Å²	94	50%	0.504	48%	0.477	S	S	.	.	H	α-helix	trans	-67.4	-43.2	174.3	0	0	0	0	0	112.3	Q208 S209 Q214 A215 R216	Q208-A212 PolarHBondContact O-N 3.03Å; S209-A212 WeakPolarHBondContact O-CB 3.38Å; S209-A212 PolarHBondContact O-N 2.98Å; S209-A212 VanDerWaalsContact O-N 3.11Å; A212-Q214 PolarHBondContact O-N 3.24Å; A212-A215 WeakPolarHBondContact O-CB 3.37Å; A212-A215 PolarHBondContact O-N 3.28Å; A212-R216 PolarHBondContact O-N 2.92Å
213	D	94.9	Very high	96.8	Very high	89 Å²	89	93.3 Å²	93.3	48%	0.476	48%	0.476	S	S	.	.	H	α-helix	trans	-62.7	-40.7	175.2	-74.4	-37.9	0	0	0	111.7	S209 R216 L217	S209-D213 PolarHBondContact O-N 2.91Å; D213-R216 PolarHBondContact O-N 2.89Å; D213-L217 WeakPolarHBondContact O-CB 3.48Å; D213-L217 VanDerWaalsContact O-CG 3.29Å; D213-L217 WeakPolarHBondContact O-CG 3.46Å; D213-L217 PolarHBondContact O-N 3.32Å
214	Q	97.1	Very high	96.8	Very high	117 Å²	117	97.3 Å²	97.3	55%	0.547	49%	0.487	S	S	.	.	H	α-helix	trans	-62.8	-39.8	173.8	-76.6	175.3	17.3	0	0	112.2	I210 A212 C218	I210-Q214 WeakPolarHBondContact O-CB 3.34Å; I210-Q214 VanDerWaalsContact O-CG 3.24Å; I210-Q214 WeakPolarHBondContact O-CG 3.45Å; I210-Q214 PolarHBondContact O-N 2.96Å; A212-Q214 PolarHBondContact O-N 3.24Å; Q214-C218 PolarHBondContact O-N 3.42Å; Q214-C218 PolarHBondContact O-SG 3.21Å
215	A	97.1	Very high	96.8	Very high	50 Å²	50	98.5 Å²	98.5	41%	0.413	49%	0.494	S	S	.	.	H	α-helix	trans	-63	-49.2	173.5	0	0	0	0	0	111.1	K211 A212 L217 C218 D219	K211-A215 PolarHBondContact O-N 3.04Å; A212-A215 WeakPolarHBondContact O-CB 3.37Å; A212-A215 PolarHBondContact O-N 3.28Å; A215-L217 VanDerWaalsContact C-N 3.31Å; A215-L217 PolarHBondContact O-N 3.01Å; A215-C218 WeakPolarHBondContact O-CA 3.28Å; A215-C218 WeakPolarHBondContact O-CB 3.15Å; A215-C218 PolarHBondContact O-N 3.23Å; A215-D219 PolarHBondContact O-N 3Å
216	R	96.9	Very high	96.8	Very high	172 Å²	172	100.6 Å²	100.6	65%	0.649	51%	0.507	S	S	*	.	H	α-helix	trans	-58.5	-40.3	177.9	-161.9	176.4	95	116.1	0.3	112.5	A212 D213 D219 L220	A212-R216 PolarHBondContact O-N 2.92Å; D213-R216 PolarHBondContact O-N 2.89Å; R216-D219 PolarHBondContact O-N 3.38Å; R216-L220 HydrophobicContact CG-CD1 4.36Å; R216-L220 WeakPolarHBondContact O-CB 3.32Å; R216-L220 VanDerWaalsContact O-CG 3.29Å; R216-L220 WeakPolarHBondContact O-CG 3.49Å; R216-L220 PolarHBondContact O-N 2.89Å
217	L	97.3	Very high	96.8	Very high	113 Å²	113	102.8 Å²	102.8	59%	0.592	51%	0.511	S	S	*	.	H	α-helix	trans	-65.5	-38.5	173.7	-74.3	170	0	0	0	112.5	D213 A215 D219 Q221	D213-L217 WeakPolarHBondContact O-CB 3.48Å; D213-L217 VanDerWaalsContact O-CG 3.29Å; D213-L217 WeakPolarHBondContact O-CG 3.46Å; D213-L217 PolarHBondContact O-N 3.32Å; A215-L217 VanDerWaalsContact C-N 3.31Å; A215-L217 PolarHBondContact O-N 3.01Å; L217-D219 VanDerWaalsContact C-N 3.33Å; L217-Q221 WeakPolarHBondContact O-CB 3.48Å; L217-Q221 PolarHBondContact O-N 3.35Å
218	C	97.6	Very high	96.8	Very high	68 Å²	68	101 Å²	101	46%	0.459	51%	0.514	S	S	.	.	H	α-helix	trans	-66	-35.6	174.7	-68.9	0	0	0	0	112.2	Q214 A215 Q221 K222	Q214-C218 PolarHBondContact O-N 3.42Å; Q214-C218 PolarHBondContact O-SG 3.21Å; A215-C218 WeakPolarHBondContact O-CA 3.28Å; A215-C218 WeakPolarHBondContact O-CB 3.15Å; A215-C218 PolarHBondContact O-N 3.23Å; C218-Q221 PolarHBondContact O-N 3.28Å; C218-K222 WeakPolarHBondContact O-CG 3.42Å; C218-K222 PolarHBondContact O-N 3.29Å; C218-K222 VanDerWaalsContact O-N 3.13Å
219	D	96.6	Very high	96.8	Very high	70 Å²	70	98.3 Å²	98.3	37%	0.374	51%	0.508	S	S	.	.	H	α-helix	trans	-73.3	-46.9	177.9	-67.4	-37	0	0	0	111.8	A215 R216 L217 Q221 K222 E223	A215-D219 PolarHBondContact O-N 3Å; R216-D219 PolarHBondContact O-N 3.38Å; L217-D219 VanDerWaalsContact C-N 3.33Å; D219-Q221 PolarHBondContact O-N 3.38Å; D219-K222 WeakPolarHBondContact O-CA 3.23Å; D219-K222 WeakPolarHBondContact O-CB 3.33Å; D219-K222 PolarHBondContact O-N 2.98Å; D219-K222 WeakPolarHBondContact OD1-CE 3.42Å; D219-K222 IonicContact OD1-NZ 2.64Å; D219-K222 PolarHBondContact OD1-NZ 2.99Å; D219-E223 PolarHBondContact O-N 3.13Å
220	L	96.8	Very high	96.8	Very high	78 Å²	78	100.2 Å²	100.2	41%	0.408	51%	0.51	S	S	.	.	H	α-helix	trans	-55.7	-33.8	170.3	-71.6	167.1	0	0	0	112.4	R216 K224	R216-L220 HydrophobicContact CG-CD1 4.36Å; R216-L220 WeakPolarHBondContact O-CB 3.32Å; R216-L220 VanDerWaalsContact O-CG 3.29Å; R216-L220 WeakPolarHBondContact O-CG 3.49Å; R216-L220 PolarHBondContact O-N 2.89Å; L220-K224 VanDerWaalsContact O-CB 3.31Å; L220-K224 WeakPolarHBondContact O-CB 3.4Å; L220-K224 PolarHBondContact O-N 2.86Å
221	Q	96.8	Very high	96.8	Very high	125 Å²	125	101.6 Å²	101.6	58%	0.584	52%	0.518	S	S	*	.	H	α-helix	trans	-71.3	-33.6	174.4	-175.7	173.2	-16.9	0	0	112.8	L217 C218 D219 M225	L217-Q221 WeakPolarHBondContact O-CB 3.48Å; L217-Q221 PolarHBondContact O-N 3.35Å; C218-Q221 PolarHBondContact O-N 3.28Å; D219-Q221 PolarHBondContact O-N 3.38Å; Q221-M225 WeakPolarHBondContact O-CG 3.46Å; Q221-M225 PolarHBondContact O-N 3.28Å
222	K	96.4	Very high	96.8	Very high	111 Å²	111	97.9 Å²	97.9	48%	0.483	51%	0.511	S	S	.	.	H	α-helix	trans	-67.3	-49.2	172.2	-65.7	161.5	-159	167.5	0	110.4	C218 D219 K224 M225 L226	C218-K222 WeakPolarHBondContact O-CG 3.42Å; C218-K222 PolarHBondContact O-N 3.29Å; C218-K222 VanDerWaalsContact O-N 3.13Å; D219-K222 WeakPolarHBondContact O-CA 3.23Å; D219-K222 WeakPolarHBondContact O-CB 3.33Å; D219-K222 PolarHBondContact O-N 2.98Å; D219-K222 WeakPolarHBondContact OD1-CE 3.42Å; D219-K222 IonicContact OD1-NZ 2.64Å; D219-K222 PolarHBondContact OD1-NZ 2.99Å; K222-K224 VanDerWaalsContact C-N 3.34Å; K222-K224 PolarHBondContact O-N 3.48Å; K222-M225 WeakPolarHBondContact O-CA 3.48Å; K222-M225 WeakPolarHBondContact O-CB 3.47Å; K222-M225 PolarHBondContact O-N 2.99Å; K222-L226 WeakPolarHBondContact O-CG 3.47Å; K222-L226 PolarHBondContact O-N 3.36Å
223	E	96.6	Very high	96.7	Very high	88 Å²	88	101.4 Å²	101.4	41%	0.411	52%	0.515	S	S	.	.	H	α-helix	trans	-55	-48.3	176.8	-70.4	171.6	-179.9	0	0	111.1	D219 M225 L226 Y227	D219-E223 PolarHBondContact O-N 3.13Å; E223-M225 VanDerWaalsContact C-N 3.27Å; E223-M225 PolarHBondContact O-N 2.95Å; E223-L226 WeakPolarHBondContact O-CB 3.11Å; E223-L226 PolarHBondContact O-N 2.88Å; E223-Y227 HydrophobicContact CB-CD2 4.4Å; E223-Y227 HydrophobicContact CB-CE2 4.06Å; E223-Y227 WeakPolarHBondContact O-CD2 3.37Å; E223-Y227 PolarHBondContact O-N 3.33Å
224	K	96.8	Very high	96.8	Very high	159 Å²	159	102.4 Å²	102.4	69%	0.691	52%	0.52	S	S	*	.	H	α-helix	trans	-56.1	-37.6	174.3	-178.2	174.3	179.2	174.8	0	113.2	L220 K222 A228	L220-K224 VanDerWaalsContact O-CB 3.31Å; L220-K224 WeakPolarHBondContact O-CB 3.4Å; L220-K224 PolarHBondContact O-N 2.86Å; K222-K224 VanDerWaalsContact C-N 3.34Å; K222-K224 PolarHBondContact O-N 3.48Å; K224-A228 VanDerWaalsContact O-CB 3.24Å; K224-A228 WeakPolarHBondContact O-CB 3.18Å; K224-A228 PolarHBondContact O-N 3.04Å
225	M	96.9	Very high	96.8	Very high	116 Å²	116	104.9 Å²	104.9	57%	0.571	53%	0.525	S	S	*	.	H	α-helix	trans	-73.5	-33.7	175.5	-71.6	-170.7	-60.3	0	0	112.7	Q221 K222 E223 S229	Q221-M225 WeakPolarHBondContact O-CG 3.46Å; Q221-M225 PolarHBondContact O-N 3.28Å; K222-M225 WeakPolarHBondContact O-CA 3.48Å; K222-M225 WeakPolarHBondContact O-CB 3.47Å; K222-M225 PolarHBondContact O-N 2.99Å; E223-M225 VanDerWaalsContact C-N 3.27Å; E223-M225 PolarHBondContact O-N 2.95Å; M225-S229 WeakPolarHBondContact O-CB 3.41Å; M225-S229 PolarHBondContact O-N 3.01Å
226	L	97.1	Very high	96.8	Very high	118 Å²	118	105.9 Å²	105.9	62%	0.618	53%	0.526	S	S	*	.	H	α-helix	trans	-65.5	-52	174.1	-67.6	173.2	0	0	0	110.7	K222 E223 A228 S229 E230	K222-L226 WeakPolarHBondContact O-CG 3.47Å; K222-L226 PolarHBondContact O-N 3.36Å; E223-L226 WeakPolarHBondContact O-CB 3.11Å; E223-L226 PolarHBondContact O-N 2.88Å; L226-A228 VanDerWaalsContact C-N 3.31Å; L226-A228 PolarHBondContact O-N 2.92Å; L226-S229 WeakPolarHBondContact O-CA 3.41Å; L226-S229 WeakPolarHBondContact O-CB 3.29Å; L226-S229 PolarHBondContact O-N 2.91Å; L226-E230 WeakPolarHBondContact O-CB 3.27Å; L226-E230 PolarHBondContact O-N 3.32Å
227	Y	96.9	Very high	96.8	Very high	139 Å²	139	101.8 Å²	101.8	55%	0.545	51%	0.514	S	S	.	.	H	α-helix	trans	-60.1	-38.6	175.9	-63.8	-52	0	0	0	112.4	E223 S229 E230 L231	E223-Y227 HydrophobicContact CB-CD2 4.4Å; E223-Y227 HydrophobicContact CB-CE2 4.06Å; E223-Y227 WeakPolarHBondContact O-CD2 3.37Å; E223-Y227 PolarHBondContact O-N 3.33Å; Y227-S229 VanDerWaalsContact C-N 3.34Å; Y227-S229 PolarHBondContact O-N 2.76Å; Y227-E230 PolarHBondContact O-N 3.06Å; Y227-L231 WeakPolarHBondContact O-CB 3.4Å; Y227-L231 VanDerWaalsContact O-CG 3.29Å; Y227-L231 WeakPolarHBondContact O-CG 3.39Å; Y227-L231 PolarHBondContact O-N 2.98Å
228	A	96.8	Very high	96.7	Very high	63 Å²	63	99 Å²	99	52%	0.521	51%	0.508	S	S	.	.	H	α-helix	trans	-64.8	-36	173.9	0	0	0	0	0	112.9	K224 L226 G232	K224-A228 VanDerWaalsContact O-CB 3.24Å; K224-A228 WeakPolarHBondContact O-CB 3.18Å; K224-A228 PolarHBondContact O-N 3.04Å; L226-A228 VanDerWaalsContact C-N 3.31Å; L226-A228 PolarHBondContact O-N 2.92Å; A228-G232 PolarHBondContact O-N 3.21Å; A228-G232 VanDerWaalsContact O-N 3.13Å
229	S	96.4	Very high	96.6	Very high	64 Å²	64	99.9 Å²	99.9	45%	0.448	51%	0.505	S	S	.	.	H	α-helix	trans	-70	-38.7	173.8	-177.8	0	0	0	0	112.1	M225 L226 Y227 G232 K233	M225-S229 WeakPolarHBondContact O-CB 3.41Å; M225-S229 PolarHBondContact O-N 3.01Å; L226-S229 WeakPolarHBondContact O-CA 3.41Å; L226-S229 WeakPolarHBondContact O-CB 3.29Å; L226-S229 PolarHBondContact O-N 2.91Å; Y227-S229 VanDerWaalsContact C-N 3.34Å; Y227-S229 PolarHBondContact O-N 2.76Å; S229-G232 PolarHBondContact O-N 3.46Å; S229-K233 WeakPolarHBondContact O-CG 3.31Å; S229-K233 PolarHBondContact O-N 3.04Å
230	E	97.1	Very high	96.5	Very high	101 Å²	101	101 Å²	101	47%	0.472	51%	0.506	S	S	.	.	H	α-helix	trans	-68.2	-47.7	178.7	-177.3	161.8	-127.5	0	0	112.4	L226 Y227 G232 K233 L234	L226-E230 WeakPolarHBondContact O-CB 3.27Å; L226-E230 PolarHBondContact O-N 3.32Å; Y227-E230 PolarHBondContact O-N 3.06Å; E230-G232 PolarHBondContact O-N 3.25Å; E230-K233 WeakPolarHBondContact O-CB 3.35Å; E230-K233 PolarHBondContact O-N 3.45Å; E230-L234 HydrophobicContact CG-CD1 4.23Å; E230-L234 WeakPolarHBondContact O-CG 3.42Å; E230-L234 PolarHBondContact O-N 2.74Å
231	L	97.3	Very high	96.4	Very high	119 Å²	119	103.3 Å²	103.3	62%	0.623	52%	0.515	S	S	*	.	H	α-helix	trans	-56.8	-36.4	169.5	-71.2	169.9	0	0	0	111.6	Y227 R235	Y227-L231 WeakPolarHBondContact O-CB 3.4Å; Y227-L231 VanDerWaalsContact O-CG 3.29Å; Y227-L231 WeakPolarHBondContact O-CG 3.39Å; Y227-L231 PolarHBondContact O-N 2.98Å; L231-R235 WeakPolarHBondContact O-CB 3.45Å; L231-R235 PolarHBondContact O-N 2.71Å
232	G	96.4	Very high	96.4	Very high	34 Å²	34	98.6 Å²	98.6	35%	0.351	50%	0.5	S	S	.	.	H	α-helix	trans	-60.9	-47.3	171.6	0	0	0	0	0	113.1	A228 S229 E230 R235 T236	A228-G232 PolarHBondContact O-N 3.21Å; A228-G232 VanDerWaalsContact O-N 3.13Å; S229-G232 PolarHBondContact O-N 3.46Å; E230-G232 PolarHBondContact O-N 3.25Å; G232-R235 PolarHBondContact O-N 3.08Å; G232-T236 WeakPolarHBondContact O-CG2 3.3Å; G232-T236 PolarHBondContact O-N 3.37Å; G232-T236 PolarHBondContact O-OG1 3.15Å
233	K	95.6	Very high	96.3	Very high	135 Å²	135	97.8 Å²	97.8	59%	0.587	50%	0.498	S	S	*	.	H	α-helix	trans	-62.2	-51.7	176.7	-66.6	167.6	-168.1	170.8	0	111.3	S229 E230 R235 T236 E237	S229-K233 WeakPolarHBondContact O-CG 3.31Å; S229-K233 PolarHBondContact O-N 3.04Å; E230-K233 WeakPolarHBondContact O-CB 3.35Å; E230-K233 PolarHBondContact O-N 3.45Å; K233-R235 VanDerWaalsContact C-N 3.27Å; K233-R235 PolarHBondContact O-N 3.38Å; K233-T236 PolarHBondContact O-N 2.94Å; K233-T236 PolarHBondContact O-OG1 2.94Å; K233-E237 PolarHBondContact O-N 2.96Å
234	L	96.8	Very high	96.2	Very high	111 Å²	111	97 Å²	97	58%	0.581	50%	0.499	S	S	*	.	H	α-helix	trans	-56.6	-42.8	179.4	-72.2	168.9	0	0	0	111.2	E230 E237 A238	E230-L234 HydrophobicContact CG-CD1 4.23Å; E230-L234 WeakPolarHBondContact O-CG 3.42Å; E230-L234 PolarHBondContact O-N 2.74Å; L234-E237 PolarHBondContact O-N 2.89Å; L234-A238 PolarHBondContact O-N 3.2Å
235	R	97	Very high	96.1	Very high	169 Å²	169	94.9 Å²	94.9	64%	0.638	49%	0.491	S	S	*	.	H	α-helix	trans	-60.1	-47.1	173.6	-176.5	179.9	178.7	98.4	23	112.2	L231 G232 K233 E237 A238 E239	L231-R235 WeakPolarHBondContact O-CB 3.45Å; L231-R235 PolarHBondContact O-N 2.71Å; G232-R235 PolarHBondContact O-N 3.08Å; K233-R235 VanDerWaalsContact C-N 3.27Å; K233-R235 PolarHBondContact O-N 3.38Å; R235-E237 PolarHBondContact O-N 3.29Å; R235-A238 PolarHBondContact O-N 3.39Å; R235-E239 HydrophobicContact CG-CG 4.46Å; R235-E239 WeakPolarHBondContact CG-OE1 3.42Å; R235-E239 IonicContact CZ-OE1 3.12Å; R235-E239 VanDerWaalsContact CZ-OE1 3.26Å; R235-E239 IonicContact NE-OE1 2.71Å; R235-E239 PolarHBondContact NE-OE1 2.99Å; R235-E239 IonicContact NH2-OE1 3.98Å; R235-E239 PolarHBondContact NH2-OE1 2.95Å; R235-E239 WeakPolarHBondContact O-CB 3.46Å; R235-E239 WeakPolarHBondContact O-CG 3.41Å; R235-E239 PolarHBondContact O-N 3.28Å
236	T	96.1	Very high	96.1	Very high	71 Å²	71	94.4 Å²	94.4	44%	0.436	49%	0.489	S	S	.	.	H	α-helix	trans	-66.8	-23.9	177.7	58.6	0	0	0	0	113.2	G232 K233 K240	G232-T236 WeakPolarHBondContact O-CG2 3.3Å; G232-T236 PolarHBondContact O-N 3.37Å; G232-T236 PolarHBondContact O-OG1 3.15Å; K233-T236 PolarHBondContact O-N 2.94Å; K233-T236 PolarHBondContact O-OG1 2.94Å; T236-K240 WeakPolarHBondContact O-CE 3.43Å; T236-K240 WeakPolarHBondContact O-CG 3.46Å; T236-K240 PolarHBondContact O-N 3.29Å; T236-K240 VanDerWaalsContact O-N 3.14Å
237	E	96.6	Very high	96	Very high	85 Å²	85	95 Å²	95	40%	0.397	48%	0.483	S	S	.	.	H	α-helix	trans	-75.9	-46.1	173.7	-155.1	62.2	-112.7	0	0	111.3	K233 L234 R235 E239 K240 Q241	K233-E237 PolarHBondContact O-N 2.96Å; L234-E237 PolarHBondContact O-N 2.89Å; R235-E237 PolarHBondContact O-N 3.29Å; E237-E239 VanDerWaalsContact C-N 3.3Å; E237-E239 PolarHBondContact O-N 2.97Å; E237-K240 CarbonylContact O-C 3.53Å; E237-K240 WeakPolarHBondContact O-CA 3.44Å; E237-K240 WeakPolarHBondContact O-CB 3.44Å; E237-K240 PolarHBondContact O-N 3.15Å; E237-K240 WeakPolarHBondContact OE1-CE 3.11Å; E237-K240 IonicContact OE1-NZ 2.63Å; E237-K240 PolarHBondContact OE1-NZ 2.68Å; E237-K240 IonicContact OE2-NZ 3.22Å; E237-K240 PolarHBondContact OE2-NZ 2.68Å; E237-Q241 WeakPolarHBondContact O-CG 3.33Å; E237-Q241 PolarHBondContact O-N 2.84Å
238	A	95.4	Very high	95.9	Very high	56 Å²	56	93.3 Å²	93.3	46%	0.463	48%	0.483	S	S	.	.	H	α-helix	trans	-58.3	-41.7	172.1	0	0	0	0	0	111.9	L234 R235 K240 Q241 G242	L234-A238 PolarHBondContact O-N 3.2Å; R235-A238 PolarHBondContact O-N 3.39Å; A238-K240 VanDerWaalsContact C-N 3.27Å; A238-K240 PolarHBondContact O-N 3.4Å; A238-Q241 PolarHBondContact O-N 2.76Å; A238-G242 PolarHBondContact O-N 3.22Å
239	E	97	Very high	95.9	Very high	86 Å²	86	94.8 Å²	94.8	40%	0.402	48%	0.479	S	S	.	.	H	α-helix	trans	-66.1	-25.4	174.8	-72.3	171.9	179.6	0	0	113	R235 E237 Q243	R235-E239 HydrophobicContact CG-CG 4.46Å; R235-E239 WeakPolarHBondContact CG-OE1 3.42Å; R235-E239 IonicContact CZ-OE1 3.12Å; R235-E239 VanDerWaalsContact CZ-OE1 3.26Å; R235-E239 IonicContact NE-OE1 2.71Å; R235-E239 PolarHBondContact NE-OE1 2.99Å; R235-E239 IonicContact NH2-OE1 3.98Å; R235-E239 PolarHBondContact NH2-OE1 2.95Å; R235-E239 WeakPolarHBondContact O-CB 3.46Å; R235-E239 WeakPolarHBondContact O-CG 3.41Å; R235-E239 PolarHBondContact O-N 3.28Å; E237-E239 VanDerWaalsContact C-N 3.3Å; E237-E239 PolarHBondContact O-N 2.97Å; E239-Q243 VanDerWaalsContact O-CG 3.3Å; E239-Q243 WeakPolarHBondContact O-CG 3.27Å; E239-Q243 PolarHBondContact O-NE2 3.31Å
240	K	93.6	Very high	95.9	Very high	93 Å²	93	98.1 Å²	98.1	40%	0.404	49%	0.488	S	S	.	.	H	α-helix	trans	-80.9	-41.1	171	-83.9	179.6	-75.1	143.9	0	112.5	T236 E237 A238 Q243 V244	T236-K240 WeakPolarHBondContact O-CE 3.43Å; T236-K240 WeakPolarHBondContact O-CG 3.46Å; T236-K240 PolarHBondContact O-N 3.29Å; T236-K240 VanDerWaalsContact O-N 3.14Å; E237-K240 CarbonylContact O-C 3.53Å; E237-K240 WeakPolarHBondContact O-CA 3.44Å; E237-K240 WeakPolarHBondContact O-CB 3.44Å; E237-K240 PolarHBondContact O-N 3.15Å; E237-K240 WeakPolarHBondContact OE1-CE 3.11Å; E237-K240 IonicContact OE1-NZ 2.63Å; E237-K240 PolarHBondContact OE1-NZ 2.68Å; E237-K240 IonicContact OE2-NZ 3.22Å; E237-K240 PolarHBondContact OE2-NZ 2.68Å; A238-K240 VanDerWaalsContact C-N 3.27Å; A238-K240 PolarHBondContact O-N 3.4Å; K240-Q243 WeakPolarHBondContact O-CB 3.44Å; K240-Q243 PolarHBondContact O-N 2.86Å; K240-V244 PolarHBondContact O-N 3.43Å
241	Q	94.1	Very high	95.8	Very high	127 Å²	127	99.1 Å²	99.1	59%	0.593	49%	0.492	S	S	*	.	H	α-helix	trans	-62.4	-44.9	176.7	-73.3	173.1	-20.8	0	0	110.8	E237 A238 Q243 V244 Q245	E237-Q241 WeakPolarHBondContact O-CG 3.33Å; E237-Q241 PolarHBondContact O-N 2.84Å; A238-Q241 PolarHBondContact O-N 2.76Å; Q241-Q243 VanDerWaalsContact C-N 3.29Å; Q241-Q243 PolarHBondContact O-N 2.67Å; Q241-V244 WeakPolarHBondContact O-CA 3.38Å; Q241-V244 WeakPolarHBondContact O-CB 3.4Å; Q241-V244 PolarHBondContact O-N 2.75Å; Q241-Q245 PolarHBondContact O-N 3.47Å
242	G	96.4	Very high	95.7	Very high	26 Å²	26	98 Å²	98	27%	0.268	49%	0.487	S	S	.	.	H	α-helix	trans	-60	-34.6	172.8	0	0	0	0	0	113.6	A238 V244 Q245 M246	A238-G242 PolarHBondContact O-N 3.22Å; G242-V244 VanDerWaalsContact C-N 3.34Å; G242-Q245 PolarHBondContact O-N 2.99Å; G242-M246 WeakPolarHBondContact O-CG 3.38Å; G242-M246 PolarHBondContact O-N 3.28Å
243	Q	96.1	Very high	95.7	Very high	94 Å²	94	101.7 Å²	101.7	44%	0.439	50%	0.496	S	S	.	.	H	α-helix	trans	-70.5	-26.8	172.1	-74.6	172.1	49.9	0	0	113.7	E239 K240 Q241 M246 R247	E239-Q243 VanDerWaalsContact O-CG 3.3Å; E239-Q243 WeakPolarHBondContact O-CG 3.27Å; E239-Q243 PolarHBondContact O-NE2 3.31Å; K240-Q243 WeakPolarHBondContact O-CB 3.44Å; K240-Q243 PolarHBondContact O-N 2.86Å; Q241-Q243 VanDerWaalsContact C-N 3.29Å; Q241-Q243 PolarHBondContact O-N 2.67Å; Q243-M246 HydrophobicContact CG-CE 4.35Å; Q243-R247 WeakPolarHBondContact O-CG 3.34Å; Q243-R247 PolarHBondContact O-N 2.91Å; Q243-R247 PolarHBondContact O-NE 3.38Å; Q243-R247 PolarHBondContact O-NH1 2.91Å; Q243-R247 PolarHBondContact O-NH2 2.93Å
244	V	93.4	Very high	95.7	Very high	72 Å²	72	100.3 Å²	100.3	44%	0.436	49%	0.492	S	S	.	.	H	α-helix	trans	-74.6	-46.2	171.8	173.2	0	0	0	0	109.7	K240 Q241 G242 R247 L248	K240-V244 PolarHBondContact O-N 3.43Å; Q241-V244 WeakPolarHBondContact O-CA 3.38Å; Q241-V244 WeakPolarHBondContact O-CB 3.4Å; Q241-V244 PolarHBondContact O-N 2.75Å; G242-V244 VanDerWaalsContact C-N 3.34Å; V244-R247 PolarHBondContact O-N 3.37Å; V244-L248 HydrophobicContact CG1-CD1 3.94Å; V244-L248 HydrophobicContact CG1-CG 4.43Å; V244-L248 WeakPolarHBondContact O-CG 3.3Å; V244-L248 PolarHBondContact O-N 2.87Å
245	Q	95.7	Very high	95.7	Very high	113 Å²	113	99.6 Å²	99.6	53%	0.528	49%	0.486	S	S	.	.	H	α-helix	trans	-54.2	-55.1	175.6	178.2	178.7	-9.9	0	0	111.6	Q241 G242 R247 L248 E249	Q241-Q245 PolarHBondContact O-N 3.47Å; G242-Q245 PolarHBondContact O-N 2.99Å; Q245-R247 VanDerWaalsContact C-N 3.26Å; Q245-R247 PolarHBondContact O-N 3.16Å; Q245-L248 PolarHBondContact O-N 3.41Å; Q245-E249 HydrophobicContact CG-CG 4.36Å; Q245-E249 VanDerWaalsContact CG-OE1 3.23Å; Q245-E249 WeakPolarHBondContact CG-OE1 3.39Å; Q245-E249 PolarHBondContact NE2-OE1 2.93Å; Q245-E249 WeakPolarHBondContact O-CG 3.23Å; Q245-E249 PolarHBondContact O-N 2.95Å
246	M	95.9	Very high	95.6	Very high	106 Å²	106	97 Å²	97	52%	0.522	48%	0.481	S	S	.	.	H	α-helix	trans	-57.4	-36.8	179.6	-71.4	-173.2	-58	0	0	112.7	G242 Q243 E249 E250	G242-M246 WeakPolarHBondContact O-CG 3.38Å; G242-M246 PolarHBondContact O-N 3.28Å; Q243-M246 HydrophobicContact CG-CE 4.35Å; M246-E249 PolarHBondContact O-N 3.35Å; M246-E250 WeakPolarHBondContact O-CB 3.43Å; M246-E250 VanDerWaalsContact O-CG 3.27Å; M246-E250 WeakPolarHBondContact O-CG 3.4Å; M246-E250 PolarHBondContact O-N 2.93Å
247	R	95.7	Very high	95.6	Very high	130 Å²	130	96.8 Å²	96.8	49%	0.491	48%	0.478	S	S	.	.	H	α-helix	trans	-69.1	-35.9	176.4	-78.3	-172.3	-64.9	-94.7	-3.1	113	Q243 V244 Q245 E251	Q243-R247 WeakPolarHBondContact O-CG 3.34Å; Q243-R247 PolarHBondContact O-N 2.91Å; Q243-R247 PolarHBondContact O-NE 3.38Å; Q243-R247 PolarHBondContact O-NH1 2.91Å; Q243-R247 PolarHBondContact O-NH2 2.93Å; V244-R247 PolarHBondContact O-N 3.37Å; Q245-R247 VanDerWaalsContact C-N 3.26Å; Q245-R247 PolarHBondContact O-N 3.16Å; R247-E251 WeakPolarHBondContact O-CB 3.48Å; R247-E251 PolarHBondContact O-N 3.47Å
248	L	95.1	Very high	95.6	Very high	105 Å²	105	97.7 Å²	97.7	55%	0.55	48%	0.48	S	S	.	.	H	α-helix	trans	-70.7	-37.3	175.2	-67.4	171	0	0	0	111.1	V244 Q245 E251 L252	V244-L248 HydrophobicContact CG1-CD1 3.94Å; V244-L248 HydrophobicContact CG1-CG 4.43Å; V244-L248 WeakPolarHBondContact O-CG 3.3Å; V244-L248 PolarHBondContact O-N 2.87Å; Q245-L248 PolarHBondContact O-N 3.41Å; L248-E251 PolarHBondContact O-N 3.33Å; L248-L252 WeakPolarHBondContact O-CB 3.38Å; L248-L252 PolarHBondContact O-N 2.89Å
249	E	95.8	Very high	95.6	Very high	94 Å²	94	100.7 Å²	100.7	44%	0.439	48%	0.483	S	S	.	.	H	α-helix	trans	-65.5	-42.6	172.7	-69.9	169.6	176.4	0	0	111.8	Q245 M246 L252 M253	Q245-E249 HydrophobicContact CG-CG 4.36Å; Q245-E249 VanDerWaalsContact CG-OE1 3.23Å; Q245-E249 WeakPolarHBondContact CG-OE1 3.39Å; Q245-E249 PolarHBondContact NE2-OE1 2.93Å; Q245-E249 WeakPolarHBondContact O-CG 3.23Å; Q245-E249 PolarHBondContact O-N 2.95Å; M246-E249 PolarHBondContact O-N 3.35Å; E249-L252 PolarHBondContact O-N 3.2Å; E249-M253 WeakPolarHBondContact O-CB 3.37Å; E249-M253 WeakPolarHBondContact O-CG 3.37Å; E249-M253 PolarHBondContact O-N 3.33Å
250	E	97	Very high	95.6	Very high	134 Å²	134	103.8 Å²	103.8	63%	0.626	49%	0.491	S	S	*	.	H	α-helix	trans	-61.2	-43.8	172.5	-78.2	175.4	169.1	0	0	112.1	M246 H254	M246-E250 WeakPolarHBondContact O-CB 3.43Å; M246-E250 VanDerWaalsContact O-CG 3.27Å; M246-E250 WeakPolarHBondContact O-CG 3.4Å; M246-E250 PolarHBondContact O-N 2.93Å; E250-H254 VanDerWaalsContact O-CB 3.27Å; E250-H254 WeakPolarHBondContact O-CB 3.41Å; E250-H254 PolarHBondContact O-N 2.75Å
251	E	95.5	Very high	95.8	Very high	121 Å²	121	102.7 Å²	102.7	57%	0.565	49%	0.492	S	S	*	.	H	α-helix	trans	-68.6	-39.4	178.2	-176.6	159.7	-150.1	0	0	112.2	R247 L248 H254 M255	R247-E251 WeakPolarHBondContact O-CB 3.48Å; R247-E251 PolarHBondContact O-N 3.47Å; L248-E251 PolarHBondContact O-N 3.33Å; E251-H254 PolarHBondContact O-N 3.04Å; E251-M255 WeakPolarHBondContact O-CB 2.96Å; E251-M255 PolarHBondContact O-N 2.96Å
252	L	95.6	Very high	95.8	Very high	96 Å²	96	100 Å²	100	50%	0.503	48%	0.482	S	S	.	.	H	α-helix	trans	-64.9	-45.4	174.7	-177.1	155.1	0	0	0	111.5	L248 E249 H254 M255 Q256	L248-L252 WeakPolarHBondContact O-CB 3.38Å; L248-L252 PolarHBondContact O-N 2.89Å; E249-L252 PolarHBondContact O-N 3.2Å; L252-H254 PolarHBondContact O-N 3.04Å; L252-M255 WeakPolarHBondContact O-CB 3.14Å; L252-M255 PolarHBondContact O-N 2.78Å; L252-Q256 HydrophobicContact CD2-CG 4.28Å; L252-Q256 WeakPolarHBondContact O-CG 3.25Å; L252-Q256 PolarHBondContact O-N 3.04Å
253	M	95.9	Very high	95.9	Very high	112 Å²	112	104.4 Å²	104.4	55%	0.552	50%	0.498	S	S	*	.	H	α-helix	trans	-57	-47.6	172.1	-85.2	-84.5	-70.7	0	0	111.6	E249 M255 Q256 D257	E249-M253 WeakPolarHBondContact O-CB 3.37Å; E249-M253 WeakPolarHBondContact O-CG 3.37Å; E249-M253 PolarHBondContact O-N 3.33Å; M253-M255 VanDerWaalsContact C-N 3.3Å; M253-M255 PolarHBondContact O-N 2.91Å; M253-Q256 PolarHBondContact O-N 3.44Å; M253-D257 WeakPolarHBondContact O-CB 3.24Å; M253-D257 PolarHBondContact O-N 2.72Å
254	H	96.1	Very high	95.9	Very high	106 Å²	106	103.1 Å²	103.1	49%	0.491	50%	0.5	S	S	.	.	H	α-helix	trans	-65.8	-30.3	178.3	176.6	-140.4	0	0	0	112.9	E250 E251 L252 K258	E250-H254 VanDerWaalsContact O-CB 3.27Å; E250-H254 WeakPolarHBondContact O-CB 3.41Å; E250-H254 PolarHBondContact O-N 2.75Å; E251-H254 PolarHBondContact O-N 3.04Å; L252-H254 PolarHBondContact O-N 3.04Å; H254-K258 PolarHBondContact CE1-NZ 3.05Å; H254-K258 VanDerWaalsContact NE2-CE 3.33Å; H254-K258 WeakPolarHBondContact NE2-CE 3.46Å; H254-K258 VanDerWaalsContact O-CG 3.32Å; H254-K258 WeakPolarHBondContact O-CG 3.5Å; H254-K258 PolarHBondContact O-N 3.24Å
255	M	95.1	Very high	96.1	Very high	96 Å²	96	105.2 Å²	105.2	47%	0.473	51%	0.505	S	S	.	.	H	α-helix	trans	-71.5	-44.3	172.2	-170.2	-174.1	-61.8	0	0	111.7	E251 L252 M253 K258 F259	E251-M255 WeakPolarHBondContact O-CB 2.96Å; E251-M255 PolarHBondContact O-N 2.96Å; L252-M255 WeakPolarHBondContact O-CB 3.14Å; L252-M255 PolarHBondContact O-N 2.78Å; M253-M255 VanDerWaalsContact C-N 3.3Å; M253-M255 PolarHBondContact O-N 2.91Å; M255-K258 PolarHBondContact O-N 2.91Å; M255-F259 HydrophobicContact CG-CD2 3.98Å; M255-F259 HydrophobicContact CG-CE2 3.49Å; M255-F259 VanDerWaalsContact CG-CE2 3.49Å; M255-F259 HydrophobicContact CG-CZ 4.06Å; M255-F259 WeakPolarHBondContact O-CD2 3.38Å; M255-F259 PolarHBondContact O-N 3.37Å; M255-F259 HydrophobicContact SD-CE2 3.81Å; M255-F259 HydrophobicContact SD-CZ 4.33Å
256	Q	95.7	Very high	96.1	Very high	113 Å²	113	105.2 Å²	105.2	53%	0.528	51%	0.505	S	S	.	.	H	α-helix	trans	-63.7	-40.5	174.9	-72.2	-176.4	-3.2	0	0	112.3	L252 M253 K258 F259 R260	L252-Q256 HydrophobicContact CD2-CG 4.28Å; L252-Q256 WeakPolarHBondContact O-CG 3.25Å; L252-Q256 PolarHBondContact O-N 3.04Å; M253-Q256 PolarHBondContact O-N 3.44Å; Q256-K258 VanDerWaalsContact C-N 3.35Å; Q256-K258 PolarHBondContact O-N 3.27Å; Q256-F259 PolarHBondContact O-N 3.18Å; Q256-R260 WeakPolarHBondContact O-CB 3.44Å; Q256-R260 PolarHBondContact O-N 3.1Å
257	D	96.9	Very high	96.2	Very high	67 Å²	67	104.7 Å²	104.7	36%	0.358	50%	0.501	S	S	.	.	H	α-helix	trans	-61	-41.8	175.2	-91.7	4.3	0	0	0	111.9	M253 R260 V261	M253-D257 WeakPolarHBondContact O-CB 3.24Å; M253-D257 PolarHBondContact O-N 2.72Å; D257-R260 VanDerWaalsContact CG-NH2 3.33Å; D257-R260 PolarHBondContact O-N 3.08Å; D257-R260 IonicContact OD1-CZ 2.69Å; D257-R260 IonicContact OD1-NH1 2.76Å; D257-R260 PolarHBondContact OD1-NH1 2.92Å; D257-R260 IonicContact OD1-NH2 2.91Å; D257-R260 PolarHBondContact OD1-NH2 3.2Å; D257-R260 IonicContact OD2-NH2 3.26Å; D257-V261 WeakPolarHBondContact O-CG2 3.43Å; D257-V261 PolarHBondContact O-N 3.28Å; D257-V261 VanDerWaalsContact O-N 3.14Å
258	K	96.5	Very high	96.3	Very high	105 Å²	105	103.9 Å²	103.9	46%	0.457	51%	0.506	S	S	.	.	H	α-helix	trans	-61.9	-54.8	172.9	-76.1	167.5	178.9	170	0	111.7	H254 M255 Q256 R260 V261 D262	H254-K258 PolarHBondContact CE1-NZ 3.05Å; H254-K258 VanDerWaalsContact NE2-CE 3.33Å; H254-K258 WeakPolarHBondContact NE2-CE 3.46Å; H254-K258 VanDerWaalsContact O-CG 3.32Å; H254-K258 WeakPolarHBondContact O-CG 3.5Å; H254-K258 PolarHBondContact O-N 3.24Å; M255-K258 PolarHBondContact O-N 2.91Å; Q256-K258 VanDerWaalsContact C-N 3.35Å; Q256-K258 PolarHBondContact O-N 3.27Å; K258-R260 PolarHBondContact O-N 2.93Å; K258-V261 CarbonylContact O-C 3.54Å; K258-V261 WeakPolarHBondContact O-CA 3.45Å; K258-V261 WeakPolarHBondContact O-CB 3.45Å; K258-V261 PolarHBondContact O-N 3.25Å; K258-D262 VanDerWaalsContact O-CG 3.26Å; K258-D262 PolarHBondContact O-N 3.09Å
259	F	94.9	Very high	96.4	Very high	118 Å²	118	103.2 Å²	103.2	52%	0.518	50%	0.502	S	S	.	.	H	α-helix	trans	-58.9	-33.4	179.9	-68.6	-40.5	0	0	0	112.3	M255 Q256 D262 L263	M255-F259 HydrophobicContact CG-CD2 3.98Å; M255-F259 HydrophobicContact CG-CE2 3.49Å; M255-F259 VanDerWaalsContact CG-CE2 3.49Å; M255-F259 HydrophobicContact CG-CZ 4.06Å; M255-F259 WeakPolarHBondContact O-CD2 3.38Å; M255-F259 PolarHBondContact O-N 3.37Å; M255-F259 HydrophobicContact SD-CE2 3.81Å; M255-F259 HydrophobicContact SD-CZ 4.33Å; Q256-F259 PolarHBondContact O-N 3.18Å; F259-D262 PolarHBondContact O-N 2.86Å; F259-L263 VanDerWaalsContact O-CB 3.23Å; F259-L263 WeakPolarHBondContact O-CB 3.15Å; F259-L263 WeakPolarHBondContact O-CD1 3.43Å; F259-L263 WeakPolarHBondContact O-CG 3.39Å; F259-L263 PolarHBondContact O-N 3.45Å
260	R	97.4	Very high	96.5	Very high	151 Å²	151	102.8 Å²	102.8	57%	0.57	50%	0.502	S	S	*	.	H	α-helix	trans	-65.5	-36.4	172.9	-171.3	178.9	65.8	-114.7	-6.4	112.7	Q256 D257 K258 S264	Q256-R260 WeakPolarHBondContact O-CB 3.44Å; Q256-R260 PolarHBondContact O-N 3.1Å; D257-R260 VanDerWaalsContact CG-NH2 3.33Å; D257-R260 PolarHBondContact O-N 3.08Å; D257-R260 IonicContact OD1-CZ 2.69Å; D257-R260 IonicContact OD1-NH1 2.76Å; D257-R260 PolarHBondContact OD1-NH1 2.92Å; D257-R260 IonicContact OD1-NH2 2.91Å; D257-R260 PolarHBondContact OD1-NH2 3.2Å; D257-R260 IonicContact OD2-NH2 3.26Å; K258-R260 PolarHBondContact O-N 2.93Å; R260-S264 PolarHBondContact O-N 2.89Å
261	V	96.9	Very high	96.5	Very high	71 Å²	71	101.1 Å²	101.1	43%	0.43	49%	0.494	S	S	.	.	H	α-helix	trans	-69.6	-50.6	172.8	173.1	0	0	0	0	110.5	D257 K258 L263 S264 E265	D257-V261 WeakPolarHBondContact O-CG2 3.43Å; D257-V261 PolarHBondContact O-N 3.28Å; D257-V261 VanDerWaalsContact O-N 3.14Å; K258-V261 CarbonylContact O-C 3.54Å; K258-V261 WeakPolarHBondContact O-CA 3.45Å; K258-V261 WeakPolarHBondContact O-CB 3.45Å; K258-V261 PolarHBondContact O-N 3.25Å; V261-L263 VanDerWaalsContact C-N 3.32Å; V261-L263 PolarHBondContact O-N 3.16Å; V261-S264 CarbonylContact O-C 3.54Å; V261-S264 WeakPolarHBondContact O-CA 3.49Å; V261-S264 WeakPolarHBondContact O-CB 3.38Å; V261-S264 PolarHBondContact O-N 2.97Å; V261-S264 PolarHBondContact O-OG 3.27Å; V261-E265 PolarHBondContact O-N 2.92Å
262	D	95.1	Very high	96.7	Very high	69 Å²	69	100.7 Å²	100.7	37%	0.369	49%	0.492	S	S	.	.	H	α-helix	trans	-58	-43.4	-179.1	-57.3	-26.2	0	0	0	111.4	K258 F259 S264 E265 H266	K258-D262 VanDerWaalsContact O-CG 3.26Å; K258-D262 PolarHBondContact O-N 3.09Å; F259-D262 PolarHBondContact O-N 2.86Å; D262-S264 VanDerWaalsContact C-N 3.32Å; D262-S264 PolarHBondContact O-N 3.01Å; D262-E265 PolarHBondContact O-N 3.13Å; D262-H266 PolarHBondContact O-CD2 3.37Å; D262-H266 PolarHBondContact O-N 3.36Å
263	L	97.3	Very high	96.7	Very high	119 Å²	119	101.1 Å²	101.1	62%	0.623	49%	0.494	S	S	*	.	H	α-helix	trans	-62.1	-36.1	173	-74.3	168.9	0	0	0	112.5	F259 V261 Q267	F259-L263 VanDerWaalsContact O-CB 3.23Å; F259-L263 WeakPolarHBondContact O-CB 3.15Å; F259-L263 WeakPolarHBondContact O-CD1 3.43Å; F259-L263 WeakPolarHBondContact O-CG 3.39Å; F259-L263 PolarHBondContact O-N 3.45Å; V261-L263 VanDerWaalsContact C-N 3.32Å; V261-L263 PolarHBondContact O-N 3.16Å; L263-Q267 VanDerWaalsContact O-CB 3.3Å; L263-Q267 WeakPolarHBondContact O-CB 3.23Å; L263-Q267 PolarHBondContact O-N 2.75Å
264	S	97.3	Very high	96.8	Very high	68 Å²	68	100.4 Å²	100.4	48%	0.476	49%	0.489	S	S	.	.	H	α-helix	trans	-71.6	-33.6	176.1	76.9	0	0	0	0	112.9	R260 V261 D262 L268	R260-S264 PolarHBondContact O-N 2.89Å; V261-S264 CarbonylContact O-C 3.54Å; V261-S264 WeakPolarHBondContact O-CA 3.49Å; V261-S264 WeakPolarHBondContact O-CB 3.38Å; V261-S264 PolarHBondContact O-N 2.97Å; V261-S264 PolarHBondContact O-OG 3.27Å; D262-S264 VanDerWaalsContact C-N 3.32Å; D262-S264 PolarHBondContact O-N 3.01Å; S264-L268 WeakPolarHBondContact O-CB 3.41Å; S264-L268 PolarHBondContact O-N 3.44Å
265	E	97.2	Very high	96.9	Very high	115 Å²	115	100.9 Å²	100.9	54%	0.537	49%	0.492	S	S	.	.	H	α-helix	trans	-69.3	-42.1	172.5	-66.1	-165.2	174.2	0	0	111.2	V261 D262 L268 I269	V261-E265 PolarHBondContact O-N 2.92Å; D262-E265 PolarHBondContact O-N 3.13Å; E265-L268 PolarHBondContact O-N 2.78Å; E265-I269 WeakPolarHBondContact O-CD1 3.39Å; E265-I269 VanDerWaalsContact O-CG1 3.29Å; E265-I269 WeakPolarHBondContact O-CG1 3.2Å; E265-I269 PolarHBondContact O-N 2.76Å
266	H	95.1	Very high	97	Very high	114 Å²	114	100.6 Å²	100.6	53%	0.528	49%	0.489	S	S	.	.	H	α-helix	trans	-63.3	-42.1	173.7	-68.1	-22	0	0	0	112.6	D262 L268 I269 I270	D262-H266 PolarHBondContact O-CD2 3.37Å; D262-H266 PolarHBondContact O-N 3.36Å; H266-L268 PolarHBondContact O-N 3.37Å; H266-I269 PolarHBondContact O-N 2.86Å; H266-I270 WeakPolarHBondContact O-CG1 3.27Å; H266-I270 PolarHBondContact O-N 2.98Å
267	Q	97.6	Very high	97.1	Very high	95 Å²	95	102.2 Å²	102.2	44%	0.444	49%	0.491	S	S	.	.	H	α-helix	trans	-60.4	-43.8	174.8	179.5	59.1	30.1	0	0	111.7	L263 I269 I270 E271	L263-Q267 VanDerWaalsContact O-CB 3.3Å; L263-Q267 WeakPolarHBondContact O-CB 3.23Å; L263-Q267 PolarHBondContact O-N 2.75Å; Q267-I269 VanDerWaalsContact C-N 3.33Å; Q267-I269 PolarHBondContact O-N 2.83Å; Q267-I270 PolarHBondContact O-N 3.47Å; Q267-E271 WeakPolarHBondContact CG-OE1 3.45Å; Q267-E271 PolarHBondContact NE2-OE1 3.32Å; Q267-E271 WeakPolarHBondContact O-CG 3.44Å; Q267-E271 PolarHBondContact O-N 3.26Å
268	L	97.9	Very high	97.2	Very high	112 Å²	112	102 Å²	102	59%	0.586	49%	0.489	S	S	*	.	H	α-helix	trans	-62.6	-37.9	176.1	-178.1	64.3	0	0	0	112.5	S264 E265 H266 E271 Q272	S264-L268 WeakPolarHBondContact O-CB 3.41Å; S264-L268 PolarHBondContact O-N 3.44Å; E265-L268 PolarHBondContact O-N 2.78Å; H266-L268 PolarHBondContact O-N 3.37Å; L268-E271 PolarHBondContact O-N 2.88Å; L268-Q272 PolarHBondContact O-N 3.46Å
269	I	97.8	Very high	97.2	Very high	91 Å²	91	100.9 Å²	100.9	47%	0.467	49%	0.488	S	S	.	.	H	α-helix	trans	-66.7	-40.7	175.1	-68.5	163.1	0	0	0	110.9	E265 H266 Q267 Q272 L273	E265-I269 WeakPolarHBondContact O-CD1 3.39Å; E265-I269 VanDerWaalsContact O-CG1 3.29Å; E265-I269 WeakPolarHBondContact O-CG1 3.2Å; E265-I269 PolarHBondContact O-N 2.76Å; H266-I269 PolarHBondContact O-N 2.86Å; Q267-I269 VanDerWaalsContact C-N 3.33Å; Q267-I269 PolarHBondContact O-N 2.83Å; I269-Q272 PolarHBondContact O-N 3.47Å; I269-L273 HydrophobicContact CG2-CD1 3.97Å; I269-L273 HydrophobicContact CG2-CG 4.49Å; I269-L273 VanDerWaalsContact O-CG 3.31Å; I269-L273 WeakPolarHBondContact O-CG 3.3Å; I269-L273 PolarHBondContact O-N 2.84Å
270	I	97.3	Very high	97.3	Very high	85 Å²	85	101.1 Å²	101.1	44%	0.436	49%	0.493	S	S	.	.	H	α-helix	trans	-61.4	-49.3	174.8	-68.9	163.7	0	0	0	110	H266 Q267 Q272 L273 E274	H266-I270 WeakPolarHBondContact O-CG1 3.27Å; H266-I270 PolarHBondContact O-N 2.98Å; Q267-I270 PolarHBondContact O-N 3.47Å; I270-Q272 VanDerWaalsContact C-N 3.31Å; I270-Q272 PolarHBondContact O-N 3.05Å; I270-L273 PolarHBondContact O-N 3.33Å; I270-L273 VanDerWaalsContact O-N 3.11Å; I270-E274 HydrophobicContact CG2-CG 4.33Å; I270-E274 WeakPolarHBondContact O-CG 3.47Å; I270-E274 PolarHBondContact O-N 2.96Å
271	E	98	Very high	97.4	Very high	99 Å²	99	96.7 Å²	96.7	46%	0.463	49%	0.489	S	S	.	.	H	α-helix	trans	-59.2	-39.2	178.1	-73.6	172.9	-160	0	0	112.6	Q267 L268 H275	Q267-E271 WeakPolarHBondContact CG-OE1 3.45Å; Q267-E271 PolarHBondContact NE2-OE1 3.32Å; Q267-E271 WeakPolarHBondContact O-CG 3.44Å; Q267-E271 PolarHBondContact O-N 3.26Å; L268-E271 PolarHBondContact O-N 2.88Å; E271-H275 WeakPolarHBondContact O-CB 3.21Å; E271-H275 PolarHBondContact O-N 3.33Å
272	Q	98.1	Very high	97.4	Very high	113 Å²	113	99.6 Å²	99.6	53%	0.528	50%	0.498	S	S	.	.	H	α-helix	trans	-64.1	-46.4	173	-176.8	-178.9	-27.4	0	0	111.8	L268 I269 I270 E274 H275 E276	L268-Q272 PolarHBondContact O-N 3.46Å; I269-Q272 PolarHBondContact O-N 3.47Å; I270-Q272 VanDerWaalsContact C-N 3.31Å; I270-Q272 PolarHBondContact O-N 3.05Å; Q272-E274 PolarHBondContact O-N 3.42Å; Q272-H275 WeakPolarHBondContact O-CB 3.49Å; Q272-H275 PolarHBondContact O-N 3.31Å; Q272-E276 PolarHBondContact NE2-OE1 2.94Å; Q272-E276 PolarHBondContact O-N 2.8Å
273	L	97.6	Very high	97.5	Very high	104 Å²	104	98.5 Å²	98.5	55%	0.545	50%	0.499	S	S	.	.	H	α-helix	trans	-67	-35.5	-179.3	-70.8	171.4	0	0	0	112.3	I269 I270 R277	I269-L273 HydrophobicContact CG2-CD1 3.97Å; I269-L273 HydrophobicContact CG2-CG 4.49Å; I269-L273 VanDerWaalsContact O-CG 3.31Å; I269-L273 WeakPolarHBondContact O-CG 3.3Å; I269-L273 PolarHBondContact O-N 2.84Å; I270-L273 PolarHBondContact O-N 3.33Å; I270-L273 VanDerWaalsContact O-N 3.11Å; L273-R277 VanDerWaalsContact O-CB 3.3Å; L273-R277 WeakPolarHBondContact O-CB 3.39Å; L273-R277 PolarHBondContact O-N 3.16Å
274	E	97.4	Very high	97.5	Very high	97 Å²	97	99.7 Å²	99.7	45%	0.453	50%	0.503	S	S	.	.	H	α-helix	trans	-65.9	-39.4	171.1	-71	-163.4	148.1	0	0	112	I270 Q272 R277 N278	I270-E274 HydrophobicContact CG2-CG 4.33Å; I270-E274 WeakPolarHBondContact O-CG 3.47Å; I270-E274 PolarHBondContact O-N 2.96Å; Q272-E274 PolarHBondContact O-N 3.42Å; E274-R277 WeakPolarHBondContact O-CB 3.4Å; E274-R277 PolarHBondContact O-N 3.47Å; E274-N278 WeakPolarHBondContact O-CB 3.26Å; E274-N278 PolarHBondContact O-N 2.96Å; E274-N278 PolarHBondContact O-ND2 2.86Å; E274-N278 PolarHBondContact O-OD1 2.93Å
275	H	97.8	Very high	97.5	Very high	117 Å²	117	102 Å²	102	54%	0.542	51%	0.506	S	S	.	.	H	α-helix	trans	-64.5	-45.8	174.7	-174.2	54.7	0	0	0	112	E271 Q272 R277 N278 I279	E271-H275 WeakPolarHBondContact O-CB 3.21Å; E271-H275 PolarHBondContact O-N 3.33Å; Q272-H275 WeakPolarHBondContact O-CB 3.49Å; Q272-H275 PolarHBondContact O-N 3.31Å; H275-R277 PolarHBondContact O-N 3.42Å; H275-N278 PolarHBondContact O-N 3.12Å; H275-I279 WeakPolarHBondContact O-CG1 3.38Å; H275-I279 PolarHBondContact O-N 2.73Å
276	E	97.8	Very high	97.6	Very high	90 Å²	90	100.8 Å²	100.8	42%	0.421	50%	0.5	S	S	.	.	H	α-helix	trans	-61.4	-41.9	174.4	-73.1	-178.3	-153.3	0	0	111.9	Q272 N278 I279 L280	Q272-E276 PolarHBondContact NE2-OE1 2.94Å; Q272-E276 PolarHBondContact O-N 2.8Å; E276-N278 VanDerWaalsContact C-N 3.34Å; E276-N278 PolarHBondContact O-N 3.02Å; E276-I279 PolarHBondContact O-N 2.7Å; E276-L280 VanDerWaalsContact O-CG 3.32Å; E276-L280 WeakPolarHBondContact O-CG 3.42Å; E276-L280 PolarHBondContact O-N 2.87Å
277	R	97.6	Very high	97.6	Very high	147 Å²	147	100.3 Å²	100.3	56%	0.555	50%	0.497	S	S	*	.	H	α-helix	trans	-57.7	-45.5	172.5	-176.6	-156	73.9	-176.6	0.3	111.7	L273 E274 H275 L280 A281	L273-R277 VanDerWaalsContact O-CB 3.3Å; L273-R277 WeakPolarHBondContact O-CB 3.39Å; L273-R277 PolarHBondContact O-N 3.16Å; E274-R277 WeakPolarHBondContact O-CB 3.4Å; E274-R277 PolarHBondContact O-N 3.47Å; H275-R277 PolarHBondContact O-N 3.42Å; R277-L280 PolarHBondContact O-N 3.1Å; R277-A281 WeakPolarHBondContact O-CB 3.44Å; R277-A281 PolarHBondContact O-N 3.48Å
278	N	97.8	Very high	97.6	Very high	61 Å²	61	101.8 Å²	101.8	33%	0.326	51%	0.505	S	S	.	.	H	α-helix	trans	-66.2	-44.2	-178.2	-66.1	-17.5	0	0	0	111.3	E274 H275 E276 L280 A281 E282	E274-N278 WeakPolarHBondContact O-CB 3.26Å; E274-N278 PolarHBondContact O-N 2.96Å; E274-N278 PolarHBondContact O-ND2 2.86Å; E274-N278 PolarHBondContact O-OD1 2.93Å; H275-N278 PolarHBondContact O-N 3.12Å; E276-N278 VanDerWaalsContact C-N 3.34Å; E276-N278 PolarHBondContact O-N 3.02Å; N278-L280 VanDerWaalsContact C-N 3.31Å; N278-L280 PolarHBondContact O-N 2.59Å; N278-A281 PolarHBondContact O-N 3.03Å; N278-A281 VanDerWaalsContact O-N 3.15Å; N278-E282 WeakPolarHBondContact O-CG 3.33Å; N278-E282 PolarHBondContact O-N 3.32Å
279	I	97.7	Very high	97.6	Very high	83 Å²	83	102.4 Å²	102.4	43%	0.426	50%	0.5	S	S	.	.	H	α-helix	trans	-58.3	-43.1	174.3	-68.7	165.5	0	0	0	111.1	H275 E276 E282 A283	H275-I279 WeakPolarHBondContact O-CG1 3.38Å; H275-I279 PolarHBondContact O-N 2.73Å; E276-I279 PolarHBondContact O-N 2.7Å; I279-E282 PolarHBondContact O-N 2.8Å; I279-A283 VanDerWaalsContact O-CB 3.31Å; I279-A283 WeakPolarHBondContact O-CB 3.3Å; I279-A283 PolarHBondContact O-N 3.32Å
280	L	97.2	Very high	97.6	Very high	122 Å²	122	102.8 Å²	102.8	64%	0.639	50%	0.499	S	S	*	.	H	α-helix	trans	-67.3	-35.2	177.6	-71.1	171.3	0	0	0	112.5	E276 R277 N278 M284	E276-L280 VanDerWaalsContact O-CG 3.32Å; E276-L280 WeakPolarHBondContact O-CG 3.42Å; E276-L280 PolarHBondContact O-N 2.87Å; R277-L280 PolarHBondContact O-N 3.1Å; N278-L280 VanDerWaalsContact C-N 3.31Å; N278-L280 PolarHBondContact O-N 2.59Å; L280-M284 VanDerWaalsContact O-CB 3.32Å; L280-M284 WeakPolarHBondContact O-CB 3.4Å; L280-M284 PolarHBondContact O-N 3.01Å
281	A	98	Very high	97.6	Very high	58 Å²	58	104.1 Å²	104.1	48%	0.479	50%	0.504	S	S	.	.	H	α-helix	trans	-67.7	-45.7	174.7	0	0	0	0	0	112	R277 N278 A283 M284 E285	R277-A281 WeakPolarHBondContact O-CB 3.44Å; R277-A281 PolarHBondContact O-N 3.48Å; N278-A281 PolarHBondContact O-N 3.03Å; N278-A281 VanDerWaalsContact O-N 3.15Å; A281-A283 PolarHBondContact O-N 3.21Å; A281-M284 PolarHBondContact O-N 2.97Å; A281-E285 PolarHBondContact O-N 2.74Å
282	E	97.9	Very high	97.6	Very high	133 Å²	133	105.8 Å²	105.8	62%	0.621	51%	0.511	S	S	*	.	H	α-helix	trans	-60.6	-44.5	175.2	-72.6	176.2	-163.5	0	0	111.7	N278 I279 M284 E285 E286	N278-E282 WeakPolarHBondContact O-CG 3.33Å; N278-E282 PolarHBondContact O-N 3.32Å; I279-E282 PolarHBondContact O-N 2.8Å; E282-M284 VanDerWaalsContact C-N 3.34Å; E282-M284 PolarHBondContact O-N 3.38Å; E282-E285 PolarHBondContact O-N 2.89Å; E282-E286 PolarHBondContact O-N 2.87Å
283	A	97.9	Very high	97.6	Very high	46 Å²	46	106.5 Å²	106.5	38%	0.38	51%	0.514	S	S	.	.	H	α-helix	trans	-64.7	-36.6	176.1	0	0	0	0	0	112.4	I279 A281 K287	I279-A283 VanDerWaalsContact O-CB 3.31Å; I279-A283 WeakPolarHBondContact O-CB 3.3Å; I279-A283 PolarHBondContact O-N 3.32Å; A281-A283 PolarHBondContact O-N 3.21Å; A283-K287 WeakPolarHBondContact O-CB 3.33Å; A283-K287 WeakPolarHBondContact O-CG 3.42Å; A283-K287 PolarHBondContact O-N 3.03Å
284	M	97.1	Very high	97.6	Very high	144 Å²	144	107 Å²	107	71%	0.709	52%	0.517	S	S	*	.	H	α-helix	trans	-67.5	-40.7	173.7	179.6	171.3	167.8	0	0	111.8	L280 A281 E282 K287 M288	L280-M284 VanDerWaalsContact O-CB 3.32Å; L280-M284 WeakPolarHBondContact O-CB 3.4Å; L280-M284 PolarHBondContact O-N 3.01Å; A281-M284 PolarHBondContact O-N 2.97Å; E282-M284 VanDerWaalsContact C-N 3.34Å; E282-M284 PolarHBondContact O-N 3.38Å; M284-K287 PolarHBondContact O-N 2.6Å; M284-M288 WeakPolarHBondContact O-CB 3.32Å; M284-M288 PolarHBondContact O-N 3.21Å
285	E	97.5	Very high	97.6	Very high	116 Å²	116	107.1 Å²	107.1	54%	0.542	52%	0.52	S	S	.	.	H	α-helix	trans	-64.1	-43.6	175.5	-158.2	-142.2	119	0	0	111.2	A281 E282 K287 M288 R289	A281-E285 PolarHBondContact O-N 2.74Å; E282-E285 PolarHBondContact O-N 2.89Å; E285-K287 PolarHBondContact O-N 3.47Å; E285-M288 WeakPolarHBondContact O-CB 3.43Å; E285-M288 PolarHBondContact O-N 2.97Å; E285-R289 VanDerWaalsContact CD-NH2 3.31Å; E285-R289 WeakPolarHBondContact O-CB 3.45Å; E285-R289 PolarHBondContact O-N 3.19Å; E285-R289 IonicContact OE1-CZ 3.19Å; E285-R289 IonicContact OE1-NE 2.67Å; E285-R289 PolarHBondContact OE1-NE 3.44Å; E285-R289 IonicContact OE1-NH2 3.29Å; E285-R289 PolarHBondContact OE1-NH2 2.89Å; E285-R289 IonicContact OE2-NH2 2.68Å
286	E	97.8	Very high	97.6	Very high	90 Å²	90	105.6 Å²	105.6	42%	0.421	51%	0.513	S	S	.	.	H	α-helix	trans	-58.1	-47.1	174.2	-174.8	-171.1	-117.4	0	0	111.8	E282 M288 R289 E290	E282-E286 PolarHBondContact O-N 2.87Å; E286-M288 VanDerWaalsContact C-N 3.31Å; E286-M288 PolarHBondContact O-N 3.04Å; E286-R289 WeakPolarHBondContact O-CB 3.45Å; E286-R289 PolarHBondContact O-N 3.01Å; E286-R289 VanDerWaalsContact O-N 3.13Å; E286-E290 PolarHBondContact O-N 3.14Å
287	K	96.4	Very high	97.6	Very high	103 Å²	103	103.9 Å²	103.9	45%	0.448	51%	0.509	S	S	.	.	H	α-helix	trans	-67.4	-31.3	179.6	-66.7	-74.2	152.5	-73.1	0	112.4	A283 M284 E285 E290 H291	A283-K287 WeakPolarHBondContact O-CB 3.33Å; A283-K287 WeakPolarHBondContact O-CG 3.42Å; A283-K287 PolarHBondContact O-N 3.03Å; M284-K287 PolarHBondContact O-N 2.6Å; E285-K287 PolarHBondContact O-N 3.47Å; K287-E290 VanDerWaalsContact CD-OE2 3.31Å; K287-E290 WeakPolarHBondContact CD-OE2 3.43Å; K287-E290 WeakPolarHBondContact CE-OE2 3.45Å; K287-E290 IonicContact NZ-OE1 3.87Å; K287-E290 PolarHBondContact NZ-OE1 2.8Å; K287-E290 IonicContact NZ-OE2 2.71Å; K287-E290 PolarHBondContact NZ-OE2 2.68Å; K287-E290 VanDerWaalsContact NZ-OE2 3.13Å; K287-H291 WeakPolarHBondContact O-CB 3.26Å; K287-H291 PolarHBondContact O-N 2.64Å
288	M	97.8	Very high	97.6	Very high	126 Å²	126	104 Å²	104	62%	0.621	51%	0.514	S	S	*	.	H	α-helix	trans	-66.9	-41.2	170.3	-172.6	61.7	177.2	0	0	111.6	M284 E285 E286 H291 Q292	M284-M288 WeakPolarHBondContact O-CB 3.32Å; M284-M288 PolarHBondContact O-N 3.21Å; E285-M288 WeakPolarHBondContact O-CB 3.43Å; E285-M288 PolarHBondContact O-N 2.97Å; E286-M288 VanDerWaalsContact C-N 3.31Å; E286-M288 PolarHBondContact O-N 3.04Å; M288-H291 PolarHBondContact O-N 2.64Å; M288-Q292 PolarHBondContact O-N 3.35Å
289	R	97.9	Very high	97.6	Very high	126 Å²	126	106 Å²	106	48%	0.475	52%	0.522	S	S	.	.	H	α-helix	trans	-63.8	-43.8	176.4	-150.2	-174.7	-54.5	122.1	-4.8	111.9	E285 E286 Q292 H293	E285-R289 VanDerWaalsContact CD-NH2 3.31Å; E285-R289 WeakPolarHBondContact O-CB 3.45Å; E285-R289 PolarHBondContact O-N 3.19Å; E285-R289 IonicContact OE1-CZ 3.19Å; E285-R289 IonicContact OE1-NE 2.67Å; E285-R289 PolarHBondContact OE1-NE 3.44Å; E285-R289 IonicContact OE1-NH2 3.29Å; E285-R289 PolarHBondContact OE1-NH2 2.89Å; E285-R289 IonicContact OE2-NH2 2.68Å; E286-R289 WeakPolarHBondContact O-CB 3.45Å; E286-R289 PolarHBondContact O-N 3.01Å; E286-R289 VanDerWaalsContact O-N 3.13Å; R289-Q292 PolarHBondContact O-N 2.91Å; R289-H293 PolarHBondContact O-N 2.98Å
290	E	97.5	Very high	97.6	Very high	98 Å²	98	104.8 Å²	104.8	46%	0.458	52%	0.516	S	S	.	.	H	α-helix	trans	-60	-45	171.1	-76.5	176.1	-169.7	0	0	112	E286 K287 H293 L294	E286-E290 PolarHBondContact O-N 3.14Å; K287-E290 VanDerWaalsContact CD-OE2 3.31Å; K287-E290 WeakPolarHBondContact CD-OE2 3.43Å; K287-E290 WeakPolarHBondContact CE-OE2 3.45Å; K287-E290 IonicContact NZ-OE1 3.87Å; K287-E290 PolarHBondContact NZ-OE1 2.8Å; K287-E290 IonicContact NZ-OE2 2.71Å; K287-E290 PolarHBondContact NZ-OE2 2.68Å; K287-E290 VanDerWaalsContact NZ-OE2 3.13Å; E290-H293 PolarHBondContact O-N 3.05Å; E290-L294 WeakPolarHBondContact O-CB 3.4Å; E290-L294 PolarHBondContact O-N 3.23Å
291	H	97.7	Very high	97.6	Very high	114 Å²	114	103.3 Å²	103.3	53%	0.528	51%	0.509	S	S	.	.	H	α-helix	trans	-63.6	-42.5	179	-173	76.7	0	0	0	112	K287 M288 L294 L295	K287-H291 WeakPolarHBondContact O-CB 3.26Å; K287-H291 PolarHBondContact O-N 2.64Å; M288-H291 PolarHBondContact O-N 2.64Å; H291-L294 PolarHBondContact O-N 2.68Å; H291-L295 WeakPolarHBondContact O-CB 3.25Å; H291-L295 PolarHBondContact O-N 2.97Å
292	Q	97.4	Very high	97.5	Very high	133 Å²	133	102.4 Å²	102.4	62%	0.621	51%	0.506	S	S	*	.	H	α-helix	trans	-61.9	-42.1	174.6	-172.4	179.8	8	0	0	111.6	M288 R289 L295 Q296	M288-Q292 PolarHBondContact O-N 3.35Å; R289-Q292 PolarHBondContact O-N 2.91Å; Q292-L295 PolarHBondContact O-N 3.47Å; Q292-Q296 PolarHBondContact O-N 2.91Å
293	H	97.8	Very high	97.4	Very high	128 Å²	128	101.2 Å²	101.2	59%	0.593	50%	0.501	S	S	*	.	H	α-helix	trans	-64.3	-43	175.4	-178.7	61.4	0	0	0	112.4	R289 E290 L295 Q296 V297	R289-H293 PolarHBondContact O-N 2.98Å; E290-H293 PolarHBondContact O-N 3.05Å; H293-L295 VanDerWaalsContact C-N 3.32Å; H293-L295 PolarHBondContact O-N 3.46Å; H293-Q296 WeakPolarHBondContact O-CB 3.49Å; H293-Q296 PolarHBondContact O-N 3.1Å; H293-V297 WeakPolarHBondContact O-CG2 3.38Å; H293-V297 PolarHBondContact O-N 3.42Å
294	L	98	Very high	97.4	Very high	116 Å²	116	103.2 Å²	103.2	61%	0.607	50%	0.503	S	S	*	.	H	α-helix	trans	-64.4	-36.2	175.7	-178.9	60.9	0	0	0	112.2	E290 H291 K298	E290-L294 WeakPolarHBondContact O-CB 3.4Å; E290-L294 PolarHBondContact O-N 3.23Å; H291-L294 PolarHBondContact O-N 2.68Å; L294-K298 VanDerWaalsContact O-CB 3.29Å; L294-K298 WeakPolarHBondContact O-CB 3.47Å; L294-K298 PolarHBondContact O-N 3Å
295	L	97.5	Very high	97.3	Very high	98 Å²	98	99.6 Å²	99.6	51%	0.513	49%	0.489	S	S	.	.	H	α-helix	trans	-65.2	-40.6	174.1	-177.6	61.6	0	0	0	111.7	H291 Q292 H293 K298 M299	H291-L295 WeakPolarHBondContact O-CB 3.25Å; H291-L295 PolarHBondContact O-N 2.97Å; Q292-L295 PolarHBondContact O-N 3.47Å; H293-L295 VanDerWaalsContact C-N 3.32Å; H293-L295 PolarHBondContact O-N 3.46Å; L295-K298 PolarHBondContact O-N 2.87Å; L295-M299 PolarHBondContact O-N 2.72Å
296	Q	97.7	Very high	97.1	Very high	85 Å²	85	96.5 Å²	96.5	40%	0.397	48%	0.483	S	S	.	.	H	α-helix	trans	-60.9	-53.2	173.2	179.1	60	45.3	0	0	111.2	Q292 H293 K298 M299 D300	Q292-Q296 PolarHBondContact O-N 2.91Å; H293-Q296 WeakPolarHBondContact O-CB 3.49Å; H293-Q296 PolarHBondContact O-N 3.1Å; Q296-K298 VanDerWaalsContact C-N 3.26Å; Q296-K298 PolarHBondContact O-N 3.29Å; Q296-M299 WeakPolarHBondContact O-CA 3.22Å; Q296-M299 WeakPolarHBondContact O-CB 3.41Å; Q296-M299 PolarHBondContact O-N 2.99Å; Q296-D300 PolarHBondContact NE2-OD1 3.46Å; Q296-D300 PolarHBondContact NE2-OD2 3.39Å; Q296-D300 PolarHBondContact O-N 3.11Å
297	V	98.1	Very high	96.9	Very high	54 Å²	54	95.6 Å²	95.6	33%	0.327	48%	0.484	S	S	.	.	H	α-helix	trans	-58.5	-37.6	178	173.1	0	0	0	0	111.8	H293 D300 L301	H293-V297 WeakPolarHBondContact O-CG2 3.38Å; H293-V297 PolarHBondContact O-N 3.42Å; V297-D300 PolarHBondContact O-N 3.04Å; V297-L301 HydrophobicContact CG1-CD1 4.02Å; V297-L301 HydrophobicContact CG1-CG 4.47Å; V297-L301 WeakPolarHBondContact O-CB 3.3Å; V297-L301 WeakPolarHBondContact O-CG 3.49Å; V297-L301 PolarHBondContact O-N 2.9Å
298	K	97.5	Very high	96.9	Very high	150 Å²	150	97 Å²	97	65%	0.652	49%	0.487	S	S	*	.	H	α-helix	trans	-64.9	-36.6	173.6	179.7	-174.1	172.9	-170.4	0	112.5	L294 L295 Q296 G302	L294-K298 VanDerWaalsContact O-CB 3.29Å; L294-K298 WeakPolarHBondContact O-CB 3.47Å; L294-K298 PolarHBondContact O-N 3Å; L295-K298 PolarHBondContact O-N 2.87Å; Q296-K298 VanDerWaalsContact C-N 3.26Å; Q296-K298 PolarHBondContact O-N 3.29Å; K298-G302 PolarHBondContact O-N 3.18Å
299	M	97.2	Very high	96.7	Very high	103 Å²	103	98.6 Å²	98.6	51%	0.507	49%	0.486	S	S	.	.	H	α-helix	trans	-68.6	-44.1	175.1	-175.3	174.4	66.5	0	0	111.2	L295 Q296 G302 M303	L295-M299 PolarHBondContact O-N 2.72Å; Q296-M299 WeakPolarHBondContact O-CA 3.22Å; Q296-M299 WeakPolarHBondContact O-CB 3.41Å; Q296-M299 PolarHBondContact O-N 2.99Å; M299-G302 CarbonylContact O-C 3.6Å; M299-G302 VanDerWaalsContact O-CA 3.31Å; M299-G302 WeakPolarHBondContact O-CA 3.47Å; M299-G302 PolarHBondContact O-N 2.91Å; M299-M303 PolarHBondContact O-N 3.16Å
300	D	97.4	Very high	96.4	Very high	57 Å²	57	96.6 Å²	96.6	31%	0.305	49%	0.488	S	S	.	.	H	α-helix	trans	-63.4	-46.8	179.1	-63.2	-36.9	0	0	0	111.6	Q296 V297 G302 M303 E304	Q296-D300 PolarHBondContact NE2-OD1 3.46Å; Q296-D300 PolarHBondContact NE2-OD2 3.39Å; Q296-D300 PolarHBondContact O-N 3.11Å; V297-D300 PolarHBondContact O-N 3.04Å; D300-G302 PolarHBondContact O-N 3.48Å; D300-M303 HydrophobicContact CB-CE 4.46Å; D300-M303 WeakPolarHBondContact O-CB 3.29Å; D300-M303 PolarHBondContact O-N 3.41Å; D300-M303 VanDerWaalsContact O-N 3.07Å; D300-M303 WeakPolarHBondContact OD1-CE 3.32Å; D300-E304 PolarHBondContact O-N 3.49Å
301	L	97.3	Very high	96.1	Very high	91 Å²	91	97.1 Å²	97.1	48%	0.476	49%	0.493	S	S	.	.	H	α-helix	trans	-61.6	-30.4	170.3	-70.8	171.5	0	0	0	112.6	V297 E304 V305	V297-L301 HydrophobicContact CG1-CD1 4.02Å; V297-L301 HydrophobicContact CG1-CG 4.47Å; V297-L301 WeakPolarHBondContact O-CB 3.3Å; V297-L301 WeakPolarHBondContact O-CG 3.49Å; V297-L301 PolarHBondContact O-N 2.9Å; L301-E304 PolarHBondContact O-N 2.85Å; L301-V305 WeakPolarHBondContact O-CB 3.47Å; L301-V305 VanDerWaalsContact O-CG2 3.31Å; L301-V305 WeakPolarHBondContact O-CG2 3.31Å; L301-V305 PolarHBondContact O-N 2.89Å
302	G	96.4	Very high	95.8	Very high	40 Å²	40	95.8 Å²	95.8	41%	0.412	49%	0.49	S	S	.	.	H	α-helix	trans	-65	-40.2	172.2	0	0	0	0	0	112.6	K298 M299 D300 A306	K298-G302 PolarHBondContact O-N 3.18Å; M299-G302 CarbonylContact O-C 3.6Å; M299-G302 VanDerWaalsContact O-CA 3.31Å; M299-G302 WeakPolarHBondContact O-CA 3.47Å; M299-G302 PolarHBondContact O-N 2.91Å; D300-G302 PolarHBondContact O-N 3.48Å; G302-A306 PolarHBondContact O-N 3Å
303	M	95.8	Very high	95.2	Very high	107 Å²	107	94.9 Å²	94.9	53%	0.527	49%	0.485	S	S	.	.	H	α-helix	trans	-67.6	-42.7	173.3	-65.3	-169.3	-71.8	0	0	111.6	M299 D300 A306 T307	M299-M303 PolarHBondContact O-N 3.16Å; D300-M303 HydrophobicContact CB-CE 4.46Å; D300-M303 WeakPolarHBondContact O-CB 3.29Å; D300-M303 PolarHBondContact O-N 3.41Å; D300-M303 VanDerWaalsContact O-N 3.07Å; D300-M303 WeakPolarHBondContact OD1-CE 3.32Å; M303-A306 WeakPolarHBondContact O-CB 3.46Å; M303-A306 PolarHBondContact O-N 3.34Å; M303-A306 VanDerWaalsContact O-N 3.16Å; M303-T307 PolarHBondContact O-N 3.49Å
304	E	96.8	Very high	94	Very high	89 Å²	89	92.4 Å²	92.4	42%	0.416	48%	0.483	S	S	.	.	H	α-helix	trans	-59.1	-47.4	173	-76.8	-167.6	-147.5	0	0	112.2	D300 L301 A306 T307 Y308	D300-E304 PolarHBondContact O-N 3.49Å; L301-E304 PolarHBondContact O-N 2.85Å; E304-A306 PolarHBondContact O-N 3.4Å; E304-T307 PolarHBondContact O-N 3.37Å; E304-T307 VanDerWaalsContact O-N 3.14Å; E304-T307 PolarHBondContact O-OG1 2.95Å; E304-Y308 HydrophobicContact CB-CD2 4.25Å; E304-Y308 HydrophobicContact CB-CE2 3.83Å; E304-Y308 WeakPolarHBondContact O-CD2 3.39Å; E304-Y308 PolarHBondContact O-N 3.49Å; E304-Y308 PolarHBondContact OE2-OH 3.27Å
305	V	95.2	Very high	92.8	Very high	68 Å²	68	92.7 Å²	92.7	41%	0.412	48%	0.481	S	S	.	.	H	α-helix	trans	-62.7	-30.8	176.8	169.4	0	0	0	0	111.6	L301 R309	L301-V305 WeakPolarHBondContact O-CB 3.47Å; L301-V305 VanDerWaalsContact O-CG2 3.31Å; L301-V305 WeakPolarHBondContact O-CG2 3.31Å; L301-V305 PolarHBondContact O-N 2.89Å; V305-R309 WeakPolarHBondContact O-CB 3.41Å; V305-R309 WeakPolarHBondContact O-CD 3.11Å; V305-R309 WeakPolarHBondContact O-CG 3.42Å; V305-R309 PolarHBondContact O-N 3.29Å; V305-R309 VanDerWaalsContact O-N 3.17Å
306	A	94.1	Very high	91.1	Very high	51 Å²	51	95.6 Å²	95.6	42%	0.421	49%	0.485	S	S	.	.	H	α-helix	trans	-69.3	-43.1	172.5	0	0	0	0	0	112.4	G302 M303 E304 R309 T310	G302-A306 PolarHBondContact O-N 3Å; M303-A306 WeakPolarHBondContact O-CB 3.46Å; M303-A306 PolarHBondContact O-N 3.34Å; M303-A306 VanDerWaalsContact O-N 3.16Å; E304-A306 PolarHBondContact O-N 3.4Å; A306-R309 PolarHBondContact O-N 3.22Å; A306-T310 PolarHBondContact O-N 2.87Å; A306-T310 VanDerWaalsContact O-N 3.1Å
307	T	92.5	Very high	89.3	Confident	71 Å²	71	96.6 Å²	96.6	44%	0.436	50%	0.496	S	S	.	.	H	α-helix	trans	-69.7	-41.2	177.1	59.6	0	0	0	0	112.2	M303 E304 R309 T310 L311	M303-T307 PolarHBondContact O-N 3.49Å; E304-T307 PolarHBondContact O-N 3.37Å; E304-T307 VanDerWaalsContact O-N 3.14Å; E304-T307 PolarHBondContact O-OG1 2.95Å; T307-R309 PolarHBondContact O-N 2.96Å; T307-T310 PolarHBondContact O-N 2.89Å; T307-T310 PolarHBondContact O-OG1 3.37Å; T307-L311 WeakPolarHBondContact O-CD1 3.41Å; T307-L311 PolarHBondContact O-N 3.45Å
308	Y	96.6	Very high	87.4	Confident	133 Å²	133	96.7 Å²	96.7	52%	0.522	51%	0.509	S	S	.	.	H	α-helix	trans	-59.3	-36.1	173.4	-66.3	-52	0	0	0	112	E304 L312	E304-Y308 HydrophobicContact CB-CD2 4.25Å; E304-Y308 HydrophobicContact CB-CE2 3.83Å; E304-Y308 WeakPolarHBondContact O-CD2 3.39Å; E304-Y308 PolarHBondContact O-N 3.49Å; E304-Y308 PolarHBondContact OE2-OH 3.27Å; Y308-L312 WeakPolarHBondContact O-CB 3.47Å; Y308-L312 WeakPolarHBondContact O-CD1 3.28Å; Y308-L312 VanDerWaalsContact O-CG 3.24Å; Y308-L312 WeakPolarHBondContact O-CG 3.36Å; Y308-L312 PolarHBondContact O-N 2.79Å
309	R	94.2	Very high	85.4	Confident	158 Å²	158	96 Å²	96	60%	0.596	51%	0.509	S	S	*	.	H	α-helix	trans	-64.5	-48.6	173	-76.5	169.1	-175	174.9	3.3	112.2	V305 A306 T307 L311 L312 E313	V305-R309 WeakPolarHBondContact O-CB 3.41Å; V305-R309 WeakPolarHBondContact O-CD 3.11Å; V305-R309 WeakPolarHBondContact O-CG 3.42Å; V305-R309 PolarHBondContact O-N 3.29Å; V305-R309 VanDerWaalsContact O-N 3.17Å; A306-R309 PolarHBondContact O-N 3.22Å; T307-R309 PolarHBondContact O-N 2.96Å; R309-L311 VanDerWaalsContact C-N 3.34Å; R309-L311 PolarHBondContact O-N 3.31Å; R309-L312 PolarHBondContact O-N 3.24Å; R309-E313 WeakPolarHBondContact O-CB 3.44Å; R309-E313 VanDerWaalsContact O-CG 3.31Å; R309-E313 WeakPolarHBondContact O-CG 3.45Å; R309-E313 PolarHBondContact O-N 2.71Å
310	T	90.8	Very high	83.1	Confident	84 Å²	84	96.6 Å²	96.6	52%	0.515	51%	0.511	S	S	.	.	H	α-helix	trans	-65.8	-35.2	-179.4	58.6	0	0	0	0	112.6	A306 T307 E313 S314	A306-T310 PolarHBondContact O-N 2.87Å; A306-T310 VanDerWaalsContact O-N 3.1Å; T307-T310 PolarHBondContact O-N 2.89Å; T307-T310 PolarHBondContact O-OG1 3.37Å; T310-E313 PolarHBondContact O-N 2.69Å; T310-S314 WeakPolarHBondContact O-CB 3.49Å; T310-S314 PolarHBondContact O-N 3.37Å
311	L	93.1	Very high	80.9	Confident	110 Å²	110	97.2 Å²	97.2	58%	0.576	53%	0.531	S	S	*	.	H	α-helix	trans	-62.2	-52.3	171.3	-89	81.5	0	0	0	111.3	T307 R309 E313 S314 E315	T307-L311 WeakPolarHBondContact O-CD1 3.41Å; T307-L311 PolarHBondContact O-N 3.45Å; R309-L311 VanDerWaalsContact C-N 3.34Å; R309-L311 PolarHBondContact O-N 3.31Å; L311-E313 VanDerWaalsContact C-N 3.27Å; L311-E313 PolarHBondContact O-N 3.32Å; L311-S314 PolarHBondContact O-N 2.64Å; L311-S314 VanDerWaalsContact O-N 3.12Å; L311-S314 PolarHBondContact O-OG 2.73Å; L311-E315 PolarHBondContact O-N 3.23Å
312	L	90.3	Very high	78.8	Confident	86 Å²	86	97.1 Å²	97.1	45%	0.45	54%	0.543	S	S	.	.	H	α-helix	trans	-62.5	-32.3	179.1	-72.7	168.9	0	0	0	112.9	Y308 R309 R316	Y308-L312 WeakPolarHBondContact O-CB 3.47Å; Y308-L312 WeakPolarHBondContact O-CD1 3.28Å; Y308-L312 VanDerWaalsContact O-CG 3.24Å; Y308-L312 WeakPolarHBondContact O-CG 3.36Å; Y308-L312 PolarHBondContact O-N 2.79Å; R309-L312 PolarHBondContact O-N 3.24Å; L312-R316 WeakPolarHBondContact O-CB 3.38Å; L312-R316 WeakPolarHBondContact O-CD 2.8Å; L312-R316 WeakPolarHBondContact O-CG 3.35Å; L312-R316 PolarHBondContact O-N 2.64Å
313	E	85	Confident	76.6	Confident	114 Å²	114	101 Å²	101	53%	0.533	56%	0.555	S	S	.	*	H	α-helix	trans	-70.9	-39.9	173.8	-75.1	168.1	-166.8	0	0	111.6	R309 T310 L311 R316 V317	R309-E313 WeakPolarHBondContact O-CB 3.44Å; R309-E313 VanDerWaalsContact O-CG 3.31Å; R309-E313 WeakPolarHBondContact O-CG 3.45Å; R309-E313 PolarHBondContact O-N 2.71Å; T310-E313 PolarHBondContact O-N 2.69Å; L311-E313 VanDerWaalsContact C-N 3.27Å; L311-E313 PolarHBondContact O-N 3.32Å; E313-R316 PolarHBondContact O-N 3.33Å; E313-V317 WeakPolarHBondContact O-CG2 3.43Å; E313-V317 PolarHBondContact O-N 2.98Å
314	S	73.1	Confident	74.3	Confident	76 Å²	76	106.4 Å²	106.4	53%	0.531	57%	0.569	S	S	.	*	H	α-helix	trans	-63.9	-40.5	174.1	77.8	0	0	0	0	112.7	T310 L311 V317 G318	T310-S314 WeakPolarHBondContact O-CB 3.49Å; T310-S314 PolarHBondContact O-N 3.37Å; L311-S314 PolarHBondContact O-N 2.64Å; L311-S314 VanDerWaalsContact O-N 3.12Å; L311-S314 PolarHBondContact O-OG 2.73Å; S314-V317 PolarHBondContact O-N 2.93Å; S314-G318 PolarHBondContact O-N 2.91Å
315	E	72.2	Confident	72.1	Confident	122 Å²	122	113.7 Å²	113.7	57%	0.57	59%	0.593	S	S	*	*	H	α-helix	trans	-65.8	-42.7	174.5	-175.6	178.9	-143.6	0	0	111.3	L311 V317 G318 M319	L311-E315 PolarHBondContact O-N 3.23Å; E315-V317 VanDerWaalsContact C-N 3.33Å; E315-V317 PolarHBondContact O-N 2.8Å; E315-G318 WeakPolarHBondContact O-CA 3.14Å; E315-G318 PolarHBondContact O-N 3.3Å; E315-G318 VanDerWaalsContact O-N 3.13Å; E315-M319 PolarHBondContact O-N 3.14Å
316	R	61.2	Low	69.8	Low	158 Å²	158	117.8 Å²	117.8	60%	0.596	61%	0.61	S	S	*	*	H	α-helix	trans	-60.4	-39.5	173.8	-76.7	167.2	-177.3	-155.6	0.7	112.2	L312 E313 M319 Q320	L312-R316 WeakPolarHBondContact O-CB 3.38Å; L312-R316 WeakPolarHBondContact O-CD 2.8Å; L312-R316 WeakPolarHBondContact O-CG 3.35Å; L312-R316 PolarHBondContact O-N 2.64Å; E313-R316 PolarHBondContact O-N 3.33Å; R316-M319 PolarHBondContact O-N 2.91Å; R316-Q320 WeakPolarHBondContact O-CB 3.31Å; R316-Q320 WeakPolarHBondContact O-CG 3.42Å; R316-Q320 PolarHBondContact O-N 3.45Å
317	V	59.9	Low	67.2	Low	106 Å²	106	121.9 Å²	121.9	64%	0.642	63%	0.629	S	S	*	*	H	α-helix	trans	-64.1	-42.8	173.7	169.5	0	0	0	0	110.8	E313 S314 E315 M319 Q320 G321	E313-V317 WeakPolarHBondContact O-CG2 3.43Å; E313-V317 PolarHBondContact O-N 2.98Å; S314-V317 PolarHBondContact O-N 2.93Å; E315-V317 VanDerWaalsContact C-N 3.33Å; E315-V317 PolarHBondContact O-N 2.8Å; V317-M319 PolarHBondContact O-N 3.27Å; V317-Q320 PolarHBondContact O-N 3.13Å; V317-G321 PolarHBondContact O-N 3.42Å; V317-G321 VanDerWaalsContact O-N 3.13Å
318	G	59.7	Low	65.1	Low	57 Å²	57	126.6 Å²	126.6	59%	0.588	65%	0.646	S	S	*	*	H	α-helix	trans	-56.7	-47.3	173.8	0	0	0	0	0	113.4	S314 E315	S314-G318 PolarHBondContact O-N 2.91Å; E315-G318 WeakPolarHBondContact O-CA 3.14Å; E315-G318 PolarHBondContact O-N 3.3Å; E315-G318 VanDerWaalsContact O-N 3.13Å
319	M	53.7	Low	62.6	Low	135 Å²	135	128 Å²	128	67%	0.665	66%	0.658	S	S	*	*	H	α-helix	trans	-76.8	-34.1	179.4	-63.6	-163.8	80.8	0	0	113.7	E315 R316 V317 G321 A322 N323	E315-M319 PolarHBondContact O-N 3.14Å; R316-M319 PolarHBondContact O-N 2.91Å; V317-M319 PolarHBondContact O-N 3.27Å; M319-G321 VanDerWaalsContact C-N 3.26Å; M319-G321 PolarHBondContact O-N 3.31Å; M319-A322 PolarHBondContact O-N 2.84Å; M319-A322 VanDerWaalsContact O-N 3.14Å; M319-N323 PolarHBondContact O-N 3.11Å
320	Q	50.3	Low	60.3	Low	115 Å²	115	128.8 Å²	128.8	54%	0.537	67%	0.668	S	S	.	*	H	α-helix	trans	-68.5	-24.6	177.3	-75.8	-178	22.6	0	0	112.5	R316 V317 A322 N323 R324	R316-Q320 WeakPolarHBondContact O-CB 3.31Å; R316-Q320 WeakPolarHBondContact O-CG 3.42Å; R316-Q320 PolarHBondContact O-N 3.45Å; V317-Q320 PolarHBondContact O-N 3.13Å; Q320-A322 PolarHBondContact O-N 2.86Å; Q320-N323 PolarHBondContact O-N 3.08Å; Q320-R324 WeakPolarHBondContact O-CB 3.34Å; Q320-R324 PolarHBondContact O-N 2.82Å
321	G	51.7	Low	58	Low	70 Å²	70	135.6 Å²	135.6	72%	0.722	68%	0.684	S	S	*	*	H	α-helix	trans	-57.1	-34	169.3	0	0	0	0	0	113.5	V317 M319	V317-G321 PolarHBondContact O-N 3.42Å; V317-G321 VanDerWaalsContact O-N 3.13Å; M319-G321 VanDerWaalsContact C-N 3.26Å; M319-G321 PolarHBondContact O-N 3.31Å
322	A	51.9	Low	55.8	Low	90 Å²	90	139.1 Å²	139.1	74%	0.744	70%	0.698	S	S	*	*	H	α-helix	trans	-86.3	-37.9	179.4	0	0	0	0	0	113.5	M319 Q320	M319-A322 PolarHBondContact O-N 2.84Å; M319-A322 VanDerWaalsContact O-N 3.14Å; Q320-A322 PolarHBondContact O-N 2.86Å
323	N	50.2	Low	53.7	Low	122 Å²	122	145.6 Å²	145.6	65%	0.652	72%	0.716	S	S	*	*	H	α-helix	trans	-91.6	-3.2	-165.2	-140	4.7	0	0	0	115.1	M319 Q320 R325	M319-N323 PolarHBondContact O-N 3.11Å; Q320-N323 PolarHBondContact O-N 3.08Å; N323-R325 PolarHBondContact O-N 3.35Å
324	R	48.4	Very low	52	Low	220 Å²	220	146.6 Å²	146.6	83%	0.83	72%	0.724	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.8	29.1	-169.2	-138.7	178.7	-166.7	-146	4.2	116.5	Q320	Q320-R324 WeakPolarHBondContact O-CB 3.34Å; Q320-R324 PolarHBondContact O-N 2.82Å
325	R	50.3	Low	50.7	Low	241 Å²	241	149.6 Å²	149.6	91%	0.909	73%	0.732	S	S	*	*	T	Hydrogen-bonded Turn	trans	-127.2	-4.4	179.1	-67.4	-165.2	-172.3	-167.8	5	115.7	N323	N323-R325 PolarHBondContact O-N 3.35Å
326	M	46.8	Very low	49.1	Very low	155 Å²	155	150.3 Å²	150.3	76%	0.764	74%	0.74	S	S	*	*	S	Bend	trans	-132.1	160.2	176.1	-83.8	-71.8	172.5	0	0	110.4
327	T	39.8	Very low	48.1	Very low	136 Å²	136	149.6 Å²	149.6	83%	0.834	75%	0.746	S	S	*	*			trans	59	41.7	178.9	63.2	0	0	0	0	116.6
328	Q	47.6	Very low	47	Very low	170 Å²	170	153.6 Å²	153.6	79%	0.794	76%	0.755	S	S	*	*			trans	-70.6	150.6	141.8	-158.9	176.7	-1	0	0	107.6
329	H	44.9	Very low	46.4	Very low	164 Å²	164	156.4 Å²	156.4	76%	0.759	76%	0.761	S	S	*	*			trans	76.1	80	-178	-52.8	53.1	0	0	0	116.9
330	Q	45.5	Very low	45.9	Very low	173 Å²	173	154.9 Å²	154.9	81%	0.808	76%	0.761	S	S	*	*	S	Bend		-177.5	146.8	114.2	-101	-176.8	19.3	0	0	112.9
331	R	42.9	Very low	45.5	Very low	227 Å²	227	153.8 Å²	153.8	86%	0.857	77%	0.771	S	S	*	*			trans	65.9	67.7	169.2	-59.7	176.2	-175.4	173.5	1.6	116.7	R333	R331-R333 PolarHBondContact O-N 2.95Å
332	E	46.3	Very low	44.9	Very low	185 Å²	185	158.7 Å²	158.7	86%	0.864	78%	0.776	S	S	*	*			trans	-64.5	121.6	147.5	-69.4	172.5	163.5	0	0	109.3
333	R	46.2	Very low	44	Very low	222 Å²	222	162.8 Å²	162.8	84%	0.838	78%	0.779	S	S	*	*			trans	-132	97.5	152.7	-74.8	-158.6	-59.1	179.3	1.8	106.8	R331 I335	R331-R333 PolarHBondContact O-N 2.95Å; R333-I335 PolarHBondContact O-N 3.24Å
334	I	49.5	Very low	43.2	Very low	135 Å²	135	168.5 Å²	168.5	69%	0.692	79%	0.793	S	S	*	*			trans	-63.2	122.2	171.5	-60.4	171.1	0	0	0	106.9	D336	I334-D336 WeakPolarHBondContact CG2-OD1 3.41Å
335	I	45	Very low	42.5	Very low	138 Å²	138	162.2 Å²	162.2	71%	0.708	78%	0.783	S	S	*	*			trans	-105.8	94.6	166	-59.9	179.1	0	0	0	105.4	R333 I337	R333-I335 PolarHBondContact O-N 3.24Å; I335-I337 VanDerWaalsContact C-N 3.33Å; I335-I337 HydrophobicContact CG2-CG1 4.11Å; I335-I337 PolarHBondContact O-N 3.49Å
336	D	38.7	Very low	42	Very low	137 Å²	137	156.8 Å²	156.8	73%	0.733	78%	0.779	S	S	*	*			trans	-68.3	93.7	171.6	-71.3	-42.8	0	0	0	108.8	I334 K338	I334-D336 WeakPolarHBondContact CG2-OD1 3.41Å; D336-K338 PolarHBondContact O-N 2.89Å
337	I	40.9	Very low	41.2	Very low	143 Å²	143	160.3 Å²	160.3	73%	0.733	78%	0.784	S	S	*	*			trans	-71.9	79.4	165	-55.7	-178.3	0	0	0	106.8	I335 V339	I335-I337 VanDerWaalsContact C-N 3.33Å; I335-I337 HydrophobicContact CG2-CG1 4.11Å; I335-I337 PolarHBondContact O-N 3.49Å; I337-V339 VanDerWaalsContact C-N 3.26Å; I337-V339 HydrophobicContact CG2-CG2 4.49Å; I337-V339 PolarHBondContact O-N 3.46Å
338	K	36.7	Very low	41.2	Very low	190 Å²	190	160.1 Å²	160.1	83%	0.826	78%	0.783	S	S	*	*			trans	-68.7	86.6	173.4	-173.8	174.3	-177.1	174.9	0	108.6	D336 P340	D336-K338 PolarHBondContact O-N 2.89Å; K338-P340 VanDerWaalsContact O-CD 3.29Å; K338-P340 WeakPolarHBondContact O-CD 3.38Å
339	V	47.4	Very low	40.4	Very low	116 Å²	116	156.8 Å²	156.8	70%	0.703	78%	0.778	S	S	*	*			trans	-53.1	119.6	171.9	179.6	0	0	0	0	108.1	I337 A341	I337-V339 VanDerWaalsContact C-N 3.26Å; I337-V339 HydrophobicContact CG2-CG2 4.49Å; I337-V339 PolarHBondContact O-N 3.46Å; V339-A341 PolarHBondContact O-N 2.93Å
340	P	41.9	Very low	40.2	Very low	103 Å²	103	155.2 Å²	155.2	67%	0.669	78%	0.78	S	S	*	*			trans	-66.4	124.3	174.4	-19.1	32.7	0	0	0	109.3	K338 Q342	K338-P340 VanDerWaalsContact O-CD 3.29Å; K338-P340 WeakPolarHBondContact O-CD 3.38Å; P340-Q342 VanDerWaalsContact C-N 3.26Å; P340-Q342 PolarHBondContact O-N 2.9Å
341	A	43.7	Very low	39.6	Very low	92 Å²	92	154.6 Å²	154.6	76%	0.76	78%	0.781	S	S	*	*			trans	-71.5	85.7	168.7	0	0	0	0	0	109.1	V339	V339-A341 PolarHBondContact O-N 2.93Å
342	Q	37.3	Very low	39.3	Very low	174 Å²	174	150 Å²	150	81%	0.813	78%	0.779	S	S	*	*			trans	-84.2	117.6	163.6	-73.4	-167.5	-23	0	0	108.4	P340 Y344	P340-Q342 VanDerWaalsContact C-N 3.26Å; P340-Q342 PolarHBondContact O-N 2.9Å; Q342-Y344 PolarHBondContact O-N 3.33Å
343	H	33.8	Very low	38.5	Very low	175 Å²	175	146.9 Å²	146.9	81%	0.81	78%	0.777	S	S	*	*			trans	-63.9	130	174.7	-69.3	-110.3	0	0	0	109.2	S345	H343-S345 PolarHBondContact O-N 3.43Å; H343-S345 VanDerWaalsContact O-N 3.08Å
344	Y	33.6	Very low	37.8	Very low	242 Å²	242	147.9 Å²	147.9	95%	0.949	78%	0.781	S	S	*	*			trans	-64.9	108.6	165.4	-99.3	-99.6	0	0	0	108.5	Q342	Q342-Y344 PolarHBondContact O-N 3.33Å
345	S	32.8	Very low	37.1	Very low	89 Å²	89	152.4 Å²	152.4	62%	0.622	79%	0.79	S	S	*	*			trans	-115	129.3	165	-178	0	0	0	0	107.1	H343 R347	H343-S345 PolarHBondContact O-N 3.43Å; H343-S345 VanDerWaalsContact O-N 3.08Å; S345-R347 PolarHBondContact O-N 3.49Å
346	P	40.4	Very low	36.3	Very low	126 Å²	126	154.3 Å²	154.3	82%	0.818	80%	0.795	S	S	*	*			trans	-74.9	85.3	-170.3	30.4	-35.5	0	0	0	111.4	T348	P346-T348 PolarHBondContact O-N 3.27Å
347	R	30.8	Very low	36.2	Very low	229 Å²	229	154.9 Å²	154.9	86%	0.864	80%	0.797	S	S	*	*			trans	-82.3	103.3	167.5	-84.8	-173	168.6	166.3	-1.5	110.8	S345 S349	S345-R347 PolarHBondContact O-N 3.49Å; R347-S349 PolarHBondContact O-N 2.84Å; R347-S349 VanDerWaalsContact O-N 3.11Å
348	T	39.2	Very low	35.8	Very low	133 Å²	133	154.5 Å²	154.5	82%	0.816	80%	0.796	S	S	*	*			trans	-50.9	109	153.8	37.2	0	0	0	0	109.1	P346 T350	P346-T348 PolarHBondContact O-N 3.27Å; T348-T350 PolarHBondContact O-N 2.89Å
349	S	31.4	Very low	35.5	Very low	100 Å²	100	154.1 Å²	154.1	70%	0.699	80%	0.799	S	S	*	*			trans	-90.6	80.8	-171.1	-175.7	0	0	0	0	111.6	R347 L351	R347-S349 PolarHBondContact O-N 2.84Å; R347-S349 VanDerWaalsContact O-N 3.11Å; S349-L351 PolarHBondContact O-N 3.2Å; S349-L351 VanDerWaalsContact O-N 3.12Å
350	T	39.5	Very low	34.8	Very low	130 Å²	130	159.3 Å²	159.3	80%	0.798	81%	0.806	S	S	*	*			trans	-59	111.2	163.5	51.4	0	0	0	0	109.7	T348	T348-T350 PolarHBondContact O-N 2.89Å
351	L	33	Very low	34.2	Very low	160 Å²	160	166.1 Å²	166.1	84%	0.838	82%	0.821	S	S	*	*			trans	-108.2	118.4	170.9	-102.1	170.3	0	0	0	110.4	S349	S349-L351 PolarHBondContact O-N 3.2Å; S349-L351 VanDerWaalsContact O-N 3.12Å
352	T	36.1	Very low	33.7	Very low	130 Å²	130	165.9 Å²	165.9	80%	0.798	82%	0.818	S	S	*	*			trans	-84.9	134.1	-171.5	50.8	0	0	0	0	112.6
353	S	29.9	Very low	33.4	Very low	120 Å²	120	162.7 Å²	162.7	84%	0.839	82%	0.816	S	S	*	*			trans	-164.6	92.6	137.8	-165.7	0	0	0	0	112.4
354	R	32.3	Very low	33.6	Very low	243 Å²	243	160.7 Å²	160.7	92%	0.917	82%	0.818	S	S	*	*			trans	-136.7	124.4	150.2	-152.1	177.5	-163.5	-165.3	5.5	107.8
355	R	33.8	Very low	33.3	Very low	230 Å²	230	154.6 Å²	154.6	87%	0.868	81%	0.806	S	S	*	*			trans	-68.4	131.8	172.5	-67.5	173.1	175.4	156.2	-3.5	107.7	I357	R355-I357 PolarHBondContact O-N 2.67Å
356	H	29.8	Very low	33.3	Very low	178 Å²	178	156.9 Å²	156.9	82%	0.824	81%	0.811	S	S	*	*			trans	-63.9	132.8	160.5	-97.3	-114.8	0	0	0	108.7
357	I	35.8	Very low	33	Very low	149 Å²	149	159 Å²	159	76%	0.764	82%	0.815	S	S	*	*			trans	-121	124.2	157.4	-66.8	175.7	0	0	0	103.7	R355 M359	R355-I357 PolarHBondContact O-N 2.67Å; I357-M359 PolarHBondContact O-N 3.38Å
358	D	33	Very low	32.9	Very low	135 Å²	135	160 Å²	160	72%	0.722	82%	0.818	S	S	*	*			trans	-71.8	98.2	-179.8	-59.3	-48.5	0	0	0	110.1	R360	D358-R360 VanDerWaalsContact C-N 3.3Å; D358-R360 PolarHBondContact O-N 3.19Å
359	M	30.3	Very low	32.4	Very low	182 Å²	182	163.4 Å²	163.4	90%	0.897	82%	0.816	S	S	*	*			trans	-72.5	92.4	160.6	-80.2	-157.1	-59.3	0	0	108.7	I357 Y361	I357-M359 PolarHBondContact O-N 3.38Å; M359-Y361 PolarHBondContact O-N 2.92Å
360	R	32.4	Very low	32.5	Very low	225 Å²	225	164.1 Å²	164.1	85%	0.849	82%	0.819	S	S	*	*			trans	-57.6	130.2	156.6	-75.2	-177	-96.1	-178	-9.3	108.6	D358 A362	D358-R360 VanDerWaalsContact C-N 3.3Å; D358-R360 PolarHBondContact O-N 3.19Å; R360-A362 PolarHBondContact O-N 3.49Å
361	Y	30.3	Very low	32.5	Very low	247 Å²	247	163.6 Å²	163.6	97%	0.969	82%	0.818	S	S	*	*			trans	-61.5	116.8	160.6	-105.1	-103.2	0	0	0	108.2	M359	M359-Y361 PolarHBondContact O-N 2.92Å
362	A	32.2	Very low	32.4	Very low	86 Å²	86	161.3 Å²	161.3	71%	0.711	81%	0.81	S	S	*	*			trans	-144.9	134.7	174	0	0	0	0	0	108.2	R360	R360-A362 PolarHBondContact O-N 3.49Å
363	S	31.8	Very low	31.9	Very low	108 Å²	108	161.5 Å²	161.5	76%	0.755	81%	0.811	S	S	*	*			trans	-62.8	135	-164.2	-44.6	0	0	0	0	113.5	T365	S363-T365 PolarHBondContact O-N 3.36Å
364	P	37	Very low	31.8	Very low	133 Å²	133	160.8 Å²	160.8	86%	0.864	81%	0.806	S	S	*	*			trans	-72.5	118.8	179.7	28.7	-33.6	0	0	0	111.3
365	T	27.7	Very low	31.7	Very low	113 Å²	113	154.9 Å²	154.9	69%	0.693	80%	0.802	S	S	*	*			trans	-130	96.4	173.9	-62.2	0	0	0	0	111	S363	S363-T365 PolarHBondContact O-N 3.36Å
366	N	32.2	Very low	31.4	Very low	138 Å²	138	146.7 Å²	146.7	74%	0.738	79%	0.79	S	S	*	*			trans	61.6	128.9	158.1	-61.7	-59.9	0	0	0	120.6
367	L	34.5	Very low	31.6	Very low	169 Å²	169	143.7 Å²	143.7	89%	0.885	79%	0.788	S	S	*	*				152.5	117	108.3	-80.7	-176.1	0	0	0	114.5
368	R	28.2	Very low	31.4	Very low	250 Å²	250	144.1 Å²	144.1	94%	0.943	79%	0.791	S	S	*	*			trans	-159.2	146.3	132.7	-154	162.9	-177.8	154.5	0.9	112.2
369	R	30.2	Very low	31.2	Very low	205 Å²	205	143 Å²	143	77%	0.774	79%	0.793	S	S	*	*			trans	-132	147.1	178	-175.5	-160.4	-83.5	179.1	-7.2	110.1
370	P	32.6	Very low	31.9	Very low	115 Å²	115	139.7 Å²	139.7	75%	0.747	79%	0.786	S	S	*	*				-142.9	173.1	130	39.5	-27.3	0	0	0	113.1
371	P	39.7	Very low	31.8	Very low	120 Å²	120	134.2 Å²	134.2	78%	0.779	78%	0.781	S	S	*	*			cis	-109.8	-147.3	-33.5	38.5	-25.5	0	0	0	110.4
372	V	31.6	Very low	31.8	Very low	111 Å²	111	134 Å²	134	67%	0.673	78%	0.779	S	S	*	*			trans	-138.9	138.7	-169.5	174.1	0	0	0	0	114.3
373	T	25.7	Very low	31.9	Very low	135 Å²	135	136 Å²	136	83%	0.828	78%	0.782	S	S	*	*			trans	-137	110.5	145.8	50.8	0	0	0	0	107.2
374	S	26.9	Very low	31.8	Very low	105 Å²	105	138.2 Å²	138.2	73%	0.734	78%	0.784	S	S	*	*				56.6	114.7	92.4	-165.8	0	0	0	0	113.1
375	S	29.4	Very low	31.8	Very low	118 Å²	118	136.7 Å²	136.7	83%	0.825	77%	0.774	S	S	*	*			cis	-165.7	164.5	-6.4	-143.9	0	0	0	0	108.5
376	G	28.9	Very low	31.7	Very low	59 Å²	59	138.8 Å²	138.8	61%	0.608	78%	0.779	S	S	*	*			cis	134.3	168.6	-0.2	0	0	0	0	0	112.6
377	S	32.8	Very low	31.4	Very low	114 Å²	114	137 Å²	137	80%	0.797	78%	0.778	S	S	*	*			trans	76.5	138.5	170.1	91.3	0	0	0	0	116.4
378	I	33.2	Very low	31.2	Very low	159 Å²	159	136 Å²	136	82%	0.815	78%	0.778	S	S	*	*			cis	-146.4	155.2	7	-103.9	139.1	0	0	0	110.8
379	S	27	Very low	31.2	Very low	110 Å²	110	128.6 Å²	128.6	77%	0.769	77%	0.77	S	S	*	*			trans	-105.4	-157.4	178.6	-41.1	0	0	0	0	110.5
380	P	45.3	Very low	31.2	Very low	114 Å²	114	121.5 Å²	121.5	74%	0.74	76%	0.761	S	S	*	*			cis	-140.9	171.2	-0.8	42.9	-23.3	0	0	0	118.7
381	S	30.5	Very low	31.1	Very low	109 Å²	109	126.1 Å²	126.1	76%	0.762	76%	0.764	S	S	*	*			trans	2	143	148.8	-41	0	0	0	0	123
382	R	30.7	Very low	30.8	Very low	243 Å²	243	123.1 Å²	123.1	92%	0.917	75%	0.749	S	S	*	*				-174.6	161.9	106.6	-106.8	-176.1	179.6	-163.7	-0.8	115.9
383	V	34.6	Very low	31	Very low	127 Å²	127	124.8 Å²	124.8	77%	0.77	74%	0.743	S	S	*	*			trans	-130.8	176.7	157	-134.5	0	0	0	0	105
384	I	28.6	Very low	31.3	Very low	156 Å²	156	125.2 Å²	125.2	80%	0.8	74%	0.735	S	S	*	*			cis	-157.1	-171.4	18	9.1	170	0	0	0	105.8
385	P	37.5	Very low	31.3	Very low	101 Å²	101	129.1 Å²	129.1	66%	0.656	74%	0.742	S	S	*	*			cis	-132	-160.1	-14.3	29.7	-5.4	0	0	0	113.3
386	I	26.7	Very low	31.6	Very low	157 Å²	157	128.9 Å²	128.9	81%	0.805	74%	0.74	S	S	*	*			trans	80.3	150.4	158.4	-74.7	164.9	0	0	0	118.4
387	S	26.1	Very low	32.2	Very low	100 Å²	100	131.7 Å²	131.7	70%	0.699	75%	0.748	S	S	*	*			cis	179.7	161.2	-47.5	-98.6	0	0	0	0	112
388	V	28.8	Very low	32.1	Very low	149 Å²	149	130.6 Å²	130.6	90%	0.903	75%	0.745	S	S	*	*			trans	69.4	160.1	159.6	154	0	0	0	0	118
389	A	29.8	Very low	32.1	Very low	93 Å²	93	128.4 Å²	128.4	77%	0.769	74%	0.744	S	S	*	*			cis	-170.1	166.3	-48.1	0	0	0	0	0	108.5
390	G	30.2	Very low	32.4	Very low	57 Å²	57	133.1 Å²	133.1	59%	0.588	75%	0.745	S	S	*	*			cis	144.6	69.6	-9.6	0	0	0	0	0	116.5	R761	G390-R761 PolarHBondContact O-NH1 2.92Å; G390-R761 PolarHBondContact O-NH2 2.88Å
391	R	30.5	Very low	31.8	Very low	212 Å²	212	136.9 Å²	136.9	80%	0.8	75%	0.745	S	S	*	*			trans	-132.1	157.4	170.2	-89.2	-170.8	-176.2	-109.3	7.4	110.3	R761	R391-R761 VanDerWaalsContact CG-NH2 3.25Å
392	A	33.1	Very low	31.9	Very low	56 Å²	56	137.9 Å²	137.9	46%	0.463	74%	0.742	S	S	.	*			cis	-174.1	139.1	-28.7	0	0	0	0	0	110.4
393	R	34.6	Very low	31.7	Very low	146 Å²	146	133.2 Å²	133.2	55%	0.551	73%	0.732	S	S	*	*			trans	37	142.1	161.1	-52.5	-178.1	170.9	161.5	-3.1	119.7	R761	R393-R761 PolarHBondContact NH2-O 3.05Å
394	H	32.4	Very low	31.8	Very low	145 Å²	145	133.3 Å²	133.3	67%	0.671	73%	0.727	S	S	*	*			cis	-165.2	154.1	48.9	-85	-95.7	0	0	0	112.6
395	Q	27.9	Very low	32	Very low	186 Å²	186	131.4 Å²	131.4	87%	0.869	73%	0.727	S	S	*	*			trans	57.9	152.4	149.3	-73	174.5	-14.7	0	0	123.3
396	S	35.6	Very low	31.6	Very low	113 Å²	113	134.9 Å²	134.9	79%	0.79	73%	0.732	S	S	*	*			trans	-71	175.2	178.9	-45	0	0	0	0	112.7
397	P	41.4	Very low	31.8	Very low	119 Å²	119	134.5 Å²	134.5	77%	0.773	73%	0.732	S	S	*	*			cis	-149.6	-177.2	24.5	45.5	-24.5	0	0	0	119
398	A	29.7	Very low	32	Very low	90 Å²	90	138.5 Å²	138.5	74%	0.744	74%	0.737	S	S	*	*			trans	42.9	127.8	141.8	0	0	0	0	0	123.4
399	S	32.4	Very low	32.1	Very low	113 Å²	113	136.5 Å²	136.5	79%	0.79	74%	0.736	S	S	*	*			trans	79.7	160.8	140.6	-156.4	0	0	0	0	119.4
400	R	33.3	Very low	32.2	Very low	210 Å²	210	143.7 Å²	143.7	79%	0.792	74%	0.743	S	S	*	*			trans	68.6	121.7	-178.5	-59.7	-177	178.8	-150.2	-0.4	114.2
401	R	33.1	Very low	32.2	Very low	192 Å²	192	145.5 Å²	145.5	73%	0.725	75%	0.753	S	S	*	*			cis	85.1	132.9	49.6	-170.6	-156.5	-69.4	-179.9	-4.6	110.6
402	D	32.4	Very low	32.2	Very low	131 Å²	131	139.8 Å²	139.8	70%	0.701	75%	0.751	S	S	*	*			trans	69.3	147.6	177.7	-54.6	-44.9	0	0	0	115.1
403	M	27.6	Very low	32.1	Very low	145 Å²	145	143.7 Å²	143.7	71%	0.714	77%	0.769	S	S	*	*			cis	166.5	115.2	-28.2	164.2	172.8	56.2	0	0	105
404	I	36.5	Very low	31.8	Very low	128 Å²	128	142 Å²	142	66%	0.656	78%	0.78	S	S	*	*			trans	46.3	116	151.6	-53.8	168.8	0	0	0	118.5	F406	I404-F406 HydrophobicContact CG2-CD2 3.67Å; I404-F406 HydrophobicContact CG2-CE2 3.82Å
405	S	32.6	Very low	31.9	Very low	116 Å²	116	141.7 Å²	141.7	81%	0.811	79%	0.788	S	S	*	*			trans	-157.5	107.2	133.5	-85	0	0	0	0	110.2
406	F	29.8	Very low	32.7	Very low	175 Å²	175	138.1 Å²	138.1	77%	0.768	78%	0.781	S	S	*	*				83.1	106	78.4	-96.2	-64.4	0	0	0	115.2	I404	I404-F406 HydrophobicContact CG2-CD2 3.67Å; I404-F406 HydrophobicContact CG2-CE2 3.82Å
407	N	29.8	Very low	32.4	Very low	148 Å²	148	138.6 Å²	138.6	79%	0.791	78%	0.779	S	S	*	*			trans	-151.6	155.7	140.4	-91	-63.3	0	0	0	108.8
408	K	31.1	Very low	31.8	Very low	184 Å²	184	138.4 Å²	138.4	80%	0.8	78%	0.776	S	S	*	*			cis	-176.7	115.3	-30.5	171	171.7	179.1	177.3	0	108.5
409	A	31.1	Very low	31.7	Very low	108 Å²	108	138.7 Å²	138.7	89%	0.893	77%	0.772	S	S	*	*			trans	-138.9	154.8	168.1	0	0	0	0	0	109.9
410	R	31.3	Very low	31.5	Very low	243 Å²	243	138.6 Å²	138.6	92%	0.917	77%	0.767	S	S	*	*			trans	-145.3	123.3	-158.2	172.8	-165.3	-179.5	-169.3	2.3	112.3
411	A	29.9	Very low	31.2	Very low	95 Å²	95	136.3 Å²	136.3	79%	0.785	77%	0.765	S	S	*	*			trans	-156.2	135.1	151.6	0	0	0	0	0	111.2
412	A	30.7	Very low	30.9	Very low	92 Å²	92	134.9 Å²	134.9	76%	0.76	77%	0.77	S	S	*	*			trans	16.1	147	155.7	0	0	0	0	0	121.4
413	T	30.7	Very low	30.7	Very low	139 Å²	139	132.1 Å²	132.1	85%	0.853	77%	0.773	S	S	*	*			cis	-155.4	153.2	12.4	-24.5	0	0	0	0	110.6
414	S	28.9	Very low	30.8	Very low	111 Å²	111	134.1 Å²	134.1	78%	0.776	78%	0.781	S	S	*	*			trans	-148.7	156	169.8	61.4	0	0	0	0	111.6
415	V	34.5	Very low	30.5	Very low	137 Å²	137	133.5 Å²	133.5	83%	0.83	78%	0.779	S	S	*	*			trans	147.1	142.4	165.3	153.2	0	0	0	0	108.4
416	P	44.2	Very low	30.5	Very low	112 Å²	112	135.6 Å²	135.6	73%	0.727	77%	0.773	S	S	*	*			cis	-112.1	-178.6	-1.2	10.2	14.3	0	0	0	115.7
417	T	28.8	Very low	30.6	Very low	122 Å²	122	133.6 Å²	133.6	75%	0.748	77%	0.771	S	S	*	*			trans	-49.7	177.8	168.9	61	0	0	0	0	115.7
418	T	29.8	Very low	30.8	Very low	115 Å²	115	134.7 Å²	134.7	71%	0.706	77%	0.768	S	S	*	*			cis	-162.1	122.5	28.3	-8.2	0	0	0	0	107.6
419	S	27.6	Very low	30.9	Very low	96 Å²	96	133.3 Å²	133.3	67%	0.671	77%	0.768	S	S	*	*				80.4	138.1	94.1	74	0	0	0	0	117.8
420	T	28.5	Very low	30.7	Very low	111 Å²	111	133.8 Å²	133.8	68%	0.681	77%	0.765	S	S	*	*			trans	90.5	92.6	149.2	-47.6	0	0	0	0	119.7
421	E	27.1	Very low	30.8	Very low	162 Å²	162	131.8 Å²	131.8	76%	0.757	76%	0.763	S	S	*	*				74.1	145.3	127.8	-70.9	176.2	-170.5	0	0	124.7
422	I	27.1	Very low	31.4	Very low	162 Å²	162	132.8 Å²	132.8	83%	0.831	76%	0.761	S	S	*	*			trans	55.9	121.7	147.8	-61.6	159	0	0	0	118.4
423	G	27.6	Very low	31.4	Very low	74 Å²	74	132.4 Å²	132.4	76%	0.763	76%	0.759	S	S	*	*			trans	172.5	121.5	163.3	0	0	0	0	0	113.5
424	Q	29.9	Very low	31.6	Very low	187 Å²	187	133.2 Å²	133.2	87%	0.874	75%	0.753	S	S	*	*			trans	-80.8	171.8	173.2	-65.4	169.9	-61.8	0	0	111.8
425	D	30.3	Very low	31.8	Very low	115 Å²	115	136 Å²	136	62%	0.615	75%	0.751	S	S	*	*			trans	85	113.6	145.1	-97.4	17.9	0	0	0	122.5
426	K	32.5	Very low	31.6	Very low	159 Å²	159	135.2 Å²	135.2	69%	0.691	75%	0.746	S	S	*	*				62.6	100.3	123.1	-65.3	-177.5	-173.4	80.8	0	121
427	N	32.1	Very low	31	Very low	133 Å²	133	137.1 Å²	137.1	71%	0.711	76%	0.756	S	S	*	*				86.7	147.7	109	-144.3	-6.4	0	0	0	120.6
428	K	34.3	Very low	31.3	Very low	171 Å²	171	135.6 Å²	135.6	74%	0.743	76%	0.755	S	S	*	*			trans	67.8	110.4	167.1	-56.8	-173.1	179.9	178	0	117.4
429	I	32	Very low	31.5	Very low	155 Å²	155	139 Å²	139	80%	0.795	76%	0.763	S	S	*	*				75	112.7	73.5	-66.8	164.8	0	0	0	114.2
430	S	27.1	Very low	31.7	Very low	119 Å²	119	140.5 Å²	140.5	83%	0.832	76%	0.76	S	S	*	*				-173.9	158.2	129.6	34	0	0	0	0	113.5
431	K	33.3	Very low	32	Very low	200 Å²	200	143 Å²	143	87%	0.87	76%	0.761	S	S	*	*			trans	-99.7	-168.7	169.3	-66.2	-178.3	177.1	176.6	0	107.8
432	P	43.3	Very low	32.1	Very low	116 Å²	116	141.3 Å²	141.3	75%	0.753	76%	0.762	S	S	*	*			cis	-151.3	-173.5	11.9	45.4	-23.3	0	0	0	118.8
433	A	31	Very low	32.2	Very low	85 Å²	85	140.3 Å²	140.3	70%	0.702	76%	0.755	S	S	*	*			trans	47	155.6	134.6	0	0	0	0	0	122.7
434	Q	32.9	Very low	32.7	Very low	156 Å²	156	145.5 Å²	145.5	73%	0.729	75%	0.752	S	S	*	*			cis	-170.1	168.9	-8	-114.3	-176.1	26.4	0	0	110.6
435	K	33.2	Very low	33.2	Very low	170 Å²	170	144.6 Å²	144.6	74%	0.739	75%	0.745	S	S	*	*			trans	62.1	119.3	149.8	-76.3	-176.5	176.5	179.7	0	119.8
436	T	32	Very low	33.5	Very low	120 Å²	120	146.7 Å²	146.7	74%	0.736	75%	0.749	S	S	*	*				83.4	124.1	61.1	63.1	0	0	0	0	117
437	V	30.6	Very low	33.6	Very low	152 Å²	152	145.5 Å²	145.5	92%	0.921	75%	0.746	S	S	*	*			trans	164.6	166.6	133.3	159.1	0	0	0	0	109
438	A	35.7	Very low	33.5	Very low	89 Å²	89	144.6 Å²	144.6	74%	0.736	74%	0.74	S	S	*	*			trans	-125.5	170.6	-158.2	0	0	0	0	0	115.1
439	E	34.3	Very low	34.1	Very low	186 Å²	186	142 Å²	142	87%	0.869	74%	0.741	S	S	*	*			trans	-166.4	156.4	141.8	-112.5	176.3	-178.6	0	0	116.3
440	E	30.2	Very low	34	Very low	129 Å²	129	143.1 Å²	143.1	60%	0.603	74%	0.737	S	S	*	*			trans	49.2	111.9	153.9	-62.3	-82.9	89.1	0	0	125.1
441	K	35.5	Very low	34.1	Very low	163 Å²	163	144.1 Å²	144.1	71%	0.709	73%	0.728	S	S	*	*				39.2	130.1	128.9	-52.5	169.5	-174.2	137.3	0	120.5
442	T	28.5	Very low	34	Very low	126 Å²	126	138.4 Å²	138.4	77%	0.773	71%	0.713	S	S	*	*				-176	154.4	72.8	-64.7	0	0	0	0	112.1
443	M	30.8	Very low	33.2	Very low	142 Å²	142	141.4 Å²	141.4	70%	0.7	71%	0.714	S	S	*	*			trans	-8.3	149.1	168.9	-59.1	-168.1	-167.4	0	0	120
444	R	38.1	Very low	33.1	Very low	183 Å²	183	141.9 Å²	141.9	69%	0.691	72%	0.718	S	S	*	*			cis	-175.2	169.5	-2.1	-102.5	167	175.9	162.3	-2.9	104.6
445	F	39.2	Very low	32.8	Very low	167 Å²	167	139 Å²	139	73%	0.732	72%	0.715	S	S	*	*			cis	-159	-174.2	-3.4	-108.3	-36.7	0	0	0	103.9
446	K	36.5	Very low	32.5	Very low	160 Å²	160	140.7 Å²	140.7	70%	0.696	72%	0.723	S	S	*	*			cis	-163.5	174.1	-2.4	-124.2	-164.2	172.4	-156.8	0	103.7
447	Q	34.2	Very low	32.2	Very low	134 Å²	134	139.9 Å²	139.9	63%	0.626	72%	0.723	S	S	*	*			cis	-161.2	110.7	-10.4	176.8	-176.6	-66.1	0	0	103.9
448	L	31.1	Very low	32.8	Very low	113 Å²	113	137.8 Å²	137.8	59%	0.592	71%	0.712	S	S	*	*				65.1	134.8	90	-66.9	175.8	0	0	0	115.3	Y450	L448-Y450 HydrophobicContact CD2-CD1 4.44Å; L448-Y450 HydrophobicContact CD2-CE1 3.77Å; L448-Y450 HydrophobicContact CD2-CE2 4.1Å
449	P	46.9	Very low	32.2	Very low	116 Å²	116	141.8 Å²	141.8	75%	0.753	72%	0.715	S	S	*	*			cis	-110.9	-117.8	42.8	9.5	14.6	0	0	0	119
450	Y	30.5	Very low	31.9	Very low	180 Å²	180	138.2 Å²	138.2	71%	0.706	71%	0.706	S	S	*	*			trans	-149.2	157.5	-147.4	-65	-69.1	0	0	0	111.5	L448	L448-Y450 HydrophobicContact CD2-CD1 4.44Å; L448-Y450 HydrophobicContact CD2-CE1 3.77Å; L448-Y450 HydrophobicContact CD2-CE2 4.1Å
451	E	28.8	Very low	31.7	Very low	140 Å²	140	141 Å²	141	65%	0.654	72%	0.716	S	S	*	*			cis	87	135.5	34.8	-86.9	-130.5	-67.7	0	0	115.7	K453	E451-K453 WeakPolarHBondContact OE2-CE 3.43Å; E451-K453 IonicContact OE2-NZ 2.68Å; E451-K453 PolarHBondContact OE2-NZ 3.43Å
452	S	30.6	Very low	31.2	Very low	80 Å²	80	138.7 Å²	138.7	56%	0.559	72%	0.721	S	S	*	*			cis	-174.2	165.4	-7.4	-133.6	0	0	0	0	117.9
453	K	27.6	Very low	31	Very low	178 Å²	178	139.1 Å²	139.1	77%	0.774	72%	0.723	S	S	*	*			trans	71	169.2	143.5	-74.7	156.6	-168.6	148.3	0	122.7	E451	E451-K453 WeakPolarHBondContact OE2-CE 3.43Å; E451-K453 IonicContact OE2-NZ 2.68Å; E451-K453 PolarHBondContact OE2-NZ 3.43Å
454	A	28.7	Very low	30.6	Very low	95 Å²	95	142.9 Å²	142.9	79%	0.785	73%	0.73	S	S	*	*			trans	-105.1	-165.6	178.2	0	0	0	0	0	111.1
455	S	27	Very low	30.1	Very low	96 Å²	96	140.4 Å²	140.4	67%	0.671	74%	0.735	S	S	*	*			cis	-178.3	179.1	35.9	45.4	0	0	0	0	113.1
456	F	25.4	Very low	29.4	Very low	205 Å²	205	139.1 Å²	139.1	90%	0.899	74%	0.74	S	S	*	*			trans	90.3	161.4	167.6	-73.2	-78.7	0	0	0	120.6
457	S	27.1	Very low	29.2	Very low	104 Å²	104	136.3 Å²	136.3	73%	0.727	74%	0.741	S	S	*	*			trans	-134.7	-172.2	-161.6	64	0	0	0	0	110.4
458	P	42.8	Very low	29.2	Very low	108 Å²	108	135.7 Å²	135.7	70%	0.701	75%	0.748	S	S	*	*			cis	-138	-179.6	0.3	43.9	-25.9	0	0	0	117
459	E	23.4	Very low	29.4	Very low	172 Å²	172	136.2 Å²	136.2	80%	0.804	76%	0.758	S	S	*	*			trans	70.7	142.6	142.8	-116.4	174.4	-141	0	0	125
460	T	27.1	Very low	28.4	Very low	111 Å²	111	135.1 Å²	135.1	68%	0.681	76%	0.759	S	S	*	*			trans	81.7	126.8	159.3	67	0	0	0	0	123
461	K	26.5	Very low	28.2	Very low	187 Å²	187	136 Å²	136	81%	0.813	77%	0.767	S	S	*	*			trans	69	87.9	141.5	-67	169.2	-176.7	175.1	0	121.2
462	S	25.1	Very low	28	Very low	115 Å²	115	133.5 Å²	133.5	80%	0.804	77%	0.765	S	S	*	*				55	136.2	114	-54	0	0	0	0	123.8
463	V	22.7	Very low	27.8	Very low	135 Å²	135	137.6 Å²	137.6	82%	0.818	78%	0.779	S	S	*	*			trans	89.6	139.7	146	163.6	0	0	0	0	120.3
464	R	24.3	Very low	27.6	Very low	221 Å²	221	132.7 Å²	132.7	83%	0.834	77%	0.772	S	S	*	*			trans	79.9	94.7	169.2	-157.3	155.1	-85.1	174.1	-4.7	114.5
465	V	25.8	Very low	27.4	Very low	132 Å²	132	136.7 Å²	136.7	80%	0.8	77%	0.774	S	S	*	*				60.4	122.1	85.9	174.9	0	0	0	0	113.6
466	V	26	Very low	27.3	Very low	139 Å²	139	137.6 Å²	137.6	84%	0.842	78%	0.776	S	S	*	*			trans	-173.8	140.1	134.8	138	0	0	0	0	109.2
467	S	31.5	Very low	27.3	Very low	101 Å²	101	133.8 Å²	133.8	71%	0.706	77%	0.769	S	S	*	*			trans	-67.1	179.1	172.7	-41	0	0	0	0	111.5
468	P	34	Very low	27.3	Very low	122 Å²	122	134.6 Å²	134.6	79%	0.792	77%	0.769	S	S	*	*				-154.6	-146.9	91.9	47.9	-27	0	0	0	111.8
469	P	36.7	Very low	26.5	Very low	123 Å²	123	136.8 Å²	136.8	80%	0.799	77%	0.771	S	S	*	*				-134.5	-162.8	-127.9	34.7	-6.9	0	0	0	115.3
470	A	24.9	Very low	26.7	Very low	94 Å²	94	132.6 Å²	132.6	78%	0.777	76%	0.76	S	S	*	*			trans	-64.9	155.7	-175.9	0	0	0	0	0	117.2
471	K	27.3	Very low	26.7	Very low	198 Å²	198	135.5 Å²	135.5	86%	0.861	76%	0.763	S	S	*	*			trans	-150.4	122.8	144.2	-89	171.6	-178.1	172.8	0	106.7
472	S	22.8	Very low	26.7	Very low	88 Å²	88	136.7 Å²	136.7	62%	0.615	76%	0.763	S	S	*	*			cis	95.2	140.1	29.6	77.8	0	0	0	0	114.2
473	I	26.7	Very low	26.7	Very low	165 Å²	165	137.7 Å²	137.7	85%	0.846	76%	0.755	S	S	*	*			trans	76.6	135.9	166.9	-54.7	158.8	0	0	0	112.9
474	A	24.1	Very low	26.8	Very low	76 Å²	76	137.1 Å²	137.1	63%	0.628	75%	0.751	S	S	*	*			cis	-147.4	157.4	-0.4	0	0	0	0	0	108.8
475	Q	25.2	Very low	26.9	Very low	179 Å²	179	131 Å²	131	84%	0.836	74%	0.743	S	S	*	*				47.3	135.4	82.3	-72.6	-177.3	-13.6	0	0	114.2
476	T	23.5	Very low	26.9	Very low	115 Å²	115	131 Å²	131	71%	0.706	74%	0.738	S	S	*	*			cis	-167.6	170.4	20.9	-6.7	0	0	0	0	112.3
477	V	25.5	Very low	27.1	Very low	125 Å²	125	130.6 Å²	130.6	76%	0.758	73%	0.727	S	S	*	*			trans	71.3	136.7	148.7	162.5	0	0	0	0	117.6
478	T	27	Very low	27	Very low	120 Å²	120	133.8 Å²	133.8	74%	0.736	73%	0.728	S	S	*	*			cis	-166.7	179.3	-19.8	41.2	0	0	0	0	106.6
479	E	26.2	Very low	26.8	Very low	155 Å²	155	134.5 Å²	134.5	72%	0.724	72%	0.721	S	S	*	*			cis	-160.5	174.4	5.6	-136.7	-108.5	-105	0	0	109.4
480	S	28.4	Very low	26.4	Very low	84 Å²	84	136.1 Å²	136.1	59%	0.587	72%	0.715	S	S	*	*			trans	65	144.4	153.3	-86.5	0	0	0	0	120.5
481	K	27.4	Very low	26.3	Very low	172 Å²	172	136.8 Å²	136.8	75%	0.748	71%	0.714	S	S	*	*			cis	-175.8	120	-3.6	161.9	-175.5	176.5	-174.3	0	112
482	R	25	Very low	26.4	Very low	212 Å²	212	137.9 Å²	137.9	80%	0.8	71%	0.714	S	S	*	*			trans	58.3	153.6	156.6	-67.7	-179	167.6	-147.6	9.2	118
483	Q	26.1	Very low	26.6	Very low	135 Å²	135	137.9 Å²	137.9	63%	0.631	72%	0.72	S	S	*	*			cis	-164.4	152.7	-3.1	-121.9	178.5	-98.3	0	0	109.1
484	V	25.5	Very low	26.6	Very low	124 Å²	124	138 Å²	138	75%	0.752	72%	0.717	S	S	*	*			trans	65.6	135.8	148.8	170.5	0	0	0	0	117.6
485	S	26.4	Very low	26.7	Very low	93 Å²	93	140.4 Å²	140.4	65%	0.65	72%	0.719	S	S	*	*			cis	-170	159.6	-12.3	51.8	0	0	0	0	112.5
486	N	25.9	Very low	26.9	Very low	132 Å²	132	139.5 Å²	139.5	71%	0.706	72%	0.715	S	S	*	*			trans	71.8	131.2	155.1	-83	40.8	0	0	0	123
487	E	29	Very low	27.5	Very low	130 Å²	130	141.1 Å²	141.1	61%	0.607	72%	0.718	S	S	*	*			trans	72	126.9	140.4	-70.8	178.7	-109.8	0	0	123.2
488	K	30.4	Very low	27.5	Very low	167 Å²	167	144 Å²	144	73%	0.726	72%	0.72	S	S	*	*			trans	53.9	147.1	133.6	-64.7	170.2	-176.1	154.6	0	120.9
489	E	28.4	Very low	27.6	Very low	137 Å²	137	143.8 Å²	143.8	64%	0.64	72%	0.715	S	S	*	*			cis	-161.7	155.2	-29.7	-149.5	-176.6	138.6	0	0	108
490	K	29.5	Very low	27.7	Very low	157 Å²	157	144.9 Å²	144.9	68%	0.683	72%	0.718	S	S	*	*			trans	35.7	106.4	162.8	-74.3	160.2	-176.5	149.6	0	119.3
491	S	22.9	Very low	27.7	Very low	108 Å²	108	150.3 Å²	150.3	76%	0.755	73%	0.733	S	S	*	*			trans	-63	152.5	147.3	53.9	0	0	0	0	112.6
492	Y	27.9	Very low	27.7	Very low	221 Å²	221	152 Å²	152	87%	0.867	74%	0.741	S	S	*	*			trans	-131.3	153.2	144.1	-89.2	-81	0	0	0	109.5
493	A	28.3	Very low	27.6	Very low	88 Å²	88	146.7 Å²	146.7	73%	0.727	74%	0.743	S	S	*	*			trans	-138.5	139.1	-175.6	0	0	0	0	0	111.5
494	Q	26.4	Very low	27.9	Very low	168 Å²	168	148.3 Å²	148.3	79%	0.785	75%	0.75	S	S	*	*			trans	37.2	118.2	144.7	-74.9	-168.8	-92.1	0	0	121.6
495	D	27	Very low	28.5	Very low	126 Å²	126	148.4 Å²	148.4	67%	0.674	75%	0.753	S	S	*	*				85	139.5	112.2	-66.2	-16.6	0	0	0	125.4
496	E	29.3	Very low	28.6	Very low	161 Å²	161	150 Å²	150	75%	0.752	75%	0.753	S	S	*	*			trans	71.5	99.7	138.9	-75.1	-165.1	163.6	0	0	123.4
497	L	34.6	Very low	28.8	Very low	148 Å²	148	149.2 Å²	149.2	78%	0.775	75%	0.748	S	S	*	*				67.3	155.1	111.4	-73.6	173.6	0	0	0	122.4
498	K	27	Very low	28.7	Very low	185 Å²	185	152.3 Å²	152.3	80%	0.804	76%	0.762	S	S	*	*			trans	92.7	149.7	168.2	-63.4	176.1	179.9	168.5	0	116.7
499	D	29	Very low	28.8	Very low	117 Å²	117	154 Å²	154	63%	0.626	77%	0.77	S	S	*	*			cis	-144.2	-174.9	-1.2	-134.5	-51.6	0	0	0	112.4
500	K	28.2	Very low	28.9	Very low	178 Å²	178	157.1 Å²	157.1	77%	0.774	78%	0.781	S	S	*	*			trans	-78.9	164.8	-173.1	-41.5	125	-174.6	167.3	0	114.6
501	E	28.4	Very low	29	Very low	197 Å²	197	157 Å²	157	92%	0.921	79%	0.787	S	S	*	*				-165	-178.7	105.4	-115.3	-175.6	160.2	0	0	114.8
502	K	26	Very low	29.5	Very low	208 Å²	208	159 Å²	159	90%	0.904	79%	0.788	S	S	*	*			trans	-107.8	156.2	-166.1	-61	-177.6	173.1	-167.2	0	114.6
503	A	24.1	Very low	29.7	Very low	101 Å²	101	155 Å²	155	84%	0.835	78%	0.782	S	S	*	*			trans	-164.1	143.8	134.7	0	0	0	0	0	112.6
504	E	31.6	Very low	30.4	Very low	168 Å²	168	156.8 Å²	156.8	79%	0.785	79%	0.789	S	S	*	*			trans	-111.7	168.6	158.3	-63.2	-172.7	143.5	0	0	108.9
505	P	37.7	Very low	30.9	Very low	127 Å²	127	152 Å²	152	83%	0.825	77%	0.771	S	S	*	*				-146.5	159.6	95.8	39	-24	0	0	0	116.2
506	I	28.9	Very low	32	Very low	126 Å²	126	149.1 Å²	149.1	65%	0.646	76%	0.76	S	S	*	*			trans	-91.2	166.8	163	53.2	168.4	0	0	0	110.5
507	I	29.9	Very low	32.8	Very low	116 Å²	116	145.4 Å²	145.4	60%	0.595	75%	0.749	S	S	*	*			cis	-152.2	151.7	19.4	-11.2	170.3	0	0	0	109.8	N126	N126-I507 WeakPolarHBondContact ND2-CD1 3.5Å
508	E	26.4	Very low	33.6	Very low	195 Å²	195	144.7 Å²	144.7	91%	0.911	74%	0.741	S	S	*	*			trans	-169	157.7	132.8	-110.4	171.3	-152.9	0	0	112.3
509	K	33	Very low	34.8	Very low	202 Å²	202	139.7 Å²	139.7	88%	0.878	72%	0.721	S	S	*	*			trans	-123.6	153.4	179.6	-89	-169.8	175	-174.7	0	110.8
510	K	30.2	Very low	35.8	Very low	202 Å²	202	138.1 Å²	138.1	88%	0.878	71%	0.711	S	S	*	*			trans	73	90.5	177.4	-55.7	-173.3	174.7	-164	0	116
511	I	32.8	Very low	36.7	Very low	156 Å²	156	133.9 Å²	133.9	80%	0.8	70%	0.696	S	S	*	*				-144.3	138.9	94	-52.7	-172.8	0	0	0	107
512	L	32.7	Very low	37.5	Very low	150 Å²	150	129.9 Å²	129.9	79%	0.785	68%	0.677	S	S	*	*			trans	-168.5	93.3	147.5	-108.4	169.1	0	0	0	108.4	V515	L512-V515 HydrophobicContact CD2-CB 4.45Å; L512-V515 HydrophobicContact CD2-CG2 3.58Å
513	D	33.3	Very low	38.5	Very low	137 Å²	137	126.3 Å²	126.3	73%	0.733	66%	0.662	S	S	*	*			trans	-66.6	168.3	152.4	-76.2	-51.7	0	0	0	109.2	V515	D513-V515 PolarHBondContact O-N 2.92Å
514	S	41.9	Very low	39.6	Very low	125 Å²	125	126.9 Å²	126.9	87%	0.874	66%	0.655	S	S	*	*			trans	-53.5	120.2	179.7	54.3	0	0	0	0	113.2
515	V	37.7	Very low	40.3	Very low	67 Å²	67	123.1 Å²	123.1	41%	0.406	64%	0.639	S	S	.	*			trans	-110.7	117.4	169.9	176.9	0	0	0	0	107.9	L512 D513 E519 I520	L512-V515 HydrophobicContact CD2-CB 4.45Å; L512-V515 HydrophobicContact CD2-CG2 3.58Å; D513-V515 PolarHBondContact O-N 2.92Å; V515-E519 HydrophobicContact CG1-CB 4.17Å; V515-I520 HydrophobicContact CG1-CD1 4.35Å; V515-I520 HydrophobicContact CG1-CG1 3.7Å
516	S	49.4	Very low	40.4	Very low	66 Å²	66	122.7 Å²	122.7	46%	0.462	63%	0.625	S	S	.	*			trans	-79	159.2	177.4	86.4	0	0	0	0	111.8	E518 E519 I520	S516-E518 WeakPolarHBondContact CB-OE2 3.48Å; S516-E518 PolarHBondContact O-N 3.16Å; S516-E518 PolarHBondContact OG-OE2 2.68Å; S516-E519 PolarHBondContact O-N 3.42Å; S516-I520 PolarHBondContact O-N 2.67Å
517	V	47	Very low	40.6	Very low	83 Å²	83	123 Å²	123	50%	0.503	64%	0.635	S	S	.	*	H	α-helix	trans	-61.6	-32	-175.4	-179.7	0	0	0	0	111.7	E519 I520 I521	V517-E519 VanDerWaalsContact C-N 3.31Å; V517-E519 PolarHBondContact O-N 3.3Å; V517-I520 PolarHBondContact O-N 2.91Å; V517-I521 HydrophobicContact CG1-CD1 3.91Å; V517-I521 HydrophobicContact CG1-CG1 4.38Å; V517-I521 WeakPolarHBondContact O-CG1 3.45Å; V517-I521 PolarHBondContact O-N 3.14Å
518	E	51	Low	40.8	Very low	133 Å²	133	122.6 Å²	122.6	62%	0.621	65%	0.648	S	S	*	*	H	α-helix	trans	-58.6	-42	173.6	-62.4	70.8	-155.4	0	0	112	S516 I521 E522	S516-E518 WeakPolarHBondContact CB-OE2 3.48Å; S516-E518 PolarHBondContact O-N 3.16Å; S516-E518 PolarHBondContact OG-OE2 2.68Å; E518-I521 PolarHBondContact O-N 3.12Å; E518-E522 WeakPolarHBondContact O-CB 3.43Å; E518-E522 PolarHBondContact O-N 3.29Å
519	E	50.7	Low	41	Very low	80 Å²	80	116.8 Å²	116.8	37%	0.374	64%	0.641	S	S	.	*	H	α-helix	trans	-73.4	-31.6	-179	-143.7	-158.7	-161.7	0	0	111.7	V515 S516 V517 K523	V515-E519 HydrophobicContact CG1-CB 4.17Å; S516-E519 PolarHBondContact O-N 3.42Å; V517-E519 VanDerWaalsContact C-N 3.31Å; V517-E519 PolarHBondContact O-N 3.3Å; E519-K523 HydrophobicContact CG-CD 4.16Å; E519-K523 VanDerWaalsContact O-CB 3.25Å; E519-K523 WeakPolarHBondContact O-CB 3.2Å; E519-K523 VanDerWaalsContact O-CG 3.3Å; E519-K523 WeakPolarHBondContact O-CG 3.31Å; E519-K523 PolarHBondContact O-N 3Å; E519-K523 WeakPolarHBondContact OE1-CE 3.38Å; E519-K523 IonicContact OE1-NZ 3.21Å; E519-K523 PolarHBondContact OE1-NZ 2.86Å; E519-K523 WeakPolarHBondContact OE2-CE 3.33Å; E519-K523 IonicContact OE2-NZ 2.61Å; E519-K523 PolarHBondContact OE2-NZ 3.24Å
520	I	50.5	Low	40.9	Very low	84 Å²	84	115.5 Å²	115.5	43%	0.431	64%	0.643	S	S	.	*	H	α-helix	trans	-65.2	-48.9	171.2	-56.7	178.7	0	0	0	109.9	V515 S516 V517 E522 K523 V524	V515-I520 HydrophobicContact CG1-CD1 4.35Å; V515-I520 HydrophobicContact CG1-CG1 3.7Å; S516-I520 PolarHBondContact O-N 2.67Å; V517-I520 PolarHBondContact O-N 2.91Å; I520-E522 VanDerWaalsContact C-N 3.35Å; I520-E522 PolarHBondContact O-N 2.93Å; I520-K523 PolarHBondContact O-N 2.88Å; I520-V524 HydrophobicContact CG2-CG2 3.94Å; I520-V524 WeakPolarHBondContact O-CB 3.32Å; I520-V524 VanDerWaalsContact O-CG2 3.26Å; I520-V524 WeakPolarHBondContact O-CG2 3.32Å; I520-V524 PolarHBondContact O-N 2.93Å
521	I	47.3	Very low	40.9	Very low	88 Å²	88	114.3 Å²	114.3	45%	0.451	64%	0.641	S	S	.	*	H	α-helix	trans	-62.3	-42.3	-180	-69	171.2	0	0	0	110.8	V517 E518 I525	V517-I521 HydrophobicContact CG1-CD1 3.91Å; V517-I521 HydrophobicContact CG1-CG1 4.38Å; V517-I521 WeakPolarHBondContact O-CG1 3.45Å; V517-I521 PolarHBondContact O-N 3.14Å; E518-I521 PolarHBondContact O-N 3.12Å; I521-I525 WeakPolarHBondContact O-CB 3.36Å; I521-I525 PolarHBondContact O-N 3.17Å; I521-I525 VanDerWaalsContact O-N 3.17Å
522	E	46.2	Very low	40.9	Very low	113 Å²	113	110.4 Å²	110.4	53%	0.528	63%	0.631	S	S	.	*	H	α-helix	trans	-71.5	-38.7	178.7	-174.8	144.2	-107.7	0	0	113.1	E518 I520 K526	E518-E522 WeakPolarHBondContact O-CB 3.43Å; E518-E522 PolarHBondContact O-N 3.29Å; I520-E522 VanDerWaalsContact C-N 3.35Å; I520-E522 PolarHBondContact O-N 2.93Å; E522-K526 HydrophobicContact CG-CD 4.28Å; E522-K526 WeakPolarHBondContact O-CB 3.49Å; E522-K526 PolarHBondContact O-N 2.89Å; E522-K526 IonicContact OE1-NZ 2.62Å; E522-K526 PolarHBondContact OE1-NZ 2.89Å
523	K	46.4	Very low	40.7	Very low	133 Å²	133	112.8 Å²	112.8	58%	0.578	64%	0.635	S	S	*	*	H	α-helix	trans	-78.8	-30.8	179.3	-71.5	174.8	178.5	170	0	114.5	E519 I520	E519-K523 HydrophobicContact CG-CD 4.16Å; E519-K523 VanDerWaalsContact O-CB 3.25Å; E519-K523 WeakPolarHBondContact O-CB 3.2Å; E519-K523 VanDerWaalsContact O-CG 3.3Å; E519-K523 WeakPolarHBondContact O-CG 3.31Å; E519-K523 PolarHBondContact O-N 3Å; E519-K523 WeakPolarHBondContact OE1-CE 3.38Å; E519-K523 IonicContact OE1-NZ 3.21Å; E519-K523 PolarHBondContact OE1-NZ 2.86Å; E519-K523 WeakPolarHBondContact OE2-CE 3.33Å; E519-K523 IonicContact OE2-NZ 2.61Å; E519-K523 PolarHBondContact OE2-NZ 3.24Å; I520-K523 PolarHBondContact O-N 2.88Å
524	V	47.7	Very low	40.5	Very low	113 Å²	113	110.9 Å²	110.9	69%	0.685	64%	0.639	S	S	*	*	H	α-helix	trans	-90.5	-29.8	-175.8	179.5	0	0	0	0	112.2	I520	I520-V524 HydrophobicContact CG2-CG2 3.94Å; I520-V524 WeakPolarHBondContact O-CB 3.32Å; I520-V524 VanDerWaalsContact O-CG2 3.26Å; I520-V524 WeakPolarHBondContact O-CG2 3.32Å; I520-V524 PolarHBondContact O-N 2.93Å
525	I	46.6	Very low	39.7	Very low	90 Å²	90	111.2 Å²	111.2	46%	0.462	64%	0.64	S	S	.	*	H	α-helix	trans	-106.9	-9.1	-174.8	-50.7	-175.9	0	0	0	112.8	I521 Y544	I521-I525 WeakPolarHBondContact O-CB 3.36Å; I521-I525 PolarHBondContact O-N 3.17Å; I521-I525 VanDerWaalsContact O-N 3.17Å; I525-Y544 HydrophobicContact CG2-CE1 3.75Å
526	K	38.6	Very low	39.6	Very low	118 Å²	118	113.6 Å²	113.6	51%	0.513	66%	0.659	S	S	.	*	S	Bend	trans	-119.3	114.6	166	-58	179.1	-168.9	165.2	0	111.5	E522 A528	E522-K526 HydrophobicContact CG-CD 4.28Å; E522-K526 WeakPolarHBondContact O-CB 3.49Å; E522-K526 PolarHBondContact O-N 2.89Å; E522-K526 IonicContact OE1-NZ 2.62Å; E522-K526 PolarHBondContact OE1-NZ 2.89Å; K526-A528 PolarHBondContact O-N 3.28Å
527	P	34.1	Very low	38.9	Very low	132 Å²	132	116.6 Å²	116.6	86%	0.857	68%	0.68	S	S	*	*			trans	-76.1	94.1	176.2	30.1	-34	0	0	0	111.7	G529	P527-G529 PolarHBondContact O-N 3.24Å
528	A	33.8	Very low	38.2	Very low	107 Å²	107	115.8 Å²	115.8	88%	0.884	69%	0.688	S	S	*	*			trans	-84.8	90.1	173.9	0	0	0	0	0	111.4	K526	K526-A528 PolarHBondContact O-N 3.28Å
529	G	28.9	Very low	37.4	Very low	74 Å²	74	115.8 Å²	115.8	76%	0.763	69%	0.693	S	S	*	*			trans	-178.4	21.4	-178	0	0	0	0	0	119.1	P527 E531	P527-G529 PolarHBondContact O-N 3.24Å; G529-E531 PolarHBondContact O-N 3.5Å
530	L	31.2	Very low	36.7	Very low	174 Å²	174	116.7 Å²	116.7	91%	0.911	71%	0.708	S	S	*	*			trans	-82.1	92.8	177.8	-99.1	173.4	0	0	0	112.6
531	E	30.9	Very low	36.5	Very low	178 Å²	178	119.7 Å²	119.7	83%	0.832	72%	0.718	S	S	*	*			trans	-123.2	89	156.9	-91.6	-66.2	-179.4	0	0	111.2	G529	G529-E531 PolarHBondContact O-N 3.5Å
532	A	32.1	Very low	36.4	Very low	73 Å²	73	118.9 Å²	118.9	60%	0.603	72%	0.717	S	S	*	*	S	Bend	trans	44.2	81.4	152.9	0	0	0	0	0	120
533	K	29.8	Very low	36.4	Very low	200 Å²	200	121.6 Å²	121.6	87%	0.87	72%	0.722	S	S	*	*				166	138	98.6	-89.6	168.7	-178.7	-179.9	0	114.3
534	A	29	Very low	36.4	Very low	97 Å²	97	121 Å²	121	80%	0.802	72%	0.717	S	S	*	*			trans	61.3	127.7	158.7	0	0	0	0	0	117.1
535	C	25.3	Very low	36.4	Very low	133 Å²	133	121 Å²	121	90%	0.899	71%	0.71	S	S	*	*			cis	-139.7	171.5	-1.4	-83.6	0	0	0	0	110.1
536	S	35	Very low	36.6	Very low	116 Å²	116	120 Å²	120	81%	0.811	71%	0.707	S	S	*	*			trans	-120.9	137.1	-177.6	54.8	0	0	0	0	113
537	S	34.5	Very low	37.3	Very low	130 Å²	130	120.4 Å²	120.4	91%	0.909	71%	0.711	S	S	*	*			trans	170.2	142.1	145.5	-170.1	0	0	0	0	108.2
538	G	33.3	Very low	37.9	Very low	65 Å²	65	120.1 Å²	120.1	67%	0.67	70%	0.696	S	S	*	*			cis	-152.1	170.2	-0.3	0	0	0	0	0	111.6
539	D	33.4	Very low	38.9	Very low	134 Å²	134	117.9 Å²	117.9	72%	0.717	67%	0.674	S	S	*	*			trans	-75	142.8	-168.1	-90.9	-8.4	0	0	0	114.3	K541	D539-K541 IonicContact OD2-NZ 2.72Å; D539-K541 PolarHBondContact OD2-NZ 2.94Å
540	S	36.2	Very low	40	Very low	99 Å²	99	122.4 Å²	122.4	69%	0.692	68%	0.675	S	S	*	*			trans	-126.4	98.9	152.8	-175.9	0	0	0	0	108.5	V542	S540-V542 PolarHBondContact O-N 3.15Å; S540-V542 VanDerWaalsContact O-N 3.1Å
541	K	46.7	Very low	41.2	Very low	147 Å²	147	119.3 Å²	119.3	64%	0.639	66%	0.656	S	S	*	*			trans	-93.7	61.4	-156.9	-148.8	-178.5	-148.7	98.5	0	113.4	D539 R543	D539-K541 IonicContact OD2-NZ 2.72Å; D539-K541 PolarHBondContact OD2-NZ 2.94Å; K541-R543 PolarHBondContact O-N 3.35Å
542	V	45.3	Very low	42.2	Very low	71 Å²	71	120.6 Å²	120.6	43%	0.43	66%	0.662	S	S	.	*			trans	-61.5	126.2	171.3	-175.2	0	0	0	0	109.5	S540 L562	S540-V542 PolarHBondContact O-N 3.15Å; S540-V542 VanDerWaalsContact O-N 3.1Å; V542-L562 HydrophobicContact CG1-CB 4.46Å; V542-L562 HydrophobicContact CG1-CD2 3.8Å
543	R	46.6	Very low	42.7	Very low	169 Å²	169	123.7 Å²	123.7	64%	0.638	67%	0.669	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-100.3	124.9	176.1	-167.7	-167	-50.3	-88.7	-6.4	108.5	K541 E563	K541-R543 PolarHBondContact O-N 3.35Å; R543-E563 PolarHBondContact N-O 2.94Å; R543-E563 IonicContact NE-OE2 4Å; R543-E563 PolarHBondContact O-N 3.46Å
544	Y	45.5	Very low	44	Very low	120 Å²	120	117.3 Å²	117.3	47%	0.471	66%	0.66	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-104.9	149	171.6	67.9	-89.4	0	0	0	111.3	I525 V546 V561	I525-Y544 HydrophobicContact CG2-CE1 3.75Å; Y544-V546 HydrophobicContact CD2-CG2 4.01Å; Y544-V546 HydrophobicContact CE2-CG2 4.34Å; Y544-V561 CarbonylContact C-O 3.56Å; Y544-V561 VanDerWaalsContact CA-O 3.32Å; Y544-V561 WeakPolarHBondContact CA-O 3.47Å
545	H	47	Very low	44.7	Very low	115 Å²	115	115.4 Å²	115.4	53%	0.532	64%	0.638	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-127.4	138.4	167.6	-173.3	53.9	0	0	0	108.4	I560 V561	H545-I560 WeakPolarHBondContact O-CA 3.02Å; H545-V561 PolarHBondContact N-O 3.2Å; H545-V561 PolarHBondContact O-N 2.86Å
546	V	51	Low	46.1	Very low	68 Å²	68	111.1 Å²	111.1	41%	0.412	61%	0.608	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-121	122.3	175.8	-173.3	0	0	0	0	107.3	Y544 T558 Q559 I560	Y544-V546 HydrophobicContact CD2-CG2 4.01Å; Y544-V546 HydrophobicContact CE2-CG2 4.34Å; V546-T558 HydrophobicContact CG1-CG2 3.67Å; V546-Q559 WeakPolarHBondContact CA-O 3.29Å; V546-I560 HydrophobicContact CG1-CG1 4.25Å; V546-I560 HydrophobicContact CG2-CG1 4.17Å; V546-I560 HydrophobicContact CG2-CG2 4.4Å
547	E	53.6	Low	47	Very low	126 Å²	126	108 Å²	108	59%	0.589	58%	0.58	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-118.9	123.3	175.7	-167.9	164.3	-149.5	0	0	107.7	Q559	E547-Q559 PolarHBondContact N-O 3.35Å; E547-Q559 PolarHBondContact O-N 2.92Å
548	K	46.4	Very low	47.8	Very low	127 Å²	127	103.5 Å²	103.5	55%	0.552	55%	0.547	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.6	123.5	-178.9	-173.1	165.3	-175.4	166.4	0	108.8	T556 K557 T558	K548-T556 WeakPolarHBondContact CE-OG1 3.41Å; K548-T556 PolarHBondContact NZ-OG1 3.22Å; K548-K557 CarbonylContact C-O 3.57Å; K548-K557 WeakPolarHBondContact CA-O 3.26Å; K548-T558 HydrophobicContact CB-CG2 4.4Å; K548-T558 WeakPolarHBondContact CD-OG1 3.12Å
549	S	55.5	Low	48.4	Very low	60 Å²	60	103.4 Å²	103.4	42%	0.42	53%	0.529	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	132.3	-179.5	49.7	0	0	0	0	110.9	K557	S549-K557 PolarHBondContact N-O 2.9Å; S549-K557 PolarHBondContact O-N 3.4Å
550	E	51.1	Low	49	Very low	168 Å²	168	100.5 Å²	100.5	79%	0.785	51%	0.513	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.6	130.3	168.1	-79.1	159.3	-162.9	0	0	108.6	T556	E550-T556 HydrophobicContact CG-CG2 3.84Å
551	Q	57.1	Low	49.6	Very low	109 Å²	109	98.2 Å²	98.2	51%	0.509	49%	0.494	S	S	.	.			trans	-100.2	153.2	176.1	-155.7	159.2	-30.3	0	0	109.2	D553 G554 T555	Q551-D553 PolarHBondContact O-N 3.42Å; Q551-G554 PolarHBondContact O-N 3.49Å; Q551-T555 PolarHBondContact N-O 3.48Å; Q551-T555 VanDerWaalsContact N-O 3.12Å
552	E	51.3	Low	49.5	Very low	205 Å²	205	95.7 Å²	95.7	96%	0.958	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	-19.6	-170.8	-70.4	-172.2	123.7	0	0	114.1	G554	E552-G554 PolarHBondContact O-N 2.99Å
553	D	43.5	Very low	49.5	Very low	139 Å²	139	95.9 Å²	95.9	74%	0.743	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.7	2.9	175	-53.6	-58.5	0	0	0	114	Q551	Q551-D553 PolarHBondContact O-N 3.42Å
554	G	56.3	Low	49.3	Very low	66 Å²	66	91 Å²	91	68%	0.68	48%	0.475	S	S	*	.	S	Bend	trans	87.2	-2.2	174.7	0	0	0	0	0	115.8	Q551 E552	Q551-G554 PolarHBondContact O-N 3.49Å; E552-G554 PolarHBondContact O-N 2.99Å
555	T	45.1	Very low	49.2	Very low	57 Å²	57	91 Å²	91	35%	0.35	48%	0.478	S	S	.	.			trans	-82.3	140.3	174.2	51.4	0	0	0	0	111.5	Q551	Q551-T555 PolarHBondContact N-O 3.48Å; Q551-T555 VanDerWaalsContact N-O 3.12Å
556	T	54.7	Low	48.9	Very low	43 Å²	43	93.7 Å²	93.7	26%	0.264	49%	0.488	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	111.2	175.7	66.7	0	0	0	0	111.5	K548 E550	K548-T556 WeakPolarHBondContact CE-OG1 3.41Å; K548-T556 PolarHBondContact NZ-OG1 3.22Å; E550-T556 HydrophobicContact CG-CG2 3.84Å
557	K	51.9	Low	48.3	Very low	50 Å²	50	99.4 Å²	99.4	22%	0.217	51%	0.51	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	128.5	173.4	175.9	166.5	174	148.8	0	110	K548 S549 E624	K548-K557 CarbonylContact C-O 3.57Å; K548-K557 WeakPolarHBondContact CA-O 3.26Å; S549-K557 PolarHBondContact N-O 2.9Å; S549-K557 PolarHBondContact O-N 3.4Å; K557-E624 VanDerWaalsContact CE-OE1 3.24Å; K557-E624 WeakPolarHBondContact CE-OE1 3.31Å; K557-E624 VanDerWaalsContact CE-OE2 3.27Å; K557-E624 WeakPolarHBondContact CE-OE2 3.46Å; K557-E624 IonicContact NZ-OE1 2.73Å; K557-E624 PolarHBondContact NZ-OE1 3.03Å; K557-E624 IonicContact NZ-OE2 3.13Å; K557-E624 PolarHBondContact NZ-OE2 2.79Å
558	T	52.5	Low	47.5	Very low	36 Å²	36	100 Å²	100	22%	0.221	51%	0.514	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	116.1	177.5	-49.8	0	0	0	0	109.7	V546 K548	V546-T558 HydrophobicContact CG1-CG2 3.67Å; K548-T558 HydrophobicContact CB-CG2 4.4Å; K548-T558 WeakPolarHBondContact CD-OG1 3.12Å
559	Q	45.8	Very low	47.2	Very low	62 Å²	62	103.4 Å²	103.4	29%	0.29	53%	0.531	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	131.2	-178.6	-176.4	173.8	-13.3	0	0	110.5	V546 E547 V561	V546-Q559 WeakPolarHBondContact CA-O 3.29Å; E547-Q559 PolarHBondContact N-O 3.35Å; E547-Q559 PolarHBondContact O-N 2.92Å; Q559-V561 HydrophobicContact CG-CG2 4.3Å
560	I	45.8	Very low	46.3	Very low	74 Å²	74	107.6 Å²	107.6	38%	0.379	55%	0.546	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	125.7	177.7	-53	-178	0	0	0	109.2	H545 V546	H545-I560 WeakPolarHBondContact O-CA 3.02Å; V546-I560 HydrophobicContact CG1-CG1 4.25Å; V546-I560 HydrophobicContact CG2-CG1 4.17Å; V546-I560 HydrophobicContact CG2-CG2 4.4Å
561	V	49.3	Very low	45.9	Very low	50 Å²	50	106.2 Å²	106.2	30%	0.303	54%	0.544	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	130.7	179.5	-177.4	0	0	0	0	109.7	Y544 H545 Q559	Y544-V561 CarbonylContact C-O 3.56Å; Y544-V561 VanDerWaalsContact CA-O 3.32Å; Y544-V561 WeakPolarHBondContact CA-O 3.47Å; H545-V561 PolarHBondContact N-O 3.2Å; H545-V561 PolarHBondContact O-N 2.86Å; Q559-V561 HydrophobicContact CG-CG2 4.3Å
562	L	43.8	Very low	45.4	Very low	95 Å²	95	106.6 Å²	106.6	50%	0.497	55%	0.554	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-114.9	120.3	-178.2	-71.2	161	0	0	0	110.8	V542	V542-L562 HydrophobicContact CG1-CB 4.46Å; V542-L562 HydrophobicContact CG1-CD2 3.8Å
563	E	45.6	Very low	45.4	Very low	75 Å²	75	101.1 Å²	101.1	35%	0.35	54%	0.538	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	123.7	172.9	-168.5	-164.9	-161.9	0	0	109.5	R543 K565	R543-E563 PolarHBondContact N-O 2.94Å; R543-E563 IonicContact NE-OE2 4Å; R543-E563 PolarHBondContact O-N 3.46Å; E563-K565 WeakPolarHBondContact OE1-CE 3.33Å; E563-K565 IonicContact OE1-NZ 3.04Å; E563-K565 PolarHBondContact OE1-NZ 2.91Å; E563-K565 IonicContact OE2-NZ 3.98Å
564	S	43	Very low	45.7	Very low	66 Å²	66	103.5 Å²	103.5	46%	0.462	55%	0.545	S	S	.	.			trans	-107.4	141.5	173.9	-171.5	0	0	0	0	110.8
565	K	42.9	Very low	45.4	Very low	120 Å²	120	105.3 Å²	105.3	52%	0.522	54%	0.539	S	S	.	.			trans	-134.2	137.2	170.4	-67.4	-170	-178.7	173.2	0	109.5	E563	E563-K565 WeakPolarHBondContact OE1-CE 3.33Å; E563-K565 IonicContact OE1-NZ 3.04Å; E563-K565 PolarHBondContact OE1-NZ 2.91Å; E563-K565 IonicContact OE2-NZ 3.98Å
566	F	40	Very low	46	Very low	171 Å²	171	107.5 Å²	107.5	75%	0.75	56%	0.556	S	S	*	*			trans	-116	109.3	-177	-168.8	-87.2	0	0	0	108.8	E568	F566-E568 HydrophobicContact CE1-CB 3.91Å; F566-E568 HydrophobicContact CZ-CB 4.34Å
567	E	39.1	Very low	46	Very low	188 Å²	188	108.6 Å²	108.6	88%	0.879	57%	0.57	S	S	*	*			trans	-129.3	125	169.4	-73.7	178.5	135.9	0	0	106.6
568	E	36.7	Very low	45.9	Very low	140 Å²	140	110.8 Å²	110.8	65%	0.654	58%	0.583	S	S	*	*			trans	-119.9	99.7	-171.8	-176.9	175.5	-160.6	0	0	109.7	F566 M570	F566-E568 HydrophobicContact CE1-CB 3.91Å; F566-E568 HydrophobicContact CZ-CB 4.34Å; E568-M570 HydrophobicContact CG-CG 4.34Å
569	E	39.3	Very low	46	Very low	198 Å²	198	116.3 Å²	116.3	93%	0.925	61%	0.607	S	S	*	*			trans	-105.9	110.5	168.4	-68.8	-165.4	154.9	0	0	109.4
570	M	36.5	Very low	46.4	Very low	147 Å²	147	120.5 Å²	120.5	72%	0.724	63%	0.626	S	S	*	*			trans	-91.9	111.9	176.2	-69.9	-147.7	77.9	0	0	111.7	E568 V572	E568-M570 HydrophobicContact CG-CG 4.34Å; M570-V572 PolarHBondContact O-N 3.45Å
571	D	43.6	Very low	46.6	Very low	139 Å²	139	125.5 Å²	125.5	74%	0.743	65%	0.645	S	S	*	*			trans	-85.3	95	174	-168.3	-2.3	0	0	0	111.5	S573	D571-S573 PolarHBondContact O-N 3.49Å; D571-S573 WeakPolarHBondContact OD1-CB 3.41Å; D571-S573 PolarHBondContact OD1-OG 2.9Å
572	V	47	Very low	46.9	Very low	118 Å²	118	129.4 Å²	129.4	72%	0.715	66%	0.664	S	S	*	*			trans	-94	66.6	178	-82.2	0	0	0	0	111.6	M570	M570-V572 PolarHBondContact O-N 3.45Å
573	S	50.1	Low	47.4	Very low	90 Å²	90	129.1 Å²	129.1	63%	0.629	67%	0.67	S	S	*	*			trans	-113.9	-11	-173.1	-67.5	0	0	0	0	116.9	D571	D571-S573 PolarHBondContact O-N 3.49Å; D571-S573 WeakPolarHBondContact OD1-CB 3.41Å; D571-S573 PolarHBondContact OD1-OG 2.9Å
574	E	50.7	Low	47.7	Very low	189 Å²	189	134 Å²	134	88%	0.883	69%	0.693	S	S	*	*			trans	-116.9	17	-175.9	-65.6	-152	145.5	0	0	115.9	S576	E574-S576 PolarHBondContact O-N 3.45Å
575	D	50.1	Low	48.2	Very low	104 Å²	104	134.5 Å²	134.5	56%	0.556	71%	0.708	S	S	*	*			trans	-82.1	33.4	-174.9	-114.5	-21.1	0	0	0	115.5	A577 L578	D575-A577 PolarHBondContact O-N 3.38Å; D575-L578 PolarHBondContact O-N 2.99Å
576	S	57.2	Low	48.2	Very low	103 Å²	103	135.1 Å²	135.1	72%	0.72	72%	0.722	S	S	*	*	H	α-helix	trans	-60.2	-18	-178.1	-68.6	0	0	0	0	114.2	E574	E574-S576 PolarHBondContact O-N 3.45Å
577	A	55.5	Low	48.8	Very low	66 Å²	66	136 Å²	136	55%	0.545	73%	0.725	S	S	.	*	H	α-helix	trans	-77.1	-27.3	175.9	0	0	0	0	0	113.5	D575 F581	D575-A577 PolarHBondContact O-N 3.38Å; A577-F581 WeakPolarHBondContact O-CD2 3.41Å
578	L	50.5	Low	49.3	Very low	95 Å²	95	136.9 Å²	136.9	50%	0.497	73%	0.726	S	S	.	*	H	α-helix	trans	-81	-31.6	-177.4	-85.1	171.7	0	0	0	113	D575 E580 F581 L582	D575-L578 PolarHBondContact O-N 2.99Å; L578-E580 VanDerWaalsContact C-N 3.32Å; L578-E580 PolarHBondContact O-N 2.99Å; L578-F581 PolarHBondContact O-N 3.28Å; L578-L582 WeakPolarHBondContact O-CG 3.31Å; L578-L582 PolarHBondContact O-N 3.24Å; L578-L582 VanDerWaalsContact O-N 3.15Å
579	E	52.8	Low	50	Low	153 Å²	153	134.5 Å²	134.5	72%	0.715	72%	0.721	S	S	*	*	H	α-helix	trans	-60.8	-40.1	174.9	-168.2	82.5	-130.3	0	0	111.5	L582 S583	E579-L582 PolarHBondContact O-N 2.88Å; E579-S583 PolarHBondContact O-N 3.2Å; E579-S583 VanDerWaalsContact O-N 3.1Å
580	E	54.8	Low	51.1	Low	150 Å²	150	127.8 Å²	127.8	70%	0.701	70%	0.696	S	S	*	*	H	α-helix	trans	-64.6	-46.7	-179.2	-171.1	168.2	-158.7	0	0	111.9	L578 L582 S583	L578-E580 VanDerWaalsContact C-N 3.32Å; L578-E580 PolarHBondContact O-N 2.99Å; E580-L582 PolarHBondContact O-N 3.14Å; E580-S583 PolarHBondContact O-N 3.01Å; E580-S583 PolarHBondContact O-OG 3.04Å
581	F	50.1	Low	52.1	Low	178 Å²	178	126.5 Å²	126.5	78%	0.781	69%	0.692	S	S	*	*	H	α-helix	trans	-66.7	-34.7	177.5	-81.6	-73.9	0	0	0	113.5	A577 L578 S583	A577-F581 WeakPolarHBondContact O-CD2 3.41Å; L578-F581 PolarHBondContact O-N 3.28Å; F581-S583 VanDerWaalsContact C-N 3.33Å
582	L	56	Low	53.1	Low	132 Å²	132	126.8 Å²	126.8	69%	0.691	69%	0.688	S	S	*	*	H	α-helix	trans	-75.3	-21.7	178.7	-69.4	173.5	0	0	0	113.2	L578 E579 E580 Q584	L578-L582 WeakPolarHBondContact O-CG 3.31Å; L578-L582 PolarHBondContact O-N 3.24Å; L578-L582 VanDerWaalsContact O-N 3.15Å; E579-L582 PolarHBondContact O-N 2.88Å; E580-L582 PolarHBondContact O-N 3.14Å; L582-Q584 PolarHBondContact O-N 3.2Å
583	S	54.6	Low	54	Low	90 Å²	90	126.4 Å²	126.4	63%	0.629	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.4	-22.6	178.1	78.6	0	0	0	0	114.1	E579 E580 F581	E579-S583 PolarHBondContact O-N 3.2Å; E579-S583 VanDerWaalsContact O-N 3.1Å; E580-S583 PolarHBondContact O-N 3.01Å; E580-S583 PolarHBondContact O-OG 3.04Å; F581-S583 VanDerWaalsContact C-N 3.33Å
584	Q	52.3	Low	54.7	Low	178 Å²	178	124.4 Å²	124.4	83%	0.832	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.8	67.4	-163.5	-157.1	165.1	88.2	0	0	114.3	L582	L582-Q584 PolarHBondContact O-N 3.2Å
585	G	53.8	Low	55.4	Low	76 Å²	76	119.9 Å²	119.9	78%	0.784	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	117.5	9	151.4	0	0	0	0	0	118.6
586	V	41.8	Very low	56.1	Low	132 Å²	132	123.3 Å²	123.3	80%	0.8	66%	0.661	S	S	*	*			trans	-104.6	138.5	172.5	-174.3	0	0	0	0	110.3	K588	V586-K588 PolarHBondContact O-N 3.04Å
587	K	53.2	Low	56.8	Low	189 Å²	189	121.6 Å²	121.6	82%	0.822	65%	0.647	S	S	*	*			trans	-73.5	122.1	172.3	-72.2	-172.1	176.1	-172.1	0	109.5	V589	K587-V589 PolarHBondContact O-N 3.25Å
588	K	49.4	Very low	57.4	Low	208 Å²	208	122.2 Å²	122.2	90%	0.904	65%	0.652	S	S	*	*			trans	-59.8	125.3	166.7	-164.1	166.2	-173.5	166.4	0	108.7	V586	V586-K588 PolarHBondContact O-N 3.04Å
589	V	51.9	Low	58.3	Low	89 Å²	89	121.7 Å²	121.7	54%	0.539	65%	0.653	S	S	.	*			trans	-111.2	130.3	174.9	178.5	0	0	0	0	106.2	K587 D593 I594	K587-V589 PolarHBondContact O-N 3.25Å; V589-D593 HydrophobicContact CG1-CB 3.62Å; V589-I594 HydrophobicContact CG1-CD1 4.08Å; V589-I594 HydrophobicContact CG1-CG1 3.89Å
590	S	61.3	Low	59.6	Low	58 Å²	58	115 Å²	115	41%	0.406	62%	0.624	S	S	.	*			trans	-74.6	158.8	-179.3	-26.7	0	0	0	0	109.6	E592 D593 I594	S590-E592 WeakPolarHBondContact CB-OE2 3.36Å; S590-E592 PolarHBondContact O-N 3.03Å; S590-D593 WeakPolarHBondContact CA-OD2 3.47Å; S590-D593 WeakPolarHBondContact CB-OD2 3.31Å; S590-D593 PolarHBondContact N-OD2 2.75Å; S590-D593 WeakPolarHBondContact O-CB 3.28Å; S590-D593 PolarHBondContact O-N 3.27Å; S590-D593 VanDerWaalsContact O-N 3.15Å; S590-D593 PolarHBondContact OG-OD2 2.89Å; S590-I594 WeakPolarHBondContact O-CG1 3.4Å
591	L	57.8	Low	60.4	Low	120 Å²	120	111 Å²	111	63%	0.628	61%	0.61	S	S	*	*	S	Bend	trans	-67.4	-31.6	177.2	-146.1	76.5	0	0	0	110.7	D593 I594 E595	L591-D593 VanDerWaalsContact C-N 3.29Å; L591-D593 PolarHBondContact O-N 3.32Å; L591-I594 PolarHBondContact O-N 2.88Å; L591-E595 PolarHBondContact O-N 3.02Å
592	E	65.1	Low	61.3	Low	145 Å²	145	108.6 Å²	108.6	68%	0.678	60%	0.603	S	S	*	*	G	3₁₀ helix	trans	-59.8	-33.1	172.2	-60	83.5	171.3	0	0	112.8	S590 I594	S590-E592 WeakPolarHBondContact CB-OE2 3.36Å; S590-E592 PolarHBondContact O-N 3.03Å; E592-I594 PolarHBondContact O-N 3.37Å
593	D	65	Low	62.2	Low	109 Å²	109	105.5 Å²	105.5	58%	0.583	59%	0.586	S	S	*	*	G	3₁₀ helix	trans	-71.9	-9.9	179.3	-67.2	-54.2	0	0	0	112.8	V589 S590 L591	V589-D593 HydrophobicContact CG1-CB 3.62Å; S590-D593 WeakPolarHBondContact CA-OD2 3.47Å; S590-D593 WeakPolarHBondContact CB-OD2 3.31Å; S590-D593 PolarHBondContact N-OD2 2.75Å; S590-D593 WeakPolarHBondContact O-CB 3.28Å; S590-D593 PolarHBondContact O-N 3.27Å; S590-D593 VanDerWaalsContact O-N 3.15Å; S590-D593 PolarHBondContact OG-OD2 2.89Å; L591-D593 VanDerWaalsContact C-N 3.29Å; L591-D593 PolarHBondContact O-N 3.32Å
594	I	64.4	Low	63	Low	48 Å²	48	106.4 Å²	106.4	25%	0.246	58%	0.579	C	S	.	*	G	3₁₀ helix	trans	-119	-7.6	-174.6	-18.9	179.9	0	0	0	112.6	V589 S590 L591 E592 D596 T597 G600	V589-I594 HydrophobicContact CG1-CD1 4.08Å; V589-I594 HydrophobicContact CG1-CG1 3.89Å; S590-I594 WeakPolarHBondContact O-CG1 3.4Å; L591-I594 PolarHBondContact O-N 2.88Å; E592-I594 PolarHBondContact O-N 3.37Å; I594-D596 PolarHBondContact O-N 3.03Å; I594-T597 VanDerWaalsContact O-CB 3.24Å; I594-T597 WeakPolarHBondContact O-CB 3.46Å; I594-T597 PolarHBondContact O-N 3.06Å; I594-T597 PolarHBondContact O-OG1 3.38Å; I594-G600 WeakPolarHBondContact O-CA 3.46Å
595	E	66.7	Low	63.7	Low	95 Å²	95	103 Å²	103	44%	0.444	57%	0.566	S	S	.	*	T	Hydrogen-bonded Turn	trans	-60.6	-40.6	-168.2	-173.3	164	-149.4	0	0	113.4	L591 T597 K604	L591-E595 PolarHBondContact O-N 3.02Å; E595-T597 PolarHBondContact O-N 3.19Å; E595-K604 IonicContact OE1-NZ 2.69Å; E595-K604 PolarHBondContact OE1-NZ 2.91Å
596	D	63.5	Low	64.4	Low	175 Å²	175	104.3 Å²	104.3	94%	0.936	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.8	4	175.6	-77.6	-33.5	0	0	0	114.2	I594	I594-D596 PolarHBondContact O-N 3.03Å
597	T	73.2	Confident	65.4	Low	68 Å²	68	102.4 Å²	102.4	42%	0.417	54%	0.54	S	S	.	.	S	Bend	trans	-101.1	150.5	-177.6	-50.7	0	0	0	0	111.7	I594 E595 T599 G600 T601	I594-T597 VanDerWaalsContact O-CB 3.24Å; I594-T597 WeakPolarHBondContact O-CB 3.46Å; I594-T597 PolarHBondContact O-N 3.06Å; I594-T597 PolarHBondContact O-OG1 3.38Å; E595-T597 PolarHBondContact O-N 3.19Å; T597-T599 PolarHBondContact O-N 2.91Å; T597-T599 VanDerWaalsContact O-N 3.12Å; T597-G600 PolarHBondContact O-N 3.02Å; T597-T601 PolarHBondContact O-N 2.92Å; T597-T601 PolarHBondContact O-OG1 3.35Å
598	A	66.9	Low	65.7	Low	79 Å²	79	96.8 Å²	96.8	65%	0.653	52%	0.524	S	S	*	.	H	α-helix	trans	-52.1	-33.5	173.2	0	0	0	0	0	113.3	T601 M602	A598-T601 VanDerWaalsContact CA-OG1 3.32Å; A598-T601 WeakPolarHBondContact CA-OG1 3.24Å; A598-T601 PolarHBondContact O-OG1 3.43Å; A598-T601 VanDerWaalsContact O-OG1 3.11Å; A598-M602 VanDerWaalsContact O-CB 3.31Å; A598-M602 WeakPolarHBondContact O-CB 3.14Å; A598-M602 PolarHBondContact O-N 3.24Å
599	T	70.9	Confident	65.7	Low	84 Å²	84	91.5 Å²	91.5	52%	0.515	51%	0.513	S	S	.	.	H	α-helix	trans	-70.9	-44.2	175.7	-42	0	0	0	0	112.4	T597 M602 I603	T597-T599 PolarHBondContact O-N 2.91Å; T597-T599 VanDerWaalsContact O-N 3.12Å; T599-M602 PolarHBondContact O-N 3.24Å; T599-I603 HydrophobicContact CG2-CD1 4.17Å; T599-I603 WeakPolarHBondContact O-CG1 3.47Å; T599-I603 PolarHBondContact O-N 2.99Å
600	G	78.3	Confident	65.7	Low	11 Å²	11	94.2 Å²	94.2	11%	0.113	52%	0.524	C	S	.	.	H	α-helix	trans	-65.8	-42	178.4	0	0	0	0	0	112	I594 T597 I603 K604	I594-G600 WeakPolarHBondContact O-CA 3.46Å; T597-G600 PolarHBondContact O-N 3.02Å; G600-I603 PolarHBondContact O-N 2.99Å; G600-K604 VanDerWaalsContact O-CB 3.28Å; G600-K604 WeakPolarHBondContact O-CB 3.38Å; G600-K604 PolarHBondContact O-N 3.42Å
601	T	73.1	Confident	65.1	Low	66 Å²	66	99.7 Å²	99.7	41%	0.405	54%	0.543	S	S	.	.	H	α-helix	trans	-64.8	-37	173.1	42.8	0	0	0	0	112.9	T597 A598 K604 N605	T597-T601 PolarHBondContact O-N 2.92Å; T597-T601 PolarHBondContact O-OG1 3.35Å; A598-T601 VanDerWaalsContact CA-OG1 3.32Å; A598-T601 WeakPolarHBondContact CA-OG1 3.24Å; A598-T601 PolarHBondContact O-OG1 3.43Å; A598-T601 VanDerWaalsContact O-OG1 3.11Å; T601-K604 PolarHBondContact O-N 3.35Å; T601-N605 WeakPolarHBondContact O-CB 3.31Å; T601-N605 PolarHBondContact O-N 3.44Å; T601-N605 PolarHBondContact O-ND2 2.93Å
602	M	69.3	Low	64.2	Low	128 Å²	128	97.1 Å²	97.1	63%	0.631	55%	0.545	S	S	*	.	H	α-helix	trans	-63.6	-44.5	172.5	-172.2	173.8	-175.5	0	0	112.3	A598 T599 N605 L606	A598-M602 VanDerWaalsContact O-CB 3.31Å; A598-M602 WeakPolarHBondContact O-CB 3.14Å; A598-M602 PolarHBondContact O-N 3.24Å; T599-M602 PolarHBondContact O-N 3.24Å; M602-N605 PolarHBondContact O-N 3.34Å; M602-L606 WeakPolarHBondContact O-CG 3.43Å; M602-L606 PolarHBondContact O-N 3.45Å; M602-L606 VanDerWaalsContact O-N 3.08Å
603	I	73.2	Confident	63.1	Low	68 Å²	68	93 Å²	93	35%	0.349	54%	0.543	S	S	.	.	H	α-helix	trans	-63.8	-43.7	175.8	-67.9	164	0	0	0	110.8	T599 G600 N605 L606 L607	T599-I603 HydrophobicContact CG2-CD1 4.17Å; T599-I603 WeakPolarHBondContact O-CG1 3.47Å; T599-I603 PolarHBondContact O-N 2.99Å; G600-I603 PolarHBondContact O-N 2.99Å; I603-N605 VanDerWaalsContact C-N 3.31Å; I603-N605 PolarHBondContact O-N 2.91Å; I603-L606 PolarHBondContact O-N 3.27Å; I603-L607 HydrophobicContact CG2-CD1 3.98Å; I603-L607 HydrophobicContact CG2-CG 4.47Å; I603-L607 WeakPolarHBondContact O-CG 3.45Å; I603-L607 PolarHBondContact O-N 2.99Å
604	K	72.6	Confident	62.4	Low	109 Å²	109	96.3 Å²	96.3	47%	0.474	55%	0.554	S	S	.	*	H	α-helix	trans	-62	-37.5	178	-166.6	169.4	-173.2	173.7	0	112.1	E595 G600 T601 S608	E595-K604 IonicContact OE1-NZ 2.69Å; E595-K604 PolarHBondContact OE1-NZ 2.91Å; G600-K604 VanDerWaalsContact O-CB 3.28Å; G600-K604 WeakPolarHBondContact O-CB 3.38Å; G600-K604 PolarHBondContact O-N 3.42Å; T601-K604 PolarHBondContact O-N 3.35Å; K604-S608 WeakPolarHBondContact O-CB 3.2Å; K604-S608 PolarHBondContact O-N 2.89Å; K604-S608 PolarHBondContact O-OG 3.42Å
605	N	65.9	Low	61.7	Low	106 Å²	106	101.2 Å²	101.2	57%	0.567	58%	0.581	S	S	*	*	H	α-helix	trans	-66.8	-44.4	173.9	-71.9	-12.1	0	0	0	111.9	T601 M602 I603 L607 S608 S609	T601-N605 WeakPolarHBondContact O-CB 3.31Å; T601-N605 PolarHBondContact O-N 3.44Å; T601-N605 PolarHBondContact O-ND2 2.93Å; M602-N605 PolarHBondContact O-N 3.34Å; I603-N605 VanDerWaalsContact C-N 3.31Å; I603-N605 PolarHBondContact O-N 2.91Å; N605-L607 PolarHBondContact O-N 3.13Å; N605-S608 PolarHBondContact O-N 2.92Å; N605-S609 PolarHBondContact O-N 3.25Å; N605-S609 PolarHBondContact O-OG 3.47Å
606	L	69.2	Low	60.6	Low	103 Å²	103	105.1 Å²	105.1	54%	0.539	60%	0.601	S	S	.	*	H	α-helix	trans	-60.3	-45.1	176.6	-71	165.8	0	0	0	112	M602 I603 S609 L610	M602-L606 WeakPolarHBondContact O-CG 3.43Å; M602-L606 PolarHBondContact O-N 3.45Å; M602-L606 VanDerWaalsContact O-N 3.08Å; I603-L606 PolarHBondContact O-N 3.27Å; L606-S609 WeakPolarHBondContact O-CB 3.36Å; L606-S609 PolarHBondContact O-N 3.37Å; L606-L610 PolarHBondContact O-N 2.96Å
607	L	62.3	Low	59.7	Low	93 Å²	93	105 Å²	105	49%	0.487	60%	0.595	S	S	.	*	H	α-helix	trans	-64	-40.1	175.4	-67.8	170.9	0	0	0	111.9	I603 N605 S609 L610 Q611	I603-L607 HydrophobicContact CG2-CD1 3.98Å; I603-L607 HydrophobicContact CG2-CG 4.47Å; I603-L607 WeakPolarHBondContact O-CG 3.45Å; I603-L607 PolarHBondContact O-N 2.99Å; N605-L607 PolarHBondContact O-N 3.13Å; L607-S609 VanDerWaalsContact C-N 3.28Å; L607-S609 PolarHBondContact O-N 2.96Å; L607-L610 PolarHBondContact O-N 2.88Å; L607-Q611 PolarHBondContact O-N 3.27Å
608	S	59	Low	58.1	Low	70 Å²	70	107.6 Å²	107.6	49%	0.49	61%	0.607	S	S	.	*	H	α-helix	trans	-65.5	-30	175.4	-56	0	0	0	0	112.7	K604 N605 G612	K604-S608 WeakPolarHBondContact O-CB 3.2Å; K604-S608 PolarHBondContact O-N 2.89Å; K604-S608 PolarHBondContact O-OG 3.42Å; N605-S608 PolarHBondContact O-N 2.92Å; S608-G612 PolarHBondContact O-N 2.85Å
609	S	49.7	Very low	56.9	Low	97 Å²	97	113.3 Å²	113.3	68%	0.678	62%	0.617	S	S	*	*	H	α-helix	trans	-72.4	-29.9	174.6	-60	0	0	0	0	113.1	N605 L606 L607	N605-S609 PolarHBondContact O-N 3.25Å; N605-S609 PolarHBondContact O-OG 3.47Å; L606-S609 WeakPolarHBondContact O-CB 3.36Å; L606-S609 PolarHBondContact O-N 3.37Å; L607-S609 VanDerWaalsContact C-N 3.28Å; L607-S609 PolarHBondContact O-N 2.96Å
610	L	51.9	Low	55.6	Low	146 Å²	146	113.4 Å²	113.4	76%	0.764	62%	0.621	S	S	*	*	H	α-helix	trans	-77.6	-35.2	173.1	-73.7	161.9	0	0	0	112.2	L606 L607	L606-L610 PolarHBondContact O-N 2.96Å; L607-L610 PolarHBondContact O-N 2.88Å
611	Q	48.8	Very low	53.6	Low	174 Å²	174	117.8 Å²	117.8	81%	0.813	65%	0.645	S	S	*	*	H	α-helix	trans	-83.2	-9.4	-176.9	-159.8	165.8	25.9	0	0	114.2	L607 G613	L607-Q611 PolarHBondContact O-N 3.27Å; Q611-G613 VanDerWaalsContact C-N 3.29Å; Q611-G613 PolarHBondContact O-N 3Å
612	G	40.3	Very low	51.9	Low	65 Å²	65	119.5 Å²	119.5	67%	0.67	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.3	16.8	180	0	0	0	0	0	115.9	S608	S608-G612 PolarHBondContact O-N 2.85Å
613	G	40.5	Very low	50.5	Low	60 Å²	60	117.5 Å²	117.5	62%	0.619	65%	0.647	S	S	*	*			trans	-95	26	-166.1	0	0	0	0	0	117.4	Q611 N615	Q611-G613 VanDerWaalsContact C-N 3.29Å; Q611-G613 PolarHBondContact O-N 3Å; G613-N615 PolarHBondContact O-N 3.03Å
614	E	50.5	Low	48.8	Very low	177 Å²	177	119 Å²	119	83%	0.827	65%	0.652	S	S	*	*			trans	-68.6	129.7	175.1	-68.4	-171.7	157.9	0	0	111.2
615	N	49.3	Very low	47.4	Very low	151 Å²	151	118.5 Å²	118.5	81%	0.807	65%	0.653	S	S	*	*			trans	72.2	68.3	179.6	-52.1	-35.9	0	0	0	117.2	G613	G613-N615 PolarHBondContact O-N 3.03Å
616	M	45.3	Very low	46	Very low	178 Å²	178	118.5 Å²	118.5	88%	0.877	65%	0.653	S	S	*	*			trans	-84.4	102.8	146.8	-77.6	-71.5	-162.1	0	0	109.2
617	E	43.9	Very low	44.8	Very low	172 Å²	172	119.8 Å²	119.8	80%	0.804	66%	0.656	S	S	*	*			trans	-72.3	141.8	177.2	-66.7	-176.5	132.1	0	0	112.2	K619	E617-K619 PolarHBondContact O-N 2.96Å
618	N	40.1	Very low	43.5	Very low	123 Å²	123	123.1 Å²	123.1	66%	0.658	67%	0.669	S	S	*	*			trans	-62.4	121.8	-177.3	-69.1	-5.7	0	0	0	111.9
619	K	40.8	Very low	42.4	Very low	198 Å²	198	126 Å²	126	86%	0.861	69%	0.686	S	S	*	*			trans	-100.5	105.2	172.8	-64.3	177	-175.5	174	0	110.2	E617	E617-K619 PolarHBondContact O-N 2.96Å
620	S	43.5	Very low	41.8	Very low	86 Å²	86	128.9 Å²	128.9	60%	0.601	69%	0.692	S	S	*	*			trans	-83.6	140.5	168.7	52.8	0	0	0	0	110.9
621	V	37.4	Very low	40.8	Very low	103 Å²	103	130 Å²	130	62%	0.624	69%	0.694	S	S	*	*			trans	-117.1	126.4	170.6	-179.5	0	0	0	0	107.7	V623	V621-V623 HydrophobicContact CG1-CG2 4.33Å
622	N	35.9	Very low	39.9	Very low	103 Å²	103	127.3 Å²	127.3	55%	0.551	69%	0.694	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-98.9	132.2	173.6	-66	-21.5	0	0	0	108.5
623	V	40.2	Very low	39.4	Very low	86 Å²	86	133.8 Å²	133.8	52%	0.521	70%	0.704	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-122.2	134.1	170.5	-176.6	0	0	0	0	107.6	V621 I625	V621-V623 HydrophobicContact CG1-CG2 4.33Å; V623-I625 HydrophobicContact CG1-CG1 4.34Å
624	E	37.4	Very low	38.9	Very low	100 Å²	100	135.7 Å²	135.7	47%	0.467	71%	0.707	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-120.8	129.6	-179.7	-179.5	169.7	155.9	0	0	108.1	K557	K557-E624 VanDerWaalsContact CE-OE1 3.24Å; K557-E624 WeakPolarHBondContact CE-OE1 3.31Å; K557-E624 VanDerWaalsContact CE-OE2 3.27Å; K557-E624 WeakPolarHBondContact CE-OE2 3.46Å; K557-E624 IonicContact NZ-OE1 2.73Å; K557-E624 PolarHBondContact NZ-OE1 3.03Å; K557-E624 IonicContact NZ-OE2 3.13Å; K557-E624 PolarHBondContact NZ-OE2 2.79Å
625	I	43.9	Very low	38	Very low	97 Å²	97	135.4 Å²	135.4	50%	0.497	71%	0.712	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-124.9	133.4	178	-56	178.2	0	0	0	107	V623 E627	V623-I625 HydrophobicContact CG1-CG1 4.34Å; I625-E627 HydrophobicContact CG2-CG 4.19Å
626	I	37	Very low	37.3	Very low	107 Å²	107	137.1 Å²	137.1	55%	0.549	72%	0.715	S	S	.	*			trans	-119.7	128.4	176.8	-56.7	175.2	0	0	0	106.1
627	E	43.8	Very low	36.9	Very low	129 Å²	129	137.7 Å²	137.7	60%	0.603	72%	0.715	S	S	*	*			trans	-117.8	130	-178.3	-65.6	176.4	157.9	0	0	109	I625	I625-E627 HydrophobicContact CG2-CG 4.19Å
628	E	33.4	Very low	36.3	Very low	164 Å²	164	137.1 Å²	137.1	77%	0.766	72%	0.717	S	S	*	*			trans	-105.9	138.3	172.9	-65.9	-175.9	166.7	0	0	109.2
629	P	37.8	Very low	35.8	Very low	130 Å²	130	141.3 Å²	141.3	84%	0.844	73%	0.733	S	S	*	*			trans	-78.6	134.1	-172	30.6	-34.6	0	0	0	112.6
630	I	35.4	Very low	35.4	Very low	157 Å²	157	135.4 Å²	135.4	81%	0.805	72%	0.721	S	S	*	*			trans	-105.9	124	166.6	-63	177.3	0	0	0	108.2
631	E	31.7	Very low	34.8	Very low	171 Å²	171	137.1 Å²	137.1	80%	0.799	72%	0.719	S	S	*	*			trans	-70	140.1	178.5	-62.7	-172.5	142.6	0	0	111.3
632	S	29.6	Very low	34.5	Very low	117 Å²	117	140.7 Å²	140.7	82%	0.818	73%	0.733	S	S	*	*			trans	-107.8	128	-173.5	-51.9	0	0	0	0	111.5
633	F	30.5	Very low	34.1	Very low	200 Å²	200	145.3 Å²	145.3	88%	0.877	75%	0.748	S	S	*	*			trans	-105	154.2	166.1	-72.6	-82.7	0	0	0	110.5
634	S	29.9	Very low	33.5	Very low	100 Å²	100	150.2 Å²	150.2	70%	0.699	76%	0.758	S	S	*	*			trans	-104.2	132.3	-162.7	52.6	0	0	0	0	114.3	E636	S634-E636 PolarHBondContact O-N 3.32Å
635	D	30.9	Very low	32.9	Very low	171 Å²	171	151.6 Å²	151.6	91%	0.914	77%	0.773	S	S	*	*			trans	-74.1	105.7	169	-74.3	-38.1	0	0	0	111.7
636	E	35.3	Very low	32	Very low	188 Å²	188	152.5 Å²	152.5	88%	0.879	79%	0.788	S	S	*	*			trans	-132	13.5	169.3	-76.1	-157	135.8	0	0	115.1	S634	S634-E636 PolarHBondContact O-N 3.32Å
637	E	36.6	Very low	31.4	Very low	189 Å²	189	153 Å²	153	88%	0.883	80%	0.8	S	S	*	*	S	Bend	trans	-147.7	74.5	179.9	-157.8	161.6	-142.3	0	0	116.7
638	L	30.6	Very low	30.5	Very low	161 Å²	161	152.3 Å²	152.3	84%	0.843	81%	0.81	S	S	*	*			trans	-155.7	25.6	153.2	-140.1	75.8	0	0	0	117.9	A640	L638-A640 PolarHBondContact O-N 3.27Å
639	E	29.9	Very low	30.1	Very low	210 Å²	210	154.6 Å²	154.6	98%	0.981	81%	0.813	S	S	*	*			trans	-75.8	40.4	168.4	-98.1	-96.4	135.9	0	0	112.5
640	A	33.5	Very low	29.4	Very low	74 Å²	74	155.9 Å²	155.9	61%	0.612	81%	0.808	S	S	*	*			trans	-149.7	93.8	179.3	0	0	0	0	0	112	L638	L638-A640 PolarHBondContact O-N 3.27Å
641	E	30.1	Very low	29.4	Very low	122 Å²	122	153.6 Å²	153.6	57%	0.57	80%	0.804	S	S	*	*				171.3	0.9	127.9	-155.3	63.7	165.7	0	0	113.2	K643 R644	E641-K643 PolarHBondContact O-N 2.67Å; E641-R644 IonicContact OE1-CZ 2.61Å; E641-R644 IonicContact OE1-NH1 2.66Å; E641-R644 PolarHBondContact OE1-NH1 3.1Å; E641-R644 IonicContact OE1-NH2 2.69Å; E641-R644 PolarHBondContact OE1-NH2 3.4Å; E641-R644 IonicContact OE2-NH2 3.88Å
642	I	32	Very low	29.2	Very low	179 Å²	179	151.1 Å²	151.1	92%	0.918	81%	0.805	S	S	*	*			trans	-72.1	65.3	176.5	-47.8	-177.1	0	0	0	112
643	K	27.4	Very low	29	Very low	200 Å²	200	156.9 Å²	156.9	87%	0.87	81%	0.809	S	S	*	*			trans	-157.4	36	170.9	-125.8	160.7	-166.5	160.7	0	117.3	E641	E641-K643 PolarHBondContact O-N 2.67Å
644	R	26.7	Very low	28.8	Very low	189 Å²	189	157.7 Å²	157.7	71%	0.713	81%	0.808	S	S	*	*	S	Bend	trans	-113.9	77.1	161.4	-64.3	-159.9	-162.4	78.7	15.1	113.6	E641	E641-R644 IonicContact OE1-CZ 2.61Å; E641-R644 IonicContact OE1-NH1 2.66Å; E641-R644 PolarHBondContact OE1-NH1 3.1Å; E641-R644 IonicContact OE1-NH2 2.69Å; E641-R644 PolarHBondContact OE1-NH2 3.4Å; E641-R644 IonicContact OE2-NH2 3.88Å
645	T	25.5	Very low	28.6	Very low	128 Å²	128	163.2 Å²	163.2	79%	0.785	82%	0.82	S	S	*	*			trans	37.9	96.3	138.6	54.5	0	0	0	0	118.4
646	S	24.7	Very low	28.3	Very low	117 Å²	117	162.8 Å²	162.8	82%	0.818	81%	0.812	S	S	*	*			trans	-26.4	132.6	148.3	53.9	0	0	0	0	116.7
647	S	24	Very low	28.1	Very low	116 Å²	116	161.6 Å²	161.6	81%	0.811	81%	0.81	S	S	*	*			trans	173	92.8	136.4	171.4	0	0	0	0	114.2
648	S	25.3	Very low	27.7	Very low	115 Å²	115	160.3 Å²	160.3	80%	0.804	80%	0.804	S	S	*	*			trans	173.9	115.6	134.6	55.9	0	0	0	0	113.9
649	Y	23.8	Very low	27.6	Very low	212 Å²	212	161.8 Å²	161.8	83%	0.831	81%	0.807	S	S	*	*			trans	-72.5	157.1	141.7	-92.4	-130	0	0	0	107.5
650	E	24.4	Very low	27.6	Very low	157 Å²	157	160.3 Å²	160.3	73%	0.734	80%	0.802	S	S	*	*			cis	-166	-175.2	4.8	-128.8	-178.6	-174	0	0	106.1
651	P	35.5	Very low	27.4	Very low	110 Å²	110	165.6 Å²	165.6	71%	0.714	81%	0.814	S	S	*	*			cis	-128.2	177.4	-21.7	40.3	-25.9	0	0	0	113
652	S	27.3	Very low	27.4	Very low	119 Å²	119	166.5 Å²	166.5	83%	0.832	82%	0.822	S	S	*	*			trans	-67	149	171.1	-48.9	0	0	0	0	113.4
653	R	24.7	Very low	27.2	Very low	237 Å²	237	164 Å²	164	89%	0.894	82%	0.815	S	S	*	*			trans	-139.7	135.2	157.8	-177.1	176.8	-84.1	-140.8	-0.9	111
654	Y	27.3	Very low	27	Very low	218 Å²	218	160.7 Å²	160.7	86%	0.855	81%	0.812	S	S	*	*			trans	-64.3	153.7	174.5	-80.4	-111.1	0	0	0	112.4	Q656	Y654-Q656 PolarHBondContact O-N 2.86Å
655	F	25.1	Very low	27.1	Very low	216 Å²	216	159.7 Å²	159.7	95%	0.947	82%	0.815	S	S	*	*			trans	-72.4	121	153.1	-82.1	-85.9	0	0	0	109.5
656	Q	24.5	Very low	27	Very low	161 Å²	161	162.3 Å²	162.3	75%	0.752	82%	0.818	S	S	*	*			trans	-120.9	139.6	164.8	-180	172.2	-14.6	0	0	107.3	Y654 E658	Y654-Q656 PolarHBondContact O-N 2.86Å; Q656-E658 PolarHBondContact O-N 3.23Å
657	I	30.1	Very low	27.2	Very low	164 Å²	164	167.3 Å²	167.3	84%	0.841	82%	0.821	S	S	*	*			trans	-77.4	118.9	173	-59.1	171.6	0	0	0	107
658	E	29.9	Very low	27.3	Very low	162 Å²	162	169.8 Å²	169.8	76%	0.757	82%	0.82	S	S	*	*			trans	-105.1	135.5	173.5	-80.1	-174.1	147.3	0	0	111.1	Q656	Q656-E658 PolarHBondContact O-N 3.23Å
659	E	28.8	Very low	27.3	Very low	192 Å²	192	172.8 Å²	172.8	90%	0.897	82%	0.821	S	S	*	*			trans	-82.6	141	176.9	-60.7	174.8	128.5	0	0	109.8
660	M	29.3	Very low	27.5	Very low	179 Å²	179	168.2 Å²	168.2	88%	0.882	81%	0.811	S	S	*	*			trans	-88.1	109.9	175.6	-70.5	-171	70.9	0	0	111.3
661	E	29.7	Very low	27.8	Very low	185 Å²	185	168.6 Å²	168.6	86%	0.864	81%	0.81	S	S	*	*			trans	-112.9	128.9	162.4	-165.8	166.7	-128.1	0	0	110.2
662	N	29.3	Very low	27.6	Very low	140 Å²	140	168 Å²	168	75%	0.749	81%	0.808	S	S	*	*			trans	-84.6	127.2	-174.8	-75.7	-46.6	0	0	0	111.6
663	V	27.2	Very low	27.8	Very low	126 Å²	126	169.5 Å²	169.5	76%	0.764	81%	0.807	S	S	*	*			trans	-128.2	110.9	160.9	-177.5	0	0	0	0	109.5
664	T	24.9	Very low	28.2	Very low	131 Å²	131	164.8 Å²	164.8	80%	0.804	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-88.6	129.1	174.5	-51.3	0	0	0	0	109.6
665	H	28.5	Very low	28.4	Very low	169 Å²	169	160.6 Å²	160.6	78%	0.782	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-79	133.9	169.7	-90	-86.6	0	0	0	111.4
666	E	22.4	Very low	28.7	Very low	182 Å²	182	153.9 Å²	153.9	85%	0.85	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-79	152	171.7	-65.4	-177.6	128.3	0	0	112.3
667	Y	28.7	Very low	29.1	Very low	222 Å²	222	152.2 Å²	152.2	87%	0.871	78%	0.778	S	S	*	*			trans	-141.5	108.9	160.8	-94.2	-72.6	0	0	0	110.1
668	E	26	Very low	29.2	Very low	169 Å²	169	150.6 Å²	150.6	79%	0.79	78%	0.775	S	S	*	*			trans	46.1	144.7	142.3	-72.2	-69.8	-172.1	0	0	124
669	E	25.7	Very low	29.2	Very low	178 Å²	178	147.2 Å²	147.2	83%	0.832	78%	0.775	S	S	*	*			trans	60.4	135.4	169.5	-59.1	-174.6	155.3	0	0	116.4
670	D	28.3	Very low	29.2	Very low	116 Å²	116	142.8 Å²	142.8	62%	0.62	77%	0.765	S	S	*	*			cis	-163.8	147.3	40.8	-170.2	15.9	0	0	0	113.7
671	K	31.3	Very low	29.3	Very low	165 Å²	165	142.8 Å²	142.8	72%	0.717	76%	0.76	S	S	*	*			trans	69	140.4	157.1	-86.4	158.1	-162.8	78.7	0	125.4
672	S	29.9	Very low	29.2	Very low	96 Å²	96	145 Å²	145	67%	0.671	76%	0.76	S	S	*	*			trans	89.6	96.7	143.6	60.5	0	0	0	0	122.1
673	D	31.7	Very low	29.1	Very low	151 Å²	151	141.9 Å²	141.9	81%	0.807	76%	0.762	S	S	*	*				91.5	125	117.4	-58.9	-6.7	0	0	0	123
674	D	33.3	Very low	29.2	Very low	138 Å²	138	140 Å²	140	74%	0.738	76%	0.759	S	S	*	*			trans	89	114.5	137.1	-91.9	12	0	0	0	124.1
675	N	32.8	Very low	29.4	Very low	131 Å²	131	141.7 Å²	141.7	70%	0.701	76%	0.763	S	S	*	*			trans	80.9	98.1	132.7	-75.2	-47.1	0	0	0	122.2
676	A	31.3	Very low	29.8	Very low	75 Å²	75	142.5 Å²	142.5	62%	0.62	77%	0.767	S	S	*	*				92.9	103.5	105.7	0	0	0	0	0	121
677	T	32.8	Very low	30.7	Very low	126 Å²	126	139.6 Å²	139.6	77%	0.773	76%	0.764	S	S	*	*				75.2	118.6	126.4	55.7	0	0	0	0	122.8
678	V	32.4	Very low	30.7	Very low	129 Å²	129	134.7 Å²	134.7	78%	0.782	76%	0.763	S	S	*	*				78.2	103.5	126.4	179.1	0	0	0	0	119.5
679	A	28.1	Very low	30.7	Very low	91 Å²	91	130.5 Å²	130.5	75%	0.752	76%	0.764	S	S	*	*				40	144.9	128.2	0	0	0	0	0	120.8
680	S	30.1	Very low	30.6	Very low	99 Å²	99	125.4 Å²	125.4	69%	0.692	76%	0.76	S	S	*	*				174.8	144.6	69.2	-169.5	0	0	0	0	114.6
681	K	31.4	Very low	30.6	Very low	180 Å²	180	125.3 Å²	125.3	78%	0.783	77%	0.768	S	S	*	*			trans	30.4	119.7	144.3	-66.6	176.6	179.6	171.2	0	122.4
682	R	27.9	Very low	30.3	Very low	231 Å²	231	124.1 Å²	124.1	87%	0.872	78%	0.775	S	S	*	*				68.2	110.8	112.6	-171.7	-163.3	-74.4	-157.6	-6.6	120.7
683	G	27.1	Very low	29.9	Very low	75 Å²	75	127.5 Å²	127.5	77%	0.773	78%	0.78	S	S	*	*			trans	75.7	171.1	141.5	0	0	0	0	0	117.3
684	A	29.3	Very low	29.6	Very low	87 Å²	87	125.3 Å²	125.3	72%	0.719	77%	0.771	S	S	*	*			cis	-161.1	167	-14	0	0	0	0	0	110.4
685	D	29.3	Very low	29.1	Very low	166 Å²	166	125.6 Å²	125.6	89%	0.888	77%	0.768	S	S	*	*			trans	71.3	158.5	159	-57.4	-29.1	0	0	0	122
686	Q	36.3	Very low	28.7	Very low	185 Å²	185	125.3 Å²	125.3	86%	0.864	76%	0.763	S	S	*	*			trans	-86.8	176.8	-176	-82	-175.7	2.9	0	0	111.2
687	P	40.8	Very low	28.4	Very low	121 Å²	121	129.8 Å²	129.8	79%	0.786	77%	0.769	S	S	*	*			cis	-153.4	-165.5	36.3	44.9	-21.3	0	0	0	118.9
688	S	28.3	Very low	28.3	Very low	120 Å²	120	128 Å²	128	84%	0.839	76%	0.761	S	S	*	*			trans	-73.2	148.5	-172.5	77.8	0	0	0	0	116.4
689	G	26.3	Very low	28.3	Very low	80 Å²	80	130.7 Å²	130.7	83%	0.825	76%	0.757	S	S	*	*				116.6	123.8	113.3	0	0	0	0	0	119.6
690	G	25.1	Very low	28.5	Very low	71 Å²	71	132.8 Å²	132.8	73%	0.732	75%	0.752	S	S	*	*			trans	122.9	154.8	141.8	0	0	0	0	0	119
691	S	27.5	Very low	28.7	Very low	115 Å²	115	134.1 Å²	134.1	80%	0.804	75%	0.751	S	S	*	*			trans	74.7	130.7	177.1	73.3	0	0	0	0	117.5
692	V	24.6	Very low	28.3	Very low	140 Å²	140	135.3 Å²	135.3	85%	0.848	76%	0.756	S	S	*	*			cis	112.2	105.1	-3	-175.9	0	0	0	0	117
693	H	22.4	Very low	28.3	Very low	167 Å²	167	129.1 Å²	129.1	77%	0.773	75%	0.748	S	S	*	*			trans	91.4	163.9	143	-158.3	54.8	0	0	0	121.9
694	V	24.7	Very low	29.1	Very low	105 Å²	105	130.9 Å²	130.9	64%	0.636	75%	0.746	S	S	*	*			trans	82.2	105.4	171.7	-173	0	0	0	0	116.1
695	Q	23.3	Very low	29.1	Very low	144 Å²	144	133.9 Å²	133.9	67%	0.673	75%	0.75	S	S	*	*				89	139.2	75.5	-146.1	161.6	-9.1	0	0	111.4
696	E	24.5	Very low	29	Very low	124 Å²	124	132 Å²	132	58%	0.579	74%	0.744	S	S	*	*			cis	-165.4	161.8	15.1	-141.5	169.4	-140.9	0	0	114.7
697	F	23.8	Very low	28.6	Very low	170 Å²	170	128.6 Å²	128.6	75%	0.746	74%	0.741	S	S	*	*			trans	51.9	163.2	151.9	-72.5	-37.4	0	0	0	121.2
698	S	32.1	Very low	27.8	Very low	89 Å²	89	128.1 Å²	128.1	62%	0.622	74%	0.739	S	S	*	*			cis	-168.8	171.3	0.9	-112.6	0	0	0	0	108.3
699	R	32.3	Very low	27.7	Very low	184 Å²	184	130 Å²	130	69%	0.694	74%	0.735	S	S	*	*			cis	-171.9	151.8	-19.4	-114.4	171.6	79.9	-169	0.8	109.3
700	E	32	Very low	27.8	Very low	136 Å²	136	133.2 Å²	133.2	64%	0.636	73%	0.728	S	S	*	*			trans	68.5	152.5	143.1	-81.9	174.7	-161.1	0	0	123.2
701	N	33.2	Very low	28	Very low	127 Å²	127	137.3 Å²	137.3	68%	0.679	73%	0.729	S	S	*	*			cis	-166.4	156.3	-17.3	-148.7	-12.1	0	0	0	113.2
702	K	23.8	Very low	28.1	Very low	204 Å²	204	140.3 Å²	140.3	89%	0.887	73%	0.73	S	S	*	*			trans	-170.6	156.2	132.7	-106.6	167.5	-176.1	176.9	0	112.8
703	S	27.9	Very low	28.3	Very low	101 Å²	101	141 Å²	141	71%	0.706	72%	0.724	S	S	*	*			trans	-111.7	-175.9	-159.5	53.5	0	0	0	0	113.8
704	P	43.8	Very low	28.4	Very low	113 Å²	113	140 Å²	140	73%	0.734	72%	0.718	S	S	*	*			cis	-117.4	165.9	-5.5	37.5	-20.6	0	0	0	113.9
705	N	29.3	Very low	28.3	Very low	149 Å²	149	142 Å²	142	80%	0.797	72%	0.72	S	S	*	*			cis	68.5	134.9	49.3	-66.7	-11.1	0	0	0	113.8
706	V	27.4	Very low	28.4	Very low	127 Å²	127	140.8 Å²	140.8	77%	0.77	71%	0.714	S	S	*	*			cis	-158.8	135.8	48.5	161.6	0	0	0	0	113.9
707	S	27.4	Very low	28.8	Very low	113 Å²	113	143.3 Å²	143.3	79%	0.79	72%	0.719	S	S	*	*			trans	47.4	162.4	144.3	-63.6	0	0	0	0	124.7
708	C	24.9	Very low	29.2	Very low	112 Å²	112	143.5 Å²	143.5	76%	0.757	72%	0.72	S	S	*	*			cis	-169.7	-171.2	-26.4	-159.7	0	0	0	0	109.4
709	E	26.4	Very low	29.1	Very low	160 Å²	160	143.9 Å²	143.9	75%	0.748	72%	0.719	S	S	*	*			trans	-112.1	173.3	-157.9	-53.8	147.7	117.6	0	0	116.7
710	Q	27.9	Very low	29.1	Very low	146 Å²	146	140.5 Å²	140.5	68%	0.682	72%	0.723	S	S	*	*			trans	91.4	120.6	132.7	-140.5	153.3	6.9	0	0	124.1
711	E	29.7	Very low	29.4	Very low	158 Å²	158	139.5 Å²	139.5	74%	0.738	73%	0.726	S	S	*	*			trans	63.8	165	140.2	-74.3	171.1	-140.1	0	0	125.8
712	Q	29.1	Very low	30.1	Very low	178 Å²	178	138.5 Å²	138.5	83%	0.832	73%	0.727	S	S	*	*			trans	86.7	99.9	164.8	-66.1	-172.5	-16.7	0	0	122.5
713	E	27.7	Very low	30.4	Very low	153 Å²	153	135.3 Å²	135.3	72%	0.715	72%	0.719	S	S	*	*				39.3	144.7	122.2	-134.7	173.6	-169.7	0	0	124.8
714	F	24.5	Very low	30.5	Very low	148 Å²	148	138 Å²	138	65%	0.649	72%	0.721	S	S	*	*			trans	85.6	137.9	159.5	-64.8	-59.9	0	0	0	123.2
715	H	24.3	Very low	29.8	Very low	147 Å²	147	138.7 Å²	138.7	68%	0.681	72%	0.718	S	S	*	*			trans	21.9	147.9	138.8	-60.2	-50.5	0	0	0	121.3
716	E	24.8	Very low	29.9	Very low	118 Å²	118	139 Å²	139	55%	0.551	72%	0.719	S	S	*	*			cis	-174.3	168.1	3.5	-119.4	174.6	152.5	0	0	111
717	Y	32	Very low	30.1	Very low	177 Å²	177	138.3 Å²	138.3	69%	0.694	72%	0.72	S	S	*	*			trans	62.1	164.9	160.6	-56.5	-45.7	0	0	0	117.3
718	F	32.3	Very low	30.1	Very low	174 Å²	174	141.9 Å²	141.9	76%	0.763	72%	0.724	S	S	*	*			cis	-160.2	157.3	-5.9	-127.9	-150.4	0	0	0	107.1
719	V	29.6	Very low	31.4	Very low	97 Å²	97	141.3 Å²	141.3	59%	0.588	72%	0.719	S	S	*	*			cis	-173.3	158.8	-24.4	71	0	0	0	0	108.6
720	S	33.2	Very low	31.7	Very low	112 Å²	112	142.1 Å²	142.1	78%	0.783	72%	0.723	S	S	*	*				-178.5	126.8	126.3	-74.7	0	0	0	0	111.4
721	T	39.3	Very low	32.1	Very low	116 Å²	116	143.2 Å²	143.2	71%	0.712	73%	0.734	S	S	*	*			trans	-87.7	176.5	157.6	58.5	0	0	0	0	108.8
722	P	47	Very low	32.2	Very low	106 Å²	106	138.9 Å²	138.9	69%	0.688	73%	0.731	S	S	*	*				-140.3	152.5	72.4	26.5	-3.9	0	0	0	115.9
723	D	29.4	Very low	32.2	Very low	136 Å²	136	134.4 Å²	134.4	73%	0.727	73%	0.732	S	S	*	*				45.4	148.1	118.2	-38.7	-22.4	0	0	0	120.2
724	E	31.1	Very low	32.3	Very low	158 Å²	158	130.4 Å²	130.4	74%	0.738	73%	0.732	S	S	*	*			cis	-163.2	153.3	-2.2	-130	-169.2	-150.5	0	0	110.9
725	N	29.5	Very low	32.7	Very low	127 Å²	127	131.3 Å²	131.3	68%	0.679	74%	0.742	S	S	*	*			trans	51.7	156.7	144.9	-72.3	-38.5	0	0	0	124.4
726	L	30.2	Very low	33	Very low	157 Å²	157	132.5 Å²	132.5	82%	0.822	75%	0.75	S	S	*	*			trans	93.7	114.4	155.4	-54	-170.8	0	0	0	121.6
727	S	32.8	Very low	33.5	Very low	112 Å²	112	130.8 Å²	130.8	78%	0.783	75%	0.751	S	S	*	*			trans	89.8	129.6	132.6	-59.3	0	0	0	0	122.6
728	E	27.4	Very low	33.6	Very low	187 Å²	187	133.4 Å²	133.4	87%	0.874	76%	0.762	S	S	*	*			trans	-73.3	179.3	149.4	-39	172.2	122.9	0	0	110
729	P	51.5	Low	33.4	Very low	101 Å²	101	128 Å²	128	66%	0.656	76%	0.755	S	S	*	*			cis	-133.9	-168.4	-5	40.4	-21.3	0	0	0	114.1
730	E	33.1	Very low	33.4	Very low	177 Å²	177	132.7 Å²	132.7	83%	0.827	77%	0.77	S	S	*	*			trans	51.5	109.2	147.8	-76.7	177.5	134.9	0	0	122.6
731	D	35.5	Very low	33.4	Very low	169 Å²	169	138.4 Å²	138.4	90%	0.904	78%	0.776	S	S	*	*				68.6	169.1	115.4	-157.5	25.1	0	0	0	120.7
732	G	31.1	Very low	33.2	Very low	67 Å²	67	135.8 Å²	135.8	69%	0.691	77%	0.772	S	S	*	*			trans	94.3	57.2	172.6	0	0	0	0	0	115.1
733	G	29.9	Very low	32.7	Very low	83 Å²	83	137.7 Å²	137.7	86%	0.856	78%	0.775	S	S	*	*			trans	-69	168.4	-173.9	0	0	0	0	0	116.8
734	G	29.8	Very low	33.2	Very low	69 Å²	69	137.9 Å²	137.9	71%	0.711	78%	0.78	S	S	*	*			trans	171.9	104.7	170.2	0	0	0	0	0	116.9
735	I	33.5	Very low	33.7	Very low	168 Å²	168	136.5 Å²	136.5	86%	0.862	78%	0.778	S	S	*	*			trans	51.1	114.8	140.1	-48.7	164.3	0	0	0	118.7
736	M	29.9	Very low	34.1	Very low	172 Å²	172	136.7 Å²	136.7	85%	0.847	78%	0.779	S	S	*	*				-169	107.9	122.1	-79	-131.1	89.5	0	0	107.8
737	S	36.2	Very low	34.6	Very low	82 Å²	82	137 Å²	137	57%	0.573	78%	0.781	S	S	*	*				68.4	103.9	92.9	178.9	0	0	0	0	115.1
738	Y	32.4	Very low	35	Very low	232 Å²	232	136.9 Å²	136.9	91%	0.91	78%	0.78	S	S	*	*				176.6	140.2	117.4	-107.9	-76.6	0	0	0	112.8
739	G	29	Very low	35.4	Very low	61 Å²	61	136.5 Å²	136.5	63%	0.629	78%	0.784	S	S	*	*			trans	111.3	127.6	138	0	0	0	0	0	120.6
740	H	29.9	Very low	34.8	Very low	195 Å²	195	139.8 Å²	139.8	90%	0.903	79%	0.79	S	S	*	*			trans	78.1	144.8	151	-84.5	59.4	0	0	0	121.8
741	Y	33.7	Very low	34.9	Very low	232 Å²	232	141.4 Å²	141.4	91%	0.91	79%	0.789	S	S	*	*			trans	-115.2	158.5	-177	-86.1	-105.5	0	0	0	110.6
742	G	33.7	Very low	34.8	Very low	60 Å²	60	142.9 Å²	142.9	62%	0.619	78%	0.784	S	S	*	*			trans	168.7	82.1	171.9	0	0	0	0	0	106.5
743	I	36.7	Very low	35	Very low	147 Å²	147	151 Å²	151	75%	0.754	80%	0.795	S	S	*	*				54	109.5	89.4	-56.3	178.2	0	0	0	110.1
744	V	40.4	Very low	35.1	Very low	139 Å²	139	154.7 Å²	154.7	84%	0.842	79%	0.79	S	S	*	*			trans	-130.9	109.2	168.2	179.8	0	0	0	0	105
745	D	42	Very low	35.3	Very low	129 Å²	129	158.6 Å²	158.6	69%	0.69	79%	0.794	S	S	*	*			trans	-139.7	146.7	172.9	-73.5	-57.3	0	0	0	108.6
746	D	37.2	Very low	35.1	Very low	131 Å²	131	160.3 Å²	160.3	70%	0.701	80%	0.799	S	S	*	*			trans	56.1	101.2	158.6	-59.4	-19.7	0	0	0	122
747	L	40.9	Very low	35.2	Very low	165 Å²	165	157 Å²	157	86%	0.864	79%	0.793	S	S	*	*				41.5	95.5	106.9	-61.1	170.7	0	0	0	118.4
748	S	41	Very low	35	Very low	109 Å²	109	160.7 Å²	160.7	76%	0.762	81%	0.805	S	S	*	*			trans	-159.6	96.1	143.5	66.7	0	0	0	0	112.1
749	D	36.4	Very low	34.9	Very low	179 Å²	179	155.5 Å²	155.5	96%	0.957	80%	0.8	S	S	*	*			trans	-128	83.5	161.9	-104.6	-33.1	0	0	0	108.3
750	E	37.4	Very low	34.9	Very low	169 Å²	169	162 Å²	162	79%	0.79	81%	0.814	S	S	*	*			trans	-105.9	126.2	-175	-158	-175.5	175.1	0	0	110.4
751	R	37	Very low	34.8	Very low	211 Å²	211	158 Å²	158	80%	0.796	79%	0.791	S	S	*	*			trans	72.9	120.4	177.6	-44.6	-169.6	-67.4	-129.1	2.6	116.6
752	Y	32.2	Very low	34.5	Very low	201 Å²	201	155.2 Å²	155.2	79%	0.788	78%	0.783	S	S	*	*				-157.4	95.4	114.1	-112.3	-76	0	0	0	111.3	Q754	Y752-Q754 HydrophobicContact CD1-CG 4.05Å; Y752-Q754 HydrophobicContact CE1-CG 4.03Å
753	Y	34.9	Very low	34.1	Very low	237 Å²	237	158 Å²	158	93%	0.929	79%	0.788	S	S	*	*			trans	-98.1	120.7	152.5	-91.8	-84.8	0	0	0	107.1
754	Q	33.2	Very low	33.7	Very low	160 Å²	160	157.3 Å²	157.3	75%	0.748	78%	0.784	S	S	*	*			trans	-147.5	132.8	161.1	-75.3	-161.5	-30.2	0	0	109.8	Y752	Y752-Q754 HydrophobicContact CD1-CG 4.05Å; Y752-Q754 HydrophobicContact CE1-CG 4.03Å
755	D	32.6	Very low	33	Very low	151 Å²	151	156.5 Å²	156.5	81%	0.807	78%	0.78	S	S	*	*			trans	-70.9	137.8	177.1	-63.2	-73.3	0	0	0	112.8	S757	D755-S757 PolarHBondContact O-N 2.91Å
756	E	29.6	Very low	32.3	Very low	204 Å²	204	158.3 Å²	158.3	95%	0.953	78%	0.784	S	S	*	*			trans	-76.7	74.6	158.7	-71.7	-151.2	144	0	0	110.5
757	S	32.2	Very low	31.7	Very low	104 Å²	104	160.4 Å²	160.4	73%	0.727	79%	0.79	S	S	*	*			trans	-78.1	140.8	169.7	57.3	0	0	0	0	111.9	D755	D755-S757 PolarHBondContact O-N 2.91Å
758	L	31.8	Very low	31.1	Very low	158 Å²	158	158 Å²	158	83%	0.827	79%	0.787	S	S	*	*			trans	-65.3	150.4	-170.9	-71.7	169.9	0	0	0	113.7	Q760	L758-Q760 PolarHBondContact O-N 3.21Å
759	P	31.2	Very low	30.6	Very low	123 Å²	123	162.4 Å²	162.4	80%	0.799	80%	0.795	S	S	*	*			trans	-76	111.5	-161.6	28.6	-36.5	0	0	0	114.5
760	Q	28.7	Very low	30.2	Very low	197 Å²	197	160.4 Å²	160.4	92%	0.921	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-78.3	133.3	167.4	-71.3	-158.2	5.2	0	0	112.9	L758	L758-Q760 PolarHBondContact O-N 3.21Å
761	R	27	Very low	29.7	Very low	113 Å²	113	161.5 Å²	161.5	43%	0.426	78%	0.778	S	S	.	*	P	Polyproline II helix	trans	-100.8	120.1	179.4	-170.4	174.4	-157.2	122.7	25.4	112.1	G390 R391 R393	G390-R761 PolarHBondContact O-NH1 2.92Å; G390-R761 PolarHBondContact O-NH2 2.88Å; R391-R761 VanDerWaalsContact CG-NH2 3.25Å; R393-R761 PolarHBondContact NH2-O 3.05Å
762	K	28.5	Very low	29.2	Very low	173 Å²	173	160 Å²	160	75%	0.752	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-50	139.4	177	-62.7	-172.2	177.7	-170.9	0	114.2
763	V	25.1	Very low	29.1	Very low	119 Å²	119	161.8 Å²	161.8	72%	0.721	78%	0.784	S	S	*	*			trans	-111.2	158.1	141.7	177.1	0	0	0	0	106.5
764	I	28.3	Very low	28.7	Very low	131 Å²	131	159.5 Å²	159.5	67%	0.672	78%	0.779	S	S	*	*			trans	-133.5	128.2	-173.3	-58.4	170.3	0	0	0	109.1
765	V	25.6	Very low	28.5	Very low	123 Å²	123	157.4 Å²	157.4	75%	0.745	78%	0.783	S	S	*	*			trans	-145.6	121.1	154.7	-171	0	0	0	0	101.9
766	E	26.8	Very low	27.9	Very low	166 Å²	166	155 Å²	155	78%	0.776	78%	0.777	S	S	*	*				56.3	130	81.4	-86.6	170.4	-172	0	0	111.9
767	E	26.1	Very low	27.7	Very low	176 Å²	176	151.4 Å²	151.4	82%	0.822	77%	0.765	S	S	*	*			cis	-134.5	171.4	7.9	-66.6	-171.9	97.6	0	0	113.7
768	S	28	Very low	27.4	Very low	114 Å²	114	154.9 Å²	154.9	80%	0.797	77%	0.769	S	S	*	*			trans	-41.5	146.2	163.1	-39.2	0	0	0	0	116.1
769	E	30	Very low	27.1	Very low	201 Å²	201	153.1 Å²	153.1	94%	0.939	77%	0.77	S	S	*	*				-158.7	-178.8	113.4	-122.2	-174	-146	0	0	112.6
770	E	28.9	Very low	27	Very low	137 Å²	137	152.3 Å²	152.3	64%	0.64	77%	0.767	S	S	*	*			trans	-128.1	155.1	-149.7	-154.9	-173.9	167.2	0	0	113.6
771	Y	26.8	Very low	26.8	Very low	193 Å²	193	148.3 Å²	148.3	76%	0.757	76%	0.758	S	S	*	*			trans	67.8	150.1	-179.2	-53.2	-79.3	0	0	0	114.3
772	K	26.4	Very low	26.9	Very low	179 Å²	179	152.9 Å²	152.9	78%	0.778	78%	0.781	S	S	*	*			cis	-163.4	122.1	37.8	-167.8	172.5	-163.4	157.5	0	112.1	K774	K772-K774 PolarHBondContact O-N 3.25Å
773	Y	29.4	Very low	26.8	Very low	238 Å²	238	152.7 Å²	152.7	93%	0.933	78%	0.783	S	S	*	*			trans	-66.7	128.4	170.2	-108.1	-94.6	0	0	0	111.2
774	K	27.2	Very low	26.9	Very low	189 Å²	189	152.6 Å²	152.6	82%	0.822	79%	0.788	S	S	*	*			trans	-143.3	120.6	156.3	-88.7	-165	171.2	-170.7	0	109.1	K772	K772-K774 PolarHBondContact O-N 3.25Å
775	S	27.6	Very low	26.7	Very low	117 Å²	117	155 Å²	155	82%	0.818	79%	0.794	S	S	*	*			trans	-84.7	139.9	162	47.8	0	0	0	0	109.9
776	S	21.5	Very low	26.9	Very low	99 Å²	99	155 Å²	155	69%	0.692	80%	0.797	S	S	*	*			trans	178.7	119.9	135.1	-166.6	0	0	0	0	111.1
777	N	24	Very low	26.8	Very low	130 Å²	130	151.9 Å²	151.9	70%	0.695	78%	0.782	S	S	*	*			trans	54.4	112.5	139.6	-60.4	13	0	0	0	121.5
778	H	27.2	Very low	26.8	Very low	176 Å²	176	149.1 Å²	149.1	82%	0.815	78%	0.781	S	S	*	*			trans	55	95.9	136.8	-50.7	-59.6	0	0	0	120.3
779	S	25.6	Very low	26.9	Very low	121 Å²	121	147 Å²	147	85%	0.846	76%	0.76	S	S	*	*				-153.9	136.7	113.4	53.1	0	0	0	0	109.9
780	S	27.5	Very low	26.8	Very low	106 Å²	106	145.2 Å²	145.2	74%	0.741	76%	0.755	S	S	*	*			trans	-93.4	134.3	167.6	43.2	0	0	0	0	109.1
781	P	26.3	Very low	26.7	Very low	113 Å²	113	143.7 Å²	143.7	73%	0.734	75%	0.748	S	S	*	*			trans	-64.7	135.2	163.5	29	-32.1	0	0	0	108.4	E783	P781-E783 PolarHBondContact O-N 2.66Å
782	K	28.4	Very low	27.1	Very low	209 Å²	209	142.4 Å²	142.4	91%	0.909	75%	0.749	S	S	*	*			trans	-78.7	102.6	163.4	-74.3	-178.7	178.3	178.2	0	107.4
783	E	26.8	Very low	27.4	Very low	169 Å²	169	140.6 Å²	140.6	79%	0.79	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-72.2	127.9	159.9	-69.6	-179.2	140.7	0	0	108	P781	P781-E783 PolarHBondContact O-N 2.66Å
784	S	25.7	Very low	28.3	Very low	117 Å²	117	132.6 Å²	132.6	82%	0.818	72%	0.719	S	S	*	*	P	Polyproline II helix	trans	-96	124.5	175.4	-166.6	0	0	0	0	108.3
785	F	24.9	Very low	29.1	Very low	182 Å²	182	133.5 Å²	133.5	80%	0.798	72%	0.717	S	S	*	*	P	Polyproline II helix	trans	-72.6	149.5	164.3	-65.5	-79.8	0	0	0	109.5
786	P	30.6	Very low	30.4	Very low	124 Å²	124	129.2 Å²	129.2	81%	0.805	69%	0.686	S	S	*	*	P	Polyproline II helix	trans	-72.5	147.5	179	29.4	-34.2	0	0	0	112.1
787	E	24.8	Very low	32	Very low	99 Å²	99	127.2 Å²	127.2	46%	0.463	67%	0.672	S	S	.	*	P	Polyproline II helix	trans	-70.2	128.1	173.8	-161.7	164.2	-162.8	0	0	108.6	I789 K992	E787-I789 PolarHBondContact O-N 2.95Å; E787-K992 VanDerWaalsContact CD-NZ 3.26Å; E787-K992 WeakPolarHBondContact OE1-CG 3.28Å; E787-K992 IonicContact OE1-NZ 2.68Å; E787-K992 PolarHBondContact OE1-NZ 3.44Å; E787-K992 IonicContact OE2-NZ 3.94Å; E787-K992 PolarHBondContact OE2-NZ 2.8Å
788	C	25.5	Very low	33.5	Very low	119 Å²	119	125.2 Å²	125.2	80%	0.804	67%	0.666	S	S	*	*			trans	-85	113.3	-179.4	-171.1	0	0	0	0	109.7
789	I	30	Very low	35.4	Very low	69 Å²	69	123.1 Å²	123.1	35%	0.354	66%	0.659	S	S	.	*			trans	-103.6	132.1	175.6	-52.9	176.6	0	0	0	107.8	E787 E791	E787-I789 PolarHBondContact O-N 2.95Å; I789-E791 HydrophobicContact CB-CG 4.45Å; I789-E791 HydrophobicContact CG2-CG 3.68Å
790	I	27.7	Very low	37.4	Very low	163 Å²	163	118.6 Å²	118.6	84%	0.836	63%	0.626	S	S	*	*			trans	-94.4	107.5	166.6	-58.7	175.9	0	0	0	106.3
791	E	27.5	Very low	39.1	Very low	105 Å²	105	116 Å²	116	49%	0.491	60%	0.602	S	S	.	*			trans	-98.1	129.4	175.6	-61.7	-170.5	139.4	0	0	109.4	I789 T996	I789-E791 HydrophobicContact CB-CG 4.45Å; I789-E791 HydrophobicContact CG2-CG 3.68Å; E791-T996 VanDerWaalsContact OE1-CB 3.29Å; E791-T996 WeakPolarHBondContact OE1-CB 3.49Å; E791-T996 PolarHBondContact OE1-OG1 3.13Å
792	E	33.9	Very low	40.9	Very low	167 Å²	167	116.2 Å²	116.2	78%	0.78	59%	0.594	S	S	*	*			trans	-104.6	115.3	176	-171.9	167.9	179.8	0	0	109.5	V794	E792-V794 PolarHBondContact O-N 3.34Å
793	E	33.9	Very low	43	Very low	141 Å²	141	108.1 Å²	108.1	66%	0.659	56%	0.563	S	S	*	*			trans	-80.3	83.4	-169.4	-166.3	-160.6	138.5	0	0	112.3	R795	E793-R795 PolarHBondContact O-N 3.23Å; E793-R795 IonicContact OE1-CZ 2.71Å; E793-R795 IonicContact OE1-NE 3.36Å; E793-R795 PolarHBondContact OE1-NE 2.86Å; E793-R795 IonicContact OE1-NH2 2.69Å; E793-R795 PolarHBondContact OE1-NH2 3.42Å; E793-R795 IonicContact OE2-NH2 3.83Å
794	V	47.5	Very low	44.9	Very low	70 Å²	70	101.1 Å²	101.1	42%	0.424	53%	0.531	S	S	.	.			trans	-78.2	105.6	174.9	-173.4	0	0	0	0	110.3	E792 V796 V830 L834	E792-V794 PolarHBondContact O-N 3.34Å; V794-V796 HydrophobicContact CG1-CG2 4.07Å; V794-V796 PolarHBondContact O-N 3.02Å; V794-V796 VanDerWaalsContact O-N 3.12Å; V794-V830 HydrophobicContact CG1-CG2 4.4Å; V794-L834 HydrophobicContact CG1-CD2 4.2Å; V794-L834 HydrophobicContact CG2-CD2 3.69Å
795	R	45	Very low	46.8	Very low	208 Å²	208	97.3 Å²	97.3	79%	0.785	50%	0.501	S	S	*	.			trans	-77.2	96.3	177.1	-68.1	-172.9	-179.5	156.2	13.2	112	E793	E793-R795 PolarHBondContact O-N 3.23Å; E793-R795 IonicContact OE1-CZ 2.71Å; E793-R795 IonicContact OE1-NE 3.36Å; E793-R795 PolarHBondContact OE1-NE 2.86Å; E793-R795 IonicContact OE1-NH2 2.69Å; E793-R795 PolarHBondContact OE1-NH2 3.42Å; E793-R795 IonicContact OE2-NH2 3.83Å
796	V	53.7	Low	49.1	Very low	27 Å²	27	94.7 Å²	94.7	16%	0.164	49%	0.491	C	S	.	.			trans	-87.7	140.1	178.1	-179.6	0	0	0	0	111	V794 V800 Q801 L826	V794-V796 HydrophobicContact CG1-CG2 4.07Å; V794-V796 PolarHBondContact O-N 3.02Å; V794-V796 VanDerWaalsContact O-N 3.12Å; V796-V800 HydrophobicContact CG1-CB 3.58Å; V796-V800 HydrophobicContact CG1-CG1 3.44Å; V796-V800 VanDerWaalsContact CG1-CG1 3.44Å; V796-Q801 HydrophobicContact CB-CG 4.18Å; V796-Q801 HydrophobicContact CG1-CG 4.03Å; V796-Q801 PolarHBondContact O-NE2 2.98Å; V796-L826 HydrophobicContact CG1-CD1 4.44Å; V796-L826 HydrophobicContact CG2-CD1 3.54Å
797	S	55.5	Low	51	Low	57 Å²	57	92 Å²	92	40%	0.399	47%	0.467	S	S	.	.			trans	-61.2	141.5	177.2	178.6	0	0	0	0	112.2	I799 V800 Q801	S797-I799 PolarHBondContact O-N 3.08Å; S797-I799 VanDerWaalsContact O-N 3.14Å; S797-V800 WeakPolarHBondContact O-CA 3.48Å; S797-V800 WeakPolarHBondContact O-CB 3.46Å; S797-V800 PolarHBondContact O-N 3.11Å; S797-Q801 PolarHBondContact O-N 3.18Å
798	P	56.3	Low	52.8	Low	87 Å²	87	88.7 Å²	88.7	57%	0.565	45%	0.453	S	S	*	.	H	α-helix	trans	-52.8	-37.3	-179.8	-28.6	35.9	0	0	0	114.4	V800 Q801 E802	P798-V800 VanDerWaalsContact C-N 3.28Å; P798-V800 PolarHBondContact O-N 2.87Å; P798-Q801 WeakPolarHBondContact O-CB 3.24Å; P798-Q801 PolarHBondContact O-N 3.12Å; P798-E802 PolarHBondContact O-N 3.44Å
799	I	67.3	Low	54.7	Low	133 Å²	133	89.8 Å²	89.8	68%	0.682	44%	0.44	S	S	*	.	H	α-helix	trans	-60	-40.6	177.3	-59.8	169.6	0	0	0	111	S797 E802 S803	S797-I799 PolarHBondContact O-N 3.08Å; S797-I799 VanDerWaalsContact O-N 3.14Å; I799-E802 PolarHBondContact O-N 3.43Å; I799-S803 WeakPolarHBondContact O-CB 3.38Å; I799-S803 PolarHBondContact O-N 3.18Å
800	V	67.8	Low	56.8	Low	25 Å²	25	91.1 Å²	91.1	15%	0.152	44%	0.444	C	S	.	.	H	α-helix	trans	-75.5	-35.5	179.1	178.2	0	0	0	0	110.3	V796 S797 P798 E802 S803 M804 T825	V796-V800 HydrophobicContact CG1-CB 3.58Å; V796-V800 HydrophobicContact CG1-CG1 3.44Å; V796-V800 VanDerWaalsContact CG1-CG1 3.44Å; S797-V800 WeakPolarHBondContact O-CA 3.48Å; S797-V800 WeakPolarHBondContact O-CB 3.46Å; S797-V800 PolarHBondContact O-N 3.11Å; P798-V800 VanDerWaalsContact C-N 3.28Å; P798-V800 PolarHBondContact O-N 2.87Å; V800-E802 VanDerWaalsContact C-N 3.35Å; V800-S803 PolarHBondContact O-N 3.3Å; V800-M804 HydrophobicContact CG1-CG 4.41Å; V800-M804 HydrophobicContact CG1-SD 4.16Å; V800-M804 WeakPolarHBondContact O-CB 3.38Å; V800-M804 VanDerWaalsContact O-CG 3.23Å; V800-M804 WeakPolarHBondContact O-CG 3.34Å; V800-M804 PolarHBondContact O-N 2.96Å; V800-T825 HydrophobicContact CG1-CG2 4.11Å
801	Q	61.6	Low	58.4	Low	51 Å²	51	90.1 Å²	90.1	24%	0.238	44%	0.441	C	S	.	.	H	α-helix	trans	-61.4	-41.8	171.3	-61.6	-178.7	14	0	0	111.8	V796 S797 P798 L805 L999	V796-Q801 HydrophobicContact CB-CG 4.18Å; V796-Q801 HydrophobicContact CG1-CG 4.03Å; V796-Q801 PolarHBondContact O-NE2 2.98Å; S797-Q801 PolarHBondContact O-N 3.18Å; P798-Q801 WeakPolarHBondContact O-CB 3.24Å; P798-Q801 PolarHBondContact O-N 3.12Å; Q801-L805 VanDerWaalsContact O-CB 3.26Å; Q801-L805 WeakPolarHBondContact O-CB 3.34Å; Q801-L805 WeakPolarHBondContact O-CG 3.32Å; Q801-L805 PolarHBondContact O-N 3.14Å; Q801-L999 HydrophobicContact CB-CD2 4.01Å; Q801-L999 HydrophobicContact CG-CD2 4.33Å
802	E	64.9	Low	60.4	Low	119 Å²	119	90.2 Å²	90.2	56%	0.556	45%	0.453	S	S	*	.	H	α-helix	trans	-68.9	-39.6	177.4	-72.7	-167.9	147.1	0	0	112.8	P798 I799 V800 L805 E806	P798-E802 PolarHBondContact O-N 3.44Å; I799-E802 PolarHBondContact O-N 3.43Å; V800-E802 VanDerWaalsContact C-N 3.35Å; E802-L805 CarbonylContact O-C 3.52Å; E802-L805 WeakPolarHBondContact O-CB 3.36Å; E802-L805 PolarHBondContact O-N 2.94Å; E802-E806 PolarHBondContact O-N 3.1Å
803	S	71.6	Confident	62	Low	38 Å²	38	84.6 Å²	84.6	27%	0.266	43%	0.428	S	S	.	.	H	α-helix	trans	-69.1	-41.8	175.3	-176.5	0	0	0	0	112.5	I799 V800 L805 E806 F807	I799-S803 WeakPolarHBondContact O-CB 3.38Å; I799-S803 PolarHBondContact O-N 3.18Å; V800-S803 PolarHBondContact O-N 3.3Å; S803-L805 VanDerWaalsContact C-N 3.28Å; S803-L805 PolarHBondContact O-N 3.02Å; S803-E806 VanDerWaalsContact O-CB 3.29Å; S803-E806 WeakPolarHBondContact O-CB 3.33Å; S803-E806 PolarHBondContact O-N 3.29Å; S803-F807 VanDerWaalsContact O-CD2 3.31Å; S803-F807 WeakPolarHBondContact O-CD2 3.19Å; S803-F807 PolarHBondContact O-N 3.05Å
804	M	67.6	Low	63.6	Low	23 Å²	23	84.1 Å²	84.1	11%	0.113	43%	0.426	C	S	.	.	H	α-helix	trans	-59	-41.9	169.1	-72.3	174.4	70.3	0	0	111	V800 E806 F807 L808 A822 T825 L826	V800-M804 HydrophobicContact CG1-CG 4.41Å; V800-M804 HydrophobicContact CG1-SD 4.16Å; V800-M804 WeakPolarHBondContact O-CB 3.38Å; V800-M804 VanDerWaalsContact O-CG 3.23Å; V800-M804 WeakPolarHBondContact O-CG 3.34Å; V800-M804 PolarHBondContact O-N 2.96Å; M804-E806 PolarHBondContact O-N 3.17Å; M804-F807 PolarHBondContact O-N 3.27Å; M804-L808 VanDerWaalsContact O-CG 3.3Å; M804-L808 WeakPolarHBondContact O-CG 3.47Å; M804-L808 PolarHBondContact O-N 2.91Å; M804-L808 VanDerWaalsContact O-N 3.11Å; M804-A822 HydrophobicContact CE-CB 4.46Å; M804-T825 HydrophobicContact CG-CG2 3.76Å; M804-L826 HydrophobicContact CE-CB 4Å; M804-L826 HydrophobicContact CE-CD1 4.33Å; M804-L826 HydrophobicContact CE-CD2 4.27Å; M804-L826 HydrophobicContact CE-CG 4.43Å; M804-L826 HydrophobicContact SD-CB 3.98Å; M804-L826 HydrophobicContact SD-CD1 3.97Å; M804-L826 HydrophobicContact SD-CG 4.48Å
805	L	65.2	Low	64.3	Low	36 Å²	36	83.8 Å²	83.8	19%	0.188	43%	0.425	C	S	.	.	H	α-helix	trans	-64.6	-23.3	174	-92.4	169.3	0	0	0	113.4	Q801 E802 S803 R809 L999	Q801-L805 VanDerWaalsContact O-CB 3.26Å; Q801-L805 WeakPolarHBondContact O-CB 3.34Å; Q801-L805 WeakPolarHBondContact O-CG 3.32Å; Q801-L805 PolarHBondContact O-N 3.14Å; E802-L805 CarbonylContact O-C 3.52Å; E802-L805 WeakPolarHBondContact O-CB 3.36Å; E802-L805 PolarHBondContact O-N 2.94Å; S803-L805 VanDerWaalsContact C-N 3.28Å; S803-L805 PolarHBondContact O-N 3.02Å; L805-R809 VanDerWaalsContact O-CB 3.27Å; L805-R809 WeakPolarHBondContact O-CB 3.13Å; L805-R809 WeakPolarHBondContact O-CG 3.3Å; L805-R809 PolarHBondContact O-N 3.36Å; L805-R809 VanDerWaalsContact O-N 3.13Å; L805-R809 PolarHBondContact O-NE 3.48Å; L805-L999 HydrophobicContact CD1-CD1 4.14Å; L805-L999 HydrophobicContact CD1-CD2 4.23Å; L805-L999 HydrophobicContact CD2-CD1 3.86Å; L805-L999 HydrophobicContact CG-CD1 3.91Å; L805-L999 HydrophobicContact CG-CD2 4.42Å
806	E	73.1	Confident	65.3	Low	128 Å²	128	77.5 Å²	77.5	60%	0.598	40%	0.404	S	S	*	.	H	α-helix	trans	-69.1	-55.2	174.8	-168.4	169	-156.3	0	0	110.4	E802 S803 M804 L808 R809 E810	E802-E806 PolarHBondContact O-N 3.1Å; S803-E806 VanDerWaalsContact O-CB 3.29Å; S803-E806 WeakPolarHBondContact O-CB 3.33Å; S803-E806 PolarHBondContact O-N 3.29Å; M804-E806 PolarHBondContact O-N 3.17Å; E806-L808 PolarHBondContact O-N 2.94Å; E806-R809 PolarHBondContact O-N 3.16Å; E806-E810 PolarHBondContact O-N 3.07Å
807	F	70.6	Confident	66	Low	67 Å²	67	81.1 Å²	81.1	29%	0.294	42%	0.418	S	S	.	.	H	α-helix	trans	-56.6	-33.9	174.1	-67.7	-71.4	0	0	0	113.2	S803 M804 L813 Q818 T825	S803-F807 VanDerWaalsContact O-CD2 3.31Å; S803-F807 WeakPolarHBondContact O-CD2 3.19Å; S803-F807 PolarHBondContact O-N 3.05Å; M804-F807 PolarHBondContact O-N 3.27Å; F807-L813 HydrophobicContact CD1-CD1 4.35Å; F807-Q818 WeakPolarHBondContact O-CB 3.13Å; F807-Q818 VanDerWaalsContact O-CG 3.32Å; F807-Q818 WeakPolarHBondContact O-CG 3.34Å; F807-T825 WeakPolarHBondContact CD2-OG1 3.47Å; F807-T825 WeakPolarHBondContact CE2-OG1 3.16Å
808	L	63.7	Low	66.7	Low	30 Å²	30	79 Å²	79	16%	0.157	40%	0.403	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.9	-8.4	176.7	-63.3	-175.2	0	0	0	114.6	M804 E806 Q818 A822 M866 I868	M804-L808 VanDerWaalsContact O-CG 3.3Å; M804-L808 WeakPolarHBondContact O-CG 3.47Å; M804-L808 PolarHBondContact O-N 2.91Å; M804-L808 VanDerWaalsContact O-N 3.11Å; E806-L808 PolarHBondContact O-N 2.94Å; L808-Q818 HydrophobicContact CD2-CB 4.18Å; L808-A822 HydrophobicContact CD1-CB 4.32Å; L808-A822 HydrophobicContact CD2-CB 3.87Å; L808-A822 HydrophobicContact CG-CB 3.97Å; L808-M866 HydrophobicContact CB-CE 4.39Å; L808-M866 WeakPolarHBondContact O-CE 3.19Å; L808-I868 HydrophobicContact CD2-CD1 3.67Å
809	R	65.5	Low	67.3	Low	142 Å²	142	76.6 Å²	76.6	54%	0.536	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.5	-5.6	175.6	-74	177.1	-66.8	174.5	-1.3	113.4	L805 E806 D811	L805-R809 VanDerWaalsContact O-CB 3.27Å; L805-R809 WeakPolarHBondContact O-CB 3.13Å; L805-R809 WeakPolarHBondContact O-CG 3.3Å; L805-R809 PolarHBondContact O-N 3.36Å; L805-R809 VanDerWaalsContact O-N 3.13Å; L805-R809 PolarHBondContact O-NE 3.48Å; E806-R809 PolarHBondContact O-N 3.16Å; R809-D811 PolarHBondContact O-N 3.3Å
810	E	72.5	Confident	67.7	Low	96 Å²	96	73.2 Å²	73.2	45%	0.449	37%	0.365	S	S	.	.			trans	-77.7	91.5	177.9	-170.6	164.9	-148.6	0	0	111.2	E806 S812 L813 Q818	E806-E810 PolarHBondContact O-N 3.07Å; E810-S812 PolarHBondContact O-N 2.94Å; E810-L813 HydrophobicContact CB-CD1 4.23Å; E810-L813 HydrophobicContact CB-CG 4.32Å; E810-L813 HydrophobicContact CG-CD1 4.43Å; E810-L813 HydrophobicContact CG-CG 4.11Å; E810-L813 PolarHBondContact O-N 2.98Å; E810-L813 VanDerWaalsContact O-N 3.1Å; E810-L813 WeakPolarHBondContact OE2-CD1 3.34Å; E810-Q818 PolarHBondContact O-NE2 3.01Å
811	D	61.8	Low	68	Low	143 Å²	143	72.3 Å²	72.3	77%	0.765	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-3.4	176.2	-71.4	-30.7	0	0	0	114.5	R809	R809-D811 PolarHBondContact O-N 3.3Å
812	S	69.3	Low	68.5	Low	106 Å²	106	70.1 Å²	70.1	74%	0.741	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.9	-11.9	176.7	-167.4	0	0	0	0	114.4	E810	E810-S812 PolarHBondContact O-N 2.94Å
813	L	66.8	Low	68.9	Low	50 Å²	50	66.2 Å²	66.2	26%	0.262	33%	0.334	S	S	.	.	S	Bend	trans	-96.4	148.5	178.9	-66.1	179.9	0	0	0	110.9	F807 E810 E817 Q818	F807-L813 HydrophobicContact CD1-CD1 4.35Å; E810-L813 HydrophobicContact CB-CD1 4.23Å; E810-L813 HydrophobicContact CB-CG 4.32Å; E810-L813 HydrophobicContact CG-CD1 4.43Å; E810-L813 HydrophobicContact CG-CG 4.11Å; E810-L813 PolarHBondContact O-N 2.98Å; E810-L813 VanDerWaalsContact O-N 3.1Å; E810-L813 WeakPolarHBondContact OE2-CD1 3.34Å; L813-E817 HydrophobicContact CB-CB 4.16Å; L813-E817 HydrophobicContact CD2-CB 4.48Å; L813-Q818 HydrophobicContact CB-CG 3.7Å
814	E	68.7	Low	69.2	Low	130 Å²	130	68.2 Å²	68.2	61%	0.607	34%	0.339	S	S	*	.			trans	-66.4	149.9	169.9	-73.2	-159.9	171.9	0	0	110.8	K816 E817 Q818	E814-K816 PolarHBondContact O-N 3.32Å; E814-E817 HydrophobicContact CB-CG 4.27Å; E814-E817 PolarHBondContact N-OE2 3.15Å; E814-E817 WeakPolarHBondContact O-CA 3.43Å; E814-E817 WeakPolarHBondContact O-CB 3.49Å; E814-E817 PolarHBondContact O-N 3.13Å; E814-Q818 PolarHBondContact O-N 3.37Å
815	P	62.3	Low	69.7	Low	63 Å²	63	68 Å²	68	41%	0.409	34%	0.339	S	S	.	.	H	α-helix	trans	-56.5	-22.4	179.4	-28.6	36.2	0	0	0	115.1	L819 I854	P815-L819 WeakPolarHBondContact O-CB 3.12Å; P815-L819 PolarHBondContact O-N 3.35Å; P815-I854 HydrophobicContact CB-CD1 4.23Å; P815-I854 WeakPolarHBondContact O-CD1 3.35Å
816	K	64.8	Low	69.9	Low	77 Å²	77	67.8 Å²	67.8	34%	0.335	34%	0.338	S	S	.	.	H	α-helix	trans	-73.3	-38	170.9	-71	-172.2	172.3	-174.4	0	112.4	E814 K820 P849 V852 I854	E814-K816 PolarHBondContact O-N 3.32Å; K816-K820 VanDerWaalsContact O-CB 3.31Å; K816-K820 WeakPolarHBondContact O-CB 3.07Å; K816-K820 PolarHBondContact O-N 2.96Å; K816-P849 PolarHBondContact NZ-O 3.42Å; K816-V852 VanDerWaalsContact CE-O 3.29Å; K816-V852 WeakPolarHBondContact CE-O 3.5Å; K816-V852 PolarHBondContact NZ-O 2.88Å; K816-I854 HydrophobicContact CG-CD1 3.84Å
817	E	69.2	Low	70.1	Confident	102 Å²	102	63.9 Å²	63.9	48%	0.477	32%	0.32	S	S	.	.	H	α-helix	trans	-74.1	-40.8	176.9	-61.4	177.6	134.1	0	0	111.4	L813 E814 L819 K820 G821	L813-E817 HydrophobicContact CB-CB 4.16Å; L813-E817 HydrophobicContact CD2-CB 4.48Å; E814-E817 HydrophobicContact CB-CG 4.27Å; E814-E817 PolarHBondContact N-OE2 3.15Å; E814-E817 WeakPolarHBondContact O-CA 3.43Å; E814-E817 WeakPolarHBondContact O-CB 3.49Å; E814-E817 PolarHBondContact O-N 3.13Å; E817-L819 PolarHBondContact O-N 2.71Å; E817-K820 PolarHBondContact O-N 2.86Å; E817-G821 PolarHBondContact O-N 3.34Å
818	Q	71.1	Confident	70.2	Confident	14 Å²	14	65 Å²	65	7%	0.065	34%	0.336	C	S	.	.	H	α-helix	trans	-54.8	-50.8	170.9	-65.1	-176.7	-24.4	0	0	111.1	F807 L808 E810 L813 E814 K820 G821 A822	F807-Q818 WeakPolarHBondContact O-CB 3.13Å; F807-Q818 VanDerWaalsContact O-CG 3.32Å; F807-Q818 WeakPolarHBondContact O-CG 3.34Å; L808-Q818 HydrophobicContact CD2-CB 4.18Å; E810-Q818 PolarHBondContact O-NE2 3.01Å; L813-Q818 HydrophobicContact CB-CG 3.7Å; E814-Q818 PolarHBondContact O-N 3.37Å; Q818-K820 PolarHBondContact O-N 3.29Å; Q818-G821 PolarHBondContact O-N 2.82Å; Q818-A822 WeakPolarHBondContact O-CB 3.08Å; Q818-A822 PolarHBondContact O-N 2.86Å; Q818-A822 VanDerWaalsContact O-N 3.1Å
819	L	68.4	Low	70.5	Confident	35 Å²	35	66 Å²	66	18%	0.183	35%	0.345	C	S	.	.	H	α-helix	trans	-63.6	-39.4	176.8	-179.8	61.1	0	0	0	112	P815 E817 L823 I854 A870	P815-L819 WeakPolarHBondContact O-CB 3.12Å; P815-L819 PolarHBondContact O-N 3.35Å; E817-L819 PolarHBondContact O-N 2.71Å; L819-L823 HydrophobicContact CD1-CD1 4.29Å; L819-L823 HydrophobicContact CD1-CG 4.4Å; L819-L823 HydrophobicContact CG-CD1 4.12Å; L819-L823 WeakPolarHBondContact O-CB 3.32Å; L819-L823 VanDerWaalsContact O-CG 3.32Å; L819-L823 WeakPolarHBondContact O-CG 3.29Å; L819-L823 PolarHBondContact O-N 2.86Å; L819-I854 HydrophobicContact CD2-CD1 4Å; L819-I854 HydrophobicContact CD2-CG1 4.36Å; L819-A870 HydrophobicContact CD2-CB 4.03Å
820	K	74.3	Confident	70.6	Confident	63 Å²	63	60.2 Å²	60.2	27%	0.274	33%	0.326	S	S	.	.	H	α-helix	trans	-63.3	-48.6	176.9	-172.5	-169.1	175.2	-100	0	111.8	K816 E817 Q818 A822 L823 E824	K816-K820 VanDerWaalsContact O-CB 3.31Å; K816-K820 WeakPolarHBondContact O-CB 3.07Å; K816-K820 PolarHBondContact O-N 2.96Å; E817-K820 PolarHBondContact O-N 2.86Å; Q818-K820 PolarHBondContact O-N 3.29Å; K820-A822 VanDerWaalsContact C-N 3.33Å; K820-A822 PolarHBondContact O-N 3.28Å; K820-L823 PolarHBondContact O-N 3.47Å; K820-L823 VanDerWaalsContact O-N 3.15Å; K820-E824 WeakPolarHBondContact CE-OE1 3.34Å; K820-E824 HydrophobicContact CG-CG 4.48Å; K820-E824 IonicContact NZ-OE1 2.6Å; K820-E824 PolarHBondContact NZ-OE1 3Å; K820-E824 IonicContact NZ-OE2 2.7Å; K820-E824 PolarHBondContact NZ-OE2 2.97Å; K820-E824 PolarHBondContact O-N 3.03Å
821	G	74.3	Confident	70.4	Confident	6 Å²	6	60.6 Å²	60.6	6%	0.062	34%	0.339	C	S	.	.	H	α-helix	trans	-61.8	-40.2	178.9	0	0	0	0	0	112.3	E817 Q818 E824 T825	E817-G821 PolarHBondContact O-N 3.34Å; Q818-G821 PolarHBondContact O-N 2.82Å; G821-E824 PolarHBondContact O-N 3.13Å; G821-T825 VanDerWaalsContact O-CB 3.31Å; G821-T825 WeakPolarHBondContact O-CB 3.34Å; G821-T825 PolarHBondContact O-N 2.71Å; G821-T825 PolarHBondContact O-OG1 2.95Å
822	A	73.6	Confident	70.5	Confident	5 Å²	5	55.9 Å²	55.9	4%	0.041	32%	0.324	C	S	.	.	H	α-helix	trans	-63.9	-39.4	173	0	0	0	0	0	112.9	M804 L808 Q818 K820 L826	M804-A822 HydrophobicContact CE-CB 4.46Å; L808-A822 HydrophobicContact CD1-CB 4.32Å; L808-A822 HydrophobicContact CD2-CB 3.87Å; L808-A822 HydrophobicContact CG-CB 3.97Å; Q818-A822 WeakPolarHBondContact O-CB 3.08Å; Q818-A822 PolarHBondContact O-N 2.86Å; Q818-A822 VanDerWaalsContact O-N 3.1Å; K820-A822 VanDerWaalsContact C-N 3.33Å; K820-A822 PolarHBondContact O-N 3.28Å; A822-L826 WeakPolarHBondContact O-CB 3.21Å; A822-L826 PolarHBondContact O-N 2.97Å
823	L	72.8	Confident	69.7	Low	36 Å²	36	53.7 Å²	53.7	19%	0.188	31%	0.307	C	S	.	.	H	α-helix	trans	-69.6	-41.9	175.4	-74.4	170.4	0	0	0	112.6	L819 K820 T825 L826 Q827 L838	L819-L823 HydrophobicContact CD1-CD1 4.29Å; L819-L823 HydrophobicContact CD1-CG 4.4Å; L819-L823 HydrophobicContact CG-CD1 4.12Å; L819-L823 WeakPolarHBondContact O-CB 3.32Å; L819-L823 VanDerWaalsContact O-CG 3.32Å; L819-L823 WeakPolarHBondContact O-CG 3.29Å; L819-L823 PolarHBondContact O-N 2.86Å; K820-L823 PolarHBondContact O-N 3.47Å; K820-L823 VanDerWaalsContact O-N 3.15Å; L823-T825 VanDerWaalsContact C-N 3.29Å; L823-T825 PolarHBondContact O-N 3.33Å; L823-L826 PolarHBondContact O-N 2.9Å; L823-Q827 WeakPolarHBondContact O-CB 3.38Å; L823-Q827 PolarHBondContact O-N 2.99Å; L823-L838 HydrophobicContact CD2-CD2 3.92Å
824	E	77.8	Confident	69.1	Low	80 Å²	80	54 Å²	54	37%	0.374	31%	0.309	S	S	.	.	H	α-helix	trans	-62.2	-37.1	174.9	-76.7	178.5	150.1	0	0	111.6	K820 G821 S828 T842	K820-E824 WeakPolarHBondContact CE-OE1 3.34Å; K820-E824 HydrophobicContact CG-CG 4.48Å; K820-E824 IonicContact NZ-OE1 2.6Å; K820-E824 PolarHBondContact NZ-OE1 3Å; K820-E824 IonicContact NZ-OE2 2.7Å; K820-E824 PolarHBondContact NZ-OE2 2.97Å; K820-E824 PolarHBondContact O-N 3.03Å; G821-E824 PolarHBondContact O-N 3.13Å; E824-S828 PolarHBondContact O-N 3.33Å; E824-S828 VanDerWaalsContact O-N 3.08Å; E824-T842 HydrophobicContact CG-CG2 3.45Å; E824-T842 VanDerWaalsContact CG-CG2 3.45Å
825	T	77.4	Confident	69.4	Low	18 Å²	18	54.1 Å²	54.1	11%	0.11	30%	0.304	C	S	.	.	H	α-helix	trans	-70.9	-38.6	175.6	-56.2	0	0	0	0	112.4	V800 M804 F807 G821 L823 S828 S829	V800-T825 HydrophobicContact CG1-CG2 4.11Å; M804-T825 HydrophobicContact CG-CG2 3.76Å; F807-T825 WeakPolarHBondContact CD2-OG1 3.47Å; F807-T825 WeakPolarHBondContact CE2-OG1 3.16Å; G821-T825 VanDerWaalsContact O-CB 3.31Å; G821-T825 WeakPolarHBondContact O-CB 3.34Å; G821-T825 PolarHBondContact O-N 2.71Å; G821-T825 PolarHBondContact O-OG1 2.95Å; L823-T825 VanDerWaalsContact C-N 3.29Å; L823-T825 PolarHBondContact O-N 3.33Å; T825-S828 PolarHBondContact O-OG 2.84Å; T825-S829 PolarHBondContact O-N 3.12Å
826	L	70.5	Confident	69.6	Low	32 Å²	32	56.3 Å²	56.3	17%	0.168	31%	0.309	C	S	.	.	H	α-helix	trans	-68.5	-41	173.6	-172.7	62.5	0	0	0	111.4	V796 M804 A822 L823 S828 S829 V830 L838	V796-L826 HydrophobicContact CG1-CD1 4.44Å; V796-L826 HydrophobicContact CG2-CD1 3.54Å; M804-L826 HydrophobicContact CE-CB 4Å; M804-L826 HydrophobicContact CE-CD1 4.33Å; M804-L826 HydrophobicContact CE-CD2 4.27Å; M804-L826 HydrophobicContact CE-CG 4.43Å; M804-L826 HydrophobicContact SD-CB 3.98Å; M804-L826 HydrophobicContact SD-CD1 3.97Å; M804-L826 HydrophobicContact SD-CG 4.48Å; A822-L826 WeakPolarHBondContact O-CB 3.21Å; A822-L826 PolarHBondContact O-N 2.97Å; L823-L826 PolarHBondContact O-N 2.9Å; L826-S828 VanDerWaalsContact C-N 3.28Å; L826-S828 PolarHBondContact O-N 3.5Å; L826-S829 PolarHBondContact O-N 2.91Å; L826-S829 VanDerWaalsContact O-N 3.16Å; L826-V830 HydrophobicContact CD1-CG2 4.05Å; L826-V830 HydrophobicContact CG-CG2 4.28Å; L826-V830 WeakPolarHBondContact O-CB 3.31Å; L826-V830 VanDerWaalsContact O-CG2 3.31Å; L826-V830 WeakPolarHBondContact O-CG2 3.32Å; L826-V830 PolarHBondContact O-N 3.33Å; L826-V830 VanDerWaalsContact O-N 3.07Å; L826-L838 HydrophobicContact CB-CD1 4.46Å; L826-L838 HydrophobicContact CD2-CD1 4.01Å; L826-L838 HydrophobicContact CD2-CD2 3.96Å; L826-L838 HydrophobicContact CG-CD1 3.81Å
827	Q	77.3	Confident	69.3	Low	46 Å²	46	56.2 Å²	56.2	22%	0.215	31%	0.31	C	S	.	.	H	α-helix	trans	-63.8	-28.5	177.3	-174.2	-165.2	-26.9	0	0	113	L823 R835 L838 A839 T842	L823-Q827 WeakPolarHBondContact O-CB 3.38Å; L823-Q827 PolarHBondContact O-N 2.99Å; Q827-R835 HydrophobicContact CG-CG 4.33Å; Q827-R835 WeakPolarHBondContact O-CG 3.46Å; Q827-L838 HydrophobicContact CB-CB 4.03Å; Q827-L838 HydrophobicContact CG-CB 4.15Å; Q827-A839 VanDerWaalsContact CD-CA 3.46Å; Q827-A839 HydrophobicContact CG-CB 4.3Å; Q827-A839 VanDerWaalsContact NE2-CB 3.29Å; Q827-T842 PolarHBondContact OE1-OG1 3.22Å
828	S	72.6	Confident	69.1	Low	91 Å²	91	52 Å²	52	64%	0.636	29%	0.29	S	S	*	.	H	α-helix	trans	-78.6	-29.5	174	70	0	0	0	0	112.7	E824 T825 L826	E824-S828 PolarHBondContact O-N 3.33Å; E824-S828 VanDerWaalsContact O-N 3.08Å; T825-S828 PolarHBondContact O-OG 2.84Å; L826-S828 VanDerWaalsContact C-N 3.28Å; L826-S828 PolarHBondContact O-N 3.5Å
829	S	69.8	Low	68.9	Low	51 Å²	51	53 Å²	53	36%	0.357	30%	0.3	S	S	.	.	H	α-helix	trans	-83	-18.6	178.2	-178	0	0	0	0	115	T825 L826	T825-S829 PolarHBondContact O-N 3.12Å; L826-S829 PolarHBondContact O-N 2.91Å; L826-S829 VanDerWaalsContact O-N 3.16Å
830	V	67	Low	68.5	Low	20 Å²	20	54.8 Å²	54.8	12%	0.121	31%	0.307	C	S	.	.			trans	-103.7	145.5	-174	172.1	0	0	0	0	110.8	V794 L826 L834 R835 L838	V794-V830 HydrophobicContact CG1-CG2 4.4Å; L826-V830 HydrophobicContact CD1-CG2 4.05Å; L826-V830 HydrophobicContact CG-CG2 4.28Å; L826-V830 WeakPolarHBondContact O-CB 3.31Å; L826-V830 VanDerWaalsContact O-CG2 3.31Å; L826-V830 WeakPolarHBondContact O-CG2 3.32Å; L826-V830 PolarHBondContact O-N 3.33Å; L826-V830 VanDerWaalsContact O-N 3.07Å; V830-L834 HydrophobicContact CG1-CB 3.78Å; V830-L834 HydrophobicContact CG1-CD2 3.81Å; V830-L834 HydrophobicContact CG1-CG 3.79Å; V830-R835 HydrophobicContact CG1-CB 4.43Å; V830-R835 WeakPolarHBondContact O-CB 3.38Å; V830-R835 VanDerWaalsContact O-CD 3.23Å; V830-R835 WeakPolarHBondContact O-CD 3.25Å; V830-R835 VanDerWaalsContact O-CG 3.24Å; V830-R835 WeakPolarHBondContact O-CG 3.49Å; V830-L838 HydrophobicContact CB-CD1 4.19Å; V830-L838 HydrophobicContact CG1-CD1 4.34Å; V830-L838 HydrophobicContact CG2-CD1 4.24Å
831	S	67.7	Low	67.8	Low	105 Å²	105	54.9 Å²	54.9	73%	0.734	31%	0.31	S	S	*	.			trans	-123.5	168.8	177.5	66	0	0	0	0	112.1
832	G	65.3	Low	67.4	Low	44 Å²	44	55 Å²	55	45%	0.454	31%	0.31	S	S	.	.	S	Bend	trans	70.3	-161.3	-176.8	0	0	0	0	0	113.8	L834 R835	G832-L834 VanDerWaalsContact C-N 3.31Å; G832-L834 PolarHBondContact O-N 3.27Å; G832-R835 WeakPolarHBondContact O-CB 3.33Å; G832-R835 PolarHBondContact O-N 3.05Å
833	P	51.8	Low	67.1	Low	59 Å²	59	59.6 Å²	59.6	38%	0.383	33%	0.329	S	S	.	.	H	α-helix	trans	-56	-38.2	-171.8	-28.3	36	0	0	0	114.6	R835 E836 E837	P833-R835 PolarHBondContact O-N 3.42Å; P833-R835 VanDerWaalsContact O-N 3.15Å; P833-E836 WeakPolarHBondContact O-CA 3.34Å; P833-E836 WeakPolarHBondContact O-CB 3.39Å; P833-E836 PolarHBondContact O-N 3.17Å; P833-E837 PolarHBondContact O-N 2.8Å
834	L	55.2	Low	66.3	Low	56 Å²	56	58.9 Å²	58.9	29%	0.293	33%	0.326	S	S	.	.	H	α-helix	trans	-60	-28	178.4	-175.6	63.2	0	0	0	112.5	V794 V830 G832 E836 L838	V794-L834 HydrophobicContact CG1-CD2 4.2Å; V794-L834 HydrophobicContact CG2-CD2 3.69Å; V830-L834 HydrophobicContact CG1-CB 3.78Å; V830-L834 HydrophobicContact CG1-CD2 3.81Å; V830-L834 HydrophobicContact CG1-CG 3.79Å; G832-L834 VanDerWaalsContact C-N 3.31Å; G832-L834 PolarHBondContact O-N 3.27Å; L834-E836 VanDerWaalsContact C-N 3.35Å; L834-L838 HydrophobicContact CG-CD1 4.22Å; L834-L838 WeakPolarHBondContact O-CB 3.2Å; L834-L838 WeakPolarHBondContact O-CD1 3.19Å; L834-L838 WeakPolarHBondContact O-CG 3.43Å; L834-L838 PolarHBondContact O-N 2.99Å
835	R	74.8	Confident	65.2	Low	134 Å²	134	56.1 Å²	56.1	51%	0.506	32%	0.315	S	S	.	.	H	α-helix	trans	-66.8	-36.7	172.1	-168.1	-172.1	-176.6	-144.1	2.7	112.1	Q827 V830 G832 P833 A839	Q827-R835 HydrophobicContact CG-CG 4.33Å; Q827-R835 WeakPolarHBondContact O-CG 3.46Å; V830-R835 HydrophobicContact CG1-CB 4.43Å; V830-R835 WeakPolarHBondContact O-CB 3.38Å; V830-R835 VanDerWaalsContact O-CD 3.23Å; V830-R835 WeakPolarHBondContact O-CD 3.25Å; V830-R835 VanDerWaalsContact O-CG 3.24Å; V830-R835 WeakPolarHBondContact O-CG 3.49Å; G832-R835 WeakPolarHBondContact O-CB 3.33Å; G832-R835 PolarHBondContact O-N 3.05Å; P833-R835 PolarHBondContact O-N 3.42Å; P833-R835 VanDerWaalsContact O-N 3.15Å; R835-A839 VanDerWaalsContact O-CB 3.23Å; R835-A839 WeakPolarHBondContact O-CB 3.46Å; R835-A839 PolarHBondContact O-N 2.8Å
836	E	65.3	Low	64.2	Low	108 Å²	108	58.7 Å²	58.7	51%	0.505	33%	0.334	S	S	.	.	H	α-helix	trans	-75.1	-37.1	-179.5	-55.8	-174	162.6	0	0	110.6	P833 L834 A839 F840	P833-E836 WeakPolarHBondContact O-CA 3.34Å; P833-E836 WeakPolarHBondContact O-CB 3.39Å; P833-E836 PolarHBondContact O-N 3.17Å; L834-E836 VanDerWaalsContact C-N 3.35Å; E836-A839 PolarHBondContact O-N 3.3Å; E836-F840 PolarHBondContact O-N 2.85Å
837	E	58.4	Low	63.3	Low	76 Å²	76	63.5 Å²	63.5	36%	0.355	36%	0.356	S	S	.	.	H	α-helix	trans	-64.5	-46.4	170.9	-61.4	-171.1	-178.3	0	0	112	P833 A839 F840 L841 F910	P833-E837 PolarHBondContact O-N 2.8Å; E837-A839 VanDerWaalsContact C-N 3.35Å; E837-A839 PolarHBondContact O-N 2.85Å; E837-F840 WeakPolarHBondContact O-CB 3.2Å; E837-F840 PolarHBondContact O-N 3.39Å; E837-L841 WeakPolarHBondContact O-CG 3.32Å; E837-L841 PolarHBondContact O-N 3.39Å; E837-F910 HydrophobicContact CG-CD1 4.3Å; E837-F910 HydrophobicContact CG-CE1 3.64Å; E837-F910 HydrophobicContact CG-CZ 4.28Å; E837-F910 WeakPolarHBondContact OE1-CE1 3.32Å
838	L	65.6	Low	61.8	Low	13 Å²	13	63 Å²	63	7%	0.068	36%	0.357	C	S	.	.	H	α-helix	trans	-63.1	-39.5	174.1	-72.3	168.4	0	0	0	111.9	L823 L826 Q827 V830 L834 F840 L841 T842	L823-L838 HydrophobicContact CD2-CD2 3.92Å; L826-L838 HydrophobicContact CB-CD1 4.46Å; L826-L838 HydrophobicContact CD2-CD1 4.01Å; L826-L838 HydrophobicContact CD2-CD2 3.96Å; L826-L838 HydrophobicContact CG-CD1 3.81Å; Q827-L838 HydrophobicContact CB-CB 4.03Å; Q827-L838 HydrophobicContact CG-CB 4.15Å; V830-L838 HydrophobicContact CB-CD1 4.19Å; V830-L838 HydrophobicContact CG1-CD1 4.34Å; V830-L838 HydrophobicContact CG2-CD1 4.24Å; L834-L838 HydrophobicContact CG-CD1 4.22Å; L834-L838 WeakPolarHBondContact O-CB 3.2Å; L834-L838 WeakPolarHBondContact O-CD1 3.19Å; L834-L838 WeakPolarHBondContact O-CG 3.43Å; L834-L838 PolarHBondContact O-N 2.99Å; L838-F840 VanDerWaalsContact C-N 3.32Å; L838-F840 PolarHBondContact O-N 3Å; L838-L841 PolarHBondContact O-N 3.18Å; L838-T842 WeakPolarHBondContact O-CB 3.31Å; L838-T842 PolarHBondContact O-N 3.02Å; L838-T842 PolarHBondContact O-OG1 2.7Å; L838-T842 VanDerWaalsContact O-OG1 3.08Å
839	A	67.2	Low	60.7	Low	34 Å²	34	62.3 Å²	62.3	28%	0.281	35%	0.351	S	S	.	.	H	α-helix	trans	-61.1	-39.9	173.9	0	0	0	0	0	112.4	Q827 R835 E836 E837 K843	Q827-A839 VanDerWaalsContact CD-CA 3.46Å; Q827-A839 HydrophobicContact CG-CB 4.3Å; Q827-A839 VanDerWaalsContact NE2-CB 3.29Å; R835-A839 VanDerWaalsContact O-CB 3.23Å; R835-A839 WeakPolarHBondContact O-CB 3.46Å; R835-A839 PolarHBondContact O-N 2.8Å; E836-A839 PolarHBondContact O-N 3.3Å; E837-A839 VanDerWaalsContact C-N 3.35Å; E837-A839 PolarHBondContact O-N 2.85Å; A839-K843 VanDerWaalsContact O-CB 3.26Å; A839-K843 WeakPolarHBondContact O-CB 3.33Å; A839-K843 PolarHBondContact O-N 3.3Å
840	F	60.2	Low	59.6	Low	73 Å²	73	69 Å²	69	32%	0.32	38%	0.376	S	S	.	.	H	α-helix	trans	-64.7	-45.4	174.4	-178.7	-100.3	0	0	0	111.7	E836 E837 L838 K843 V844 L906	E836-F840 PolarHBondContact O-N 2.85Å; E837-F840 WeakPolarHBondContact O-CB 3.2Å; E837-F840 PolarHBondContact O-N 3.39Å; L838-F840 VanDerWaalsContact C-N 3.32Å; L838-F840 PolarHBondContact O-N 3Å; F840-K843 PolarHBondContact O-N 2.86Å; F840-V844 HydrophobicContact CD1-CG2 4.07Å; F840-V844 HydrophobicContact CD2-CG2 4.33Å; F840-V844 HydrophobicContact CE1-CG2 3.58Å; F840-V844 HydrophobicContact CE2-CG2 3.86Å; F840-V844 HydrophobicContact CG-CG2 4.42Å; F840-V844 HydrophobicContact CZ-CG2 3.44Å; F840-V844 VanDerWaalsContact CZ-CG2 3.44Å; F840-V844 WeakPolarHBondContact O-CG2 3.23Å; F840-V844 PolarHBondContact O-N 3.5Å; F840-L906 HydrophobicContact CD1-CD1 4.46Å; F840-L906 HydrophobicContact CE1-CD1 3.72Å; F840-L906 HydrophobicContact CE2-CD1 3.81Å; F840-L906 HydrophobicContact CZ-CD1 3.36Å
841	L	59.4	Low	58.5	Low	66 Å²	66	69.4 Å²	69.4	35%	0.346	38%	0.378	S	S	.	.	H	α-helix	trans	-61.1	-45.6	177	-69.5	170	0	0	0	112.4	E837 L838 K843 V844 S845 L872	E837-L841 WeakPolarHBondContact O-CG 3.32Å; E837-L841 PolarHBondContact O-N 3.39Å; L838-L841 PolarHBondContact O-N 3.18Å; L841-K843 VanDerWaalsContact C-N 3.31Å; L841-K843 PolarHBondContact O-N 3.47Å; L841-V844 PolarHBondContact O-N 3.47Å; L841-S845 WeakPolarHBondContact O-CB 3.35Å; L841-S845 PolarHBondContact O-N 3.14Å; L841-S845 VanDerWaalsContact O-N 3.12Å; L841-L872 HydrophobicContact CD2-CD1 3.61Å
842	T	66.2	Low	57.6	Low	9 Å²	9	64.8 Å²	64.8	6%	0.055	35%	0.345	C	S	.	.	H	α-helix	trans	-56.9	-44	172.6	-65	0	0	0	0	111.6	E824 Q827 L838 S846	E824-T842 HydrophobicContact CG-CG2 3.45Å; E824-T842 VanDerWaalsContact CG-CG2 3.45Å; Q827-T842 PolarHBondContact OE1-OG1 3.22Å; L838-T842 WeakPolarHBondContact O-CB 3.31Å; L838-T842 PolarHBondContact O-N 3.02Å; L838-T842 PolarHBondContact O-OG1 2.7Å; L838-T842 VanDerWaalsContact O-OG1 3.08Å; T842-S846 PolarHBondContact O-N 3.46Å
843	K	66.3	Low	56.6	Low	101 Å²	101	64.4 Å²	64.4	44%	0.439	34%	0.338	S	S	.	.	H	α-helix	trans	-69.7	-43.5	-178.9	-170.4	-177.3	177	-157.6	0	112.7	A839 F840 L841 S845 S846 E847	A839-K843 VanDerWaalsContact O-CB 3.26Å; A839-K843 WeakPolarHBondContact O-CB 3.33Å; A839-K843 PolarHBondContact O-N 3.3Å; F840-K843 PolarHBondContact O-N 2.86Å; L841-K843 VanDerWaalsContact C-N 3.31Å; L841-K843 PolarHBondContact O-N 3.47Å; K843-S845 VanDerWaalsContact C-N 3.27Å; K843-S845 PolarHBondContact O-N 3.39Å; K843-S846 PolarHBondContact O-N 3.13Å; K843-S846 PolarHBondContact O-OG 3.48Å; K843-E847 WeakPolarHBondContact CE-OE1 3.32Å; K843-E847 WeakPolarHBondContact CE-OE2 3.43Å; K843-E847 HydrophobicContact CG-CG 4.37Å; K843-E847 IonicContact NZ-OE1 2.68Å; K843-E847 IonicContact NZ-OE2 2.74Å; K843-E847 PolarHBondContact O-N 3.45Å
844	V	56.2	Low	56.5	Low	21 Å²	21	63.6 Å²	63.6	13%	0.127	33%	0.33	C	S	.	.	H	α-helix	trans	-60.9	-38.7	176.4	168.5	0	0	0	0	111.4	F840 L841 S846 S848 V874	F840-V844 HydrophobicContact CD1-CG2 4.07Å; F840-V844 HydrophobicContact CD2-CG2 4.33Å; F840-V844 HydrophobicContact CE1-CG2 3.58Å; F840-V844 HydrophobicContact CE2-CG2 3.86Å; F840-V844 HydrophobicContact CG-CG2 4.42Å; F840-V844 HydrophobicContact CZ-CG2 3.44Å; F840-V844 VanDerWaalsContact CZ-CG2 3.44Å; F840-V844 WeakPolarHBondContact O-CG2 3.23Å; F840-V844 PolarHBondContact O-N 3.5Å; L841-V844 PolarHBondContact O-N 3.47Å; V844-S846 VanDerWaalsContact C-N 3.27Å; V844-S846 PolarHBondContact O-N 2.81Å; V844-S848 PolarHBondContact O-N 2.9Å; V844-S848 PolarHBondContact O-OG 3.31Å; V844-S848 VanDerWaalsContact O-OG 3.1Å; V844-V874 HydrophobicContact CG1-CG2 4.47Å
845	S	54.7	Low	56	Low	21 Å²	21	67.2 Å²	67.2	15%	0.147	34%	0.343	C	S	.	.	H	α-helix	trans	-62.2	-30.8	174.7	-165.1	0	0	0	0	113	L841 K843	L841-S845 WeakPolarHBondContact O-CB 3.35Å; L841-S845 PolarHBondContact O-N 3.14Å; L841-S845 VanDerWaalsContact O-N 3.12Å; K843-S845 VanDerWaalsContact C-N 3.27Å; K843-S845 PolarHBondContact O-N 3.39Å
846	S	56.7	Low	54.5	Low	72 Å²	72	65.7 Å²	65.7	50%	0.503	34%	0.34	S	S	.	.	H	α-helix	trans	-90.9	-34.4	-179.3	70.8	0	0	0	0	114.5	T842 K843 V844	T842-S846 PolarHBondContact O-N 3.46Å; K843-S846 PolarHBondContact O-N 3.13Å; K843-S846 PolarHBondContact O-OG 3.48Å; V844-S846 VanDerWaalsContact C-N 3.27Å; V844-S846 PolarHBondContact O-N 2.81Å
847	E	51.6	Low	53.4	Low	134 Å²	134	63.4 Å²	63.4	63%	0.626	33%	0.333	S	S	*	.	H	α-helix	trans	-89.3	-20.5	-176.1	-70.3	-177.3	168	0	0	114.1	K843	K843-E847 WeakPolarHBondContact CE-OE1 3.32Å; K843-E847 WeakPolarHBondContact CE-OE2 3.43Å; K843-E847 HydrophobicContact CG-CG 4.37Å; K843-E847 IonicContact NZ-OE1 2.68Å; K843-E847 IonicContact NZ-OE2 2.74Å; K843-E847 PolarHBondContact O-N 3.45Å
848	S	46.3	Very low	52.6	Low	34 Å²	34	65 Å²	65	24%	0.238	34%	0.341	C	S	.	.			trans	-144.2	72.8	-174.4	64.8	0	0	0	0	113.7	V844 E850 N851	V844-S848 PolarHBondContact O-N 2.9Å; V844-S848 PolarHBondContact O-OG 3.31Å; V844-S848 VanDerWaalsContact O-OG 3.1Å; S848-E850 PolarHBondContact O-N 2.99Å; S848-N851 VanDerWaalsContact CB-ND2 3.27Å; S848-N851 WeakPolarHBondContact CB-ND2 3.32Å; S848-N851 PolarHBondContact O-N 3.18Å; S848-N851 PolarHBondContact OG-ND2 2.95Å
849	P	49.1	Very low	51.5	Low	78 Å²	78	70.2 Å²	70.2	51%	0.506	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-11	-166.6	25.4	-35.5	0	0	0	115.7	K816	K816-P849 PolarHBondContact NZ-O 3.42Å
850	E	46.1	Very low	50	Low	190 Å²	190	71.2 Å²	71.2	89%	0.888	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.1	-23.5	175.1	-62.6	-171.5	142.3	0	0	113.2	S848 V852	S848-E850 PolarHBondContact O-N 2.99Å; E850-V852 PolarHBondContact O-N 2.9Å
851	N	45.6	Very low	49.2	Very low	29 Å²	29	74 Å²	74	16%	0.155	40%	0.398	C	S	.	.	S	Bend	trans	-74.6	-1.5	-179.1	-71.6	-45.3	0	0	0	114.1	S848 N873 V874 S875	S848-N851 VanDerWaalsContact CB-ND2 3.27Å; S848-N851 WeakPolarHBondContact CB-ND2 3.32Å; S848-N851 PolarHBondContact O-N 3.18Å; S848-N851 PolarHBondContact OG-ND2 2.95Å; N851-N873 PolarHBondContact O-N 2.85Å; N851-N873 PolarHBondContact OD1-O 3.37Å; N851-N873 VanDerWaalsContact OD1-O 3.08Å; N851-V874 WeakPolarHBondContact OD1-CA 3.34Å; N851-S875 PolarHBondContact OD1-N 3.12Å; N851-S875 VanDerWaalsContact OD1-N 3.1Å
852	V	48.3	Very low	48.1	Very low	8 Å²	8	74 Å²	74	5%	0.048	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	107.2	-176.1	-167.9	0	0	0	0	111.1	K816 E850 I854 L872	K816-V852 VanDerWaalsContact CE-O 3.29Å; K816-V852 WeakPolarHBondContact CE-O 3.5Å; K816-V852 PolarHBondContact NZ-O 2.88Å; E850-V852 PolarHBondContact O-N 2.9Å; V852-I854 HydrophobicContact CG1-CG1 4.49Å; V852-L872 HydrophobicContact CB-CD2 4.25Å; V852-L872 HydrophobicContact CG1-CD2 3.97Å; V852-L872 HydrophobicContact CG2-CD2 3.78Å
853	A	43.5	Very low	46.7	Very low	36 Å²	36	79.6 Å²	79.6	30%	0.298	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	94	179.8	0	0	0	0	0	111.1	K855 E871	A853-K855 PolarHBondContact O-N 3.35Å; A853-E871 PolarHBondContact N-O 3.24Å; A853-E871 PolarHBondContact O-N 2.82Å
854	I	49.1	Very low	45.7	Very low	43 Å²	43	76.6 Å²	76.6	22%	0.221	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	107.6	172.5	-55.3	177.9	0	0	0	108.3	P815 K816 L819 V852 V857 I868 A870	P815-I854 HydrophobicContact CB-CD1 4.23Å; P815-I854 WeakPolarHBondContact O-CD1 3.35Å; K816-I854 HydrophobicContact CG-CD1 3.84Å; L819-I854 HydrophobicContact CD2-CD1 4Å; L819-I854 HydrophobicContact CD2-CG1 4.36Å; V852-I854 HydrophobicContact CG1-CG1 4.49Å; I854-V857 HydrophobicContact CG2-CG2 4.19Å; I854-I868 HydrophobicContact CG2-CG2 4.18Å; I854-A870 HydrophobicContact CG1-CB 4.16Å
855	K	45.2	Very low	44.7	Very low	131 Å²	131	78.5 Å²	78.5	57%	0.57	45%	0.454	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.8	-21.5	-173.4	-73.6	-174.6	-177.5	173.2	0	113.9	A853 V869 E871	A853-K855 PolarHBondContact O-N 3.35Å; K855-V869 PolarHBondContact N-O 2.83Å; K855-V869 VanDerWaalsContact N-O 3.09Å; K855-E871 HydrophobicContact CD-CB 4.46Å; K855-E871 WeakPolarHBondContact CE-OE1 3.47Å; K855-E871 WeakPolarHBondContact CE-OE2 3.32Å; K855-E871 IonicContact NZ-OE1 3.57Å; K855-E871 PolarHBondContact NZ-OE1 3.14Å; K855-E871 IonicContact NZ-OE2 2.64Å; K855-E871 PolarHBondContact NZ-OE2 3.27Å
856	K	43.6	Very low	44.1	Very low	103 Å²	103	79.1 Å²	79.1	45%	0.448	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.8	138.1	173.1	-149.6	179.9	-174.5	-167	0	113.1	E858 V869	K856-E858 VanDerWaalsContact CE-CD 3.44Å; K856-E858 VanDerWaalsContact CE-OE1 3.23Å; K856-E858 WeakPolarHBondContact CE-OE1 3.32Å; K856-E858 WeakPolarHBondContact CE-OE2 3.42Å; K856-E858 IonicContact NZ-OE1 3.57Å; K856-E858 PolarHBondContact NZ-OE1 2.84Å; K856-E858 IonicContact NZ-OE2 3.88Å; K856-E858 PolarHBondContact NZ-OE2 2.66Å; K856-V869 HydrophobicContact CB-CB 4.49Å; K856-V869 PolarHBondContact N-O 3.44Å; K856-V869 PolarHBondContact O-N 3.3Å
857	V	42.7	Very low	43.5	Very low	59 Å²	59	79.7 Å²	79.7	36%	0.358	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	127.6	159.2	178.1	0	0	0	0	106.2	I854 M866 I868	I854-V857 HydrophobicContact CG2-CG2 4.19Å; V857-M866 HydrophobicContact CG1-CE 3.81Å; V857-I868 HydrophobicContact CG1-CG1 4.27Å; V857-I868 HydrophobicContact CG2-CG1 4.2Å; V857-I868 HydrophobicContact CG2-CG2 4.29Å
858	E	41.3	Very low	43.1	Very low	110 Å²	110	75 Å²	75	51%	0.514	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	111.7	-179.2	-164.9	157.8	-124.2	0	0	110.3	K856 T867	K856-E858 VanDerWaalsContact CE-CD 3.44Å; K856-E858 VanDerWaalsContact CE-OE1 3.23Å; K856-E858 WeakPolarHBondContact CE-OE1 3.32Å; K856-E858 WeakPolarHBondContact CE-OE2 3.42Å; K856-E858 IonicContact NZ-OE1 3.57Å; K856-E858 PolarHBondContact NZ-OE1 2.84Å; K856-E858 IonicContact NZ-OE2 3.88Å; K856-E858 PolarHBondContact NZ-OE2 2.66Å; E858-T867 PolarHBondContact N-O 3.21Å; E858-T867 PolarHBondContact O-N 2.96Å; E858-T867 VanDerWaalsContact O-N 3.13Å
859	Q	41.3	Very low	42.9	Very low	123 Å²	123	76.8 Å²	76.8	58%	0.575	44%	0.443	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.5	120.2	175.5	-74.1	179.9	-5.5	0	0	109.8	S861 M866	Q859-S861 PolarHBondContact O-N 3.26Å; Q859-M866 HydrophobicContact CG-CB 4.38Å; Q859-M866 HydrophobicContact CG-CG 4.07Å; Q859-M866 HydrophobicContact CG-SD 3.56Å; Q859-M866 VanDerWaalsContact CG-SD 3.56Å; Q859-M866 PolarHBondContact NE2-SD 2.83Å
860	S	37.5	Very low	42.6	Very low	54 Å²	54	75.2 Å²	75.2	38%	0.378	44%	0.437	S	S	.	.			trans	-86.8	109.5	175.7	75.2	0	0	0	0	110.8	G862 T865	S860-G862 PolarHBondContact O-N 2.92Å; S860-T865 PolarHBondContact N-O 2.93Å; S860-T865 VanDerWaalsContact N-O 3.16Å; S860-T865 PolarHBondContact OG-O 3.42Å; S860-T865 PolarHBondContact OG-OG1 2.81Å
861	S	41.7	Very low	42.4	Very low	131 Å²	131	69.8 Å²	69.8	92%	0.916	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	-3.3	-171.7	-171.9	0	0	0	0	115.6	Q859	Q859-S861 PolarHBondContact O-N 3.26Å
862	G	36.1	Very low	42.3	Very low	68 Å²	68	72.7 Å²	72.7	70%	0.701	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.6	-49.7	179.8	0	0	0	0	0	114	S860	S860-G862 PolarHBondContact O-N 2.92Å
863	N	38.2	Very low	42.1	Very low	126 Å²	126	76 Å²	76	67%	0.674	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.7	-12.9	-161.1	-65.8	21.1	0	0	0	113.7	T865 R1001	N863-T865 VanDerWaalsContact C-N 3.3Å; N863-R1001 PolarHBondContact O-NH1 2.91Å
864	G	44.2	Very low	42	Very low	38 Å²	38	79 Å²	79	39%	0.392	46%	0.458	S	S	.	.			trans	82.3	3.8	-174.9	0	0	0	0	0	114.6
865	T	36.8	Very low	41.5	Very low	61 Å²	61	81.4 Å²	81.4	37%	0.374	48%	0.479	S	S	.	.			trans	-73.1	122.9	167.1	35.1	0	0	0	0	110.2	S860 N863	S860-T865 PolarHBondContact N-O 2.93Å; S860-T865 VanDerWaalsContact N-O 3.16Å; S860-T865 PolarHBondContact OG-O 3.42Å; S860-T865 PolarHBondContact OG-OG1 2.81Å; N863-T865 VanDerWaalsContact C-N 3.3Å
866	M	42.1	Very low	41.6	Very low	33 Å²	33	80.4 Å²	80.4	16%	0.163	48%	0.476	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	126.1	174.3	171.2	154.3	152.1	0	0	108.4	L808 V857 Q859 I868	L808-M866 HydrophobicContact CB-CE 4.39Å; L808-M866 WeakPolarHBondContact O-CE 3.19Å; V857-M866 HydrophobicContact CG1-CE 3.81Å; Q859-M866 HydrophobicContact CG-CB 4.38Å; Q859-M866 HydrophobicContact CG-CG 4.07Å; Q859-M866 HydrophobicContact CG-SD 3.56Å; Q859-M866 VanDerWaalsContact CG-SD 3.56Å; Q859-M866 PolarHBondContact NE2-SD 2.83Å; M866-I868 HydrophobicContact CE-CD1 3.89Å; M866-I868 HydrophobicContact CE-CG1 4.22Å
867	T	42.7	Very low	41.8	Very low	84 Å²	84	80.7 Å²	80.7	52%	0.515	49%	0.487	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	126	-177.8	-52.8	0	0	0	0	109.7	E858 V869	E858-T867 PolarHBondContact N-O 3.21Å; E858-T867 PolarHBondContact O-N 2.96Å; E858-T867 VanDerWaalsContact O-N 3.13Å; T867-V869 HydrophobicContact CG2-CG2 4.45Å
868	I	44.3	Very low	42.2	Very low	37 Å²	37	81.1 Å²	81.1	19%	0.19	49%	0.487	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	128.7	177.3	-59	-176.9	0	0	0	108.1	L808 I854 V857 M866	L808-I868 HydrophobicContact CD2-CD1 3.67Å; I854-I868 HydrophobicContact CG2-CG2 4.18Å; V857-I868 HydrophobicContact CG1-CG1 4.27Å; V857-I868 HydrophobicContact CG2-CG1 4.2Å; V857-I868 HydrophobicContact CG2-CG2 4.29Å; M866-I868 HydrophobicContact CE-CD1 3.89Å; M866-I868 HydrophobicContact CE-CG1 4.22Å
869	V	42	Very low	42.5	Very low	71 Å²	71	83.2 Å²	83.2	43%	0.43	50%	0.497	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	105.2	176.5	-175.8	0	0	0	0	108.6	K855 K856 T867	K855-V869 PolarHBondContact N-O 2.83Å; K855-V869 VanDerWaalsContact N-O 3.09Å; K856-V869 HydrophobicContact CB-CB 4.49Å; K856-V869 PolarHBondContact N-O 3.44Å; K856-V869 PolarHBondContact O-N 3.3Å; T867-V869 HydrophobicContact CG2-CG2 4.45Å
870	A	42.8	Very low	42.5	Very low	45 Å²	45	85.6 Å²	85.6	37%	0.372	51%	0.513	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	143.5	177.3	0	0	0	0	0	111.2	L819 I854	L819-A870 HydrophobicContact CD2-CB 4.03Å; I854-A870 HydrophobicContact CG1-CB 4.16Å
871	E	41.3	Very low	42.9	Very low	75 Å²	75	85.5 Å²	85.5	35%	0.35	51%	0.513	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	122.5	176.2	-166.1	-178.8	102.7	0	0	109	A853 K855 N873	A853-E871 PolarHBondContact N-O 3.24Å; A853-E871 PolarHBondContact O-N 2.82Å; K855-E871 HydrophobicContact CD-CB 4.46Å; K855-E871 WeakPolarHBondContact CE-OE1 3.47Å; K855-E871 WeakPolarHBondContact CE-OE2 3.32Å; K855-E871 IonicContact NZ-OE1 3.57Å; K855-E871 PolarHBondContact NZ-OE1 3.14Å; K855-E871 IonicContact NZ-OE2 2.64Å; K855-E871 PolarHBondContact NZ-OE2 3.27Å; E871-N873 PolarHBondContact OE1-ND2 2.88Å
872	L	43	Very low	43.4	Very low	91 Å²	91	82.9 Å²	82.9	48%	0.476	51%	0.507	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	116	178.7	-68.6	166.9	0	0	0	108.9	L841 V852	L841-L872 HydrophobicContact CD2-CD1 3.61Å; V852-L872 HydrophobicContact CB-CD2 4.25Å; V852-L872 HydrophobicContact CG1-CD2 3.97Å; V852-L872 HydrophobicContact CG2-CD2 3.78Å
873	N	44.1	Very low	44.1	Very low	76 Å²	76	84.8 Å²	84.8	41%	0.406	50%	0.5	S	S	.	.			trans	-121.4	77.5	179.2	-75.7	-62.1	0	0	0	109.4	N851 E871 S875	N851-N873 PolarHBondContact O-N 2.85Å; N851-N873 PolarHBondContact OD1-O 3.37Å; N851-N873 VanDerWaalsContact OD1-O 3.08Å; E871-N873 PolarHBondContact OE1-ND2 2.88Å; N873-S875 PolarHBondContact O-N 2.82Å; N873-S875 PolarHBondContact O-OG 3.43Å
874	V	41	Very low	44.5	Very low	100 Å²	100	84.7 Å²	84.7	61%	0.606	50%	0.499	S	S	*	.			trans	-68.9	103.8	175.5	-177	0	0	0	0	109.2	V844 N851	V844-V874 HydrophobicContact CG1-CG2 4.47Å; N851-V874 WeakPolarHBondContact OD1-CA 3.34Å
875	S	40.6	Very low	44.6	Very low	93 Å²	93	92 Å²	92	65%	0.65	52%	0.523	S	S	*	.			trans	-119.5	109.3	-176.1	-53.9	0	0	0	0	109.5	N851 N873	N851-S875 PolarHBondContact OD1-N 3.12Å; N851-S875 VanDerWaalsContact OD1-N 3.1Å; N873-S875 PolarHBondContact O-N 2.82Å; N873-S875 PolarHBondContact O-OG 3.43Å
876	Q	47	Very low	44.8	Very low	110 Å²	110	99 Å²	99	51%	0.514	55%	0.551	S	S	.	*			trans	-112.9	118.3	-176.6	-166.3	177	21.1	0	0	110.6	S902 N903	Q876-S902 PolarHBondContact NE2-OG 3.38Å; Q876-N903 PolarHBondContact OE1-ND2 3.33Å
877	T	46.7	Very low	45	Very low	109 Å²	109	101.1 Å²	101.1	67%	0.669	58%	0.581	S	S	*	*			trans	-77.6	139.7	171.4	50.1	0	0	0	0	110.1	E879	T877-E879 PolarHBondContact O-N 3.46Å
878	L	51.3	Low	45	Very low	69 Å²	69	104.4 Å²	104.4	36%	0.361	60%	0.596	S	S	.	*	S	Bend	trans	-80.2	6.7	-173.5	-84.9	165.1	0	0	0	114.4	D880 S881 I895 A898 L899	L878-D880 PolarHBondContact O-N 3.06Å; L878-S881 WeakPolarHBondContact CD2-OG 3.48Å; L878-S881 WeakPolarHBondContact O-CB 3.36Å; L878-S881 PolarHBondContact O-N 2.83Å; L878-S881 PolarHBondContact O-OG 2.86Å; L878-I895 HydrophobicContact CD1-CG2 4.23Å; L878-A898 HydrophobicContact CD2-CB 4.38Å; L878-L899 HydrophobicContact CD2-CD2 3.96Å; L878-L899 HydrophobicContact CD2-CG 4.33Å; L878-L899 HydrophobicContact CG-CD2 4.42Å
879	E	48.1	Very low	45.3	Very low	153 Å²	153	110.3 Å²	110.3	72%	0.715	63%	0.628	S	S	*	*	G	3₁₀ helix	trans	-64.9	-34.9	-164	-62.1	-177.4	139.4	0	0	113.8	T877 S881	T877-E879 PolarHBondContact O-N 3.46Å; E879-S881 PolarHBondContact O-N 2.93Å
880	D	41.1	Very low	45.9	Very low	173 Å²	173	110.2 Å²	110.2	93%	0.925	62%	0.624	S	S	*	*	G	3₁₀ helix	trans	-75.6	-2	176.2	-81.6	-33.4	0	0	0	114.2	L878 G882	L878-D880 PolarHBondContact O-N 3.06Å; D880-G882 PolarHBondContact O-N 2.98Å
881	S	46.8	Very low	46.7	Very low	52 Å²	52	110.4 Å²	110.4	36%	0.364	62%	0.623	S	S	.	*	G	3₁₀ helix	trans	-72.2	-12.3	-177.5	-48.5	0	0	0	0	114.2	L878 E879 L883	L878-S881 WeakPolarHBondContact CD2-OG 3.48Å; L878-S881 WeakPolarHBondContact O-CB 3.36Å; L878-S881 PolarHBondContact O-N 2.83Å; L878-S881 PolarHBondContact O-OG 2.86Å; E879-S881 PolarHBondContact O-N 2.93Å; S881-L883 PolarHBondContact O-N 3.36Å; S881-L883 VanDerWaalsContact O-N 3.15Å
882	G	51.7	Low	47.3	Very low	77 Å²	77	112.5 Å²	112.5	79%	0.794	63%	0.633	S	S	*	*	S	Bend	trans	63.9	14.4	-177.3	0	0	0	0	0	115.3	D880	D880-G882 PolarHBondContact O-N 2.98Å
883	L	50	Low	47.8	Very low	107 Å²	107	115.9 Å²	115.9	56%	0.56	65%	0.646	S	S	*	*			trans	-101.8	10.8	-172.8	-94.3	166.8	0	0	0	114.3	S881 A898	S881-L883 PolarHBondContact O-N 3.36Å; S881-L883 VanDerWaalsContact O-N 3.15Å; L883-A898 HydrophobicContact CD1-CB 4.17Å
884	L	45.8	Very low	48.6	Very low	124 Å²	124	117.1 Å²	117.1	65%	0.649	65%	0.649	S	S	*	*			trans	-108.5	79.7	177.4	-61	-179.9	0	0	0	111	I890	L884-I890 HydrophobicContact CD2-CD1 3.77Å
885	E	46.3	Very low	49.3	Very low	193 Å²	193	114.6 Å²	114.6	90%	0.902	63%	0.632	S	S	*	*			trans	-89.2	146.7	148.1	-77.7	-165.1	133.4	0	0	108.6	G887	E885-G887 PolarHBondContact O-N 3.36Å
886	E	41.2	Very low	50	Low	207 Å²	207	112.1 Å²	112.1	97%	0.967	61%	0.611	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72	117.2	-162.6	-60.7	177.5	118.3	0	0	113.8
887	G	47.4	Very low	50.5	Low	77 Å²	77	114.6 Å²	114.6	79%	0.794	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	126.3	-8.8	146.4	0	0	0	0	0	119.2	E885	E885-G887 PolarHBondContact O-N 3.36Å
888	D	43.1	Very low	51	Low	154 Å²	154	110 Å²	110	82%	0.824	59%	0.592	S	S	*	*			trans	-91.6	146	179.3	-81	-25.6	0	0	0	113.1	I890	D888-I890 PolarHBondContact O-N 3.43Å
889	D	50.4	Low	51.1	Low	160 Å²	160	108 Å²	108	86%	0.856	58%	0.582	S	S	*	*			trans	-71.9	88.4	173.7	-81.7	-50.6	0	0	0	110.8	S891	D889-S891 PolarHBondContact O-N 2.99Å
890	I	54.2	Low	51.2	Low	70 Å²	70	104.3 Å²	104.3	36%	0.359	56%	0.564	S	S	.	*			trans	-55.9	127.9	177.6	-54.8	177.2	0	0	0	110.2	L884 D888 Q894 I895	L884-I890 HydrophobicContact CD2-CD1 3.77Å; D888-I890 PolarHBondContact O-N 3.43Å; I890-Q894 HydrophobicContact CG2-CB 3.78Å; I890-I895 HydrophobicContact CG2-CG1 3.88Å
891	S	58.9	Low	51.7	Low	48 Å²	48	100.1 Å²	100.1	34%	0.336	55%	0.548	S	S	.	.			trans	-74.8	152.8	-174	80.9	0	0	0	0	113	D889 E893 Q894 I895	D889-S891 PolarHBondContact O-N 2.99Å; S891-E893 PolarHBondContact O-N 3.2Å; S891-Q894 WeakPolarHBondContact O-CA 3.24Å; S891-Q894 WeakPolarHBondContact O-CB 3.28Å; S891-Q894 PolarHBondContact O-N 3.44Å; S891-Q894 WeakPolarHBondContact OG-CG 3.36Å; S891-Q894 PolarHBondContact OG-N 2.82Å; S891-I895 PolarHBondContact O-N 3.3Å
892	E	54	Low	51.9	Low	119 Å²	119	101 Å²	101	56%	0.556	55%	0.554	S	S	*	*	H	α-helix	trans	-57	-35.9	179	-164.6	161.4	-135.8	0	0	111.9	M896 I952	E892-M896 WeakPolarHBondContact O-CB 3.3Å; E892-M896 VanDerWaalsContact O-CG 3.24Å; E892-M896 WeakPolarHBondContact O-CG 3.34Å; E892-M896 PolarHBondContact O-N 2.94Å; E892-I952 HydrophobicContact CG-CD1 4.11Å
893	E	54.2	Low	51.7	Low	162 Å²	162	99.9 Å²	99.9	76%	0.757	53%	0.53	S	S	*	.	H	α-helix	trans	-65.1	-38.6	171.2	-70.4	-166.4	122.6	0	0	113.5	S891 K897	S891-E893 PolarHBondContact O-N 3.2Å; E893-K897 WeakPolarHBondContact O-CB 3.35Å; E893-K897 PolarHBondContact O-N 2.86Å
894	Q	60.3	Low	51.6	Low	103 Å²	103	99.5 Å²	99.5	48%	0.481	53%	0.528	S	S	.	.	H	α-helix	trans	-67.5	-41.7	178.3	-73.5	169.4	-23.6	0	0	111.1	I890 S891 K897 A898	I890-Q894 HydrophobicContact CG2-CB 3.78Å; S891-Q894 WeakPolarHBondContact O-CA 3.24Å; S891-Q894 WeakPolarHBondContact O-CB 3.28Å; S891-Q894 PolarHBondContact O-N 3.44Å; S891-Q894 WeakPolarHBondContact OG-CG 3.36Å; S891-Q894 PolarHBondContact OG-N 2.82Å; Q894-K897 PolarHBondContact O-N 2.81Å; Q894-A898 WeakPolarHBondContact O-CB 3.29Å; Q894-A898 PolarHBondContact O-N 3.03Å
895	I	55.9	Low	51.6	Low	47 Å²	47	98.9 Å²	98.9	24%	0.241	53%	0.526	C	S	.	.	H	α-helix	trans	-62.1	-49.9	174.7	-61.8	171.6	0	0	0	110.2	L878 I890 S891 K897 A898 L899	L878-I895 HydrophobicContact CD1-CG2 4.23Å; I890-I895 HydrophobicContact CG2-CG1 3.88Å; S891-I895 PolarHBondContact O-N 3.3Å; I895-K897 VanDerWaalsContact C-N 3.3Å; I895-K897 PolarHBondContact O-N 2.87Å; I895-A898 PolarHBondContact O-N 2.85Å; I895-L899 HydrophobicContact CG2-CD1 3.98Å; I895-L899 WeakPolarHBondContact O-CG 3.49Å; I895-L899 PolarHBondContact O-N 3.45Å
896	M	54.4	Low	51.7	Low	41 Å²	41	92.3 Å²	92.3	20%	0.202	50%	0.496	C	S	.	.	H	α-helix	trans	-62.2	-35.7	177.9	-73.4	-70.2	-78.4	0	0	112.7	E892 K900 I920	E892-M896 WeakPolarHBondContact O-CB 3.3Å; E892-M896 VanDerWaalsContact O-CG 3.24Å; E892-M896 WeakPolarHBondContact O-CG 3.34Å; E892-M896 PolarHBondContact O-N 2.94Å; M896-K900 WeakPolarHBondContact O-CB 3.4Å; M896-K900 WeakPolarHBondContact O-CG 3.46Å; M896-K900 PolarHBondContact O-N 3.39Å; M896-I920 HydrophobicContact CE-CD1 4.21Å; M896-I920 HydrophobicContact SD-CD1 4.32Å
897	K	59.5	Low	51.8	Low	161 Å²	161	85.3 Å²	85.3	70%	0.7	46%	0.464	S	S	*	.	H	α-helix	trans	-70	-40.3	176.5	-173.8	174.3	-176.5	176.2	0	112.3	E893 Q894 I895 S901	E893-K897 WeakPolarHBondContact O-CB 3.35Å; E893-K897 PolarHBondContact O-N 2.86Å; Q894-K897 PolarHBondContact O-N 2.81Å; I895-K897 VanDerWaalsContact C-N 3.3Å; I895-K897 PolarHBondContact O-N 2.87Å; K897-S901 WeakPolarHBondContact O-CB 3.32Å; K897-S901 PolarHBondContact O-N 3.09Å; K897-S901 PolarHBondContact O-OG 2.88Å
898	A	55.3	Low	51.9	Low	12 Å²	12	87.4 Å²	87.4	10%	0.099	45%	0.451	C	S	.	.	H	α-helix	trans	-61.7	-52.8	173.2	0	0	0	0	0	110.8	L878 L883 Q894 I895 K900 S901 S902	L878-A898 HydrophobicContact CD2-CB 4.38Å; L883-A898 HydrophobicContact CD1-CB 4.17Å; Q894-A898 WeakPolarHBondContact O-CB 3.29Å; Q894-A898 PolarHBondContact O-N 3.03Å; I895-A898 PolarHBondContact O-N 2.85Å; A898-K900 PolarHBondContact O-N 3.44Å; A898-S901 PolarHBondContact O-N 3.17Å; A898-S901 VanDerWaalsContact O-N 3.08Å; A898-S901 PolarHBondContact O-OG 3.06Å; A898-S902 PolarHBondContact O-N 2.73Å
899	L	53.3	Low	51.8	Low	27 Å²	27	81.5 Å²	81.5	14%	0.141	42%	0.423	C	S	.	.	H	α-helix	trans	-57.1	-45.2	178.8	-71.8	170.8	0	0	0	112.7	L878 I895 S902 N903 I920 V922	L878-L899 HydrophobicContact CD2-CD2 3.96Å; L878-L899 HydrophobicContact CD2-CG 4.33Å; L878-L899 HydrophobicContact CG-CD2 4.42Å; I895-L899 HydrophobicContact CG2-CD1 3.98Å; I895-L899 WeakPolarHBondContact O-CG 3.49Å; I895-L899 PolarHBondContact O-N 3.45Å; L899-S902 PolarHBondContact O-N 3.35Å; L899-N903 WeakPolarHBondContact O-CB 3.31Å; L899-N903 PolarHBondContact O-N 2.99Å; L899-N903 PolarHBondContact O-ND2 3.34Å; L899-I920 HydrophobicContact CD1-CG2 4.22Å; L899-V922 HydrophobicContact CD1-CG2 4.27Å
900	K	51.6	Low	51.4	Low	76 Å²	76	77.9 Å²	77.9	33%	0.33	40%	0.4	S	S	.	.	H	α-helix	trans	-61.9	-43.4	173.7	-81.8	174	168	-90.7	0	112.5	M896 A898 S902 N903 L904 E907 Y918	M896-K900 WeakPolarHBondContact O-CB 3.4Å; M896-K900 WeakPolarHBondContact O-CG 3.46Å; M896-K900 PolarHBondContact O-N 3.39Å; A898-K900 PolarHBondContact O-N 3.44Å; K900-S902 VanDerWaalsContact C-N 3.3Å; K900-S902 PolarHBondContact O-N 3.35Å; K900-N903 CarbonylContact O-C 3.58Å; K900-N903 PolarHBondContact O-N 2.92Å; K900-N903 VanDerWaalsContact O-N 3.15Å; K900-L904 PolarHBondContact O-N 2.8Å; K900-E907 IonicContact NZ-OE1 3.12Å; K900-E907 PolarHBondContact NZ-OE1 3.29Å; K900-E907 IonicContact NZ-OE2 3.79Å; K900-Y918 PolarHBondContact NZ-OH 2.78Å
901	S	52.1	Low	51	Low	85 Å²	85	81.5 Å²	81.5	59%	0.594	42%	0.415	S	S	*	.	H	α-helix	trans	-65.3	-31.8	179.6	71.6	0	0	0	0	113.4	K897 A898	K897-S901 WeakPolarHBondContact O-CB 3.32Å; K897-S901 PolarHBondContact O-N 3.09Å; K897-S901 PolarHBondContact O-OG 2.88Å; A898-S901 PolarHBondContact O-N 3.17Å; A898-S901 VanDerWaalsContact O-N 3.08Å; A898-S901 PolarHBondContact O-OG 3.06Å
902	S	49.3	Very low	50	Low	71 Å²	71	82.1 Å²	82.1	50%	0.497	43%	0.43	S	S	.	.	H	α-helix	trans	-80.8	-12.2	175	-170.8	0	0	0	0	114	Q876 A898 L899 K900	Q876-S902 PolarHBondContact NE2-OG 3.38Å; A898-S902 PolarHBondContact O-N 2.73Å; L899-S902 PolarHBondContact O-N 3.35Å; K900-S902 VanDerWaalsContact C-N 3.3Å; K900-S902 PolarHBondContact O-N 3.35Å
903	N	48.1	Very low	48.9	Very low	53 Å²	53	77.7 Å²	77.7	28%	0.283	42%	0.416	S	S	.	.	T	Hydrogen-bonded Turn	trans	-120.8	33.3	-175.9	-73.3	-84.4	0	0	0	112.1	Q876 L899 K900 D905 L906 E907	Q876-N903 PolarHBondContact OE1-ND2 3.33Å; L899-N903 WeakPolarHBondContact O-CB 3.31Å; L899-N903 PolarHBondContact O-N 2.99Å; L899-N903 PolarHBondContact O-ND2 3.34Å; K900-N903 CarbonylContact O-C 3.58Å; K900-N903 PolarHBondContact O-N 2.92Å; K900-N903 VanDerWaalsContact O-N 3.15Å; N903-D905 PolarHBondContact O-N 3.11Å; N903-D905 VanDerWaalsContact O-N 3.14Å; N903-L906 HydrophobicContact CB-CB 4.14Å; N903-L906 HydrophobicContact CB-CD2 4.47Å; N903-L906 WeakPolarHBondContact O-CB 3.19Å; N903-L906 PolarHBondContact O-N 2.95Å; N903-E907 PolarHBondContact O-N 2.9Å
904	L	48.2	Very low	47.9	Very low	99 Å²	99	74.8 Å²	74.8	52%	0.518	42%	0.419	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61	-24.3	-175.3	-155.6	83.2	0	0	0	114	K900 K908	K900-L904 PolarHBondContact O-N 2.8Å; L904-K908 WeakPolarHBondContact O-CG 3.34Å
905	D	47	Very low	47	Very low	112 Å²	112	73.9 Å²	73.9	60%	0.599	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.7	-27.1	176.4	-68.2	-21.8	0	0	0	112.5	N903 K908 A909	N903-D905 PolarHBondContact O-N 3.11Å; N903-D905 VanDerWaalsContact O-N 3.14Å; D905-K908 PolarHBondContact O-N 2.92Å; D905-K908 IonicContact OD1-NZ 2.64Å; D905-K908 PolarHBondContact OD1-NZ 2.84Å; D905-A909 PolarHBondContact O-N 3.08Å
906	L	46.5	Very low	46	Very low	54 Å²	54	76.2 Å²	76.2	28%	0.283	46%	0.458	S	S	.	.	H	α-helix	trans	-65.7	-46.4	172.2	-167.6	78.1	0	0	0	110.5	F840 N903 K908 A909 F910	F840-L906 HydrophobicContact CD1-CD1 4.46Å; F840-L906 HydrophobicContact CE1-CD1 3.72Å; F840-L906 HydrophobicContact CE2-CD1 3.81Å; F840-L906 HydrophobicContact CZ-CD1 3.36Å; N903-L906 HydrophobicContact CB-CB 4.14Å; N903-L906 HydrophobicContact CB-CD2 4.47Å; N903-L906 WeakPolarHBondContact O-CB 3.19Å; N903-L906 PolarHBondContact O-N 2.95Å; L906-K908 PolarHBondContact O-N 3.44Å; L906-A909 PolarHBondContact O-N 2.95Å; L906-F910 HydrophobicContact CD1-CD2 4.28Å; L906-F910 HydrophobicContact CD1-CE2 3.8Å; L906-F910 HydrophobicContact CG-CD2 4.35Å; L906-F910 HydrophobicContact CG-CE2 4.35Å; L906-F910 WeakPolarHBondContact O-CD2 3.47Å; L906-F910 PolarHBondContact O-N 3.35Å
907	E	44.3	Very low	45	Very low	61 Å²	61	78 Å²	78	29%	0.285	49%	0.487	S	S	.	.	H	α-helix	trans	-67.2	-19.8	179.4	-169.6	161.5	-117.2	0	0	112.8	K900 N903 Q911 Y918	K900-E907 IonicContact NZ-OE1 3.12Å; K900-E907 PolarHBondContact NZ-OE1 3.29Å; K900-E907 IonicContact NZ-OE2 3.79Å; N903-E907 PolarHBondContact O-N 2.9Å; E907-Q911 PolarHBondContact O-NE2 2.92Å; E907-Y918 PolarHBondContact OE1-OH 2.85Å
908	K	49	Very low	43.8	Very low	120 Å²	120	75.9 Å²	75.9	52%	0.522	48%	0.476	S	S	.	.	H	α-helix	trans	-82.7	-44.9	171.3	-72.6	172.8	-165.6	156.1	0	113.3	L904 D905 L906 F910 Q911	L904-K908 WeakPolarHBondContact O-CG 3.34Å; D905-K908 PolarHBondContact O-N 2.92Å; D905-K908 IonicContact OD1-NZ 2.64Å; D905-K908 PolarHBondContact OD1-NZ 2.84Å; L906-K908 PolarHBondContact O-N 3.44Å; K908-F910 VanDerWaalsContact C-N 3.3Å; K908-F910 PolarHBondContact O-N 2.85Å; K908-Q911 VanDerWaalsContact O-CB 3.25Å; K908-Q911 WeakPolarHBondContact O-CB 3.42Å; K908-Q911 PolarHBondContact O-N 3.35Å
909	A	42.3	Very low	42.8	Very low	30 Å²	30	80.2 Å²	80.2	25%	0.248	51%	0.506	C	S	.	.	H	α-helix	trans	-57.7	-44.1	-176	0	0	0	0	0	111.6	D905 L906 Q911	D905-A909 PolarHBondContact O-N 3.08Å; L906-A909 PolarHBondContact O-N 2.95Å; A909-Q911 PolarHBondContact O-N 2.99Å
910	F	42	Very low	42	Very low	84 Å²	84	82 Å²	82	37%	0.368	51%	0.514	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.4	16.7	178.4	-64.9	-78.6	0	0	0	114.3	E837 L906 K908	E837-F910 HydrophobicContact CG-CD1 4.3Å; E837-F910 HydrophobicContact CG-CE1 3.64Å; E837-F910 HydrophobicContact CG-CZ 4.28Å; E837-F910 WeakPolarHBondContact OE1-CE1 3.32Å; L906-F910 HydrophobicContact CD1-CD2 4.28Å; L906-F910 HydrophobicContact CD1-CE2 3.8Å; L906-F910 HydrophobicContact CG-CD2 4.35Å; L906-F910 HydrophobicContact CG-CE2 4.35Å; L906-F910 WeakPolarHBondContact O-CD2 3.47Å; L906-F910 PolarHBondContact O-N 3.35Å; K908-F910 VanDerWaalsContact C-N 3.3Å; K908-F910 PolarHBondContact O-N 2.85Å
911	Q	44.1	Very low	41.3	Very low	146 Å²	146	86.5 Å²	86.5	68%	0.682	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.5	-8.4	-176.9	-148	147.4	103	0	0	114.1	E907 K908 A909	E907-Q911 PolarHBondContact O-NE2 2.92Å; K908-Q911 VanDerWaalsContact O-CB 3.25Å; K908-Q911 WeakPolarHBondContact O-CB 3.42Å; K908-Q911 PolarHBondContact O-N 3.35Å; A909-Q911 PolarHBondContact O-N 2.99Å
912	G	38.9	Very low	40.7	Very low	62 Å²	62	85.8 Å²	85.8	64%	0.639	52%	0.521	S	S	*	.	S	Bend	trans	-97.5	-18.8	174	0	0	0	0	0	115.1
913	G	30.8	Very low	40.3	Very low	26 Å²	26	86.8 Å²	86.8	27%	0.268	53%	0.528	S	S	.	.	S	Bend	trans	-89.8	174.6	175.6	0	0	0	0	0	113.6	G915	G913-G915 PolarHBondContact O-N 3.47Å
914	A	33.1	Very low	40	Very low	100 Å²	100	91.6 Å²	91.6	83%	0.826	55%	0.547	S	S	*	.	S	Bend	trans	-60.2	122.3	175.5	0	0	0	0	0	110.3	S916	A914-S916 PolarHBondContact O-N 3.34Å
915	G	40.6	Very low	39.5	Very low	84 Å²	84	95 Å²	95	87%	0.866	56%	0.56	S	S	*	*			trans	-59.9	95.5	-165.8	0	0	0	0	0	114.3	G913	G913-G915 PolarHBondContact O-N 3.47Å
916	S	36	Very low	39	Very low	96 Å²	96	96 Å²	96	67%	0.671	56%	0.561	S	S	*	*			trans	-105.2	131.9	-179.3	-164.5	0	0	0	0	110.3	A914 Y918	A914-S916 PolarHBondContact O-N 3.34Å; S916-Y918 PolarHBondContact O-N 2.92Å
917	G	32.9	Very low	38.3	Very low	79 Å²	79	97 Å²	97	81%	0.814	59%	0.585	S	S	*	*			trans	-76.6	120.1	-170.2	0	0	0	0	0	113.2
918	Y	35.6	Very low	37.7	Very low	117 Å²	117	99.3 Å²	99.3	46%	0.459	60%	0.603	S	S	.	*			trans	-73.7	142.7	167.1	54.2	-105.6	0	0	0	111.1	K900 E907 S916 I920	K900-Y918 PolarHBondContact NZ-OH 2.78Å; E907-Y918 PolarHBondContact OE1-OH 2.85Å; S916-Y918 PolarHBondContact O-N 2.92Å; Y918-I920 HydrophobicContact CD2-CD1 4.23Å; Y918-I920 HydrophobicContact CD2-CG1 4.14Å; Y918-I920 HydrophobicContact CE2-CD1 4.13Å
919	S	32.5	Very low	37.1	Very low	103 Å²	103	98.4 Å²	98.4	72%	0.72	62%	0.617	S	S	*	*			trans	-114.5	120.9	177.9	-175	0	0	0	0	109.9
920	I	36.8	Very low	36.6	Very low	64 Å²	64	107.1 Å²	107.1	33%	0.328	65%	0.645	S	S	.	*			trans	-100.3	121.3	-179.1	-59	177.9	0	0	0	108.5	M896 L899 Y918 V922	M896-I920 HydrophobicContact CE-CD1 4.21Å; M896-I920 HydrophobicContact SD-CD1 4.32Å; L899-I920 HydrophobicContact CD1-CG2 4.22Å; Y918-I920 HydrophobicContact CD2-CD1 4.23Å; Y918-I920 HydrophobicContact CD2-CG1 4.14Å; Y918-I920 HydrophobicContact CE2-CD1 4.13Å; I920-V922 HydrophobicContact CG2-CG2 4.09Å
921	R	38.1	Very low	36.1	Very low	171 Å²	171	107.9 Å²	107.9	65%	0.645	67%	0.667	S	S	*	*			trans	-99.2	123.2	174.2	-170.2	-171.4	-58.7	-139.7	7.4	109	E949	R921-E949 VanDerWaalsContact CD-OE1 3.3Å; R921-E949 WeakPolarHBondContact CD-OE1 3.49Å; R921-E949 IonicContact CZ-OE1 2.73Å; R921-E949 IonicContact NE-OE1 3.83Å; R921-E949 IonicContact NH1-OE1 2.64Å; R921-E949 PolarHBondContact NH1-OE1 3.31Å
922	V	39.8	Very low	35.7	Very low	69 Å²	69	110.8 Å²	110.8	42%	0.418	68%	0.681	S	S	.	*	B	Isolated β-bridge	trans	-114.6	119.8	176.4	-176.8	0	0	0	0	109	L899 I920	L899-V922 HydrophobicContact CD1-CG2 4.27Å; I920-V922 HydrophobicContact CG2-CG2 4.09Å
923	S	39.9	Very low	35.3	Very low	93 Å²	93	111.4 Å²	111.4	65%	0.65	69%	0.687	S	S	*	*			trans	-115.2	115.5	178.1	51.4	0	0	0	0	110.4
924	K	41	Very low	35.2	Very low	153 Å²	153	119.8 Å²	119.8	67%	0.665	72%	0.716	S	S	*	*			trans	-87.7	116.5	174.3	-169.8	-171.1	-174.7	-167.1	0	109.6	E926	K924-E926 HydrophobicContact CD-CG 4Å; K924-E926 VanDerWaalsContact CE-OE1 3.26Å; K924-E926 WeakPolarHBondContact CE-OE1 3.43Å; K924-E926 HydrophobicContact CG-CG 4.18Å; K924-E926 IonicContact NZ-OE1 3.1Å; K924-E926 PolarHBondContact NZ-OE1 3.09Å
925	E	39.2	Very low	35.3	Very low	170 Å²	170	123.4 Å²	123.4	79%	0.794	72%	0.716	S	S	*	*			trans	-95	103.9	174.5	-171.6	159.9	-135.9	0	0	110.2	G927	E925-G927 PolarHBondContact O-N 3.48Å
926	E	35.7	Very low	35	Very low	134 Å²	134	122.6 Å²	122.6	63%	0.626	71%	0.708	S	S	*	*			trans	-87.7	95.8	179.8	-68.4	-170.6	159.2	0	0	111.1	K924 V928	K924-E926 HydrophobicContact CD-CG 4Å; K924-E926 VanDerWaalsContact CE-OE1 3.26Å; K924-E926 WeakPolarHBondContact CE-OE1 3.43Å; K924-E926 HydrophobicContact CG-CG 4.18Å; K924-E926 IonicContact NZ-OE1 3.1Å; K924-E926 PolarHBondContact NZ-OE1 3.09Å; E926-V928 PolarHBondContact O-N 2.92Å; E926-V928 VanDerWaalsContact O-N 3.12Å
927	G	32.3	Very low	34.7	Very low	76 Å²	76	128.3 Å²	128.3	78%	0.784	72%	0.721	S	S	*	*			trans	-66.2	103.8	177	0	0	0	0	0	113	E925 A929	E925-G927 PolarHBondContact O-N 3.48Å; G927-A929 PolarHBondContact O-N 2.78Å; G927-A929 VanDerWaalsContact O-N 3.16Å
928	V	31.3	Very low	34.8	Very low	109 Å²	109	128.6 Å²	128.6	66%	0.661	72%	0.724	S	S	*	*			trans	-79	98.6	177.4	-173.2	0	0	0	0	110.7	E926 Y930	E926-V928 PolarHBondContact O-N 2.92Å; E926-V928 VanDerWaalsContact O-N 3.12Å; V928-Y930 HydrophobicContact CB-CE2 4.35Å; V928-Y930 HydrophobicContact CG1-CD2 3.94Å; V928-Y930 HydrophobicContact CG1-CE2 3.44Å; V928-Y930 VanDerWaalsContact CG1-CE2 3.44Å; V928-Y930 PolarHBondContact O-N 2.91Å
929	A	35.3	Very low	34.3	Very low	100 Å²	100	128.1 Å²	128.1	83%	0.826	74%	0.738	S	S	*	*			trans	-69.3	114.3	175.2	0	0	0	0	0	111.9	G927	G927-A929 PolarHBondContact O-N 2.78Å; G927-A929 VanDerWaalsContact O-N 3.16Å
930	Y	32	Very low	34.7	Very low	214 Å²	214	131.2 Å²	131.2	84%	0.839	74%	0.744	S	S	*	*	P	Polyproline II helix	trans	-102.7	137.6	166.4	-79.7	-77.6	0	0	0	110.9	V928	V928-Y930 HydrophobicContact CB-CE2 4.35Å; V928-Y930 HydrophobicContact CG1-CD2 3.94Å; V928-Y930 HydrophobicContact CG1-CE2 3.44Å; V928-Y930 VanDerWaalsContact CG1-CE2 3.44Å; V928-Y930 PolarHBondContact O-N 2.91Å
931	A	31.6	Very low	34.3	Very low	100 Å²	100	136.6 Å²	136.6	83%	0.826	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-76.1	157.8	-174	0	0	0	0	0	113.7
932	E	35.8	Very low	33.9	Very low	207 Å²	207	137.3 Å²	137.3	97%	0.967	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-55.4	138.2	-177.5	-58.9	175	102.9	0	0	113.8
933	G	31.2	Very low	33.4	Very low	74 Å²	74	139.8 Å²	139.8	76%	0.763	80%	0.799	S	S	*	*			trans	-170.2	70.1	-175.5	0	0	0	0	0	118.2
934	F	28	Very low	32.7	Very low	203 Å²	203	140 Å²	140	89%	0.89	81%	0.807	S	S	*	*			trans	76.4	166.9	158.3	-115.8	-97	0	0	0	120.2
935	E	36.8	Very low	32.3	Very low	175 Å²	175	136.8 Å²	136.8	82%	0.818	80%	0.803	S	S	*	*			trans	-95.7	148.1	-162.8	-53.4	170.2	108.4	0	0	115.1
936	G	33.7	Very low	31.6	Very low	67 Å²	67	137.7 Å²	137.7	69%	0.691	81%	0.805	S	S	*	*			trans	121.1	127.3	136.3	0	0	0	0	0	118.7
937	F	28.9	Very low	31.4	Very low	217 Å²	217	137.3 Å²	137.3	95%	0.952	81%	0.806	S	S	*	*			trans	56.5	103.5	164.2	-70.3	-85.8	0	0	0	117.7
938	G	34.8	Very low	31.3	Very low	85 Å²	85	139.9 Å²	139.9	88%	0.876	80%	0.8	S	S	*	*			trans	-90.5	173.5	-175.1	0	0	0	0	0	116.7
939	S	26.8	Very low	31.1	Very low	107 Å²	107	139.1 Å²	139.1	75%	0.748	79%	0.789	S	S	*	*			trans	-139	160.7	158.2	46.2	0	0	0	0	108.2
940	I	40	Very low	30.8	Very low	168 Å²	168	141.6 Å²	141.6	86%	0.862	78%	0.781	S	S	*	*			trans	-73.1	127.8	171.6	-62.7	166.1	0	0	0	108
941	E	28	Very low	30.6	Very low	176 Å²	176	136.4 Å²	136.4	82%	0.822	77%	0.765	S	S	*	*			trans	-147	124	170.7	-158.4	157.9	-136.2	0	0	109.1
942	E	29	Very low	30.4	Very low	186 Å²	186	135.6 Å²	135.6	87%	0.869	75%	0.746	S	S	*	*			trans	-80.8	119.8	-170.8	-67.6	174	122.3	0	0	111.2	A944	E942-A944 PolarHBondContact O-N 3.11Å
943	S	30.3	Very low	30.1	Very low	121 Å²	121	133.3 Å²	133.3	85%	0.846	73%	0.733	S	S	*	*			trans	-80.9	99.8	173.7	-66.8	0	0	0	0	110.2	S945	S943-S945 PolarHBondContact O-N 2.86Å; S943-S945 VanDerWaalsContact O-N 3.14Å
944	A	25.7	Very low	29.9	Very low	98 Å²	98	137 Å²	137	81%	0.81	73%	0.734	S	S	*	*			trans	-76.4	96.5	-179.9	0	0	0	0	0	112	E942 K946	E942-A944 PolarHBondContact O-N 3.11Å; A944-K946 PolarHBondContact O-N 3.46Å
945	S	31.3	Very low	29.8	Very low	86 Å²	86	134.1 Å²	134.1	60%	0.601	72%	0.723	S	S	*	*			trans	-57.6	117.5	170.7	-62.3	0	0	0	0	110.7	S943 I947	S943-S945 PolarHBondContact O-N 2.86Å; S943-S945 VanDerWaalsContact O-N 3.14Å; S945-I947 PolarHBondContact O-N 2.88Å
946	K	26	Very low	29.5	Very low	188 Å²	188	131.8 Å²	131.8	82%	0.817	72%	0.723	S	S	*	*			trans	-84.2	80.4	-178.2	-167.8	-176.8	179.6	-174.3	0	110.8	A944 I948	A944-K946 PolarHBondContact O-N 3.46Å; K946-I948 PolarHBondContact O-N 3.45Å
947	I	30.5	Very low	29.1	Very low	127 Å²	127	133.3 Å²	133.3	65%	0.651	72%	0.723	S	S	*	*			trans	-56.2	122.4	174.5	-56.2	173.2	0	0	0	109.3	S945 E949	S945-I947 PolarHBondContact O-N 2.88Å; I947-E949 HydrophobicContact CG2-CB 4.25Å
948	I	29.7	Very low	29.1	Very low	130 Å²	130	130.8 Å²	130.8	67%	0.667	72%	0.715	S	S	*	*			trans	-103.6	92.6	169.3	-60.1	179.7	0	0	0	106.8	K946	K946-I948 PolarHBondContact O-N 3.45Å
949	E	28.3	Very low	28.7	Very low	93 Å²	93	135.9 Å²	135.9	44%	0.435	71%	0.713	S	S	.	*			trans	-84.5	128.2	-176.7	-165.6	161.4	-148.8	0	0	110.6	R921 I947 H951	R921-E949 VanDerWaalsContact CD-OE1 3.3Å; R921-E949 WeakPolarHBondContact CD-OE1 3.49Å; R921-E949 IonicContact CZ-OE1 2.73Å; R921-E949 IonicContact NE-OE1 3.83Å; R921-E949 IonicContact NH1-OE1 2.64Å; R921-E949 PolarHBondContact NH1-OE1 3.31Å; I947-E949 HydrophobicContact CG2-CB 4.25Å; E949-H951 IonicContact OE1-CE1 2.67Å; E949-H951 IonicContact OE1-NE2 3.43Å
950	K	29.1	Very low	28.6	Very low	151 Å²	151	136.1 Å²	136.1	66%	0.657	71%	0.714	S	S	*	*	B	Isolated β-bridge	trans	-123.2	133.6	172.7	-73.8	-175.5	176.7	-178.7	0	109
951	H	27.7	Very low	27.8	Very low	106 Å²	106	137.3 Å²	137.3	49%	0.491	71%	0.713	S	S	.	*			trans	-112.7	132	176	-63.4	-65.3	0	0	0	110.4	E949	E949-H951 IonicContact OE1-CE1 2.67Å; E949-H951 IonicContact OE1-NE2 3.43Å
952	I	27.5	Very low	27.6	Very low	83 Å²	83	135.4 Å²	135.4	43%	0.426	71%	0.714	S	S	.	*			trans	-100.8	128.9	169.9	-50.8	174.2	0	0	0	107.3	E892	E892-I952 HydrophobicContact CG-CD1 4.11Å
953	K	28.4	Very low	27.3	Very low	159 Å²	159	135.6 Å²	135.6	69%	0.691	71%	0.712	S	S	*	*			trans	-107.5	127.2	171.4	-170.9	-165.2	179.9	-159.3	0	108.8	E955	K953-E955 HydrophobicContact CD-CG 4.43Å; K953-E955 IonicContact NZ-OE1 3.38Å; K953-E955 PolarHBondContact NZ-OE1 2.82Å
954	L	27.5	Very low	27	Very low	151 Å²	151	138.2 Å²	138.2	79%	0.791	71%	0.711	S	S	*	*			trans	-110.7	139.5	167.2	-68.4	171.8	0	0	0	108.5
955	E	26.8	Very low	26.9	Very low	142 Å²	142	142 Å²	142	66%	0.664	71%	0.714	S	S	*	*			trans	-103.5	158.2	-176.5	-60.3	-163.5	137.8	0	0	111.9	K953 S957	K953-E955 HydrophobicContact CD-CG 4.43Å; K953-E955 IonicContact NZ-OE1 3.38Å; K953-E955 PolarHBondContact NZ-OE1 2.82Å; E955-S957 PolarHBondContact O-N 2.88Å
956	P	29.6	Very low	26.5	Very low	126 Å²	126	146.9 Å²	146.9	82%	0.818	73%	0.727	S	S	*	*			trans	-68.3	131.1	-172.5	-19.1	32.9	0	0	0	112.7	E958	P956-E958 PolarHBondContact O-N 3.11Å
957	S	25.8	Very low	26.5	Very low	100 Å²	100	147.3 Å²	147.3	70%	0.699	73%	0.733	S	S	*	*			trans	-82.6	102.4	175.8	63.8	0	0	0	0	111.8	E955 K959	E955-S957 PolarHBondContact O-N 2.88Å; S957-K959 PolarHBondContact O-N 3.09Å
958	E	27.9	Very low	26.4	Very low	164 Å²	164	150.8 Å²	150.8	77%	0.766	75%	0.746	S	S	*	*			trans	-64.8	103.1	165.5	-75.5	-167.7	168.3	0	0	109.9	K86 P956 S960	K86-E958 IonicContact NZ-OE1 2.93Å; P956-E958 PolarHBondContact O-N 3.11Å; E958-S960 PolarHBondContact O-N 3.41Å
959	K	27.3	Very low	26.2	Very low	192 Å²	192	148.5 Å²	148.5	84%	0.835	76%	0.755	S	S	*	*			trans	-74.3	84.9	176.7	-73.6	-179.3	180	171.2	0	111.3	S957	S957-K959 PolarHBondContact O-N 3.09Å
960	S	24.8	Very low	26.1	Very low	111 Å²	111	150.8 Å²	150.8	78%	0.776	77%	0.77	S	S	*	*			trans	-82.3	133.8	164.7	52.9	0	0	0	0	110.8	E958	E958-S960 PolarHBondContact O-N 3.41Å
961	F	23.3	Very low	26.1	Very low	193 Å²	193	151.7 Å²	151.7	85%	0.846	78%	0.776	S	S	*	*			trans	-107.2	106.3	-172.8	-136.5	-74.3	0	0	0	110.3
962	T	23.6	Very low	26.1	Very low	137 Å²	137	150.2 Å²	150.2	84%	0.84	79%	0.789	S	S	*	*			trans	-138.5	157.6	169.4	49.6	0	0	0	0	111.3
963	F	22.3	Very low	26.1	Very low	190 Å²	190	156 Å²	156	83%	0.833	81%	0.814	S	S	*	*			trans	-114.5	123.9	-166.1	-132.4	-90.4	0	0	0	109.6
964	Q	23	Very low	26.1	Very low	175 Å²	175	157.6 Å²	157.6	82%	0.818	83%	0.825	S	S	*	*				168.2	129.1	124	-93.4	177.3	3.6	0	0	115.3
965	M	24.3	Very low	26	Very low	179 Å²	179	156.1 Å²	156.1	88%	0.882	83%	0.827	S	S	*	*			trans	60.4	122.6	136.5	-140.9	163.1	77.9	0	0	121.2
966	E	23.9	Very low	26.1	Very low	187 Å²	187	155 Å²	155	87%	0.874	83%	0.834	S	S	*	*			trans	-73.2	151.2	167.5	-57.5	165.1	99.6	0	0	112.5
967	E	25.1	Very low	25.9	Very low	198 Å²	198	158.5 Å²	158.5	93%	0.925	84%	0.84	S	S	*	*			trans	-147.9	156.8	137.7	-145.5	169.4	-150.3	0	0	109.9
968	Q	28	Very low	26	Very low	200 Å²	200	162.4 Å²	162.4	94%	0.935	85%	0.847	S	S	*	*			trans	-88.3	149.9	-159.8	-57.4	175.2	-66.4	0	0	114.6
969	G	26.1	Very low	25.9	Very low	82 Å²	82	160.8 Å²	160.8	85%	0.845	85%	0.854	S	S	*	*			trans	-168.6	105.9	168.6	0	0	0	0	0	113
970	D	26	Very low	25.8	Very low	140 Å²	140	160.1 Å²	160.1	75%	0.749	85%	0.854	S	S	*	*			trans	-94.3	166.9	-175.7	-174.6	17.9	0	0	0	112.7
971	H	28.9	Very low	25.8	Very low	171 Å²	171	160.8 Å²	160.8	79%	0.792	85%	0.848	S	S	*	*			trans	94.4	119.5	169.7	-51.8	-20.8	0	0	0	117.2
972	G	27.6	Very low	25.9	Very low	75 Å²	75	161.5 Å²	161.5	77%	0.773	85%	0.851	S	S	*	*			trans	-117.1	-176.3	162.4	0	0	0	0	0	111.2
973	E	27.5	Very low	26	Very low	203 Å²	203	162.8 Å²	162.8	95%	0.949	85%	0.847	S	S	*	*			trans	-156.8	152.8	164.5	-128	172	-161.8	0	0	109.5
974	E	28	Very low	26.1	Very low	194 Å²	194	160.9 Å²	160.9	91%	0.907	85%	0.846	S	S	*	*			trans	-89.9	151.3	-173.7	-54.4	170.9	121.4	0	0	112.6
975	S	26.5	Very low	26.4	Very low	120 Å²	120	157.7 Å²	157.7	84%	0.839	84%	0.841	S	S	*	*			trans	-160.3	116.7	148.3	65	0	0	0	0	112.1
976	S	28.9	Very low	26.5	Very low	117 Å²	117	157.8 Å²	157.8	82%	0.818	84%	0.839	S	S	*	*			trans	-70.8	154.8	169.5	-44.5	0	0	0	0	112.1
977	E	26	Very low	26.6	Very low	201 Å²	201	158.1 Å²	158.1	94%	0.939	84%	0.837	S	S	*	*			trans	-151.5	153.9	136.5	-124.1	170.8	-148.6	0	0	111.4
978	Q	26.5	Very low	26.7	Very low	182 Å²	182	157.3 Å²	157.3	85%	0.85	83%	0.831	S	S	*	*			trans	-99	153.4	-168.5	-63	170.9	-41.8	0	0	112.1
979	S	25.8	Very low	26.6	Very low	130 Å²	130	153.1 Å²	153.1	91%	0.909	82%	0.824	S	S	*	*			trans	-152.3	143.2	154.6	-81	0	0	0	0	110.3
980	Q	25.8	Very low	26.6	Very low	177 Å²	177	154.2 Å²	154.2	83%	0.827	81%	0.814	S	S	*	*			trans	-113.5	156.4	-169.3	-63	178.8	-61.3	0	0	112.5
981	L	24.4	Very low	26.7	Very low	125 Å²	125	154.2 Å²	154.2	65%	0.654	81%	0.81	S	S	*	*			trans	58.4	111.7	150.9	-78.2	158.7	0	0	0	118.3
982	F	24.9	Very low	26.7	Very low	208 Å²	208	151.3 Å²	151.3	91%	0.912	80%	0.795	S	S	*	*				-152.2	121.9	94.7	-109.8	-76	0	0	0	110.7
983	E	27.3	Very low	26.8	Very low	164 Å²	164	157.4 Å²	157.4	77%	0.766	80%	0.795	S	S	*	*			trans	-83	147.4	172.9	-66.8	174.7	114.7	0	0	111.2
984	N	23.5	Very low	26.9	Very low	151 Å²	151	150.6 Å²	150.6	81%	0.807	77%	0.766	S	S	*	*			trans	-141.2	145	149.9	-105.1	-48.8	0	0	0	108.6	E986	N984-E986 PolarHBondContact O-N 2.87Å
985	P	30.2	Very low	27	Very low	108 Å²	108	145.7 Å²	145.7	70%	0.701	76%	0.759	S	S	*	*			trans	-89.1	99.6	-161.2	33.2	-35.2	0	0	0	113.1
986	E	24.9	Very low	27.3	Very low	180 Å²	180	142.9 Å²	142.9	84%	0.841	74%	0.737	S	S	*	*			trans	-72.9	133.9	159.7	-64.7	-159.7	143.5	0	0	110	N984	N984-E986 PolarHBondContact O-N 2.87Å
987	K	26.8	Very low	27.4	Very low	194 Å²	194	141.9 Å²	141.9	84%	0.843	73%	0.726	S	S	*	*			trans	-98.5	110.7	-175.4	-67	170.9	-174.2	164.6	0	108.9	S989	K987-S989 PolarHBondContact O-N 2.89Å
988	F	26.5	Very low	27.7	Very low	182 Å²	182	140.4 Å²	140.4	80%	0.798	71%	0.713	S	S	*	*			trans	-59.8	132.1	172.5	-63.4	-79.7	0	0	0	110.9
989	S	25.8	Very low	28	Very low	112 Å²	112	133.6 Å²	133.6	78%	0.783	68%	0.682	S	S	*	*			trans	-70	124.1	162.2	48.6	0	0	0	0	108.8	K987 E991	K987-S989 PolarHBondContact O-N 2.89Å; S989-E991 PolarHBondContact O-N 3.01Å
990	T	27.5	Very low	28.2	Very low	104 Å²	104	135.9 Å²	135.9	64%	0.638	68%	0.679	S	S	*	*			trans	-68.8	112.2	168.3	50.4	0	0	0	0	108.9	K992	T990-K992 PolarHBondContact O-N 3.42Å
991	E	27.3	Very low	28.2	Very low	140 Å²	140	135.6 Å²	135.6	65%	0.654	67%	0.67	S	S	*	*			trans	-69	95.3	173.7	-173.2	-171.9	144.6	0	0	109.5	S989 R993	S989-E991 PolarHBondContact O-N 3.01Å; E991-R993 IonicContact OE1-CZ 2.65Å; E991-R993 IonicContact OE1-NE 2.65Å; E991-R993 PolarHBondContact OE1-NE 3.33Å; E991-R993 IonicContact OE1-NH2 2.77Å; E991-R993 PolarHBondContact OE1-NH2 3.4Å
992	K	29.9	Very low	28.7	Very low	111 Å²	111	135.1 Å²	135.1	48%	0.483	67%	0.674	S	S	.	*			trans	-82.7	115.3	166.2	-69.4	-158.9	-144.7	75.1	0	109.7	E787 T990 V994	E787-K992 VanDerWaalsContact CD-NZ 3.26Å; E787-K992 WeakPolarHBondContact OE1-CG 3.28Å; E787-K992 IonicContact OE1-NZ 2.68Å; E787-K992 PolarHBondContact OE1-NZ 3.44Å; E787-K992 IonicContact OE2-NZ 3.94Å; E787-K992 PolarHBondContact OE2-NZ 2.8Å; T990-K992 PolarHBondContact O-N 3.42Å; K992-V994 HydrophobicContact CB-CG2 4.3Å
993	R	29.1	Very low	29	Very low	203 Å²	203	137 Å²	137	77%	0.766	69%	0.692	S	S	*	*			trans	-82.1	118.5	161.2	-62.5	-172.7	-177.1	-170.1	0.2	108.4	E991	E991-R993 IonicContact OE1-CZ 2.65Å; E991-R993 IonicContact OE1-NE 2.65Å; E991-R993 PolarHBondContact OE1-NE 3.33Å; E991-R993 IonicContact OE1-NH2 2.77Å; E991-R993 PolarHBondContact OE1-NH2 3.4Å
994	V	28.6	Very low	29.1	Very low	59 Å²	59	135.6 Å²	135.6	36%	0.358	69%	0.688	S	S	.	*			trans	-118.5	122.2	176	179.7	0	0	0	0	107	K992 T996	K992-V994 HydrophobicContact CB-CG2 4.3Å; V994-T996 PolarHBondContact O-N 3.14Å
995	A	31.4	Very low	29.4	Very low	91 Å²	91	134.8 Å²	134.8	75%	0.752	68%	0.682	S	S	*	*			trans	-87.5	95.7	175.2	0	0	0	0	0	109.6	V997	A995-V997 PolarHBondContact O-N 3.06Å
996	T	31.4	Very low	29.4	Very low	61 Å²	61	136.3 Å²	136.3	37%	0.374	68%	0.681	S	S	.	*			trans	-85	92.3	179	-41.8	0	0	0	0	110.6	E791 V994 Y998	E791-T996 VanDerWaalsContact OE1-CB 3.29Å; E791-T996 WeakPolarHBondContact OE1-CB 3.49Å; E791-T996 PolarHBondContact OE1-OG1 3.13Å; V994-T996 PolarHBondContact O-N 3.14Å; T996-Y998 HydrophobicContact CG2-CD2 4.16Å; T996-Y998 HydrophobicContact CG2-CE1 4.27Å; T996-Y998 HydrophobicContact CG2-CE2 3.52Å; T996-Y998 WeakPolarHBondContact O-CD2 3.48Å; T996-Y998 PolarHBondContact O-N 3.26Å
997	V	32.4	Very low	29.6	Very low	96 Å²	96	133.7 Å²	133.7	58%	0.582	67%	0.672	S	S	*	*			trans	-80.5	107.2	176	-171.4	0	0	0	0	110	A995 L999	A995-V997 PolarHBondContact O-N 3.06Å; V997-L999 HydrophobicContact CG1-CD2 4.06Å; V997-L999 HydrophobicContact CG1-CG 4.06Å
998	Y	32.2	Very low	29.8	Very low	170 Å²	170	129.9 Å²	129.9	67%	0.667	66%	0.661	S	S	*	*			trans	-81.5	119.4	173.5	-68.6	-86	0	0	0	110.4	T996	T996-Y998 HydrophobicContact CG2-CD2 4.16Å; T996-Y998 HydrophobicContact CG2-CE1 4.27Å; T996-Y998 HydrophobicContact CG2-CE2 3.52Å; T996-Y998 WeakPolarHBondContact O-CD2 3.48Å; T996-Y998 PolarHBondContact O-N 3.26Å
999	L	33.3	Very low	30	Very low	39 Å²	39	126.5 Å²	126.5	20%	0.204	65%	0.652	C	S	.	*			trans	-115.3	90	-178.2	-66	164.3	0	0	0	108.8	Q801 L805 V997	Q801-L999 HydrophobicContact CB-CD2 4.01Å; Q801-L999 HydrophobicContact CG-CD2 4.33Å; L805-L999 HydrophobicContact CD1-CD1 4.14Å; L805-L999 HydrophobicContact CD1-CD2 4.23Å; L805-L999 HydrophobicContact CD2-CD1 3.86Å; L805-L999 HydrophobicContact CG-CD1 3.91Å; L805-L999 HydrophobicContact CG-CD2 4.42Å; V997-L999 HydrophobicContact CG1-CD2 4.06Å; V997-L999 HydrophobicContact CG1-CG 4.06Å
1000	E	28.2	Very low	30.3	Very low	179 Å²	179	127.5 Å²	127.5	84%	0.836	64%	0.642	S	S	*	*	P	Polyproline II helix	trans	-74.2	126.9	173	-67.7	-160.9	133.8	0	0	110
1001	R	27.5	Very low	30.5	Very low	171 Å²	171	129.3 Å²	129.3	65%	0.645	64%	0.643	S	S	*	*	P	Polyproline II helix	trans	-81.9	136.5	172.8	-78.2	179.4	168.1	166.9	-5.7	110.5	N863	N863-R1001 PolarHBondContact O-NH1 2.91Å
1002	P	34.4	Very low	30.8	Very low	114 Å²	114	128.4 Å²	128.4	74%	0.74	64%	0.642	S	S	*	*	P	Polyproline II helix	trans	-56	148.3	154.4	-19.8	32.7	0	0	0	110.8
1003	L	31.5	Very low	30.9	Very low	247 Å²	247	130 Å²	130	100%	1.293	66%	0.656	S	S	*	*			trans	-106.1	0	-179.4	-97.8	167.3	0	0	0	112.1

Retrieved 1,003 of 1,003 residues in 649.5 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).