A0A3Q0KKU6_SCHMA Loading...

Hepatoma derived growth factor, putative

AlphaFold DB , UniProt , Accession A0A3Q0KKU6, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,318 aa.

						>A0A3Q0KKU6_SCHMA|A0A3Q0KKU6
MAYSPGDKIFAKVKGHPHWPSRINLLPEDVPIPKGKYPIFFYGTHEVYFLAPKDIFPYEKFKHKYGVPRNKAVFQAGLREIEENPDVLLYKKDPEAETFLAQFYSFKRGCKDTGQNSVLVSPTTEIQSQKRSKSTSAETEHGRPAKRPHTESRKSSGSVNHHSYSAQRDKRSSAIKCVKKSPNTTNSPVKSSISSADVVESDGFVPVDSQRVSALRLRIRKHSSVFMSPDSVSPSSPSTTGSTATLEARHGFEQSHTSSNDPLKIIIRQNTAISPLVSIEEKTKSRPIVSVTPTRSTASENHTNQSDTHRTRSTAVVTPLLRNVLPELSDDSSDSVVSTNDANLKTNNTDNKEKQSILEEEAAKNNQDSNRDTYRTDSIRLRRRSAKQGRYSTEFIIFTNVKNSRKRSPSVSPKLSSRSWEKSPMELTSKSVGVRTPSVVSSNSTVVVQSNTMSTFSDRNIKDKEQQLKDLDAEERLLLIDRSIKSSLIQGHEDIATCVDRLEFLDKMTISLPIMARCWTVVETIRKCRRYKRSLEVKIAAQKVFNKFLQLYATADKNELDLAHAELIKHQQRHIKKHFPGFNKGDSLEETASMSANSIPPYMGPKSMADLFQLTMRSTKSEVPDVKKTCHEAGKSNSEILQSPSSVDITPNTSQALERFELSTVNMDTLTCVAVKSPTQHVVTTVCESESHSSLHSPLKVGYQTDVSVQDIPLPEETPTQFISPKETTMNSTDLIAIGKDICEMPTEEEDVEEEFELLDVYEEPEEPDDAAIIQQSDCKFPIPQFSEPDNFVKTKSISLSTTPEQAGFTVTPMSDINCGSSATYMGAYHSHPVITNKSLYPYPIFPNLQMQNPYRNHGNLLTDYSSPSHSHLRQNVDATPPQSSSRAYIPHSLHPSEDPPPPYRPYIPSRCDREQTQELMTSLESSTKLPKELSQSSNITNNGTIQELTSTTKQSNLNPDRRKVCSASNKNNISREIRTPPHRGRSPHALPHPLEHYQRYLNSALSSEDETSKNNTSKQFTDRPLLSHDTLPNDQSSVNDSKTDKVKTHISPVNDNLHNEMPFVSPSAEDLDTRIARLYDLAMRKNNITTSNTSVDTSNENKSQKPTGNPITSPPPPPPPLPTSQRILFTHRPQNPIHSNVSKSLTPLSSSQQELRLSSHKINSNNRNLENNTGHRGPIDRSNQISSSSLHEQIRYLPSGSHPPGPDNIVINSYISSEQQTRNIPISESALGFSGISSDSIHPATCSYPRRPLNNQPQSARHYPMNPRHNYQTPPTAHPHFQHSNSNRMKLNNDPLHSGRRHSNRDDDRDIYSMLGV
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	61.7	Low	90.5	Very high	177 Å²	177	54.7 Å²	54.7	87%	0.872	33%	0.332	S	S	*	.				0	101.6	0	-57.2	-169.9	77.8	0	0	108.3
2	A	83.9	Confident	91.1	Very high	86 Å²	86	55.5 Å²	55.5	71%	0.711	33%	0.327	S	S	*	.			trans	-73.4	165.2	153.7	0	0	0	0	0	108.3
3	Y	90.5	Very high	91.4	Very high	37 Å²	37	52.9 Å²	52.9	15%	0.145	31%	0.312	C	S	.	.			trans	-116.1	146.1	172.1	-62.1	-87.3	0	0	0	109.9	D7 I9 I23 Y37 I55 F56 P57	Y3-D7 WeakPolarHBondContact CA-OD2 3.5Å; Y3-D7 VanDerWaalsContact CB-OD2 3.32Å; Y3-D7 WeakPolarHBondContact CB-OD2 3.11Å; Y3-D7 HydrophobicContact CD1-CB 4.47Å; Y3-I9 HydrophobicContact CD1-CG2 4.08Å; Y3-I9 HydrophobicContact CE1-CG2 3.88Å; Y3-I23 HydrophobicContact CD1-CD1 4.35Å; Y3-I23 HydrophobicContact CD2-CD1 4.4Å; Y3-I23 HydrophobicContact CG-CD1 3.83Å; Y3-Y37 AromaticContact CD2-CE2 3.88Å; Y3-Y37 HydrophobicContact CD2-CE2 3.88Å; Y3-Y37 PolarHBondContact N-OH 2.96Å; Y3-Y37 WeakPolarHBondContact O-CE1 3.38Å; Y3-I55 HydrophobicContact CD2-CG2 4.33Å; Y3-I55 HydrophobicContact CE1-CG2 4.11Å; Y3-I55 HydrophobicContact CE2-CB 4.28Å; Y3-I55 HydrophobicContact CE2-CG2 3.77Å; Y3-I55 PolarHBondContact OH-O 2.51Å; Y3-I55 VanDerWaalsContact OH-O 3.07Å; Y3-F56 WeakPolarHBondContact OH-CA 3.34Å; Y3-P57 HydrophobicContact CE1-CB 4.47Å; Y3-P57 HydrophobicContact CE1-CG 3.92Å; Y3-P57 VanDerWaalsContact OH-CD 3.31Å; Y3-P57 WeakPolarHBondContact OH-CD 3.44Å
4	S	91.3	Very high	91.7	Very high	70 Å²	70	64 Å²	64	49%	0.49	36%	0.355	S	S	.	.			trans	-98.8	156.8	177	-68.6	0	0	0	0	111.9	G6 D7	S4-G6 PolarHBondContact O-N 2.65Å; S4-D7 WeakPolarHBondContact CB-OD1 3.08Å; S4-D7 VanDerWaalsContact N-CG 3.29Å; S4-D7 PolarHBondContact N-OD2 2.92Å; S4-D7 WeakPolarHBondContact O-CB 3.28Å; S4-D7 PolarHBondContact O-N 2.92Å
5	P	91.7	Very high	91.8	Very high	83 Å²	83	62.4 Å²	62.4	54%	0.539	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	130.5	164	-20.7	34.5	0	0	0	110.2	L25	P5-L25 HydrophobicContact CB-CD1 3.44Å; P5-L25 VanDerWaalsContact CB-CD1 3.44Å; P5-L25 HydrophobicContact CB-CG 3.64Å
6	G	92.9	Very high	91.8	Very high	32 Å²	32	63.6 Å²	63.6	33%	0.33	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	107.6	-29.3	-170.9	0	0	0	0	0	113.5	S4 K8 I23	S4-G6 PolarHBondContact O-N 2.65Å; G6-K8 PolarHBondContact O-N 3.44Å; G6-I23 PolarHBondContact N-O 3.22Å
7	D	95.7	Very high	92	Very high	54 Å²	54	61.8 Å²	61.8	29%	0.289	35%	0.351	S	S	.	.			trans	-53.2	126.6	-172.1	-75.4	10.6	0	0	0	113.6	Y3 S4 I9 R22 I23	Y3-D7 WeakPolarHBondContact CA-OD2 3.5Å; Y3-D7 VanDerWaalsContact CB-OD2 3.32Å; Y3-D7 WeakPolarHBondContact CB-OD2 3.11Å; Y3-D7 HydrophobicContact CD1-CB 4.47Å; S4-D7 WeakPolarHBondContact CB-OD1 3.08Å; S4-D7 VanDerWaalsContact N-CG 3.29Å; S4-D7 PolarHBondContact N-OD2 2.92Å; S4-D7 WeakPolarHBondContact O-CB 3.28Å; S4-D7 PolarHBondContact O-N 2.92Å; D7-I9 HydrophobicContact CB-CG2 4.43Å; D7-R22 CarbonylContact O-C 3.59Å; D7-R22 WeakPolarHBondContact O-CA 3.03Å; D7-I23 HydrophobicContact CB-CD1 4.45Å; D7-I23 PolarHBondContact O-N 2.93Å
8	K	96.4	Very high	92.2	Very high	63 Å²	63	60.1 Å²	60.1	27%	0.274	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	126.5	171.3	-62.5	-171.4	-175.2	-162	0	109.9	G6 Y58 I81	G6-K8 PolarHBondContact O-N 3.44Å; K8-Y58 HydrophobicContact CB-CD1 4.36Å; K8-Y58 HydrophobicContact CB-CG 4.21Å; K8-Y58 VanDerWaalsContact O-CB 3.29Å; K8-Y58 WeakPolarHBondContact O-CB 3.28Å; K8-Y58 PolarHBondContact O-N 2.97Å; K8-I81 HydrophobicContact CB-CD1 4.2Å; K8-I81 HydrophobicContact CB-CG1 4.47Å; K8-I81 HydrophobicContact CD-CG1 4.09Å; K8-I81 HydrophobicContact CG-CD1 4.49Å; K8-I81 HydrophobicContact CG-CG1 4.26Å; K8-I81 PolarHBondContact NZ-O 3.28Å
9	I	97.1	Very high	92.5	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	164.8	-174.4	53.7	162.9	0	0	0	112.7	Y3 D7 A11 S21 I23 I39 I55 F56	Y3-I9 HydrophobicContact CD1-CG2 4.08Å; Y3-I9 HydrophobicContact CE1-CG2 3.88Å; D7-I9 HydrophobicContact CB-CG2 4.43Å; I9-A11 HydrophobicContact CD1-CB 4.41Å; I9-S21 CarbonylContact C-O 3.21Å; I9-S21 VanDerWaalsContact CG1-O 3.24Å; I9-S21 WeakPolarHBondContact CG1-O 3.15Å; I9-S21 PolarHBondContact N-O 2.93Å; I9-S21 PolarHBondContact O-N 3.48Å; I9-I23 HydrophobicContact CD1-CG1 3.8Å; I9-I23 HydrophobicContact CG1-CG1 4.48Å; I9-I39 HydrophobicContact CD1-CD1 3.77Å; I9-I39 HydrophobicContact CD1-CG2 4.14Å; I9-I55 HydrophobicContact CB-CG2 3.95Å; I9-I55 HydrophobicContact CD1-CG1 4.5Å; I9-I55 HydrophobicContact CD1-CG2 3.66Å; I9-I55 HydrophobicContact CG1-CG2 4.4Å; I9-I55 HydrophobicContact CG2-CG2 3.69Å; I9-F56 CarbonylContact C-O 3.51Å; I9-F56 WeakPolarHBondContact CA-O 3.5Å; I9-F56 VanDerWaalsContact CB-O 3.31Å; I9-F56 WeakPolarHBondContact CB-O 3.24Å
10	F	97.2	Very high	92.7	Very high	0 Å²	0	54.9 Å²	54.9	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	123.7	153.5	-75.1	-80.9	0	0	0	109.7	H18 W19 P20 F56 Y58 F61 K62 Y65 L78	F10-H18 HydrophobicContact CB-CB 4.29Å; F10-H18 HydrophobicContact CD1-CB 4.43Å; F10-W19 CarbonylContact C-O 3.3Å; F10-W19 VanDerWaalsContact CA-O 3.31Å; F10-W19 WeakPolarHBondContact CA-O 3.4Å; F10-P20 HydrophobicContact CE1-CB 4.39Å; F10-F56 HydrophobicContact CB-CB 4.4Å; F10-F56 PolarHBondContact N-O 3.45Å; F10-F56 PolarHBondContact O-N 3.44Å; F10-Y58 AromaticContact CD2-CD2 3.93Å; F10-Y58 HydrophobicContact CD2-CD2 3.93Å; F10-Y58 HydrophobicContact CE1-CD2 4.31Å; F10-Y58 HydrophobicContact CE1-CE2 4.35Å; F10-Y58 AromaticContact CE2-CD2 3.28Å; F10-Y58 HydrophobicContact CE2-CD2 3.28Å; F10-Y58 AromaticContact CE2-CE2 3.76Å; F10-Y58 HydrophobicContact CE2-CE2 3.76Å; F10-Y58 HydrophobicContact CE2-CG 4.05Å; F10-Y58 WeakPolarHBondContact CE2-O 3.46Å; F10-Y58 AromaticContact CZ-CD2 3.51Å; F10-Y58 HydrophobicContact CZ-CD2 3.51Å; F10-Y58 AromaticContact CZ-CE2 3.53Å; F10-Y58 HydrophobicContact CZ-CE2 3.53Å; F10-F61 HydrophobicContact CD2-CB 4.01Å; F10-K62 HydrophobicContact CE2-CB 4.49Å; F10-Y65 HydrophobicContact CB-CD2 3.87Å; F10-Y65 HydrophobicContact CD2-CD2 4.22Å; F10-Y65 AromaticContact CG-CD2 3.98Å; F10-Y65 HydrophobicContact CG-CD2 3.98Å; F10-Y65 HydrophobicContact CG-CG 4.42Å; F10-L78 HydrophobicContact CE1-CD2 4.1Å; F10-L78 HydrophobicContact CZ-CD2 4.22Å
11	A	97.7	Very high	92.9	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	152.7	178.8	0	0	0	0	0	112.5	I9 H18 W19 S21 I39 F41 L50 D54	I9-A11 HydrophobicContact CD1-CB 4.41Å; A11-H18 WeakPolarHBondContact O-CA 3.17Å; A11-W19 PolarHBondContact N-O 2.89Å; A11-W19 PolarHBondContact O-N 3.47Å; A11-S21 WeakPolarHBondContact CB-OG 3.42Å; A11-I39 HydrophobicContact CB-CG2 3.77Å; A11-F41 HydrophobicContact CB-CE1 3.58Å; A11-F41 HydrophobicContact CB-CE2 4.48Å; A11-F41 HydrophobicContact CB-CZ 3.53Å; A11-L50 HydrophobicContact CB-CD1 3.92Å; A11-D54 CarbonylContact C-O 3.38Å
12	K	96.8	Very high	94.6	Very high	64 Å²	64	43.9 Å²	43.9	28%	0.278	25%	0.252	S	S	.	.			trans	-126	81.6	-172.6	-171.3	43.7	164.2	-169.8	0	114	H16 D54 F56	K12-H16 PolarHBondContact NZ-O 3.35Å; K12-D54 HydrophobicContact CB-CB 4.13Å; K12-D54 VanDerWaalsContact CB-O 3.32Å; K12-D54 WeakPolarHBondContact CB-O 3.45Å; K12-D54 PolarHBondContact N-O 2.93Å; K12-F56 HydrophobicContact CB-CE2 4.23Å
13	V	96	Very high	95.2	Very high	22 Å²	22	39.8 Å²	39.8	13%	0.133	22%	0.219	C	C	.	.			trans	-72.7	141.9	171	-172.9	0	0	0	0	110.9	G15 H16 F41 Y48 L50	V13-G15 PolarHBondContact O-N 3.02Å; V13-H16 HydrophobicContact CB-CB 4.27Å; V13-H16 PolarHBondContact O-N 3.48Å; V13-F41 HydrophobicContact CG2-CE1 3.71Å; V13-F41 HydrophobicContact CG2-CE2 4.2Å; V13-F41 HydrophobicContact CG2-CZ 3.36Å; V13-Y48 HydrophobicContact CG2-CD2 4.5Å; V13-L50 HydrophobicContact CG2-CD1 4.4Å
14	K	95	Very high	95.3	Very high	208 Å²	208	38.2 Å²	38.2	90%	0.904	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.2	111.8	-178.8	-177.3	179.4	178.4	179.9	0	111.2
15	G	93.3	Very high	95.4	Very high	40 Å²	40	37.2 Å²	37.2	41%	0.412	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	88.2	2.8	177.4	0	0	0	0	0	115.4	V13 R1302	V13-G15 PolarHBondContact O-N 3.02Å; G15-R1302 VanDerWaalsContact CA-NH2 3.29Å; G15-R1302 VanDerWaalsContact O-CZ 3.31Å; G15-R1302 PolarHBondContact O-NH1 2.82Å; G15-R1302 PolarHBondContact O-NH2 2.77Å
16	H	92.4	Very high	95.3	Very high	82 Å²	82	34.6 Å²	34.6	38%	0.38	18%	0.183	S	C	.	.	S	Bend	trans	-99.9	161.7	169.7	-74.9	-131.5	0	0	0	109.1	K12 V13	K12-H16 PolarHBondContact NZ-O 3.35Å; V13-H16 HydrophobicContact CB-CB 4.27Å; V13-H16 PolarHBondContact O-N 3.48Å
17	P	94.1	Very high	95	Very high	32 Å²	32	33.6 Å²	33.6	21%	0.208	17%	0.171	C	C	.	.			trans	-64.5	175	166.8	31.4	-35.6	0	0	0	110	W19	P17-W19 HydrophobicContact CG-CE3 3.93Å; P17-W19 HydrophobicContact CG-CZ3 4.24Å; P17-W19 PolarHBondContact O-N 2.75Å
18	H	96.4	Very high	94.3	Very high	31 Å²	31	40.7 Å²	40.7	14%	0.144	20%	0.202	C	C	.	.			trans	-62.9	131	160.7	-60.6	114.6	0	0	0	107.9	F10 A11 F56 Y65 F74	F10-H18 HydrophobicContact CB-CB 4.29Å; F10-H18 HydrophobicContact CD1-CB 4.43Å; A11-H18 WeakPolarHBondContact O-CA 3.17Å; H18-F56 AromaticContact CD2-CE2 3.72Å; H18-F56 AromaticContact NE2-CE2 3.64Å; H18-Y65 HydrophobicContact CB-CD1 4.11Å; H18-Y65 HydrophobicContact CB-CD2 3.69Å; H18-Y65 HydrophobicContact CB-CE2 4.28Å; H18-Y65 HydrophobicContact CB-CG 3.61Å; H18-Y65 AromaticContact CD2-CE2 4Å; H18-Y65 AromaticContact CE1-CE1 3.48Å; H18-Y65 VanDerWaalsContact CE1-CE1 3.48Å; H18-Y65 WeakPolarHBondContact CE1-CE1 3.38Å; H18-Y65 AromaticContact CE1-CE2 3.88Å; H18-Y65 AromaticContact CE1-CZ 3.36Å; H18-Y65 AromaticContact CG-CD1 3.88Å; H18-Y65 AromaticContact CG-CD2 3.63Å; H18-Y65 AromaticContact CG-CE1 3.98Å; H18-Y65 AromaticContact CG-CE2 3.71Å; H18-Y65 AromaticContact CG-CG 3.74Å; H18-Y65 AromaticContact CG-CZ 3.9Å; H18-Y65 AromaticContact ND1-CD1 3.26Å; H18-Y65 VanDerWaalsContact ND1-CD1 3.26Å; H18-Y65 WeakPolarHBondContact ND1-CD1 2.81Å; H18-Y65 AromaticContact ND1-CD2 3.77Å; H18-Y65 AromaticContact ND1-CE1 3.1Å; H18-Y65 WeakPolarHBondContact ND1-CE1 3.47Å; H18-Y65 AromaticContact ND1-CE2 3.62Å; H18-Y65 AromaticContact ND1-CG 3.63Å; H18-Y65 AromaticContact ND1-CZ 3.3Å; H18-Y65 VanDerWaalsContact ND1-CZ 3.3Å; H18-F74 WeakPolarHBondContact O-CE2 3.29Å
19	W	96.9	Very high	93.8	Very high	16 Å²	16	42.1 Å²	42.1	6%	0.061	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	139.1	-172.9	-157.9	-85.2	0	0	0	109.8	F10 A11 P17 S21 F41 Y42 T44 K71 V73 F74	F10-W19 CarbonylContact C-O 3.3Å; F10-W19 VanDerWaalsContact CA-O 3.31Å; F10-W19 WeakPolarHBondContact CA-O 3.4Å; A11-W19 PolarHBondContact N-O 2.89Å; A11-W19 PolarHBondContact O-N 3.47Å; P17-W19 HydrophobicContact CG-CE3 3.93Å; P17-W19 HydrophobicContact CG-CZ3 4.24Å; P17-W19 PolarHBondContact O-N 2.75Å; W19-S21 PolarHBondContact O-N 3.32Å; W19-S21 PolarHBondContact O-OG 3.39Å; W19-F41 HydrophobicContact CB-CD1 3.89Å; W19-F41 HydrophobicContact CB-CE1 4.07Å; W19-F41 AromaticContact CD1-CD1 3.71Å; W19-F41 AromaticContact CG-CD1 3.95Å; W19-F41 HydrophobicContact CG-CD1 3.95Å; W19-Y42 PolarHBondContact NE1-O 3.15Å; W19-T44 HydrophobicContact CZ2-CG2 3.86Å; W19-K71 HydrophobicContact CZ3-CD 4.42Å; W19-V73 HydrophobicContact CH2-CB 4.4Å; W19-V73 HydrophobicContact CZ2-CB 4.37Å; W19-V73 HydrophobicContact CZ2-CG1 4.18Å; W19-F74 AromaticContact CD2-CD2 3.88Å; W19-F74 HydrophobicContact CD2-CD2 3.88Å; W19-F74 AromaticContact CE3-CD2 3.67Å; W19-F74 HydrophobicContact CE3-CD2 3.67Å; W19-F74 HydrophobicContact CE3-CE2 4.43Å; W19-F74 HydrophobicContact CH2-CB 3.63Å; W19-F74 HydrophobicContact CH2-CD2 4.19Å; W19-F74 HydrophobicContact CH2-CG 4.43Å; W19-F74 HydrophobicContact CZ2-CB 4.07Å; W19-F74 HydrophobicContact CZ2-CD2 4.38Å; W19-F74 HydrophobicContact CZ3-CB 3.93Å; W19-F74 AromaticContact CZ3-CD2 3.83Å; W19-F74 HydrophobicContact CZ3-CD2 3.83Å; W19-F74 HydrophobicContact CZ3-CG 4.33Å
20	P	97.3	Very high	93.3	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.4	132	174.5	25.5	-34.4	0	0	0	110.2	F10 Y42 G77 L78 I81	F10-P20 HydrophobicContact CE1-CB 4.39Å; P20-Y42 HydrophobicContact CB-CD2 4.5Å; P20-Y42 PolarHBondContact O-N 2.92Å; P20-G77 WeakPolarHBondContact CB-O 3.48Å; P20-G77 VanDerWaalsContact CG-O 3.24Å; P20-G77 WeakPolarHBondContact CG-O 3.18Å; P20-L78 HydrophobicContact CB-CD2 4.11Å; P20-L78 HydrophobicContact CG-CD2 4.04Å; P20-L78 HydrophobicContact CG-CG 4.13Å; P20-I81 HydrophobicContact CB-CB 4.32Å; P20-I81 HydrophobicContact CB-CD1 4Å; P20-I81 HydrophobicContact CB-CG2 3.9Å
21	S	97.5	Very high	92.8	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.9	168	-173.9	-62	0	0	0	0	110.6	I9 A11 W19 F40 F41 Y42 I81	I9-S21 CarbonylContact C-O 3.21Å; I9-S21 VanDerWaalsContact CG1-O 3.24Å; I9-S21 WeakPolarHBondContact CG1-O 3.15Å; I9-S21 PolarHBondContact N-O 2.93Å; I9-S21 PolarHBondContact O-N 3.48Å; A11-S21 WeakPolarHBondContact CB-OG 3.42Å; W19-S21 PolarHBondContact O-N 3.32Å; W19-S21 PolarHBondContact O-OG 3.39Å; S21-F40 CarbonylContact C-O 3.46Å; S21-F40 WeakPolarHBondContact CA-O 3.49Å; S21-F40 WeakPolarHBondContact CB-O 3.15Å; S21-F41 VanDerWaalsContact OG-CD1 3.27Å; S21-F41 WeakPolarHBondContact OG-CD1 3.45Å; S21-Y42 VanDerWaalsContact CA-CD2 3.5Å; S21-I81 WeakPolarHBondContact O-CD1 3.12Å
22	R	96.5	Very high	92.4	Very high	1 Å²	1	51.6 Å²	51.6	0%	0.004	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	161.5	163.4	62.2	168.8	-174.1	-99.5	-8.4	110.7	D7 N24 I39 F40 Y42 P85 V87 L88	D7-R22 CarbonylContact O-C 3.59Å; D7-R22 WeakPolarHBondContact O-CA 3.03Å; R22-N24 PolarHBondContact NE-OD1 3.15Å; R22-N24 PolarHBondContact NH2-OD1 2.89Å; R22-I39 WeakPolarHBondContact O-CA 3.44Å; R22-F40 HydrophobicContact CG-CB 3.98Å; R22-F40 HydrophobicContact CG-CD1 4.23Å; R22-F40 PolarHBondContact N-O 2.89Å; R22-F40 PolarHBondContact O-N 3.21Å; R22-Y42 HydrophobicContact CB-CE2 3.93Å; R22-Y42 WeakPolarHBondContact CB-OH 3.42Å; R22-Y42 WeakPolarHBondContact CD-OH 3.36Å; R22-Y42 HydrophobicContact CG-CE2 4.12Å; R22-P85 PolarHBondContact NH1-O 2.96Å; R22-V87 PolarHBondContact NH1-O 2.77Å; R22-V87 PolarHBondContact NH2-O 2.88Å; R22-L88 VanDerWaalsContact NH2-C 3.26Å; R22-L88 PolarHBondContact NH2-O 2.71Å; R22-L88 VanDerWaalsContact NH2-O 3.08Å
23	I	96.4	Very high	92.2	Very high	1 Å²	1	51.1 Å²	51.1	1%	0.005	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	122	162.3	-59.5	-174.6	0	0	0	107.6	Y3 G6 D7 I9 Y37 P38 I39	Y3-I23 HydrophobicContact CD1-CD1 4.35Å; Y3-I23 HydrophobicContact CD2-CD1 4.4Å; Y3-I23 HydrophobicContact CG-CD1 3.83Å; G6-I23 PolarHBondContact N-O 3.22Å; D7-I23 HydrophobicContact CB-CD1 4.45Å; D7-I23 PolarHBondContact O-N 2.93Å; I9-I23 HydrophobicContact CD1-CG1 3.8Å; I9-I23 HydrophobicContact CG1-CG1 4.48Å; I23-Y37 HydrophobicContact CD1-CD1 3.79Å; I23-Y37 HydrophobicContact CD1-CD2 4.39Å; I23-Y37 HydrophobicContact CD1-CE1 4.29Å; I23-Y37 HydrophobicContact CD1-CG 3.84Å; I23-Y37 HydrophobicContact CG2-CD1 4.1Å; I23-P38 CarbonylContact C-O 3.58Å; I23-P38 VanDerWaalsContact CA-O 3.27Å; I23-P38 WeakPolarHBondContact CA-O 3.31Å; I23-P38 HydrophobicContact CG2-CG 4.37Å; I23-P38 WeakPolarHBondContact CG2-O 3.48Å; I23-I39 HydrophobicContact CG1-CD1 4.09Å
24	N	93.8	Very high	91.9	Very high	3 Å²	3	60.2 Å²	60.2	2%	0.016	31%	0.31	C	S	.	.	P	Polyproline II helix	trans	-89.2	137.4	-170.1	-150.2	49.7	0	0	0	111.6	R22 P38 F40	R22-N24 PolarHBondContact NE-OD1 3.15Å; R22-N24 PolarHBondContact NH2-OD1 2.89Å; N24-P38 PolarHBondContact N-O 2.98Å; N24-P38 VanDerWaalsContact O-CG 3.22Å; N24-P38 WeakPolarHBondContact O-CG 3.48Å; N24-F40 HydrophobicContact CB-CB 4.06Å
25	L	91.9	Very high	91.7	Very high	50 Å²	50	53.3 Å²	53.3	26%	0.262	30%	0.297	S	S	.	.	P	Polyproline II helix	trans	-65.1	143.7	161.6	-80.8	81.1	0	0	0	109	P5 L89 Y90	P5-L25 HydrophobicContact CB-CD1 3.44Å; P5-L25 VanDerWaalsContact CB-CD1 3.44Å; P5-L25 HydrophobicContact CB-CG 3.64Å; L25-L89 HydrophobicContact CB-CD1 4.26Å; L25-L89 HydrophobicContact CD1-CD1 3.83Å; L25-L89 HydrophobicContact CD1-CG 4.46Å; L25-Y90 WeakPolarHBondContact O-CB 3.38Å
26	L	89.7	Confident	91.8	Very high	27 Å²	27	55.8 Å²	55.8	14%	0.141	30%	0.297	C	S	.	.			trans	-133	155.6	174.6	-65.9	179.3	0	0	0	109.3	V30 I32 P38 F49 L100 Y104	L26-V30 HydrophobicContact CB-CB 4.37Å; L26-V30 HydrophobicContact CD1-CB 4.46Å; L26-V30 HydrophobicContact CD1-CG1 4.02Å; L26-I32 HydrophobicContact CD1-CG1 4.27Å; L26-P38 HydrophobicContact CD1-CB 3.58Å; L26-P38 HydrophobicContact CD1-CG 4.08Å; L26-P38 HydrophobicContact CG-CB 4.12Å; L26-P38 HydrophobicContact CG-CG 4.38Å; L26-F49 HydrophobicContact CD1-CE1 4.2Å; L26-F49 HydrophobicContact CD1-CZ 4.43Å; L26-L100 HydrophobicContact CD2-CD1 4.02Å; L26-L100 HydrophobicContact CD2-CD2 3.77Å; L26-Y104 HydrophobicContact CD1-CE2 4.38Å; L26-Y104 HydrophobicContact CD2-CD2 3.84Å; L26-Y104 HydrophobicContact CD2-CE2 3.51Å
27	P	86.1	Confident	91.9	Very high	12 Å²	12	54.6 Å²	54.6	8%	0.078	29%	0.29	C	S	.	.			trans	-56.9	143.8	166.7	-18.6	28.2	0	0	0	111.3	D29 V30 Y90 F106	P27-D29 PolarHBondContact O-N 2.8Å; P27-V30 HydrophobicContact CB-CG2 4.24Å; P27-V30 HydrophobicContact CG-CG2 4.26Å; P27-V30 WeakPolarHBondContact O-CB 3.2Å; P27-V30 PolarHBondContact O-N 2.97Å; P27-Y90 HydrophobicContact CB-CE1 4.26Å; P27-Y90 HydrophobicContact CG-CD1 4.45Å; P27-Y90 HydrophobicContact CG-CD2 4.28Å; P27-Y90 HydrophobicContact CG-CE1 4Å; P27-Y90 HydrophobicContact CG-CE2 3.79Å; P27-F106 HydrophobicContact CB-CB 4.38Å; P27-F106 HydrophobicContact CB-CD2 4.18Å; P27-F106 HydrophobicContact CB-CG 4.21Å; P27-F106 HydrophobicContact CG-CD1 4Å; P27-F106 HydrophobicContact CG-CD2 3.83Å; P27-F106 HydrophobicContact CG-CE1 4.07Å; P27-F106 HydrophobicContact CG-CE2 3.9Å; P27-F106 HydrophobicContact CG-CG 3.88Å; P27-F106 HydrophobicContact CG-CZ 4.03Å
28	E	82.6	Confident	92	Very high	203 Å²	203	53.5 Å²	53.5	95%	0.949	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-26.7	-178.1	-168.1	170.8	-178.4	0	0	113.1	V30	E28-V30 PolarHBondContact O-N 3.23Å; E28-V30 VanDerWaalsContact O-N 3.17Å
29	D	85	Confident	92	Very high	93 Å²	93	52 Å²	52	50%	0.497	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.7	-24.1	169.1	-102.2	22.5	0	0	0	114.4	P27 P31 F106 K107	P27-D29 PolarHBondContact O-N 2.8Å; D29-P31 VanDerWaalsContact O-CD 3.31Å; D29-P31 WeakPolarHBondContact O-CD 3.3Å; D29-F106 HydrophobicContact CB-CB 3.63Å; D29-K107 WeakPolarHBondContact OD2-CB 3.35Å; D29-K107 PolarHBondContact OD2-N 2.67Å
30	V	86.4	Confident	92	Very high	10 Å²	10	51.2 Å²	51.2	6%	0.061	27%	0.272	C	S	.	.	S	Bend	trans	-90.1	110.9	-171.1	-175.9	0	0	0	0	111.1	L26 P27 E28 I32 Y104 F106	L26-V30 HydrophobicContact CB-CB 4.37Å; L26-V30 HydrophobicContact CD1-CB 4.46Å; L26-V30 HydrophobicContact CD1-CG1 4.02Å; P27-V30 HydrophobicContact CB-CG2 4.24Å; P27-V30 HydrophobicContact CG-CG2 4.26Å; P27-V30 WeakPolarHBondContact O-CB 3.2Å; P27-V30 PolarHBondContact O-N 2.97Å; E28-V30 PolarHBondContact O-N 3.23Å; E28-V30 VanDerWaalsContact O-N 3.17Å; V30-I32 PolarHBondContact O-N 2.92Å; V30-Y104 HydrophobicContact CG1-CD1 3.62Å; V30-Y104 HydrophobicContact CG1-CE1 4.3Å; V30-Y104 HydrophobicContact CG1-CG 3.83Å; V30-F106 HydrophobicContact CG2-CB 3.92Å; V30-F106 HydrophobicContact CG2-CD1 4Å; V30-F106 HydrophobicContact CG2-CG 4.3Å
31	P	87.1	Confident	92	Very high	106 Å²	106	51.7 Å²	51.7	69%	0.688	28%	0.275	S	S	*	.			trans	-75	97.8	-171.8	29.8	-35.9	0	0	0	112.7	D29	D29-P31 VanDerWaalsContact O-CD 3.31Å; D29-P31 WeakPolarHBondContact O-CD 3.3Å
32	I	90.4	Very high	92	Very high	82 Å²	82	51.8 Å²	51.8	42%	0.421	28%	0.275	S	S	.	.	P	Polyproline II helix	trans	-65	127.4	175.4	-56.4	175.4	0	0	0	110.2	L26 V30 K34 K36 P38 F49	L26-I32 HydrophobicContact CD1-CG1 4.27Å; V30-I32 PolarHBondContact O-N 2.92Å; I32-K34 PolarHBondContact O-N 3.39Å; I32-K36 WeakPolarHBondContact CG2-O 3.49Å; I32-P38 HydrophobicContact CD1-CG 4.09Å; I32-F49 HydrophobicContact CB-CE1 4.42Å; I32-F49 HydrophobicContact CG1-CE1 4.31Å; I32-F49 HydrophobicContact CG2-CD1 4.28Å; I32-F49 HydrophobicContact CG2-CE1 4.13Å
33	P	91.3	Very high	91.9	Very high	54 Å²	54	52.7 Å²	52.7	35%	0.351	28%	0.284	S	S	.	.	P	Polyproline II helix	trans	-65.6	125.6	177.7	-20.7	32.6	0	0	0	112.2	G35 K36 F49	P33-G35 PolarHBondContact O-N 3.38Å; P33-K36 HydrophobicContact CB-CD 4.21Å; P33-K36 WeakPolarHBondContact O-CB 3.04Å; P33-K36 PolarHBondContact O-N 3.04Å; P33-K36 VanDerWaalsContact O-N 3.11Å; P33-F49 HydrophobicContact CG-CB 4.35Å; P33-F49 HydrophobicContact CG-CD1 4.37Å; P33-F49 HydrophobicContact CG-CD2 4Å; P33-F49 HydrophobicContact CG-CE2 4.33Å; P33-F49 HydrophobicContact CG-CG 4.01Å
34	K	89.1	Confident	91.8	Very high	214 Å²	214	55.1 Å²	55.1	93%	0.93	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.5	132.3	-178.5	-64.4	-165.9	175.5	-164.4	0	112.7	I32	I32-K34 PolarHBondContact O-N 3.39Å
35	G	91.5	Very high	91.9	Very high	62 Å²	62	58 Å²	58	64%	0.639	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	77	20.5	-178.6	0	0	0	0	0	114.4	P33 P52	P33-G35 PolarHBondContact O-N 3.38Å; G35-P52 WeakPolarHBondContact O-CD 3.47Å
36	K	94.6	Very high	92.1	Very high	92 Å²	92	59.5 Å²	59.5	40%	0.4	32%	0.318	S	S	.	.			trans	-135.4	153.8	173.1	-63	-169.9	169.3	-161.2	0	111.6	I32 P33 F49 L50	I32-K36 WeakPolarHBondContact CG2-O 3.49Å; P33-K36 HydrophobicContact CB-CD 4.21Å; P33-K36 WeakPolarHBondContact O-CB 3.04Å; P33-K36 PolarHBondContact O-N 3.04Å; P33-K36 VanDerWaalsContact O-N 3.11Å; K36-F49 HydrophobicContact CB-CB 4.24Å; K36-F49 HydrophobicContact CD-CB 3.71Å; K36-F49 WeakPolarHBondContact CD-O 3.24Å; K36-F49 PolarHBondContact NZ-O 2.9Å; K36-L50 CarbonylContact C-O 3.54Å; K36-L50 WeakPolarHBondContact CA-O 3.4Å; K36-L50 VanDerWaalsContact CB-O 3.25Å; K36-L50 WeakPolarHBondContact CB-O 3.49Å
37	Y	95.7	Very high	92.3	Very high	58 Å²	58	59.1 Å²	59.1	23%	0.227	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	144.3	170.8	-66.8	-80.5	0	0	0	110.6	Y3 I23 F49 L50 P52 I55	Y3-Y37 AromaticContact CD2-CE2 3.88Å; Y3-Y37 HydrophobicContact CD2-CE2 3.88Å; Y3-Y37 PolarHBondContact N-OH 2.96Å; Y3-Y37 WeakPolarHBondContact O-CE1 3.38Å; I23-Y37 HydrophobicContact CD1-CD1 3.79Å; I23-Y37 HydrophobicContact CD1-CD2 4.39Å; I23-Y37 HydrophobicContact CD1-CE1 4.29Å; I23-Y37 HydrophobicContact CD1-CG 3.84Å; I23-Y37 HydrophobicContact CG2-CD1 4.1Å; Y37-F49 WeakPolarHBondContact O-CA 3.49Å; Y37-L50 PolarHBondContact N-O 2.61Å; Y37-L50 PolarHBondContact O-N 3.31Å; Y37-L50 VanDerWaalsContact O-N 3.12Å; Y37-P52 HydrophobicContact CD2-CG 4.39Å; Y37-P52 HydrophobicContact CE2-CB 4.39Å; Y37-P52 HydrophobicContact CE2-CG 3.96Å; Y37-I55 HydrophobicContact CD2-CD1 3.62Å; Y37-I55 HydrophobicContact CG-CD1 4.19Å
38	P	95.8	Very high	92.8	Very high	8 Å²	8	62.8 Å²	62.8	5%	0.052	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	128.5	165.7	31	-33.6	0	0	0	110.1	I23 N24 L26 I32 F49	I23-P38 CarbonylContact C-O 3.58Å; I23-P38 VanDerWaalsContact CA-O 3.27Å; I23-P38 WeakPolarHBondContact CA-O 3.31Å; I23-P38 HydrophobicContact CG2-CG 4.37Å; I23-P38 WeakPolarHBondContact CG2-O 3.48Å; N24-P38 PolarHBondContact N-O 2.98Å; N24-P38 VanDerWaalsContact O-CG 3.22Å; N24-P38 WeakPolarHBondContact O-CG 3.48Å; L26-P38 HydrophobicContact CD1-CB 3.58Å; L26-P38 HydrophobicContact CD1-CG 4.08Å; L26-P38 HydrophobicContact CG-CB 4.12Å; L26-P38 HydrophobicContact CG-CG 4.38Å; I32-P38 HydrophobicContact CD1-CG 4.09Å; P38-F49 HydrophobicContact CB-CD1 4.13Å; P38-F49 HydrophobicContact CB-CE1 3.92Å
39	I	96.8	Very high	93.4	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	132.5	-173.5	-48.3	-57.2	0	0	0	109.7	I9 A11 R22 I23 F41 V47 Y48 L50 I55	I9-I39 HydrophobicContact CD1-CD1 3.77Å; I9-I39 HydrophobicContact CD1-CG2 4.14Å; A11-I39 HydrophobicContact CB-CG2 3.77Å; R22-I39 WeakPolarHBondContact O-CA 3.44Å; I23-I39 HydrophobicContact CG1-CD1 4.09Å; I39-F41 HydrophobicContact CB-CE2 3.9Å; I39-F41 HydrophobicContact CG2-CD2 3.98Å; I39-F41 HydrophobicContact CG2-CE2 3.43Å; I39-F41 VanDerWaalsContact CG2-CE2 3.43Å; I39-F41 HydrophobicContact CG2-CZ 3.81Å; I39-V47 CarbonylContact O-C 3.59Å; I39-V47 VanDerWaalsContact O-CA 3.22Å; I39-V47 WeakPolarHBondContact O-CA 3.19Å; I39-Y48 PolarHBondContact N-O 3.42Å; I39-Y48 PolarHBondContact O-N 3.08Å; I39-L50 HydrophobicContact CG1-CB 3.88Å; I39-L50 HydrophobicContact CG1-CD1 4.19Å; I39-L50 HydrophobicContact CG1-CG 3.95Å; I39-I55 HydrophobicContact CD1-CD1 3.71Å; I39-I55 HydrophobicContact CD1-CG1 4.14Å
40	F	96.9	Very high	94	Very high	0 Å²	0	52 Å²	52	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	131.9	168.5	174.6	-87	0	0	0	110	S21 R22 N24 Y42 H45 V47 V87 L88 F99	S21-F40 CarbonylContact C-O 3.46Å; S21-F40 WeakPolarHBondContact CA-O 3.49Å; S21-F40 WeakPolarHBondContact CB-O 3.15Å; R22-F40 HydrophobicContact CG-CB 3.98Å; R22-F40 HydrophobicContact CG-CD1 4.23Å; R22-F40 PolarHBondContact N-O 2.89Å; R22-F40 PolarHBondContact O-N 3.21Å; N24-F40 HydrophobicContact CB-CB 4.06Å; F40-Y42 HydrophobicContact CD1-CD1 4.24Å; F40-Y42 HydrophobicContact CD1-CE1 4.38Å; F40-Y42 HydrophobicContact CD1-CG 4.48Å; F40-Y42 AromaticContact CE1-CD1 3.83Å; F40-Y42 HydrophobicContact CE1-CD1 3.83Å; F40-Y42 HydrophobicContact CE1-CE1 4.17Å; F40-Y42 HydrophobicContact CE1-CG 4.34Å; F40-H45 AromaticContact CE1-CD2 3.97Å; F40-H45 HydrophobicContact CE2-CB 4.04Å; F40-H45 HydrophobicContact CZ-CB 4.04Å; F40-H45 AromaticContact CZ-CD2 3.39Å; F40-H45 WeakPolarHBondContact CZ-CD2 3.38Å; F40-H45 AromaticContact CZ-CG 3.88Å; F40-V47 HydrophobicContact CB-CG1 4.41Å; F40-V47 HydrophobicContact CD2-CG1 4.02Å; F40-V87 HydrophobicContact CE1-CG1 4.16Å; F40-V87 HydrophobicContact CZ-CG1 4.26Å; F40-L88 HydrophobicContact CE2-CB 4.02Å; F40-L88 HydrophobicContact CE2-CD1 4.16Å; F40-L88 HydrophobicContact CZ-CB 4.3Å; F40-L88 HydrophobicContact CZ-CD1 4.31Å; F40-F99 AromaticContact CD2-CE1 3.94Å; F40-F99 HydrophobicContact CD2-CE1 3.94Å; F40-F99 HydrophobicContact CD2-CZ 4.07Å; F40-F99 AromaticContact CE2-CE1 3.76Å; F40-F99 HydrophobicContact CE2-CE1 3.76Å; F40-F99 AromaticContact CE2-CZ 3.7Å; F40-F99 HydrophobicContact CE2-CZ 3.7Å
41	F	97.4	Very high	94.4	Very high	10 Å²	10	52.6 Å²	52.6	4%	0.044	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	111.8	-177.3	-72.9	-101.4	0	0	0	111.3	A11 V13 W19 S21 I39 T44 H45 E46 Y48 L50	A11-F41 HydrophobicContact CB-CE1 3.58Å; A11-F41 HydrophobicContact CB-CE2 4.48Å; A11-F41 HydrophobicContact CB-CZ 3.53Å; V13-F41 HydrophobicContact CG2-CE1 3.71Å; V13-F41 HydrophobicContact CG2-CE2 4.2Å; V13-F41 HydrophobicContact CG2-CZ 3.36Å; W19-F41 HydrophobicContact CB-CD1 3.89Å; W19-F41 HydrophobicContact CB-CE1 4.07Å; W19-F41 AromaticContact CD1-CD1 3.71Å; W19-F41 AromaticContact CG-CD1 3.95Å; W19-F41 HydrophobicContact CG-CD1 3.95Å; S21-F41 VanDerWaalsContact OG-CD1 3.27Å; S21-F41 WeakPolarHBondContact OG-CD1 3.45Å; I39-F41 HydrophobicContact CB-CE2 3.9Å; I39-F41 HydrophobicContact CG2-CD2 3.98Å; I39-F41 HydrophobicContact CG2-CE2 3.43Å; I39-F41 VanDerWaalsContact CG2-CE2 3.43Å; I39-F41 HydrophobicContact CG2-CZ 3.81Å; F41-T44 WeakPolarHBondContact CB-OG1 3.5Å; F41-T44 PolarHBondContact O-N 3.35Å; F41-T44 PolarHBondContact O-OG1 3.09Å; F41-H45 WeakPolarHBondContact O-CA 3.23Å; F41-H45 PolarHBondContact O-N 2.87Å; F41-E46 HydrophobicContact CB-CB 4.45Å; F41-E46 WeakPolarHBondContact CD2-O 3.47Å; F41-E46 PolarHBondContact N-O 3.35Å; F41-Y48 AromaticContact CD2-CD2 3.83Å; F41-Y48 HydrophobicContact CD2-CD2 3.83Å; F41-Y48 HydrophobicContact CD2-CE2 4.42Å; F41-Y48 AromaticContact CE2-CD2 3.49Å; F41-Y48 HydrophobicContact CE2-CD2 3.49Å; F41-Y48 VanDerWaalsContact CE2-CD2 3.49Å; F41-Y48 HydrophobicContact CE2-CE2 4.31Å; F41-Y48 HydrophobicContact CE2-CG 4.18Å; F41-Y48 HydrophobicContact CZ-CD2 4.29Å; F41-L50 HydrophobicContact CZ-CD1 4.13Å
42	Y	96.7	Very high	94.8	Very high	1 Å²	1	50.6 Å²	50.6	0%	0.004	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	144.1	179.1	-65.8	-79	0	0	0	112.1	W19 P20 S21 R22 F40 T44 G77 E80 I81 P85 V87	W19-Y42 PolarHBondContact NE1-O 3.15Å; P20-Y42 HydrophobicContact CB-CD2 4.5Å; P20-Y42 PolarHBondContact O-N 2.92Å; S21-Y42 VanDerWaalsContact CA-CD2 3.5Å; R22-Y42 HydrophobicContact CB-CE2 3.93Å; R22-Y42 WeakPolarHBondContact CB-OH 3.42Å; R22-Y42 WeakPolarHBondContact CD-OH 3.36Å; R22-Y42 HydrophobicContact CG-CE2 4.12Å; F40-Y42 HydrophobicContact CD1-CD1 4.24Å; F40-Y42 HydrophobicContact CD1-CE1 4.38Å; F40-Y42 HydrophobicContact CD1-CG 4.48Å; F40-Y42 AromaticContact CE1-CD1 3.83Å; F40-Y42 HydrophobicContact CE1-CD1 3.83Å; F40-Y42 HydrophobicContact CE1-CE1 4.17Å; F40-Y42 HydrophobicContact CE1-CG 4.34Å; Y42-T44 PolarHBondContact O-N 2.93Å; Y42-T44 VanDerWaalsContact O-N 3.13Å; Y42-G77 VanDerWaalsContact C-CA 3.49Å; Y42-G77 WeakPolarHBondContact CB-O 2.92Å; Y42-G77 WeakPolarHBondContact O-CA 3.2Å; Y42-E80 WeakPolarHBondContact CA-OE1 3.39Å; Y42-E80 VanDerWaalsContact CB-OE1 3.31Å; Y42-E80 WeakPolarHBondContact CB-OE1 3.25Å; Y42-E80 HydrophobicContact CD1-CB 4.28Å; Y42-E80 HydrophobicContact CD1-CG 3.89Å; Y42-E80 VanDerWaalsContact CD1-OE1 3.3Å; Y42-E80 WeakPolarHBondContact CD1-OE1 3.42Å; Y42-I81 HydrophobicContact CD1-CB 4.42Å; Y42-I81 HydrophobicContact CD2-CB 3.6Å; Y42-I81 HydrophobicContact CD2-CD1 3.7Å; Y42-I81 HydrophobicContact CD2-CG1 3.78Å; Y42-I81 HydrophobicContact CE1-CB 4.48Å; Y42-I81 HydrophobicContact CE2-CB 3.67Å; Y42-I81 HydrophobicContact CE2-CD1 3.44Å; Y42-I81 VanDerWaalsContact CE2-CD1 3.44Å; Y42-I81 HydrophobicContact CE2-CG1 3.38Å; Y42-I81 HydrophobicContact CG-CB 3.99Å; Y42-P85 VanDerWaalsContact CE1-O 3.32Å; Y42-P85 WeakPolarHBondContact CE1-O 3.48Å; Y42-P85 WeakPolarHBondContact OH-CA 3.36Å; Y42-P85 PolarHBondContact OH-O 2.88Å; Y42-V87 HydrophobicContact CD1-CG1 4.14Å; Y42-V87 HydrophobicContact CE1-CG1 4.13Å
43	G	94.8	Very high	95	Very high	20 Å²	20	54.3 Å²	54.3	21%	0.206	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	72.5	-12	-179.1	0	0	0	0	0	115.7	V73 E80	G43-V73 WeakPolarHBondContact O-CG1 3.12Å; G43-E80 PolarHBondContact N-OE1 3.27Å
44	T	95	Very high	95.2	Very high	53 Å²	53	53.7 Å²	53.7	33%	0.325	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.1	-18.6	168.5	54.5	0	0	0	0	113.3	W19 F41 Y42 E46 V73	W19-T44 HydrophobicContact CZ2-CG2 3.86Å; F41-T44 WeakPolarHBondContact CB-OG1 3.5Å; F41-T44 PolarHBondContact O-N 3.35Å; F41-T44 PolarHBondContact O-OG1 3.09Å; Y42-T44 PolarHBondContact O-N 2.93Å; Y42-T44 VanDerWaalsContact O-N 3.13Å; T44-E46 PolarHBondContact O-N 3.42Å; T44-E46 VanDerWaalsContact O-N 3.13Å; T44-V73 HydrophobicContact CG2-CG1 3.56Å
45	H	95.4	Very high	95.6	Very high	63 Å²	63	43.8 Å²	43.8	29%	0.292	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.9	37.2	-174.9	-48.8	154.6	0	0	0	112.4	F40 F41 E80 L88 F99	F40-H45 AromaticContact CE1-CD2 3.97Å; F40-H45 HydrophobicContact CE2-CB 4.04Å; F40-H45 HydrophobicContact CZ-CB 4.04Å; F40-H45 AromaticContact CZ-CD2 3.39Å; F40-H45 WeakPolarHBondContact CZ-CD2 3.38Å; F40-H45 AromaticContact CZ-CG 3.88Å; F41-H45 WeakPolarHBondContact O-CA 3.23Å; F41-H45 PolarHBondContact O-N 2.87Å; H45-E80 IonicContact CD2-OE1 3.94Å; H45-E80 PolarHBondContact CD2-OE1 2.99Å; H45-E80 IonicContact CD2-OE2 2.71Å; H45-E80 IonicContact CE1-OE2 3.11Å; H45-E80 VanDerWaalsContact NE2-CD 3.25Å; H45-E80 IonicContact NE2-OE1 3.06Å; H45-E80 PolarHBondContact NE2-OE1 3.22Å; H45-E80 IonicContact NE2-OE2 2.75Å; H45-E80 PolarHBondContact NE2-OE2 3.31Å; H45-L88 HydrophobicContact CB-CD1 4.37Å; H45-F99 HydrophobicContact CB-CE2 4.05Å; H45-F99 HydrophobicContact CB-CZ 4.23Å; H45-F99 WeakPolarHBondContact O-CE2 3.47Å; H45-F99 VanDerWaalsContact O-CZ 3.28Å; H45-F99 WeakPolarHBondContact O-CZ 3.14Å
46	E	95.6	Very high	95.8	Very high	81 Å²	81	43 Å²	43	38%	0.379	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	149.8	171.7	-69.9	-175.5	-169	0	0	109.3	F41 T44 Y48	F41-E46 HydrophobicContact CB-CB 4.45Å; F41-E46 WeakPolarHBondContact CD2-O 3.47Å; F41-E46 PolarHBondContact N-O 3.35Å; T44-E46 PolarHBondContact O-N 3.42Å; T44-E46 VanDerWaalsContact O-N 3.13Å; E46-Y48 HydrophobicContact CB-CD2 4.45Å; E46-Y48 HydrophobicContact CB-CE2 3.88Å; E46-Y48 WeakPolarHBondContact OE2-CE2 2.97Å; E46-Y48 PolarHBondContact OE2-OH 3.28Å
47	V	95.3	Very high	95.9	Very high	19 Å²	19	39.6 Å²	39.6	12%	0.115	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	138.8	175.8	-64.7	0	0	0	0	112.9	I39 F40 F99 F103 Y104	I39-V47 CarbonylContact O-C 3.59Å; I39-V47 VanDerWaalsContact O-CA 3.22Å; I39-V47 WeakPolarHBondContact O-CA 3.19Å; F40-V47 HydrophobicContact CB-CG1 4.41Å; F40-V47 HydrophobicContact CD2-CG1 4.02Å; V47-F99 HydrophobicContact CG1-CE1 4.11Å; V47-F99 HydrophobicContact CG1-CZ 4.2Å; V47-F103 HydrophobicContact CG2-CB 3.62Å; V47-F103 HydrophobicContact CG2-CD1 3.48Å; V47-F103 VanDerWaalsContact CG2-CD1 3.48Å; V47-F103 HydrophobicContact CG2-CD2 3.9Å; V47-F103 HydrophobicContact CG2-CE1 4.08Å; V47-F103 HydrophobicContact CG2-CE2 4.46Å; V47-F103 HydrophobicContact CG2-CG 3.37Å; V47-Y104 HydrophobicContact CB-CE2 4.48Å; V47-Y104 HydrophobicContact CG2-CE2 3.96Å
48	Y	95.6	Very high	95.9	Very high	89 Å²	89	37.3 Å²	37.3	35%	0.349	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	161.5	-179.5	-70.1	-98.6	0	0	0	112.4	V13 I39 F41 E46	V13-Y48 HydrophobicContact CG2-CD2 4.5Å; I39-Y48 PolarHBondContact N-O 3.42Å; I39-Y48 PolarHBondContact O-N 3.08Å; F41-Y48 AromaticContact CD2-CD2 3.83Å; F41-Y48 HydrophobicContact CD2-CD2 3.83Å; F41-Y48 HydrophobicContact CD2-CE2 4.42Å; F41-Y48 AromaticContact CE2-CD2 3.49Å; F41-Y48 HydrophobicContact CE2-CD2 3.49Å; F41-Y48 VanDerWaalsContact CE2-CD2 3.49Å; F41-Y48 HydrophobicContact CE2-CE2 4.31Å; F41-Y48 HydrophobicContact CE2-CG 4.18Å; F41-Y48 HydrophobicContact CZ-CD2 4.29Å; E46-Y48 HydrophobicContact CB-CD2 4.45Å; E46-Y48 HydrophobicContact CB-CE2 3.88Å; E46-Y48 WeakPolarHBondContact OE2-CE2 2.97Å; E46-Y48 PolarHBondContact OE2-OH 3.28Å
49	F	95.9	Very high	95.8	Very high	50 Å²	50	42.3 Å²	42.3	22%	0.219	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	109.8	164.3	-62.3	-72	0	0	0	111.1	L26 I32 P33 K36 Y37 P38 Y104	L26-F49 HydrophobicContact CD1-CE1 4.2Å; L26-F49 HydrophobicContact CD1-CZ 4.43Å; I32-F49 HydrophobicContact CB-CE1 4.42Å; I32-F49 HydrophobicContact CG1-CE1 4.31Å; I32-F49 HydrophobicContact CG2-CD1 4.28Å; I32-F49 HydrophobicContact CG2-CE1 4.13Å; P33-F49 HydrophobicContact CG-CB 4.35Å; P33-F49 HydrophobicContact CG-CD1 4.37Å; P33-F49 HydrophobicContact CG-CD2 4Å; P33-F49 HydrophobicContact CG-CE2 4.33Å; P33-F49 HydrophobicContact CG-CG 4.01Å; K36-F49 HydrophobicContact CB-CB 4.24Å; K36-F49 HydrophobicContact CD-CB 3.71Å; K36-F49 WeakPolarHBondContact CD-O 3.24Å; K36-F49 PolarHBondContact NZ-O 2.9Å; Y37-F49 WeakPolarHBondContact O-CA 3.49Å; P38-F49 HydrophobicContact CB-CD1 4.13Å; P38-F49 HydrophobicContact CB-CE1 3.92Å; F49-Y104 AromaticContact CE2-CE1 3.72Å; F49-Y104 HydrophobicContact CE2-CE1 3.72Å; F49-Y104 HydrophobicContact CZ-CD1 4.38Å; F49-Y104 AromaticContact CZ-CE1 3.53Å; F49-Y104 HydrophobicContact CZ-CE1 3.53Å
50	L	96.3	Very high	95.7	Very high	19 Å²	19	48.2 Å²	48.2	10%	0.099	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	155.7	179.1	-64.6	-171.7	0	0	0	112.8	A11 V13 K36 Y37 I39 F41 D54 I55	A11-L50 HydrophobicContact CB-CD1 3.92Å; V13-L50 HydrophobicContact CG2-CD1 4.4Å; K36-L50 CarbonylContact C-O 3.54Å; K36-L50 WeakPolarHBondContact CA-O 3.4Å; K36-L50 VanDerWaalsContact CB-O 3.25Å; K36-L50 WeakPolarHBondContact CB-O 3.49Å; Y37-L50 PolarHBondContact N-O 2.61Å; Y37-L50 PolarHBondContact O-N 3.31Å; Y37-L50 VanDerWaalsContact O-N 3.12Å; I39-L50 HydrophobicContact CG1-CB 3.88Å; I39-L50 HydrophobicContact CG1-CD1 4.19Å; I39-L50 HydrophobicContact CG1-CG 3.95Å; F41-L50 HydrophobicContact CZ-CD1 4.13Å; L50-D54 HydrophobicContact CB-CB 4.4Å; L50-D54 HydrophobicContact CD1-CB 4.37Å; L50-I55 HydrophobicContact CB-CD1 4.32Å; L50-I55 HydrophobicContact CB-CG1 4.3Å
51	A	95	Very high	95.6	Very high	23 Å²	23	50.7 Å²	50.7	19%	0.19	25%	0.25	C	C	.	.			trans	-85.3	156.4	176.1	0	0	0	0	0	111.1	K53 D54	A51-K53 HydrophobicContact CB-CG 4.06Å; A51-K53 PolarHBondContact O-N 3.28Å; A51-D54 PolarHBondContact O-N 3.35Å
52	P	95.2	Very high	95.4	Very high	64 Å²	64	54.4 Å²	54.4	42%	0.416	27%	0.266	S	S	.	.	G	3₁₀ helix	trans	-51.9	-34.1	-178.2	-27.1	31.9	0	0	0	115	G35 Y37 D54 I55	G35-P52 WeakPolarHBondContact O-CD 3.47Å; Y37-P52 HydrophobicContact CD2-CG 4.39Å; Y37-P52 HydrophobicContact CE2-CB 4.39Å; Y37-P52 HydrophobicContact CE2-CG 3.96Å; P52-D54 PolarHBondContact O-N 3.29Å; P52-I55 PolarHBondContact O-N 3.42Å
53	K	94.9	Very high	95.3	Very high	160 Å²	160	61.3 Å²	61.3	70%	0.696	30%	0.298	S	S	*	.	G	3₁₀ helix	trans	-65.7	-17.3	177.5	62.8	163.2	-162.4	175.1	0	115.2	A51	A51-K53 HydrophobicContact CB-CG 4.06Å; A51-K53 PolarHBondContact O-N 3.28Å
54	D	96.5	Very high	95.3	Very high	42 Å²	42	66 Å²	66	23%	0.225	31%	0.313	C	S	.	.	G	3₁₀ helix	trans	-105.2	16.2	-176.7	-58.3	-56.1	0	0	0	110.4	A11 K12 L50 A51 P52	A11-D54 CarbonylContact C-O 3.38Å; K12-D54 HydrophobicContact CB-CB 4.13Å; K12-D54 VanDerWaalsContact CB-O 3.32Å; K12-D54 WeakPolarHBondContact CB-O 3.45Å; K12-D54 PolarHBondContact N-O 2.93Å; L50-D54 HydrophobicContact CB-CB 4.4Å; L50-D54 HydrophobicContact CD1-CB 4.37Å; A51-D54 PolarHBondContact O-N 3.35Å; P52-D54 PolarHBondContact O-N 3.29Å
55	I	96.5	Very high	95.3	Very high	5 Å²	5	64.6 Å²	64.6	3%	0.026	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	135.6	-173.7	-60	164.9	0	0	0	108.9	Y3 I9 Y37 I39 L50 P52	Y3-I55 HydrophobicContact CD2-CG2 4.33Å; Y3-I55 HydrophobicContact CE1-CG2 4.11Å; Y3-I55 HydrophobicContact CE2-CB 4.28Å; Y3-I55 HydrophobicContact CE2-CG2 3.77Å; Y3-I55 PolarHBondContact OH-O 2.51Å; Y3-I55 VanDerWaalsContact OH-O 3.07Å; I9-I55 HydrophobicContact CB-CG2 3.95Å; I9-I55 HydrophobicContact CD1-CG1 4.5Å; I9-I55 HydrophobicContact CD1-CG2 3.66Å; I9-I55 HydrophobicContact CG1-CG2 4.4Å; I9-I55 HydrophobicContact CG2-CG2 3.69Å; Y37-I55 HydrophobicContact CD2-CD1 3.62Å; Y37-I55 HydrophobicContact CG-CD1 4.19Å; I39-I55 HydrophobicContact CD1-CD1 3.71Å; I39-I55 HydrophobicContact CD1-CG1 4.14Å; L50-I55 HydrophobicContact CB-CD1 4.32Å; L50-I55 HydrophobicContact CB-CG1 4.3Å; P52-I55 PolarHBondContact O-N 3.42Å
56	F	96.2	Very high	95.1	Very high	47 Å²	47	62.3 Å²	62.3	21%	0.206	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	140.1	-178.4	-55.4	-92.8	0	0	0	109.4	Y3 I9 F10 K12 H18 F61 Y65	Y3-F56 WeakPolarHBondContact OH-CA 3.34Å; I9-F56 CarbonylContact C-O 3.51Å; I9-F56 WeakPolarHBondContact CA-O 3.5Å; I9-F56 VanDerWaalsContact CB-O 3.31Å; I9-F56 WeakPolarHBondContact CB-O 3.24Å; F10-F56 HydrophobicContact CB-CB 4.4Å; F10-F56 PolarHBondContact N-O 3.45Å; F10-F56 PolarHBondContact O-N 3.44Å; K12-F56 HydrophobicContact CB-CE2 4.23Å; H18-F56 AromaticContact CD2-CE2 3.72Å; H18-F56 AromaticContact NE2-CE2 3.64Å; F56-F61 HydrophobicContact CB-CB 4.47Å; F56-F61 HydrophobicContact CB-CD2 3.78Å; F56-F61 HydrophobicContact CB-CE2 4.13Å; F56-F61 HydrophobicContact CB-CG 4.01Å; F56-F61 HydrophobicContact CD1-CD1 4.47Å; F56-F61 HydrophobicContact CD1-CE1 4.11Å; F56-F61 HydrophobicContact CD1-CE2 4.18Å; F56-F61 AromaticContact CD1-CZ 3.96Å; F56-F61 HydrophobicContact CD1-CZ 3.96Å; F56-Y65 HydrophobicContact CB-CE2 4.23Å; F56-Y65 HydrophobicContact CD1-CE2 4.18Å; F56-Y65 HydrophobicContact CD2-CE2 4.03Å; F56-Y65 AromaticContact CG-CE2 3.88Å; F56-Y65 HydrophobicContact CG-CE2 3.88Å
57	P	96.4	Very high	94.8	Very high	19 Å²	19	62.3 Å²	62.3	12%	0.123	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62	138.1	178.5	-18.6	31.4	0	0	0	111.2	Y3 K60 F61	Y3-P57 HydrophobicContact CE1-CB 4.47Å; Y3-P57 HydrophobicContact CE1-CG 3.92Å; Y3-P57 VanDerWaalsContact OH-CD 3.31Å; Y3-P57 WeakPolarHBondContact OH-CD 3.44Å; P57-K60 HydrophobicContact CB-CB 4.3Å; P57-K60 HydrophobicContact CB-CD 4.44Å; P57-K60 HydrophobicContact CB-CG 4.3Å; P57-K60 HydrophobicContact CG-CD 4.39Å; P57-F61 WeakPolarHBondContact O-CD2 3.47Å; P57-F61 PolarHBondContact O-N 2.69Å
58	Y	95.9	Very high	94.3	Very high	10 Å²	10	66 Å²	66	4%	0.039	32%	0.324	C	S	.	.	H	α-helix	trans	-64.7	-51.4	-171.8	172.3	-98.5	0	0	0	111.7	K8 F10 K60 F61 K62 L78 I81 E82	K8-Y58 HydrophobicContact CB-CD1 4.36Å; K8-Y58 HydrophobicContact CB-CG 4.21Å; K8-Y58 VanDerWaalsContact O-CB 3.29Å; K8-Y58 WeakPolarHBondContact O-CB 3.28Å; K8-Y58 PolarHBondContact O-N 2.97Å; F10-Y58 AromaticContact CD2-CD2 3.93Å; F10-Y58 HydrophobicContact CD2-CD2 3.93Å; F10-Y58 HydrophobicContact CE1-CD2 4.31Å; F10-Y58 HydrophobicContact CE1-CE2 4.35Å; F10-Y58 AromaticContact CE2-CD2 3.28Å; F10-Y58 HydrophobicContact CE2-CD2 3.28Å; F10-Y58 AromaticContact CE2-CE2 3.76Å; F10-Y58 HydrophobicContact CE2-CE2 3.76Å; F10-Y58 HydrophobicContact CE2-CG 4.05Å; F10-Y58 WeakPolarHBondContact CE2-O 3.46Å; F10-Y58 AromaticContact CZ-CD2 3.51Å; F10-Y58 HydrophobicContact CZ-CD2 3.51Å; F10-Y58 AromaticContact CZ-CE2 3.53Å; F10-Y58 HydrophobicContact CZ-CE2 3.53Å; Y58-K60 PolarHBondContact O-N 3.44Å; Y58-F61 CarbonylContact O-C 3.52Å; Y58-F61 PolarHBondContact O-N 3.43Å; Y58-F61 VanDerWaalsContact O-N 3.11Å; Y58-K62 HydrophobicContact CE1-CD 3.78Å; Y58-K62 HydrophobicContact CE1-CG 4.35Å; Y58-K62 WeakPolarHBondContact O-CA 3.19Å; Y58-K62 WeakPolarHBondContact O-CB 3.38Å; Y58-K62 PolarHBondContact O-N 3.17Å; Y58-K62 VanDerWaalsContact OH-CE 3.24Å; Y58-K62 WeakPolarHBondContact OH-CE 3.28Å; Y58-K62 PolarHBondContact OH-NZ 3.34Å; Y58-L78 HydrophobicContact CE2-CD2 4.46Å; Y58-I81 HydrophobicContact CD2-CD1 3.57Å; Y58-I81 HydrophobicContact CD2-CG1 4.45Å; Y58-I81 HydrophobicContact CE2-CD1 3.84Å; Y58-I81 HydrophobicContact CE2-CG1 4.36Å; Y58-I81 HydrophobicContact CE2-CG2 3.73Å; Y58-I81 HydrophobicContact CG-CD1 4.01Å; Y58-E82 WeakPolarHBondContact OH-CG 3.1Å; Y58-E82 PolarHBondContact OH-OE1 3.12Å
59	E	94	Very high	93.7	Very high	113 Å²	113	65.7 Å²	65.7	53%	0.528	32%	0.323	S	S	.	.	H	α-helix	trans	-58.6	-50.2	-174.9	-59.4	63.5	-134.5	0	0	109.9	F61 K62	E59-F61 PolarHBondContact O-N 2.78Å; E59-K62 PolarHBondContact O-N 3.32Å
60	K	94	Very high	92.9	Very high	124 Å²	124	71.6 Å²	71.6	54%	0.539	36%	0.357	S	S	.	.	H	α-helix	trans	-64.4	-25.8	-178.9	-59.6	-169.6	-179.3	-173.9	0	113.1	P57 Y58 H63	P57-K60 HydrophobicContact CB-CB 4.3Å; P57-K60 HydrophobicContact CB-CD 4.44Å; P57-K60 HydrophobicContact CB-CG 4.3Å; P57-K60 HydrophobicContact CG-CD 4.39Å; Y58-K60 PolarHBondContact O-N 3.44Å; K60-H63 PolarHBondContact O-CE1 2.94Å; K60-H63 PolarHBondContact O-ND1 3.19Å
61	F	95	Very high	92.5	Very high	52 Å²	52	76.3 Å²	76.3	23%	0.228	38%	0.376	C	S	.	.	H	α-helix	trans	-114.3	2.1	-177.4	-73	-92.3	0	0	0	114.8	F10 F56 P57 Y58 E59 H63 K64 Y65	F10-F61 HydrophobicContact CD2-CB 4.01Å; F56-F61 HydrophobicContact CB-CB 4.47Å; F56-F61 HydrophobicContact CB-CD2 3.78Å; F56-F61 HydrophobicContact CB-CE2 4.13Å; F56-F61 HydrophobicContact CB-CG 4.01Å; F56-F61 HydrophobicContact CD1-CD1 4.47Å; F56-F61 HydrophobicContact CD1-CE1 4.11Å; F56-F61 HydrophobicContact CD1-CE2 4.18Å; F56-F61 AromaticContact CD1-CZ 3.96Å; F56-F61 HydrophobicContact CD1-CZ 3.96Å; P57-F61 WeakPolarHBondContact O-CD2 3.47Å; P57-F61 PolarHBondContact O-N 2.69Å; Y58-F61 CarbonylContact O-C 3.52Å; Y58-F61 PolarHBondContact O-N 3.43Å; Y58-F61 VanDerWaalsContact O-N 3.11Å; E59-F61 PolarHBondContact O-N 2.78Å; F61-H63 VanDerWaalsContact C-N 3.33Å; F61-H63 PolarHBondContact O-N 2.99Å; F61-K64 HydrophobicContact CD1-CD 4.12Å; F61-K64 HydrophobicContact CE1-CD 4.42Å; F61-K64 PolarHBondContact O-N 3.01Å; F61-Y65 HydrophobicContact CB-CD2 3.71Å; F61-Y65 HydrophobicContact CB-CE2 4Å; F61-Y65 HydrophobicContact CB-CG 4.45Å; F61-Y65 HydrophobicContact CD1-CD2 4.03Å; F61-Y65 AromaticContact CD1-CE2 3.46Å; F61-Y65 HydrophobicContact CD1-CE2 3.46Å; F61-Y65 VanDerWaalsContact CD1-CE2 3.46Å; F61-Y65 AromaticContact CD1-CZ 3.82Å; F61-Y65 HydrophobicContact CE1-CE2 4.21Å; F61-Y65 HydrophobicContact CG-CD2 4.18Å; F61-Y65 AromaticContact CG-CE2 3.94Å; F61-Y65 HydrophobicContact CG-CE2 3.94Å; F61-Y65 PolarHBondContact O-N 3.44Å
62	K	94.3	Very high	92.3	Very high	88 Å²	88	77.9 Å²	77.9	38%	0.383	39%	0.39	S	S	.	.	H	α-helix	trans	-53.4	-48.4	-179.4	-172.8	173	-177.4	164.6	0	111.9	F10 Y58 E59 K64 G66 E82	F10-K62 HydrophobicContact CE2-CB 4.49Å; Y58-K62 HydrophobicContact CE1-CD 3.78Å; Y58-K62 HydrophobicContact CE1-CG 4.35Å; Y58-K62 WeakPolarHBondContact O-CA 3.19Å; Y58-K62 WeakPolarHBondContact O-CB 3.38Å; Y58-K62 PolarHBondContact O-N 3.17Å; Y58-K62 VanDerWaalsContact OH-CE 3.24Å; Y58-K62 WeakPolarHBondContact OH-CE 3.28Å; Y58-K62 PolarHBondContact OH-NZ 3.34Å; E59-K62 PolarHBondContact O-N 3.32Å; K62-K64 PolarHBondContact O-N 2.9Å; K62-K64 VanDerWaalsContact O-N 3.15Å; K62-G66 VanDerWaalsContact O-CA 3.28Å; K62-G66 WeakPolarHBondContact O-CA 3.44Å; K62-G66 PolarHBondContact O-N 2.92Å; K62-E82 WeakPolarHBondContact CE-OE1 3.38Å; K62-E82 IonicContact NZ-OE1 3.63Å; K62-E82 PolarHBondContact NZ-OE1 3.23Å
63	H	93.2	Very high	92.2	Very high	146 Å²	146	78.3 Å²	78.3	68%	0.676	39%	0.391	S	S	*	.	H	α-helix	trans	-58.2	-26.5	176.7	72.4	-93	0	0	0	114.2	K60 F61	K60-H63 PolarHBondContact O-CE1 2.94Å; K60-H63 PolarHBondContact O-ND1 3.19Å; F61-H63 VanDerWaalsContact C-N 3.33Å; F61-H63 PolarHBondContact O-N 2.99Å
64	K	94.8	Very high	92.2	Very high	118 Å²	118	70.8 Å²	70.8	51%	0.513	36%	0.358	S	S	.	.	H	α-helix	trans	-101.3	-36.8	-172.6	-166.1	179.5	-175.1	176.1	0	113.2	F61 K62	F61-K64 HydrophobicContact CD1-CD 4.12Å; F61-K64 HydrophobicContact CE1-CD 4.42Å; F61-K64 PolarHBondContact O-N 3.01Å; K62-K64 PolarHBondContact O-N 2.9Å; K62-K64 VanDerWaalsContact O-N 3.15Å
65	Y	94.7	Very high	92.1	Very high	25 Å²	25	73.3 Å²	73.3	10%	0.098	37%	0.368	C	S	.	.	H	α-helix	trans	-112.5	-29.2	-172	-62.8	-22.3	0	0	0	113.4	F10 H18 F56 F61 V67 R69 F74	F10-Y65 HydrophobicContact CB-CD2 3.87Å; F10-Y65 HydrophobicContact CD2-CD2 4.22Å; F10-Y65 AromaticContact CG-CD2 3.98Å; F10-Y65 HydrophobicContact CG-CD2 3.98Å; F10-Y65 HydrophobicContact CG-CG 4.42Å; H18-Y65 HydrophobicContact CB-CD1 4.11Å; H18-Y65 HydrophobicContact CB-CD2 3.69Å; H18-Y65 HydrophobicContact CB-CE2 4.28Å; H18-Y65 HydrophobicContact CB-CG 3.61Å; H18-Y65 AromaticContact CD2-CE2 4Å; H18-Y65 AromaticContact CE1-CE1 3.48Å; H18-Y65 VanDerWaalsContact CE1-CE1 3.48Å; H18-Y65 WeakPolarHBondContact CE1-CE1 3.38Å; H18-Y65 AromaticContact CE1-CE2 3.88Å; H18-Y65 AromaticContact CE1-CZ 3.36Å; H18-Y65 AromaticContact CG-CD1 3.88Å; H18-Y65 AromaticContact CG-CD2 3.63Å; H18-Y65 AromaticContact CG-CE1 3.98Å; H18-Y65 AromaticContact CG-CE2 3.71Å; H18-Y65 AromaticContact CG-CG 3.74Å; H18-Y65 AromaticContact CG-CZ 3.9Å; H18-Y65 AromaticContact ND1-CD1 3.26Å; H18-Y65 VanDerWaalsContact ND1-CD1 3.26Å; H18-Y65 WeakPolarHBondContact ND1-CD1 2.81Å; H18-Y65 AromaticContact ND1-CD2 3.77Å; H18-Y65 AromaticContact ND1-CE1 3.1Å; H18-Y65 WeakPolarHBondContact ND1-CE1 3.47Å; H18-Y65 AromaticContact ND1-CE2 3.62Å; H18-Y65 AromaticContact ND1-CG 3.63Å; H18-Y65 AromaticContact ND1-CZ 3.3Å; H18-Y65 VanDerWaalsContact ND1-CZ 3.3Å; F56-Y65 HydrophobicContact CB-CE2 4.23Å; F56-Y65 HydrophobicContact CD1-CE2 4.18Å; F56-Y65 HydrophobicContact CD2-CE2 4.03Å; F56-Y65 AromaticContact CG-CE2 3.88Å; F56-Y65 HydrophobicContact CG-CE2 3.88Å; F61-Y65 HydrophobicContact CB-CD2 3.71Å; F61-Y65 HydrophobicContact CB-CE2 4Å; F61-Y65 HydrophobicContact CB-CG 4.45Å; F61-Y65 HydrophobicContact CD1-CD2 4.03Å; F61-Y65 AromaticContact CD1-CE2 3.46Å; F61-Y65 HydrophobicContact CD1-CE2 3.46Å; F61-Y65 VanDerWaalsContact CD1-CE2 3.46Å; F61-Y65 AromaticContact CD1-CZ 3.82Å; F61-Y65 HydrophobicContact CE1-CE2 4.21Å; F61-Y65 HydrophobicContact CG-CD2 4.18Å; F61-Y65 AromaticContact CG-CE2 3.94Å; F61-Y65 HydrophobicContact CG-CE2 3.94Å; F61-Y65 PolarHBondContact O-N 3.44Å; Y65-V67 PolarHBondContact O-N 2.9Å; Y65-R69 PolarHBondContact O-NH2 2.93Å; Y65-R69 VanDerWaalsContact O-NH2 3.13Å; Y65-F74 WeakPolarHBondContact O-CZ 3.46Å
66	G	92.3	Very high	92	Very high	14 Å²	14	75.1 Å²	75.1	14%	0.144	38%	0.384	C	S	.	.			trans	-77.6	4.1	177.3	0	0	0	0	0	115.3	K62 P68 L78	K62-G66 VanDerWaalsContact O-CA 3.28Å; K62-G66 WeakPolarHBondContact O-CA 3.44Å; K62-G66 PolarHBondContact O-N 2.92Å; G66-P68 WeakPolarHBondContact O-CD 3.48Å; G66-L78 VanDerWaalsContact O-CD1 3.23Å; G66-L78 WeakPolarHBondContact O-CD1 2.93Å
67	V	89.3	Confident	92	Very high	82 Å²	82	72.9 Å²	72.9	50%	0.497	37%	0.374	S	S	.	.	S	Bend	trans	-56.2	122.4	171.2	-177.8	0	0	0	0	109.4	Y65 R69 F74	Y65-V67 PolarHBondContact O-N 2.9Å; V67-R69 WeakPolarHBondContact O-CG 3.42Å; V67-F74 WeakPolarHBondContact O-CE1 3.23Å
68	P	83.8	Confident	91.9	Very high	95 Å²	95	72.7 Å²	72.7	62%	0.617	37%	0.372	S	S	*	.			trans	-54.4	142.9	-179.2	-29.1	36.4	0	0	0	113.2	G66	G66-P68 WeakPolarHBondContact O-CD 3.48Å
69	R	83.6	Confident	91.8	Very high	84 Å²	84	79.9 Å²	79.9	32%	0.317	40%	0.399	S	S	.	.			trans	-127.4	159.1	-177.7	-55.4	175.9	-162.8	-97.1	-7.5	110.1	Y65 V67 K71 F74 Q75	Y65-R69 PolarHBondContact O-NH2 2.93Å; Y65-R69 VanDerWaalsContact O-NH2 3.13Å; V67-R69 WeakPolarHBondContact O-CG 3.42Å; R69-K71 PolarHBondContact O-N 2.99Å; R69-F74 HydrophobicContact CB-CD1 3.75Å; R69-F74 HydrophobicContact CB-CE1 4.13Å; R69-F74 HydrophobicContact CG-CD1 3.72Å; R69-F74 HydrophobicContact CG-CE1 3.57Å; R69-F74 HydrophobicContact CG-CZ 4.34Å; R69-Q75 PolarHBondContact O-NE2 3.17Å
70	N	79.3	Confident	91.9	Very high	174 Å²	174	76.1 Å²	76.1	93%	0.93	38%	0.382	S	S	*	.	S	Bend	trans	-69.1	26.3	-180	-55.2	18.7	0	0	0	114.6
71	K	86.8	Confident	92	Very high	117 Å²	117	70.2 Å²	70.2	51%	0.509	36%	0.356	S	S	.	.			trans	-114.9	111.5	172	-71.7	-170.3	173.3	-163.9	0	108.1	W19 R69 V73 F74 Q75	W19-K71 HydrophobicContact CZ3-CD 4.42Å; R69-K71 PolarHBondContact O-N 2.99Å; K71-V73 VanDerWaalsContact C-N 3.25Å; K71-V73 PolarHBondContact O-N 3.22Å; K71-F74 HydrophobicContact CB-CB 3.94Å; K71-F74 WeakPolarHBondContact O-CB 3.36Å; K71-F74 PolarHBondContact O-N 3.27Å; K71-Q75 PolarHBondContact O-N 3.42Å
72	A	91.9	Very high	91.9	Very high	57 Å²	57	72.6 Å²	72.6	47%	0.471	37%	0.368	S	S	.	.	H	α-helix	trans	-51.7	-44.9	178.8	0	0	0	0	0	112.2	F74 Q75 A76	A72-F74 PolarHBondContact O-N 2.87Å; A72-Q75 WeakPolarHBondContact O-CA 3.29Å; A72-Q75 WeakPolarHBondContact O-CB 3.47Å; A72-Q75 PolarHBondContact O-N 3.47Å; A72-A76 PolarHBondContact O-N 3.31Å
73	V	93.1	Very high	91.9	Very high	73 Å²	73	74.1 Å²	74.1	44%	0.442	38%	0.376	S	S	.	.	H	α-helix	trans	-58.8	-31.4	178.1	-160.7	0	0	0	0	113.5	W19 G43 T44 K71 G77	W19-V73 HydrophobicContact CH2-CB 4.4Å; W19-V73 HydrophobicContact CZ2-CB 4.37Å; W19-V73 HydrophobicContact CZ2-CG1 4.18Å; G43-V73 WeakPolarHBondContact O-CG1 3.12Å; T44-V73 HydrophobicContact CG2-CG1 3.56Å; K71-V73 VanDerWaalsContact C-N 3.25Å; K71-V73 PolarHBondContact O-N 3.22Å; V73-G77 PolarHBondContact O-N 2.83Å
74	F	94.4	Very high	91.9	Very high	1 Å²	1	71.5 Å²	71.5	0%	0.004	37%	0.367	C	S	.	.	H	α-helix	trans	-75.6	-33	175.3	178.4	-99.9	0	0	0	111.9	H18 W19 Y65 V67 R69 K71 A72 L78	H18-F74 WeakPolarHBondContact O-CE2 3.29Å; W19-F74 AromaticContact CD2-CD2 3.88Å; W19-F74 HydrophobicContact CD2-CD2 3.88Å; W19-F74 AromaticContact CE3-CD2 3.67Å; W19-F74 HydrophobicContact CE3-CD2 3.67Å; W19-F74 HydrophobicContact CE3-CE2 4.43Å; W19-F74 HydrophobicContact CH2-CB 3.63Å; W19-F74 HydrophobicContact CH2-CD2 4.19Å; W19-F74 HydrophobicContact CH2-CG 4.43Å; W19-F74 HydrophobicContact CZ2-CB 4.07Å; W19-F74 HydrophobicContact CZ2-CD2 4.38Å; W19-F74 HydrophobicContact CZ3-CB 3.93Å; W19-F74 AromaticContact CZ3-CD2 3.83Å; W19-F74 HydrophobicContact CZ3-CD2 3.83Å; W19-F74 HydrophobicContact CZ3-CG 4.33Å; Y65-F74 WeakPolarHBondContact O-CZ 3.46Å; V67-F74 WeakPolarHBondContact O-CE1 3.23Å; R69-F74 HydrophobicContact CB-CD1 3.75Å; R69-F74 HydrophobicContact CB-CE1 4.13Å; R69-F74 HydrophobicContact CG-CD1 3.72Å; R69-F74 HydrophobicContact CG-CE1 3.57Å; R69-F74 HydrophobicContact CG-CZ 4.34Å; K71-F74 HydrophobicContact CB-CB 3.94Å; K71-F74 WeakPolarHBondContact O-CB 3.36Å; K71-F74 PolarHBondContact O-N 3.27Å; A72-F74 PolarHBondContact O-N 2.87Å; F74-L78 HydrophobicContact CD1-CD1 3.91Å; F74-L78 HydrophobicContact CE1-CD1 3.35Å; F74-L78 HydrophobicContact CE1-CG 4.13Å; F74-L78 HydrophobicContact CZ-CD1 3.79Å; F74-L78 HydrophobicContact CZ-CG 4.19Å; F74-L78 WeakPolarHBondContact O-CG 3.25Å; F74-L78 PolarHBondContact O-N 3.1Å; F74-L78 VanDerWaalsContact O-N 3.1Å
75	Q	93.7	Very high	91.8	Very high	95 Å²	95	67.1 Å²	67.1	44%	0.444	35%	0.351	S	S	.	.	H	α-helix	trans	-73.2	-38.6	174.2	-59.3	179	10.6	0	0	111	R69 K71 A72 L78 R79	R69-Q75 PolarHBondContact O-NE2 3.17Å; K71-Q75 PolarHBondContact O-N 3.42Å; A72-Q75 WeakPolarHBondContact O-CA 3.29Å; A72-Q75 WeakPolarHBondContact O-CB 3.47Å; A72-Q75 PolarHBondContact O-N 3.47Å; Q75-L78 PolarHBondContact O-N 3.05Å; Q75-R79 PolarHBondContact O-N 2.84Å
76	A	94.8	Very high	91.6	Very high	43 Å²	43	68.6 Å²	68.6	36%	0.355	36%	0.36	S	S	.	.	H	α-helix	trans	-57.4	-51.9	171	0	0	0	0	0	110.8	A72 L78 R79 E80	A72-A76 PolarHBondContact O-N 3.31Å; A76-L78 PolarHBondContact O-N 3.32Å; A76-R79 PolarHBondContact O-N 2.75Å; A76-E80 WeakPolarHBondContact O-CB 3.15Å; A76-E80 PolarHBondContact O-N 2.81Å
77	G	96.1	Very high	91.7	Very high	0 Å²	0	69.6 Å²	69.6	0%	0	36%	0.364	C	S	.	.	H	α-helix	trans	-63.4	-24.8	176.5	0	0	0	0	0	115.1	P20 Y42 V73 I81	P20-G77 WeakPolarHBondContact CB-O 3.48Å; P20-G77 VanDerWaalsContact CG-O 3.24Å; P20-G77 WeakPolarHBondContact CG-O 3.18Å; Y42-G77 VanDerWaalsContact C-CA 3.49Å; Y42-G77 WeakPolarHBondContact CB-O 2.92Å; Y42-G77 WeakPolarHBondContact O-CA 3.2Å; V73-G77 PolarHBondContact O-N 2.83Å; G77-I81 WeakPolarHBondContact O-CG2 3.43Å; G77-I81 PolarHBondContact O-N 2.89Å
78	L	95.2	Very high	91.7	Very high	15 Å²	15	66.3 Å²	66.3	8%	0.079	34%	0.344	C	S	.	.	H	α-helix	trans	-77.5	-31	172.7	-80.6	174.4	0	0	0	113	F10 P20 Y58 G66 F74 Q75 A76 I81 E82	F10-L78 HydrophobicContact CE1-CD2 4.1Å; F10-L78 HydrophobicContact CZ-CD2 4.22Å; P20-L78 HydrophobicContact CB-CD2 4.11Å; P20-L78 HydrophobicContact CG-CD2 4.04Å; P20-L78 HydrophobicContact CG-CG 4.13Å; Y58-L78 HydrophobicContact CE2-CD2 4.46Å; G66-L78 VanDerWaalsContact O-CD1 3.23Å; G66-L78 WeakPolarHBondContact O-CD1 2.93Å; F74-L78 HydrophobicContact CD1-CD1 3.91Å; F74-L78 HydrophobicContact CE1-CD1 3.35Å; F74-L78 HydrophobicContact CE1-CG 4.13Å; F74-L78 HydrophobicContact CZ-CD1 3.79Å; F74-L78 HydrophobicContact CZ-CG 4.19Å; F74-L78 WeakPolarHBondContact O-CG 3.25Å; F74-L78 PolarHBondContact O-N 3.1Å; F74-L78 VanDerWaalsContact O-N 3.1Å; Q75-L78 PolarHBondContact O-N 3.05Å; A76-L78 PolarHBondContact O-N 3.32Å; L78-I81 VanDerWaalsContact O-CG2 3.32Å; L78-I81 WeakPolarHBondContact O-CG2 3.32Å; L78-E82 WeakPolarHBondContact O-CG 3.26Å
79	R	94.4	Very high	92.1	Very high	161 Å²	161	62.4 Å²	62.4	61%	0.608	32%	0.317	S	S	*	.	H	α-helix	trans	-74.6	-45.3	171.6	-165.7	-166.5	-59.3	161.9	-1.3	110.7	Q75 A76 I81 E82 E83	Q75-R79 PolarHBondContact O-N 2.84Å; A76-R79 PolarHBondContact O-N 2.75Å; R79-I81 VanDerWaalsContact C-N 3.35Å; R79-I81 PolarHBondContact O-N 2.83Å; R79-E82 CarbonylContact O-C 3.57Å; R79-E82 WeakPolarHBondContact O-CA 3.47Å; R79-E82 WeakPolarHBondContact O-CB 3.48Å; R79-E82 PolarHBondContact O-N 3.43Å; R79-E83 WeakPolarHBondContact CD-OE2 3.42Å; R79-E83 HydrophobicContact CG-CB 4.43Å; R79-E83 WeakPolarHBondContact CG-OE2 3.38Å; R79-E83 VanDerWaalsContact O-CB 3.3Å; R79-E83 WeakPolarHBondContact O-CB 3.37Å; R79-E83 PolarHBondContact O-N 3.35Å
80	E	95.9	Very high	92.3	Very high	34 Å²	34	60.2 Å²	60.2	16%	0.159	31%	0.309	C	S	.	.	H	α-helix	trans	-61.4	-37.1	-175.6	-166.9	-177.3	88.4	0	0	112.9	Y42 G43 H45 A76 E82 N84 V87	Y42-E80 WeakPolarHBondContact CA-OE1 3.39Å; Y42-E80 VanDerWaalsContact CB-OE1 3.31Å; Y42-E80 WeakPolarHBondContact CB-OE1 3.25Å; Y42-E80 HydrophobicContact CD1-CB 4.28Å; Y42-E80 HydrophobicContact CD1-CG 3.89Å; Y42-E80 VanDerWaalsContact CD1-OE1 3.3Å; Y42-E80 WeakPolarHBondContact CD1-OE1 3.42Å; G43-E80 PolarHBondContact N-OE1 3.27Å; H45-E80 IonicContact CD2-OE1 3.94Å; H45-E80 PolarHBondContact CD2-OE1 2.99Å; H45-E80 IonicContact CD2-OE2 2.71Å; H45-E80 IonicContact CE1-OE2 3.11Å; H45-E80 VanDerWaalsContact NE2-CD 3.25Å; H45-E80 IonicContact NE2-OE1 3.06Å; H45-E80 PolarHBondContact NE2-OE1 3.22Å; H45-E80 IonicContact NE2-OE2 2.75Å; H45-E80 PolarHBondContact NE2-OE2 3.31Å; A76-E80 WeakPolarHBondContact O-CB 3.15Å; A76-E80 PolarHBondContact O-N 2.81Å; E80-E82 VanDerWaalsContact C-N 3.27Å; E80-E82 PolarHBondContact O-N 2.83Å; E80-N84 CarbonylContact O-C 3.04Å; E80-N84 WeakPolarHBondContact O-CA 3.42Å; E80-N84 PolarHBondContact O-N 3.32Å; E80-V87 HydrophobicContact CG-CG1 3.88Å
81	I	95.7	Very high	92.7	Very high	0 Å²	0	60.5 Å²	60.5	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-69.9	-20	173.2	-168.4	165.5	0	0	0	113.9	K8 P20 S21 Y42 Y58 G77 L78 R79	K8-I81 HydrophobicContact CB-CD1 4.2Å; K8-I81 HydrophobicContact CB-CG1 4.47Å; K8-I81 HydrophobicContact CD-CG1 4.09Å; K8-I81 HydrophobicContact CG-CD1 4.49Å; K8-I81 HydrophobicContact CG-CG1 4.26Å; K8-I81 PolarHBondContact NZ-O 3.28Å; P20-I81 HydrophobicContact CB-CB 4.32Å; P20-I81 HydrophobicContact CB-CD1 4Å; P20-I81 HydrophobicContact CB-CG2 3.9Å; S21-I81 WeakPolarHBondContact O-CD1 3.12Å; Y42-I81 HydrophobicContact CD1-CB 4.42Å; Y42-I81 HydrophobicContact CD2-CB 3.6Å; Y42-I81 HydrophobicContact CD2-CD1 3.7Å; Y42-I81 HydrophobicContact CD2-CG1 3.78Å; Y42-I81 HydrophobicContact CE1-CB 4.48Å; Y42-I81 HydrophobicContact CE2-CB 3.67Å; Y42-I81 HydrophobicContact CE2-CD1 3.44Å; Y42-I81 VanDerWaalsContact CE2-CD1 3.44Å; Y42-I81 HydrophobicContact CE2-CG1 3.38Å; Y42-I81 HydrophobicContact CG-CB 3.99Å; Y58-I81 HydrophobicContact CD2-CD1 3.57Å; Y58-I81 HydrophobicContact CD2-CG1 4.45Å; Y58-I81 HydrophobicContact CE2-CD1 3.84Å; Y58-I81 HydrophobicContact CE2-CG1 4.36Å; Y58-I81 HydrophobicContact CE2-CG2 3.73Å; Y58-I81 HydrophobicContact CG-CD1 4.01Å; G77-I81 WeakPolarHBondContact O-CG2 3.43Å; G77-I81 PolarHBondContact O-N 2.89Å; L78-I81 VanDerWaalsContact O-CG2 3.32Å; L78-I81 WeakPolarHBondContact O-CG2 3.32Å; R79-I81 VanDerWaalsContact C-N 3.35Å; R79-I81 PolarHBondContact O-N 2.83Å
82	E	93.5	Very high	92.7	Very high	102 Å²	102	61.4 Å²	61.4	48%	0.477	31%	0.306	S	S	.	.	H	α-helix	trans	-91.5	-44.8	177.2	-66.1	175.7	171	0	0	111.2	Y58 K62 L78 R79 E80	Y58-E82 WeakPolarHBondContact OH-CG 3.1Å; Y58-E82 PolarHBondContact OH-OE1 3.12Å; K62-E82 WeakPolarHBondContact CE-OE1 3.38Å; K62-E82 IonicContact NZ-OE1 3.63Å; K62-E82 PolarHBondContact NZ-OE1 3.23Å; L78-E82 WeakPolarHBondContact O-CG 3.26Å; R79-E82 CarbonylContact O-C 3.57Å; R79-E82 WeakPolarHBondContact O-CA 3.47Å; R79-E82 WeakPolarHBondContact O-CB 3.48Å; R79-E82 PolarHBondContact O-N 3.43Å; E80-E82 VanDerWaalsContact C-N 3.27Å; E80-E82 PolarHBondContact O-N 2.83Å
83	E	93.5	Very high	92.5	Very high	121 Å²	121	60.7 Å²	60.7	57%	0.565	29%	0.294	S	S	*	.	H	α-helix	trans	-88.3	-47.1	-172	-168.2	-176.8	172.8	0	0	113	R79	R79-E83 WeakPolarHBondContact CD-OE2 3.42Å; R79-E83 HydrophobicContact CG-CB 4.43Å; R79-E83 WeakPolarHBondContact CG-OE2 3.38Å; R79-E83 VanDerWaalsContact O-CB 3.3Å; R79-E83 WeakPolarHBondContact O-CB 3.37Å; R79-E83 PolarHBondContact O-N 3.35Å
84	N	92.1	Very high	92.2	Very high	90 Å²	90	63 Å²	63	48%	0.481	31%	0.311	S	S	.	.			trans	-134.8	61.9	-172.6	-72.8	-62.6	0	0	0	111.5	E80 D86 V87	E80-N84 CarbonylContact O-C 3.04Å; E80-N84 WeakPolarHBondContact O-CA 3.42Å; E80-N84 PolarHBondContact O-N 3.32Å; N84-D86 PolarHBondContact O-N 3.42Å; N84-D86 VanDerWaalsContact O-N 3.13Å; N84-V87 VanDerWaalsContact O-CG1 3.27Å; N84-V87 WeakPolarHBondContact O-CG1 3.34Å; N84-V87 PolarHBondContact O-N 3.1Å
85	P	93.4	Very high	92	Very high	27 Å²	27	68.9 Å²	68.9	18%	0.175	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-25.5	-173.5	26.7	-36.1	0	0	0	113.9	R22 Y42	R22-P85 PolarHBondContact NH1-O 2.96Å; Y42-P85 VanDerWaalsContact CE1-O 3.32Å; Y42-P85 WeakPolarHBondContact CE1-O 3.48Å; Y42-P85 WeakPolarHBondContact OH-CA 3.36Å; Y42-P85 PolarHBondContact OH-O 2.88Å
86	D	91.8	Very high	91.8	Very high	55 Å²	55	64.3 Å²	64.3	29%	0.294	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.6	3.2	-175.9	-59.5	-65.6	0	0	0	114.3	N84 L88 L89 K92	N84-D86 PolarHBondContact O-N 3.42Å; N84-D86 VanDerWaalsContact O-N 3.13Å; D86-L88 PolarHBondContact O-N 2.9Å; D86-L89 HydrophobicContact CB-CB 4.35Å; D86-L89 HydrophobicContact CB-CD2 4.35Å; D86-L89 WeakPolarHBondContact O-CB 3.26Å; D86-L89 PolarHBondContact O-N 2.88Å; D86-L89 VanDerWaalsContact OD1-CD2 3.27Å; D86-L89 WeakPolarHBondContact OD1-CD2 3.43Å; D86-K92 HydrophobicContact CB-CD 3.8Å; D86-K92 HydrophobicContact CB-CG 4.29Å; D86-K92 IonicContact OD1-NZ 3.9Å; D86-K92 WeakPolarHBondContact OD2-CE 3.26Å; D86-K92 IonicContact OD2-NZ 3.84Å; D86-K92 PolarHBondContact OD2-NZ 3.3Å
87	V	92.6	Very high	91.5	Very high	36 Å²	36	65.9 Å²	65.9	22%	0.218	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.2	121.2	179.8	64.4	0	0	0	0	111.6	R22 F40 Y42 E80 N84 L89	R22-V87 PolarHBondContact NH1-O 2.77Å; R22-V87 PolarHBondContact NH2-O 2.88Å; F40-V87 HydrophobicContact CE1-CG1 4.16Å; F40-V87 HydrophobicContact CZ-CG1 4.26Å; Y42-V87 HydrophobicContact CD1-CG1 4.14Å; Y42-V87 HydrophobicContact CE1-CG1 4.13Å; E80-V87 HydrophobicContact CG-CG1 3.88Å; N84-V87 VanDerWaalsContact O-CG1 3.27Å; N84-V87 WeakPolarHBondContact O-CG1 3.34Å; N84-V87 PolarHBondContact O-N 3.1Å; V87-L89 VanDerWaalsContact C-N 3.26Å; V87-L89 PolarHBondContact O-N 3.08Å
88	L	89.8	Confident	91.2	Very high	13 Å²	13	69.7 Å²	69.7	7%	0.068	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	58.2	31.3	-174.6	-53.5	168.4	0	0	0	114	R22 F40 H45 D86 D93 E95 F99	R22-L88 VanDerWaalsContact NH2-C 3.26Å; R22-L88 PolarHBondContact NH2-O 2.71Å; R22-L88 VanDerWaalsContact NH2-O 3.08Å; F40-L88 HydrophobicContact CE2-CB 4.02Å; F40-L88 HydrophobicContact CE2-CD1 4.16Å; F40-L88 HydrophobicContact CZ-CB 4.3Å; F40-L88 HydrophobicContact CZ-CD1 4.31Å; H45-L88 HydrophobicContact CB-CD1 4.37Å; D86-L88 PolarHBondContact O-N 2.9Å; L88-D93 WeakPolarHBondContact CA-OD2 3.48Å; L88-D93 PolarHBondContact N-OD2 3.33Å; L88-E95 HydrophobicContact CD2-CB 3.91Å; L88-E95 HydrophobicContact CD2-CG 3.93Å; L88-F99 HydrophobicContact CB-CD1 3.94Å; L88-F99 HydrophobicContact CB-CE1 4.29Å; L88-F99 HydrophobicContact CB-CG 4.27Å; L88-F99 HydrophobicContact CD1-CB 4.46Å; L88-F99 HydrophobicContact CD1-CD1 4.17Å; L88-F99 HydrophobicContact CD1-CD2 3.7Å; L88-F99 HydrophobicContact CD1-CE1 4.35Å; L88-F99 HydrophobicContact CD1-CE2 3.88Å; L88-F99 HydrophobicContact CD1-CG 3.85Å; L88-F99 HydrophobicContact CD1-CZ 4.22Å; L88-F99 HydrophobicContact CD2-CB 3.94Å; L88-F99 HydrophobicContact CD2-CG 4.2Å; L88-F99 HydrophobicContact CG-CD1 4.48Å; L88-F99 HydrophobicContact CG-CG 4.33Å
89	L	91.8	Very high	91	Very high	13 Å²	13	70.2 Å²	70.2	7%	0.068	34%	0.342	C	S	.	.			trans	-85.4	125.6	174	-174.7	65.5	0	0	0	111.3	L25 D86 V87 K91 K92 D93 A96	L25-L89 HydrophobicContact CB-CD1 4.26Å; L25-L89 HydrophobicContact CD1-CD1 3.83Å; L25-L89 HydrophobicContact CD1-CG 4.46Å; D86-L89 HydrophobicContact CB-CB 4.35Å; D86-L89 HydrophobicContact CB-CD2 4.35Å; D86-L89 WeakPolarHBondContact O-CB 3.26Å; D86-L89 PolarHBondContact O-N 2.88Å; D86-L89 VanDerWaalsContact OD1-CD2 3.27Å; D86-L89 WeakPolarHBondContact OD1-CD2 3.43Å; V87-L89 VanDerWaalsContact C-N 3.26Å; V87-L89 PolarHBondContact O-N 3.08Å; L89-K91 PolarHBondContact O-N 3.32Å; L89-K92 HydrophobicContact CD2-CB 4.46Å; L89-K92 PolarHBondContact O-N 2.97Å; L89-D93 PolarHBondContact O-N 3.23Å; L89-A96 VanDerWaalsContact C-CB 3.46Å; L89-A96 WeakPolarHBondContact O-CB 3.49Å
90	Y	88.9	Confident	90.8	Very high	37 Å²	37	62.5 Å²	62.5	15%	0.145	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.7	138.3	-179.7	-166.9	-114.5	0	0	0	112.3	L25 P27 K92 E97 L100	L25-Y90 WeakPolarHBondContact O-CB 3.38Å; P27-Y90 HydrophobicContact CB-CE1 4.26Å; P27-Y90 HydrophobicContact CG-CD1 4.45Å; P27-Y90 HydrophobicContact CG-CD2 4.28Å; P27-Y90 HydrophobicContact CG-CE1 4Å; P27-Y90 HydrophobicContact CG-CE2 3.79Å; Y90-K92 PolarHBondContact O-N 3.32Å; Y90-E97 HydrophobicContact CD2-CG 4.48Å; Y90-E97 HydrophobicContact CE2-CG 3.85Å; Y90-E97 WeakPolarHBondContact CE2-OE1 3.46Å; Y90-E97 VanDerWaalsContact CZ-OE1 3.3Å; Y90-E97 PolarHBondContact OH-OE1 2.94Å; Y90-L100 HydrophobicContact CD2-CD1 3.85Å; Y90-L100 HydrophobicContact CG-CD1 4.13Å
91	K	86.3	Confident	90.5	Very high	181 Å²	181	62.9 Å²	62.9	79%	0.787	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.4	-11.3	-170.5	-51.4	-174.4	177.9	-175.5	0	117.4	L89	L89-K91 PolarHBondContact O-N 3.32Å
92	K	87.6	Confident	90.2	Very high	136 Å²	136	70.2 Å²	70.2	59%	0.591	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.9	-35.1	-179.1	-171	162.9	177	-175.2	0	113.5	D86 L89 Y90	D86-K92 HydrophobicContact CB-CD 3.8Å; D86-K92 HydrophobicContact CB-CG 4.29Å; D86-K92 IonicContact OD1-NZ 3.9Å; D86-K92 WeakPolarHBondContact OD2-CE 3.26Å; D86-K92 IonicContact OD2-NZ 3.84Å; D86-K92 PolarHBondContact OD2-NZ 3.3Å; L89-K92 HydrophobicContact CD2-CB 4.46Å; L89-K92 PolarHBondContact O-N 2.97Å; Y90-K92 PolarHBondContact O-N 3.32Å
93	D	87.3	Confident	90	Very high	41 Å²	41	69.7 Å²	69.7	22%	0.219	35%	0.352	C	S	.	.			trans	-107.8	125.6	174.9	-178.2	-23.5	0	0	0	109.5	L88 L89 E95 A96	L88-D93 WeakPolarHBondContact CA-OD2 3.48Å; L88-D93 PolarHBondContact N-OD2 3.33Å; L89-D93 PolarHBondContact O-N 3.23Å; D93-E95 VanDerWaalsContact C-N 3.27Å; D93-E95 PolarHBondContact O-N 3.49Å; D93-E95 WeakPolarHBondContact OD1-CB 3.38Å; D93-E95 PolarHBondContact OD1-N 3.03Å; D93-A96 HydrophobicContact CB-CB 4.22Å; D93-A96 WeakPolarHBondContact O-CB 3.37Å; D93-A96 PolarHBondContact O-N 3.34Å; D93-A96 VanDerWaalsContact O-N 3.07Å
94	P	88.4	Confident	89.7	Confident	121 Å²	121	65.1 Å²	65.1	79%	0.786	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	-25.9	178.9	27.3	-34.9	0	0	0	113.5	A96	P94-A96 VanDerWaalsContact C-N 3.25Å; P94-A96 PolarHBondContact O-N 3.13Å
95	E	88.8	Confident	89	Confident	125 Å²	125	66.5 Å²	66.5	58%	0.584	35%	0.347	S	S	*	.	H	α-helix	trans	-77.7	-11.3	174.5	-165.9	169.3	-168.5	0	0	112	L88 D93 E97 T98 F99	L88-E95 HydrophobicContact CD2-CB 3.91Å; L88-E95 HydrophobicContact CD2-CG 3.93Å; D93-E95 VanDerWaalsContact C-N 3.27Å; D93-E95 PolarHBondContact O-N 3.49Å; D93-E95 WeakPolarHBondContact OD1-CB 3.38Å; D93-E95 PolarHBondContact OD1-N 3.03Å; E95-E97 VanDerWaalsContact C-N 3.28Å; E95-E97 PolarHBondContact O-N 2.88Å; E95-T98 PolarHBondContact O-N 3.21Å; E95-T98 PolarHBondContact O-OG1 2.87Å; E95-F99 VanDerWaalsContact O-CB 3.27Å; E95-F99 WeakPolarHBondContact O-CB 3.33Å; E95-F99 PolarHBondContact O-N 3.09Å
96	A	90.3	Very high	88.4	Confident	0 Å²	0	66.9 Å²	66.9	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-61.9	-32.7	176.2	0	0	0	0	0	113.1	L89 D93 P94 L100	L89-A96 VanDerWaalsContact C-CB 3.46Å; L89-A96 WeakPolarHBondContact O-CB 3.49Å; D93-A96 HydrophobicContact CB-CB 4.22Å; D93-A96 WeakPolarHBondContact O-CB 3.37Å; D93-A96 PolarHBondContact O-N 3.34Å; D93-A96 VanDerWaalsContact O-N 3.07Å; P94-A96 VanDerWaalsContact C-N 3.25Å; P94-A96 PolarHBondContact O-N 3.13Å; A96-L100 WeakPolarHBondContact O-CB 3.46Å; A96-L100 WeakPolarHBondContact O-CG 3.2Å; A96-L100 PolarHBondContact O-N 2.66Å
97	E	87.7	Confident	87	Confident	75 Å²	75	72.7 Å²	72.7	35%	0.35	37%	0.369	S	S	.	.	H	α-helix	trans	-66.6	-45.9	177.4	-69.8	-119.1	140	0	0	111.8	Y90 E95 A101	Y90-E97 HydrophobicContact CD2-CG 4.48Å; Y90-E97 HydrophobicContact CE2-CG 3.85Å; Y90-E97 WeakPolarHBondContact CE2-OE1 3.46Å; Y90-E97 VanDerWaalsContact CZ-OE1 3.3Å; Y90-E97 PolarHBondContact OH-OE1 2.94Å; E95-E97 VanDerWaalsContact C-N 3.28Å; E95-E97 PolarHBondContact O-N 2.88Å; E97-A101 WeakPolarHBondContact O-CB 3.43Å; E97-A101 PolarHBondContact O-N 3.2Å; E97-A101 VanDerWaalsContact O-N 3.12Å
98	T	90.2	Very high	85.7	Confident	80 Å²	80	79.4 Å²	79.4	49%	0.491	39%	0.39	S	S	.	.	H	α-helix	trans	-70.8	-41.3	-179.9	46.1	0	0	0	0	111.4	E95	E95-T98 PolarHBondContact O-N 3.21Å; E95-T98 PolarHBondContact O-OG1 2.87Å
99	F	91.6	Very high	84	Confident	26 Å²	26	81.9 Å²	81.9	11%	0.114	42%	0.419	C	S	.	.	H	α-helix	trans	-60.8	-51.2	173	170.3	-100.3	0	0	0	112.1	F40 H45 V47 L88 E95 A101 Q102 F103	F40-F99 AromaticContact CD2-CE1 3.94Å; F40-F99 HydrophobicContact CD2-CE1 3.94Å; F40-F99 HydrophobicContact CD2-CZ 4.07Å; F40-F99 AromaticContact CE2-CE1 3.76Å; F40-F99 HydrophobicContact CE2-CE1 3.76Å; F40-F99 AromaticContact CE2-CZ 3.7Å; F40-F99 HydrophobicContact CE2-CZ 3.7Å; H45-F99 HydrophobicContact CB-CE2 4.05Å; H45-F99 HydrophobicContact CB-CZ 4.23Å; H45-F99 WeakPolarHBondContact O-CE2 3.47Å; H45-F99 VanDerWaalsContact O-CZ 3.28Å; H45-F99 WeakPolarHBondContact O-CZ 3.14Å; V47-F99 HydrophobicContact CG1-CE1 4.11Å; V47-F99 HydrophobicContact CG1-CZ 4.2Å; L88-F99 HydrophobicContact CB-CD1 3.94Å; L88-F99 HydrophobicContact CB-CE1 4.29Å; L88-F99 HydrophobicContact CB-CG 4.27Å; L88-F99 HydrophobicContact CD1-CB 4.46Å; L88-F99 HydrophobicContact CD1-CD1 4.17Å; L88-F99 HydrophobicContact CD1-CD2 3.7Å; L88-F99 HydrophobicContact CD1-CE1 4.35Å; L88-F99 HydrophobicContact CD1-CE2 3.88Å; L88-F99 HydrophobicContact CD1-CG 3.85Å; L88-F99 HydrophobicContact CD1-CZ 4.22Å; L88-F99 HydrophobicContact CD2-CB 3.94Å; L88-F99 HydrophobicContact CD2-CG 4.2Å; L88-F99 HydrophobicContact CG-CD1 4.48Å; L88-F99 HydrophobicContact CG-CG 4.33Å; E95-F99 VanDerWaalsContact O-CB 3.27Å; E95-F99 WeakPolarHBondContact O-CB 3.33Å; E95-F99 PolarHBondContact O-N 3.09Å; F99-A101 VanDerWaalsContact C-N 3.28Å; F99-A101 PolarHBondContact O-N 3.04Å; F99-Q102 WeakPolarHBondContact O-CB 3.27Å; F99-Q102 PolarHBondContact O-N 3.46Å; F99-F103 AromaticContact CD2-CE2 4Å; F99-F103 HydrophobicContact CD2-CE2 4Å; F99-F103 HydrophobicContact CE1-CE2 4.33Å; F99-F103 HydrophobicContact CE2-CD2 4.38Å; F99-F103 AromaticContact CE2-CE2 3.5Å; F99-F103 HydrophobicContact CE2-CE2 3.5Å; F99-F103 VanDerWaalsContact CE2-CE2 3.5Å; F99-F103 HydrophobicContact CE2-CZ 4.21Å; F99-F103 HydrophobicContact CZ-CD2 4.26Å; F99-F103 AromaticContact CZ-CE2 3.67Å; F99-F103 HydrophobicContact CZ-CE2 3.67Å; F99-F103 HydrophobicContact CZ-CZ 4.4Å; F99-F103 WeakPolarHBondContact O-CD2 3.34Å
100	L	89.8	Confident	81.3	Confident	0 Å²	0	86.5 Å²	86.5	0%	0	45%	0.451	C	S	.	.	H	α-helix	trans	-66.3	-30.3	-178.2	-70.6	175.1	0	0	0	112.7	L26 Y90 A96 Q102 F103 Y104 F106	L26-L100 HydrophobicContact CD2-CD1 4.02Å; L26-L100 HydrophobicContact CD2-CD2 3.77Å; Y90-L100 HydrophobicContact CD2-CD1 3.85Å; Y90-L100 HydrophobicContact CG-CD1 4.13Å; A96-L100 WeakPolarHBondContact O-CB 3.46Å; A96-L100 WeakPolarHBondContact O-CG 3.2Å; A96-L100 PolarHBondContact O-N 2.66Å; L100-Q102 PolarHBondContact O-N 2.7Å; L100-F103 PolarHBondContact O-N 2.81Å; L100-Y104 HydrophobicContact CB-CD2 4.34Å; L100-Y104 HydrophobicContact CD2-CD2 3.9Å; L100-Y104 HydrophobicContact CD2-CE2 3.78Å; L100-Y104 PolarHBondContact O-N 2.75Å; L100-F106 HydrophobicContact CB-CE1 4.09Å; L100-F106 HydrophobicContact CB-CZ 4.48Å
101	A	89	Confident	79.1	Confident	42 Å²	42	94 Å²	94	35%	0.347	48%	0.484	S	S	.	.	H	α-helix	trans	-63.8	-17.1	173.6	0	0	0	0	0	113.5	E97 F99 F106	E97-A101 WeakPolarHBondContact O-CB 3.43Å; E97-A101 PolarHBondContact O-N 3.2Å; E97-A101 VanDerWaalsContact O-N 3.12Å; F99-A101 VanDerWaalsContact C-N 3.28Å; F99-A101 PolarHBondContact O-N 3.04Å; A101-F106 HydrophobicContact CB-CE1 4.15Å; A101-F106 HydrophobicContact CB-CZ 4.18Å
102	Q	89.7	Confident	77	Confident	154 Å²	154	92.5 Å²	92.5	72%	0.72	49%	0.485	S	S	*	.	H	α-helix	trans	-73.5	-27.8	172.4	-165.3	179.8	39.4	0	0	112.7	F99 L100	F99-Q102 WeakPolarHBondContact O-CB 3.27Å; F99-Q102 PolarHBondContact O-N 3.46Å; L100-Q102 PolarHBondContact O-N 2.7Å
103	F	89	Confident	74.7	Confident	90 Å²	90	93.2 Å²	93.2	40%	0.395	50%	0.501	S	S	.	.	H	α-helix	trans	-110.4	-24.6	-174.2	-61.3	-86.1	0	0	0	113.7	V47 F99 L100	V47-F103 HydrophobicContact CG2-CB 3.62Å; V47-F103 HydrophobicContact CG2-CD1 3.48Å; V47-F103 VanDerWaalsContact CG2-CD1 3.48Å; V47-F103 HydrophobicContact CG2-CD2 3.9Å; V47-F103 HydrophobicContact CG2-CE1 4.08Å; V47-F103 HydrophobicContact CG2-CE2 4.46Å; V47-F103 HydrophobicContact CG2-CG 3.37Å; F99-F103 AromaticContact CD2-CE2 4Å; F99-F103 HydrophobicContact CD2-CE2 4Å; F99-F103 HydrophobicContact CE1-CE2 4.33Å; F99-F103 HydrophobicContact CE2-CD2 4.38Å; F99-F103 AromaticContact CE2-CE2 3.5Å; F99-F103 HydrophobicContact CE2-CE2 3.5Å; F99-F103 VanDerWaalsContact CE2-CE2 3.5Å; F99-F103 HydrophobicContact CE2-CZ 4.21Å; F99-F103 HydrophobicContact CZ-CD2 4.26Å; F99-F103 AromaticContact CZ-CE2 3.67Å; F99-F103 HydrophobicContact CZ-CE2 3.67Å; F99-F103 HydrophobicContact CZ-CZ 4.4Å; F99-F103 WeakPolarHBondContact O-CD2 3.34Å; L100-F103 PolarHBondContact O-N 2.81Å
104	Y	87.6	Confident	72.3	Confident	25 Å²	25	94.8 Å²	94.8	10%	0.098	53%	0.526	C	S	.	.			trans	-133	132.1	-172.8	-54.9	-68.6	0	0	0	111.6	L26 V30 V47 F49 L100 F106	L26-Y104 HydrophobicContact CD1-CE2 4.38Å; L26-Y104 HydrophobicContact CD2-CD2 3.84Å; L26-Y104 HydrophobicContact CD2-CE2 3.51Å; V30-Y104 HydrophobicContact CG1-CD1 3.62Å; V30-Y104 HydrophobicContact CG1-CE1 4.3Å; V30-Y104 HydrophobicContact CG1-CG 3.83Å; V47-Y104 HydrophobicContact CB-CE2 4.48Å; V47-Y104 HydrophobicContact CG2-CE2 3.96Å; F49-Y104 AromaticContact CE2-CE1 3.72Å; F49-Y104 HydrophobicContact CE2-CE1 3.72Å; F49-Y104 HydrophobicContact CZ-CD1 4.38Å; F49-Y104 AromaticContact CZ-CE1 3.53Å; F49-Y104 HydrophobicContact CZ-CE1 3.53Å; L100-Y104 HydrophobicContact CB-CD2 4.34Å; L100-Y104 HydrophobicContact CD2-CD2 3.9Å; L100-Y104 HydrophobicContact CD2-CE2 3.78Å; L100-Y104 PolarHBondContact O-N 2.75Å; Y104-F106 WeakPolarHBondContact O-CD1 3.32Å; Y104-F106 PolarHBondContact O-N 2.85Å
105	S	77	Confident	70.1	Confident	119 Å²	119	97.8 Å²	97.8	83%	0.832	53%	0.53	S	S	*	.			trans	-86	103.3	172.2	59.9	0	0	0	0	110.7
106	F	80.3	Confident	67.5	Low	35 Å²	35	99.5 Å²	99.5	15%	0.154	54%	0.543	C	S	.	.			trans	-124	161	168.6	56.6	-83.7	0	0	0	110.3	P27 D29 V30 L100 A101 Y104	P27-F106 HydrophobicContact CB-CB 4.38Å; P27-F106 HydrophobicContact CB-CD2 4.18Å; P27-F106 HydrophobicContact CB-CG 4.21Å; P27-F106 HydrophobicContact CG-CD1 4Å; P27-F106 HydrophobicContact CG-CD2 3.83Å; P27-F106 HydrophobicContact CG-CE1 4.07Å; P27-F106 HydrophobicContact CG-CE2 3.9Å; P27-F106 HydrophobicContact CG-CG 3.88Å; P27-F106 HydrophobicContact CG-CZ 4.03Å; D29-F106 HydrophobicContact CB-CB 3.63Å; V30-F106 HydrophobicContact CG2-CB 3.92Å; V30-F106 HydrophobicContact CG2-CD1 4Å; V30-F106 HydrophobicContact CG2-CG 4.3Å; L100-F106 HydrophobicContact CB-CE1 4.09Å; L100-F106 HydrophobicContact CB-CZ 4.48Å; A101-F106 HydrophobicContact CB-CE1 4.15Å; A101-F106 HydrophobicContact CB-CZ 4.18Å; Y104-F106 WeakPolarHBondContact O-CD1 3.32Å; Y104-F106 PolarHBondContact O-N 2.85Å
107	K	63.9	Low	65	Low	178 Å²	178	105.3 Å²	105.3	77%	0.774	58%	0.584	S	S	*	*			trans	-84.5	126.4	175.5	-67	-176.6	176.5	-175.6	0	109.5	D29 G109	D29-K107 WeakPolarHBondContact OD2-CB 3.35Å; D29-K107 PolarHBondContact OD2-N 2.67Å; K107-G109 PolarHBondContact O-N 3.17Å
108	R	64.4	Low	62.4	Low	176 Å²	176	108.1 Å²	108.1	66%	0.664	61%	0.606	S	S	*	*			trans	-71.2	100.3	159.8	-62	-174.1	-163.7	162.2	4.1	107.2	C110	R108-C110 PolarHBondContact O-N 3.18Å
109	G	53.5	Low	59.9	Low	65 Å²	65	112 Å²	112	67%	0.67	62%	0.622	S	S	*	*			trans	-71.8	112.1	177.7	0	0	0	0	0	110.1	K107 K111	K107-G109 PolarHBondContact O-N 3.17Å; G109-K111 PolarHBondContact O-N 3.27Å
110	C	35.9	Very low	57.3	Low	110 Å²	110	116.1 Å²	116.1	74%	0.743	65%	0.65	S	S	*	*			trans	-62.4	117.7	165.5	-174.7	0	0	0	0	108.6	R108	R108-C110 PolarHBondContact O-N 3.18Å
111	K	42.9	Very low	54.5	Low	195 Å²	195	120.8 Å²	120.8	85%	0.848	68%	0.682	S	S	*	*			trans	-135.9	70.1	172	-84.9	-166.9	171.2	-172.8	0	108.5	G109	G109-K111 PolarHBondContact O-N 3.27Å
112	D	42.9	Very low	52.1	Low	150 Å²	150	124 Å²	124	80%	0.802	70%	0.7	S	S	*	*			trans	-65.3	131.6	156.3	-76.6	-45.8	0	0	0	108.6	G114	D112-G114 PolarHBondContact O-N 3.03Å
113	T	37.7	Very low	49.3	Very low	150 Å²	150	122.5 Å²	122.5	92%	0.92	70%	0.701	S	S	*	*			trans	-77.2	113.8	-179.1	40.9	0	0	0	0	110.7
114	G	36.9	Very low	46.6	Very low	74 Å²	74	123.1 Å²	123.1	76%	0.763	71%	0.713	S	S	*	*			trans	-144.9	120.3	176.1	0	0	0	0	0	111	D112	D112-G114 PolarHBondContact O-N 3.03Å
115	Q	42.4	Very low	43.9	Very low	185 Å²	185	130.7 Å²	130.7	86%	0.864	75%	0.749	S	S	*	*			trans	-76.5	151.9	-170.6	-60.8	165.1	3.1	0	0	112.6
116	N	34.1	Very low	41.9	Very low	161 Å²	161	129.8 Å²	129.8	86%	0.861	73%	0.734	S	S	*	*			trans	41.8	92.7	153.3	-60.8	-12.1	0	0	0	118.7
117	S	39.2	Very low	40	Very low	122 Å²	122	133.1 Å²	133.1	85%	0.853	75%	0.75	S	S	*	*			trans	-141.5	121.6	151.4	-173.3	0	0	0	0	110.9
118	V	33.3	Very low	38.4	Very low	134 Å²	134	131 Å²	131	81%	0.812	76%	0.757	S	S	*	*			trans	-94.7	120	-176.4	173.5	0	0	0	0	109.8
119	L	37.4	Very low	37.3	Very low	160 Å²	160	129.7 Å²	129.7	84%	0.838	76%	0.758	S	S	*	*			trans	-151.8	83.4	157.6	-126.2	157.5	0	0	0	114.3
120	V	37.4	Very low	36.3	Very low	113 Å²	113	135.9 Å²	135.9	69%	0.685	77%	0.767	S	S	*	*			trans	41.3	104.4	144.1	-168.7	0	0	0	0	118.4	P122	V120-P122 WeakPolarHBondContact O-CD 3.26Å
121	S	29.9	Very low	36	Very low	98 Å²	98	142.1 Å²	142.1	69%	0.685	78%	0.775	S	S	*	*			trans	-79.4	124	154.5	55.3	0	0	0	0	111.7	T123	S121-T123 PolarHBondContact O-N 2.98Å; S121-T123 VanDerWaalsContact O-N 3.16Å
122	P	39.5	Very low	35.6	Very low	110 Å²	110	137.3 Å²	137.3	71%	0.714	77%	0.766	S	S	*	*			trans	-85.4	78	169.3	33.6	-33	0	0	0	111.2	V120 T124	V120-P122 WeakPolarHBondContact O-CD 3.26Å; P122-T124 PolarHBondContact O-N 2.96Å
123	T	29.8	Very low	35.1	Very low	123 Å²	123	140.6 Å²	140.6	76%	0.755	77%	0.773	S	S	*	*			trans	-74.3	102	161.7	-62.1	0	0	0	0	108.3	S121	S121-T123 PolarHBondContact O-N 2.98Å; S121-T123 VanDerWaalsContact O-N 3.16Å
124	T	33.7	Very low	34.7	Very low	103 Å²	103	137 Å²	137	63%	0.632	75%	0.754	S	S	*	*			trans	-121.1	85.5	179.1	-40.1	0	0	0	0	111.1	P122 I126	P122-T124 PolarHBondContact O-N 2.96Å; T124-I126 HydrophobicContact CG2-CD1 4Å; T124-I126 HydrophobicContact CG2-CG1 3.97Å; T124-I126 PolarHBondContact O-N 2.85Å
125	E	31	Very low	34.4	Very low	184 Å²	184	139.8 Å²	139.8	86%	0.86	76%	0.756	S	S	*	*			trans	-63.4	122.5	166.2	-63	-173.7	113.3	0	0	110.2
126	I	34.9	Very low	33.9	Very low	99 Å²	99	136.4 Å²	136.4	51%	0.508	75%	0.753	S	S	.	*			trans	-128.6	90.1	168.4	-56.8	-172.3	0	0	0	111.3	T124 K700	T124-I126 HydrophobicContact CG2-CD1 4Å; T124-I126 HydrophobicContact CG2-CG1 3.97Å; T124-I126 PolarHBondContact O-N 2.85Å; I126-K700 HydrophobicContact CG2-CD 4Å
127	Q	38.9	Very low	33.9	Very low	106 Å²	106	132.7 Å²	132.7	50%	0.495	75%	0.745	S	S	.	*			trans	67.5	73	141.2	-59.6	168.3	-2	0	0	117.9	Q129	Q127-Q129 HydrophobicContact CB-CG 3.97Å; Q127-Q129 HydrophobicContact CG-CG 4.16Å; Q127-Q129 PolarHBondContact O-N 3.06Å
128	S	30.4	Very low	33.9	Very low	132 Å²	132	135.8 Å²	135.8	92%	0.923	75%	0.746	S	S	*	*			trans	-72.3	61	144.8	46.7	0	0	0	0	110.8	K130	S128-K130 PolarHBondContact O-N 3.46Å
129	Q	40.7	Very low	34.2	Very low	149 Å²	149	134.8 Å²	134.8	70%	0.696	74%	0.74	S	S	*	*			trans	-71.4	102.8	-176	-86.3	-173.4	1.9	0	0	113	Q127	Q127-Q129 HydrophobicContact CB-CG 3.97Å; Q127-Q129 HydrophobicContact CG-CG 4.16Å; Q127-Q129 PolarHBondContact O-N 3.06Å
130	K	32.8	Very low	34.2	Very low	195 Å²	195	134.4 Å²	134.4	85%	0.848	73%	0.734	S	S	*	*				48.1	82	123.1	-168	-176.1	-177.9	177.4	0	116.2	S128	S128-K130 PolarHBondContact O-N 3.46Å
131	R	30.6	Very low	34.5	Very low	242 Å²	242	137.1 Å²	137.1	91%	0.913	74%	0.739	S	S	*	*			trans	-153.9	126.9	135.3	-120	164.8	179.6	158.5	-2.1	115.2
132	S	34.9	Very low	34.9	Very low	93 Å²	93	135.5 Å²	135.5	65%	0.65	74%	0.738	S	S	*	*			trans	-11	131.2	156	-43.6	0	0	0	0	118.1
133	K	30.9	Very low	34.7	Very low	219 Å²	219	142 Å²	142	95%	0.952	75%	0.749	S	S	*	*	S	Bend	trans	-108.4	73.3	143.1	-171.8	162.2	-176.2	168.3	0	109.4
134	S	29.3	Very low	35.3	Very low	75 Å²	75	141.6 Å²	141.6	52%	0.524	75%	0.748	S	S	.	*			trans	-151.2	141.1	176	57.3	0	0	0	0	108.1
135	T	32.6	Very low	35.4	Very low	132 Å²	132	140.9 Å²	140.9	81%	0.81	75%	0.753	S	S	*	*			trans	59.1	125.3	176.7	52.1	0	0	0	0	115.4
136	S	30.9	Very low	35.9	Very low	115 Å²	115	141.4 Å²	141.4	80%	0.804	75%	0.752	S	S	*	*				68	124.1	55.1	-166	0	0	0	0	111
137	A	34.8	Very low	36.1	Very low	83 Å²	83	148 Å²	148	69%	0.686	77%	0.771	S	S	*	*			cis	-139.8	-147.7	4.2	0	0	0	0	0	111.2
138	E	39.1	Very low	36	Very low	186 Å²	186	149.2 Å²	149.2	87%	0.869	79%	0.787	S	S	*	*			trans	71.3	130	171.9	-68	170.7	-158.5	0	0	115.1
139	T	39.7	Very low	36.3	Very low	114 Å²	114	150.9 Å²	150.9	70%	0.699	78%	0.78	S	S	*	*			cis	-143.4	176.4	3.8	-82.3	0	0	0	0	110.5
140	E	37.4	Very low	36.1	Very low	151 Å²	151	149.1 Å²	149.1	71%	0.706	78%	0.78	S	S	*	*			trans	-41	158.5	177.1	-46.7	173.3	90.3	0	0	115.4
141	H	42.6	Very low	36.2	Very low	170 Å²	170	148.1 Å²	148.1	79%	0.787	78%	0.778	S	S	*	*			cis	-139.7	-175.2	21.3	-40.8	-92.9	0	0	0	109.6
142	G	39.3	Very low	36.4	Very low	65 Å²	65	141.4 Å²	141.4	67%	0.67	77%	0.768	S	S	*	*			cis	157	74.4	1.1	0	0	0	0	0	115
143	R	35.5	Very low	36.5	Very low	247 Å²	247	148 Å²	148	93%	0.932	78%	0.779	S	S	*	*			trans	67.7	175.9	162.6	-51.3	174.6	171.1	-167.8	-2.6	117
144	P	41.3	Very low	36.6	Very low	113 Å²	113	147.3 Å²	147.3	73%	0.734	78%	0.776	S	S	*	*			cis	-115.8	151.1	-27.1	11.5	12.4	0	0	0	112.6
145	A	36.1	Very low	37.1	Very low	89 Å²	89	149.1 Å²	149.1	74%	0.736	79%	0.789	S	S	*	*				52.3	139.5	88.9	0	0	0	0	0	115.6
146	K	42.5	Very low	37.5	Very low	194 Å²	194	148.1 Å²	148.1	84%	0.843	79%	0.787	S	S	*	*			cis	-143.3	152.6	29.2	-58.8	158.3	-174.1	171	0	108.9
147	R	38.1	Very low	37.8	Very low	239 Å²	239	146.2 Å²	146.2	90%	0.902	79%	0.786	S	S	*	*				57.2	144.5	57.7	-79.1	-172.3	-178.4	178.9	1.2	113.8
148	P	37.5	Very low	38	Very low	131 Å²	131	147.9 Å²	147.9	85%	0.851	79%	0.792	S	S	*	*			cis	-137.8	-147.1	5.4	45	-24.8	0	0	0	114.7
149	H	36.6	Very low	38.2	Very low	166 Å²	166	144.1 Å²	144.1	77%	0.769	78%	0.782	S	S	*	*			trans	-69	176.1	-177.4	-138.2	-122.7	0	0	0	116.5
150	T	36.5	Very low	38.2	Very low	112 Å²	112	144.8 Å²	144.8	69%	0.687	78%	0.781	S	S	*	*			trans	73.2	127.6	154	27.4	0	0	0	0	122.6
151	E	34.8	Very low	38.4	Very low	175 Å²	175	144 Å²	144	82%	0.818	78%	0.777	S	S	*	*			trans	42.5	126.1	138.5	-68.9	-159.8	120.4	0	0	125
152	S	35.1	Very low	38.4	Very low	101 Å²	101	143.5 Å²	143.5	71%	0.706	78%	0.775	S	S	*	*			trans	96.8	135.7	131.6	85.1	0	0	0	0	121.8
153	R	36.4	Very low	38.3	Very low	232 Å²	232	144.7 Å²	144.7	88%	0.875	77%	0.772	S	S	*	*			trans	60.1	100.1	141.6	-68.9	171.8	179.4	-175.2	1.8	121.2
154	K	32.8	Very low	38.2	Very low	204 Å²	204	142.9 Å²	142.9	89%	0.887	77%	0.767	S	S	*	*				79.8	86.4	107.8	-166.7	-172.6	178.9	-176.4	0	119.3
155	S	40.7	Very low	38	Very low	113 Å²	113	142.6 Å²	142.6	79%	0.79	77%	0.768	S	S	*	*			trans	-164.2	145.9	150.2	54.4	0	0	0	0	110.1
156	S	40.6	Very low	38.1	Very low	111 Å²	111	143 Å²	143	78%	0.776	77%	0.771	S	S	*	*			cis	162.9	103.4	-30.6	45.7	0	0	0	0	106.4
157	G	36.4	Very low	37.9	Very low	75 Å²	75	140.9 Å²	140.9	77%	0.773	76%	0.764	S	S	*	*			trans	74.4	167.5	-173.9	0	0	0	0	0	113.9
158	S	40	Very low	37.8	Very low	118 Å²	118	139.2 Å²	139.2	83%	0.825	76%	0.758	S	S	*	*			cis	-174.6	164.1	-11.4	-131	0	0	0	0	107.5
159	V	42.1	Very low	37.8	Very low	107 Å²	107	138.8 Å²	138.8	65%	0.648	75%	0.749	S	S	*	*			cis	-148.1	136.6	11.4	-176	0	0	0	0	109.3
160	N	40.3	Very low	38	Very low	127 Å²	127	138.1 Å²	138.1	68%	0.679	74%	0.743	S	S	*	*			trans	60.2	156.1	157.4	-66.8	-4.8	0	0	0	121.1
161	H	42	Very low	38.1	Very low	135 Å²	135	143.6 Å²	143.6	63%	0.625	75%	0.751	S	S	*	*			cis	-150.9	130.1	-12.5	-119.2	-55.8	0	0	0	111.3
162	H	41.3	Very low	38.1	Very low	160 Å²	160	140 Å²	140	74%	0.741	75%	0.746	S	S	*	*			trans	57.8	144.5	152.3	-68.5	1.2	0	0	0	121.5
163	S	37.2	Very low	38.3	Very low	89 Å²	89	140.3 Å²	140.3	62%	0.622	75%	0.748	S	S	*	*			cis	-166	131.4	-18.9	48.8	0	0	0	0	112.3
164	Y	33.3	Very low	38.2	Very low	210 Å²	210	133.4 Å²	133.4	82%	0.824	74%	0.74	S	S	*	*			trans	4.3	127.7	151.1	-47.8	-74.6	0	0	0	118.7
165	S	38.5	Very low	38.6	Very low	106 Å²	106	129.8 Å²	129.8	74%	0.741	73%	0.729	S	S	*	*			cis	74.3	131.1	47.3	87	0	0	0	0	115.1
166	A	36.6	Very low	38.3	Very low	98 Å²	98	130.9 Å²	130.9	81%	0.81	72%	0.72	S	S	*	*			trans	-73.2	151.1	-168.8	0	0	0	0	0	115.7
167	Q	40	Very low	37.8	Very low	149 Å²	149	130.4 Å²	130.4	70%	0.696	72%	0.715	S	S	*	*				-164.4	160.8	115	-109	-170.1	21.5	0	0	112.6
168	R	35.3	Very low	38	Very low	205 Å²	205	131.8 Å²	131.8	77%	0.774	71%	0.709	S	S	*	*			trans	28	118.3	152.3	-62.5	168.5	170	143.9	-15.1	117.1
169	D	37.7	Very low	37.7	Very low	122 Å²	122	134.9 Å²	134.9	65%	0.652	71%	0.707	S	S	*	*				-158.8	171	89.5	-131.3	-7.7	0	0	0	117.1
170	K	41.4	Very low	37.4	Very low	151 Å²	151	139.6 Å²	139.6	66%	0.657	72%	0.719	S	S	*	*			trans	-24.1	153.2	167.3	-60.4	151.3	-167.9	81.5	0	118.5
171	R	37.2	Very low	37	Very low	227 Å²	227	138.8 Å²	138.8	86%	0.857	72%	0.723	S	S	*	*			trans	76	114.5	140.6	-84	173	168.9	-177.5	-4.1	120.3
172	S	36	Very low	36.9	Very low	100 Å²	100	138.4 Å²	138.4	70%	0.699	73%	0.733	S	S	*	*				85.4	139.2	127.9	-54.9	0	0	0	0	120.7
173	S	37.6	Very low	36.5	Very low	107 Å²	107	137.9 Å²	137.9	75%	0.748	74%	0.736	S	S	*	*			trans	49.6	100.3	140.9	60.3	0	0	0	0	120.5
174	A	35	Very low	36.4	Very low	87 Å²	87	138.2 Å²	138.2	72%	0.719	73%	0.734	S	S	*	*				63.8	146.2	105.7	0	0	0	0	0	122.1
175	I	40.7	Very low	36.6	Very low	129 Å²	129	135.2 Å²	135.2	66%	0.662	74%	0.738	S	S	*	*			trans	88	108.9	149.5	-66.9	154.4	0	0	0	119.4	E590	I175-E590 WeakPolarHBondContact CA-OE2 3.32Å; I175-E590 HydrophobicContact CG1-CG 4.44Å
176	K	36.1	Very low	36.5	Very low	135 Å²	135	137 Å²	137	59%	0.587	74%	0.739	S	S	*	*			trans	58.9	145.1	147.5	-95.7	153.1	-163.9	141.2	0	118.6	E590	K176-E590 VanDerWaalsContact CA-OE2 3.28Å; K176-E590 WeakPolarHBondContact CA-OE2 3.3Å; K176-E590 WeakPolarHBondContact CD-OE1 3.36Å; K176-E590 WeakPolarHBondContact CE-OE1 3.43Å; K176-E590 VanDerWaalsContact CG-OE1 3.28Å; K176-E590 WeakPolarHBondContact CG-OE1 3.22Å; K176-E590 WeakPolarHBondContact CG-OE2 3.39Å; K176-E590 PolarHBondContact N-OE2 3.27Å; K176-E590 IonicContact NZ-OE1 2.79Å; K176-E590 PolarHBondContact NZ-OE1 3.38Å
177	C	30	Very low	36.6	Very low	101 Å²	101	138 Å²	138	68%	0.682	74%	0.74	S	S	*	*			cis	-171.3	153.2	36.3	-138.3	0	0	0	0	113.1
178	V	39.1	Very low	36.8	Very low	104 Å²	104	136.2 Å²	136.2	63%	0.63	74%	0.741	S	S	*	*			trans	42.2	116.2	133.5	176.6	0	0	0	0	121.6
179	K	34	Very low	36.9	Very low	183 Å²	183	132.9 Å²	132.9	80%	0.796	74%	0.743	S	S	*	*			trans	23.9	127.5	134.6	-48.4	171.4	-177.3	172.7	0	120.2
180	K	35.3	Very low	37	Very low	206 Å²	206	135.7 Å²	135.7	90%	0.896	75%	0.75	S	S	*	*				-174.5	154.7	100.9	-111.1	-178	175.6	-178.5	0	113.1
181	S	32.7	Very low	36.9	Very low	110 Å²	110	133.1 Å²	133.1	77%	0.769	75%	0.751	S	S	*	*			trans	-82	161.4	169	-31	0	0	0	0	112.1
182	P	40.7	Very low	37	Very low	128 Å²	128	126.7 Å²	126.7	83%	0.831	74%	0.741	S	S	*	*			trans	-100.7	163	136.7	35.6	-29.3	0	0	0	111.1
183	N	32.8	Very low	37.2	Very low	149 Å²	149	129.5 Å²	129.5	80%	0.797	75%	0.746	S	S	*	*			trans	-140.8	167.1	174.6	-170.2	22.6	0	0	0	109.5
184	T	34.6	Very low	37.3	Very low	95 Å²	95	129.7 Å²	129.7	58%	0.583	75%	0.747	S	S	*	*			trans	73.3	123.7	162.2	-17.1	0	0	0	0	118.5
185	T	37.3	Very low	37.2	Very low	147 Å²	147	131 Å²	131	90%	0.902	75%	0.751	S	S	*	*				-156	154.6	126	15.6	0	0	0	0	108.7
186	N	37.1	Very low	37.1	Very low	145 Å²	145	129.5 Å²	129.5	78%	0.775	76%	0.758	S	S	*	*			trans	-109.8	159.6	-166	-44.6	-46.6	0	0	0	112.1
187	S	38.8	Very low	37.1	Very low	119 Å²	119	130 Å²	130	83%	0.832	77%	0.767	S	S	*	*				168.2	151.2	120	-157.6	0	0	0	0	111.9
188	P	42.8	Very low	37.5	Very low	111 Å²	111	131.6 Å²	131.6	72%	0.721	77%	0.773	S	S	*	*			trans	-126.7	-151.6	-166.2	41.1	-22.7	0	0	0	114.9
189	V	38.6	Very low	37.5	Very low	134 Å²	134	133.3 Å²	133.3	81%	0.812	78%	0.784	S	S	*	*			trans	87	127.6	174.4	-170.2	0	0	0	0	112.9
190	K	38.9	Very low	37.6	Very low	182 Å²	182	133.6 Å²	133.6	79%	0.791	79%	0.788	S	S	*	*			cis	-162.3	152.7	45.7	-151.6	-177.7	179.5	-179.9	0	113.9
191	S	39.7	Very low	37.8	Very low	96 Å²	96	129.5 Å²	129.5	67%	0.671	79%	0.785	S	S	*	*			trans	46.8	147.8	145.1	56	0	0	0	0	123.3
192	S	39.1	Very low	37.9	Very low	93 Å²	93	132.6 Å²	132.6	65%	0.65	79%	0.793	S	S	*	*			cis	174.6	167.8	-16.4	53.2	0	0	0	0	110.2
193	I	39.6	Very low	37.6	Very low	159 Å²	159	130.2 Å²	130.2	82%	0.815	79%	0.792	S	S	*	*			trans	74.9	133.2	163.9	-58.2	160.9	0	0	0	114.9
194	S	39.6	Very low	37.6	Very low	110 Å²	110	131.9 Å²	131.9	77%	0.769	79%	0.792	S	S	*	*			cis	-161.1	160.5	-18.6	51	0	0	0	0	111.2
195	S	34.1	Very low	37.9	Very low	114 Å²	114	133.1 Å²	133.1	80%	0.797	80%	0.8	S	S	*	*			trans	-86.9	160.1	-177.5	-40.4	0	0	0	0	115
196	A	39	Very low	37.7	Very low	98 Å²	98	130.5 Å²	130.5	81%	0.81	79%	0.785	S	S	*	*			trans	-166.8	85.4	148.9	0	0	0	0	0	113.1
197	D	35.5	Very low	37.8	Very low	147 Å²	147	130.1 Å²	130.1	79%	0.786	79%	0.788	S	S	*	*			trans	36.4	115.1	139.3	-49.9	-29.4	0	0	0	124.8
198	V	38.6	Very low	37.8	Very low	133 Å²	133	131.2 Å²	131.2	81%	0.806	78%	0.784	S	S	*	*				49.5	123.7	116.1	-176.9	0	0	0	0	121.5
199	V	38.4	Very low	37.5	Very low	140 Å²	140	132.1 Å²	132.1	85%	0.848	79%	0.793	S	S	*	*				-167	158.4	114.2	149.4	0	0	0	0	109.3
200	E	35.7	Very low	37.4	Very low	189 Å²	189	133.5 Å²	133.5	88%	0.883	79%	0.79	S	S	*	*			trans	-135.5	139.5	-167	169.4	-178.1	-128.8	0	0	111.7
201	S	39.4	Very low	37.2	Very low	120 Å²	120	136.2 Å²	136.2	84%	0.839	80%	0.796	S	S	*	*			trans	-164.5	158.9	158.8	63.6	0	0	0	0	113.4
202	D	35.9	Very low	37.3	Very low	176 Å²	176	138.3 Å²	138.3	94%	0.941	80%	0.804	S	S	*	*			trans	-81.7	157	-166.4	-80.8	-65.8	0	0	0	117.3
203	G	34.5	Very low	37.1	Very low	77 Å²	77	139.4 Å²	139.4	79%	0.794	81%	0.812	S	S	*	*			trans	-157.7	88.4	176.6	0	0	0	0	0	115.1
204	F	31.8	Very low	37.1	Very low	185 Å²	185	136.1 Å²	136.1	81%	0.811	81%	0.809	S	S	*	*			trans	-42.6	130.1	177.8	171.6	-87.6	0	0	0	117.6	P206	F204-P206 HydrophobicContact CE1-CG 4.43Å; F204-P206 HydrophobicContact CE2-CG 4.43Å; F204-P206 VanDerWaalsContact CZ-CD 3.49Å; F204-P206 HydrophobicContact CZ-CG 3.98Å
205	V	40.5	Very low	36.9	Very low	121 Å²	121	138.8 Å²	138.8	73%	0.733	81%	0.813	S	S	*	*			trans	-152.4	129.1	139.7	-166.2	0	0	0	0	110.6
206	P	34.6	Very low	37.1	Very low	91 Å²	91	144.2 Å²	144.2	59%	0.591	82%	0.816	S	S	*	*			trans	-83.1	139	167	33	-32.7	0	0	0	111.4	F204	F204-P206 HydrophobicContact CE1-CG 4.43Å; F204-P206 HydrophobicContact CE2-CG 4.43Å; F204-P206 VanDerWaalsContact CZ-CD 3.49Å; F204-P206 HydrophobicContact CZ-CG 3.98Å
207	V	39.6	Very low	37.3	Very low	138 Å²	138	146.7 Å²	146.7	84%	0.836	82%	0.815	S	S	*	*			trans	-114.9	140.2	-179.5	177.6	0	0	0	0	111.5
208	D	38.4	Very low	37.5	Very low	142 Å²	142	150.9 Å²	150.9	76%	0.759	82%	0.82	S	S	*	*			trans	-62.2	146.7	-160.5	-74.1	-74.1	0	0	0	118.3	Q210	D208-Q210 PolarHBondContact O-N 2.95Å
209	S	35.3	Very low	37.9	Very low	129 Å²	129	152.5 Å²	152.5	90%	0.902	82%	0.823	S	S	*	*			trans	-78.1	93.6	165	-72.3	0	0	0	0	111.8
210	Q	38.1	Very low	37.9	Very low	163 Å²	163	156.2 Å²	156.2	76%	0.762	82%	0.821	S	S	*	*			trans	-134.2	150.1	165.7	-68.4	-162.3	14.3	0	0	113.4	D208	D208-Q210 PolarHBondContact O-N 2.95Å
211	R	34.8	Very low	38.1	Very low	239 Å²	239	156.7 Å²	156.7	90%	0.902	82%	0.82	S	S	*	*			trans	73.1	138.9	-174	-48.9	174.8	173.7	-163.4	-2.5	112.5
212	V	40.1	Very low	38	Very low	141 Å²	141	159.1 Å²	159.1	86%	0.855	82%	0.818	S	S	*	*			cis	-126.6	117	20.8	-80.6	0	0	0	0	114.1
213	S	36.4	Very low	38	Very low	115 Å²	115	156 Å²	156	80%	0.804	81%	0.81	S	S	*	*			trans	-84.6	151.3	165.8	-45.1	0	0	0	0	111.7
214	A	37.8	Very low	38	Very low	91 Å²	91	157 Å²	157	75%	0.752	81%	0.805	S	S	*	*			trans	56.2	75.7	156.9	0	0	0	0	0	118.9	R216	A214-R216 PolarHBondContact O-N 2.97Å
215	L	36.2	Very low	38.2	Very low	165 Å²	165	155 Å²	155	86%	0.864	81%	0.807	S	S	*	*			trans	-72.3	72.1	161.6	-113.4	169.8	0	0	0	111.8	L217	L215-L217 VanDerWaalsContact C-N 3.35Å; L215-L217 PolarHBondContact O-N 3.11Å
216	R	38.3	Very low	38.1	Very low	228 Å²	228	156.8 Å²	156.8	86%	0.86	81%	0.806	S	S	*	*			trans	-78.3	75.4	-175.6	-161.2	172.4	-170.8	142	-0.9	111.7	A214 R218	A214-R216 PolarHBondContact O-N 2.97Å; R216-R218 PolarHBondContact O-N 2.77Å
217	L	42.4	Very low	38.3	Very low	151 Å²	151	161.3 Å²	161.3	79%	0.791	82%	0.821	S	S	*	*			trans	-62.8	120.9	-175.8	-84.8	167.8	0	0	0	113.2	L215	L215-L217 VanDerWaalsContact C-N 3.35Å; L215-L217 PolarHBondContact O-N 3.11Å
218	R	40.8	Very low	38.3	Very low	234 Å²	234	159.3 Å²	159.3	88%	0.883	81%	0.813	S	S	*	*			trans	-77.7	119	177.2	-63.2	175.3	173.2	110.4	-7.7	110.7	R216	R216-R218 PolarHBondContact O-N 2.77Å
219	I	46.2	Very low	38.7	Very low	168 Å²	168	158.1 Å²	158.1	86%	0.862	81%	0.813	S	S	*	*			trans	-89.6	113.2	163.8	-61.4	179.1	0	0	0	108.4
220	R	39.3	Very low	38.9	Very low	218 Å²	218	160.3 Å²	160.3	82%	0.823	82%	0.815	S	S	*	*			trans	-75.2	149.6	171.5	-74.5	179.8	166.3	126.1	-8.3	110.2
221	K	39.6	Very low	38.9	Very low	199 Å²	199	157.7 Å²	157.7	87%	0.865	82%	0.815	S	S	*	*			trans	-120.7	87.5	-175.7	-174.5	-169.8	173.7	-171.4	0	111.7
222	H	38.1	Very low	39.4	Very low	171 Å²	171	153.3 Å²	153.3	79%	0.792	81%	0.814	S	S	*	*			trans	-149.1	150.3	168.3	-42.7	-84.8	0	0	0	106.9
223	S	34.7	Very low	39.3	Very low	111 Å²	111	152 Å²	152	78%	0.776	81%	0.812	S	S	*	*			cis	-144.8	165.3	-11.2	-167.8	0	0	0	0	108.4
224	S	35	Very low	39.9	Very low	97 Å²	97	152.7 Å²	152.7	68%	0.678	81%	0.813	S	S	*	*			trans	-72.2	153	171.1	43.9	0	0	0	0	112.4
225	V	36.7	Very low	40.1	Very low	143 Å²	143	154 Å²	154	87%	0.867	82%	0.817	S	S	*	*			trans	-129.6	137.5	155.5	-178.9	0	0	0	0	106.9
226	F	37	Very low	40.1	Very low	159 Å²	159	151.7 Å²	151.7	70%	0.697	81%	0.814	S	S	*	*			trans	-73.6	151.5	-174.6	-80.7	-118.6	0	0	0	112.8
227	M	39.9	Very low	40.3	Very low	186 Å²	186	147.2 Å²	147.2	92%	0.916	82%	0.815	S	S	*	*				-146.6	142.8	126.8	-87.9	-58.6	100.1	0	0	108.2
228	S	39.9	Very low	40	Very low	96 Å²	96	144.9 Å²	144.9	67%	0.671	81%	0.811	S	S	*	*			trans	-111.5	167.2	-169.8	-76.1	0	0	0	0	112.4
229	P	46	Very low	39.8	Very low	117 Å²	117	139.9 Å²	139.9	76%	0.76	81%	0.807	S	S	*	*			trans	-102.7	162.5	-164.2	39.2	-34.7	0	0	0	114.7
230	D	40.1	Very low	39.6	Very low	174 Å²	174	138.3 Å²	138.3	93%	0.93	81%	0.805	S	S	*	*			trans	-90.9	150.1	160.4	-72.9	-48.9	0	0	0	111.2
231	S	38.5	Very low	39.5	Very low	109 Å²	109	131.1 Å²	131.1	76%	0.762	80%	0.799	S	S	*	*			trans	-130.4	144.5	-177.4	61.8	0	0	0	0	112.1
232	V	45	Very low	39.4	Very low	147 Å²	147	127.1 Å²	127.1	89%	0.891	80%	0.796	S	S	*	*			trans	-145.8	135.4	168.2	-95.4	0	0	0	0	109.1
233	S	38.5	Very low	39.5	Very low	114 Å²	114	125 Å²	125	80%	0.797	80%	0.795	S	S	*	*			trans	-143.7	-166.4	-176.6	-56.6	0	0	0	0	109.3
234	P	48.5	Very low	39.6	Very low	128 Å²	128	123.7 Å²	123.7	83%	0.831	79%	0.791	S	S	*	*				-124.9	170.4	-104	35.9	-17.8	0	0	0	114.9
235	S	40.8	Very low	39.4	Very low	120 Å²	120	124.9 Å²	124.9	84%	0.839	79%	0.794	S	S	*	*			trans	-156	130.5	166.4	59.4	0	0	0	0	113.2
236	S	36.4	Very low	39.5	Very low	115 Å²	115	124.5 Å²	124.5	80%	0.804	79%	0.787	S	S	*	*			trans	-89.5	171.2	164.5	-53.1	0	0	0	0	110.3
237	P	44	Very low	39.2	Very low	134 Å²	134	125.2 Å²	125.2	87%	0.87	79%	0.793	S	S	*	*				-150.5	-166.4	90.8	39.6	-20	0	0	0	115.5
238	S	34.2	Very low	38.8	Very low	102 Å²	102	120.1 Å²	120.1	71%	0.713	78%	0.78	S	S	*	*			trans	-108.1	168.2	-165.4	52	0	0	0	0	115.8
239	T	38.4	Very low	38.5	Very low	129 Å²	129	126.3 Å²	126.3	79%	0.791	79%	0.788	S	S	*	*			trans	-176.5	102.3	160.7	-72.4	0	0	0	0	106.4
240	T	40.1	Very low	37.9	Very low	135 Å²	135	129.5 Å²	129.5	83%	0.828	79%	0.793	S	S	*	*				98	140.2	55.2	55.4	0	0	0	0	114.8
241	G	38.4	Very low	37.5	Very low	67 Å²	67	124.2 Å²	124.2	69%	0.691	78%	0.779	S	S	*	*			trans	130.9	89.9	179.9	0	0	0	0	0	112.5
242	S	38.4	Very low	37.2	Very low	115 Å²	115	127.9 Å²	127.9	80%	0.804	78%	0.782	S	S	*	*				73.5	132.2	84.6	-62.7	0	0	0	0	113.3
243	T	38.3	Very low	36.5	Very low	126 Å²	126	128.1 Å²	128.1	77%	0.773	77%	0.773	S	S	*	*			cis	-160.1	138.5	6.1	5.6	0	0	0	0	108.2
244	A	37.3	Very low	36.4	Very low	85 Å²	85	129.9 Å²	129.9	70%	0.702	77%	0.769	S	S	*	*				63.2	143.9	98.2	0	0	0	0	0	116.5
245	T	31.7	Very low	35.6	Very low	121 Å²	121	127 Å²	127	74%	0.742	75%	0.752	S	S	*	*			cis	-166.8	178	-21.3	-61.6	0	0	0	0	106.5
246	L	37.5	Very low	35.4	Very low	136 Å²	136	129.2 Å²	129.2	71%	0.712	75%	0.748	S	S	*	*			trans	78.7	129.5	169.2	-55.8	174.6	0	0	0	114.3
247	E	31.5	Very low	35.4	Very low	174 Å²	174	129.4 Å²	129.4	81%	0.813	75%	0.745	S	S	*	*				71	136.1	56	-70.3	-176.6	-141.9	0	0	113.5
248	A	32	Very low	35	Very low	78 Å²	78	127.6 Å²	127.6	65%	0.645	74%	0.735	S	S	*	*			cis	-168.3	-172.5	-11.5	0	0	0	0	0	109.5
249	R	33.1	Very low	35	Very low	227 Å²	227	127.5 Å²	127.5	86%	0.857	74%	0.735	S	S	*	*			trans	77.9	132.2	156.7	-67.1	-176.2	175.9	-162.2	-3.9	119.7
250	H	33.3	Very low	35	Very low	184 Å²	184	128.9 Å²	128.9	85%	0.852	74%	0.738	S	S	*	*			trans	47.7	143.5	146.7	-65.2	-114.7	0	0	0	120.2
251	G	32	Very low	34.9	Very low	63 Å²	63	129.6 Å²	129.6	65%	0.649	74%	0.736	S	S	*	*			cis	150.1	153.8	-4.7	0	0	0	0	0	112.7
252	F	32.1	Very low	35.1	Very low	186 Å²	186	131 Å²	131	82%	0.816	73%	0.733	S	S	*	*			trans	68.5	131.5	167.2	-82.5	-111.2	0	0	0	119.8
253	E	30.9	Very low	34.9	Very low	151 Å²	151	133.4 Å²	133.4	71%	0.706	74%	0.736	S	S	*	*			trans	65.6	159.5	146.9	-65.3	-174.6	116.9	0	0	118.4
254	Q	34.8	Very low	34.7	Very low	152 Å²	152	135.7 Å²	135.7	71%	0.71	74%	0.735	S	S	*	*			cis	-159.6	158.3	-12.8	-114.1	-177.9	47.9	0	0	105.2
255	S	32.8	Very low	34.6	Very low	67 Å²	67	139.3 Å²	139.3	47%	0.469	74%	0.741	S	S	.	*			cis	-174.3	174.4	-18.7	39.3	0	0	0	0	108.6
256	H	36.7	Very low	34.8	Very low	166 Å²	166	139.7 Å²	139.7	77%	0.769	74%	0.737	S	S	*	*			trans	70.7	150	171.2	-42.6	-65.7	0	0	0	115.7
257	T	36.1	Very low	34.6	Very low	120 Å²	120	140.2 Å²	140.2	74%	0.736	74%	0.739	S	S	*	*			cis	-171.4	155.1	-7.4	20.9	0	0	0	0	107.1
258	S	35.2	Very low	34.8	Very low	95 Å²	95	143.4 Å²	143.4	66%	0.664	74%	0.744	S	S	*	*			cis	179.2	158.4	-19.4	48.3	0	0	0	0	110.1
259	S	34.9	Very low	34.9	Very low	101 Å²	101	147.5 Å²	147.5	71%	0.706	75%	0.75	S	S	*	*			trans	73.9	146.1	164.7	88.8	0	0	0	0	116.9
260	N	38.4	Very low	34.9	Very low	158 Å²	158	143.5 Å²	143.5	85%	0.845	75%	0.745	S	S	*	*			cis	-138.3	160.7	1	-95.8	-42.3	0	0	0	111
261	D	36.9	Very low	34.7	Very low	150 Å²	150	140.7 Å²	140.7	80%	0.802	74%	0.741	S	S	*	*			trans	-134.6	-142.8	-178.6	-163.2	27	0	0	0	111.3
262	P	42.7	Very low	34.6	Very low	95 Å²	95	142.1 Å²	142.1	62%	0.617	75%	0.747	S	S	*	*				-121	160.1	-120.6	39.6	-24.4	0	0	0	117.8
263	L	34.6	Very low	34.8	Very low	166 Å²	166	141.2 Å²	141.2	87%	0.869	75%	0.749	S	S	*	*			trans	-144.8	139.2	158.1	-67.1	176	0	0	0	108.8
264	K	34.4	Very low	34.8	Very low	175 Å²	175	139 Å²	139	76%	0.761	75%	0.75	S	S	*	*			cis	87.2	82.2	20.4	-157	-178.6	-176.7	-177.4	0	115.8
265	I	35.7	Very low	35	Very low	160 Å²	160	137.4 Å²	137.4	82%	0.821	75%	0.753	S	S	*	*			trans	-136	102.4	160.1	-56.6	178.4	0	0	0	104.9
266	I	36.2	Very low	34.8	Very low	130 Å²	130	141.2 Å²	141.2	67%	0.667	77%	0.767	S	S	*	*				75.5	112.5	68.4	-61.9	170.6	0	0	0	112
267	I	32.7	Very low	34.7	Very low	147 Å²	147	139.2 Å²	139.2	75%	0.754	77%	0.767	S	S	*	*			trans	-84.1	141.9	171.8	-61.8	164.2	0	0	0	108.5	Q269	I267-Q269 HydrophobicContact CG2-CG 4.46Å
268	R	34.5	Very low	34.6	Very low	241 Å²	241	138.2 Å²	138.2	91%	0.909	76%	0.764	S	S	*	*			trans	-136.1	134.6	150.5	-79.3	-166.1	164.9	175.9	-6.5	110.2
269	Q	34.1	Very low	34.7	Very low	163 Å²	163	140.6 Å²	140.6	76%	0.762	77%	0.768	S	S	*	*			trans	-93.3	146.8	170.9	-60.9	164.9	-28.2	0	0	108.2	I267	I267-Q269 HydrophobicContact CG2-CG 4.46Å
270	N	34	Very low	34.9	Very low	144 Å²	144	143.8 Å²	143.8	77%	0.77	77%	0.772	S	S	*	*				174	133.8	114	-88.9	-2.9	0	0	0	114.4
271	T	30	Very low	34.8	Very low	124 Å²	124	143.1 Å²	143.1	76%	0.761	76%	0.764	S	S	*	*			trans	2.7	125.3	151.3	47.6	0	0	0	0	122.6
272	A	29.6	Very low	34.9	Very low	94 Å²	94	143.4 Å²	143.4	78%	0.777	76%	0.758	S	S	*	*				88.2	168.1	120.6	0	0	0	0	0	121.7
273	I	34.9	Very low	34.6	Very low	166 Å²	166	143.4 Å²	143.4	85%	0.851	76%	0.756	S	S	*	*			trans	82.8	108.6	172.3	-50.8	176.7	0	0	0	116.9
274	S	32.9	Very low	34.7	Very low	105 Å²	105	145.2 Å²	145.2	73%	0.734	76%	0.757	S	S	*	*			trans	-95.5	174.3	157.6	-46.1	0	0	0	0	108.9
275	P	38.3	Very low	34.9	Very low	118 Å²	118	142.5 Å²	142.5	77%	0.766	76%	0.76	S	S	*	*			cis	-146.1	-163.9	13.3	38.1	-13.8	0	0	0	116.4
276	L	29.2	Very low	34.9	Very low	148 Å²	148	146.2 Å²	146.2	78%	0.775	76%	0.764	S	S	*	*			trans	82.7	86.3	139.3	-158.3	72.5	0	0	0	122.6
277	V	34.2	Very low	35.4	Very low	124 Å²	124	145.1 Å²	145.1	75%	0.752	77%	0.765	S	S	*	*				65.1	144.5	114.1	165.3	0	0	0	0	123.1
278	S	33.4	Very low	35.5	Very low	98 Å²	98	145.3 Å²	145.3	69%	0.685	77%	0.766	S	S	*	*			trans	95.9	150.7	158.4	-74.9	0	0	0	0	120.7
279	I	36.7	Very low	35.5	Very low	145 Å²	145	140 Å²	140	74%	0.744	76%	0.76	S	S	*	*			cis	-164.3	177.5	-24.2	-107.1	166.9	0	0	0	107.6
280	E	38.7	Very low	35.4	Very low	168 Å²	168	137 Å²	137	79%	0.785	76%	0.757	S	S	*	*			trans	99.2	147.5	164.8	-57.3	-155.5	-162.7	0	0	120
281	E	37	Very low	35.6	Very low	145 Å²	145	135.5 Å²	135.5	68%	0.678	75%	0.753	S	S	*	*			cis	-165.3	-178.8	-44.7	-138.6	-146.2	169.3	0	0	112.2
282	K	38.7	Very low	35.8	Very low	155 Å²	155	135.7 Å²	135.7	67%	0.674	75%	0.754	S	S	*	*			trans	72.7	152.1	159.8	-74.4	157.4	-172.7	131.9	0	120.7
283	T	36.3	Very low	36.5	Very low	96 Å²	96	136.2 Å²	136.2	59%	0.589	75%	0.75	S	S	*	*			cis	-171.1	141.5	-44.6	26.3	0	0	0	0	112.4
284	K	37.9	Very low	36.3	Very low	204 Å²	204	134.4 Å²	134.4	89%	0.887	75%	0.747	S	S	*	*			trans	65.7	161.2	152.7	-66	160.2	-178.4	164.4	0	116.5
285	S	38.5	Very low	36.2	Very low	118 Å²	118	140.5 Å²	140.5	83%	0.825	75%	0.753	S	S	*	*			cis	-142.6	-163.5	8.4	61.9	0	0	0	0	113.4
286	R	34.9	Very low	35.9	Very low	237 Å²	237	139.5 Å²	139.5	89%	0.894	75%	0.75	S	S	*	*			trans	-135.3	-167.3	-174.9	-71.3	-175.9	171.6	-167.5	-0.1	110
287	P	47.9	Very low	36.2	Very low	107 Å²	107	139 Å²	139	70%	0.695	75%	0.753	S	S	*	*				-124.7	-166.2	-65.6	38.3	-21.6	0	0	0	111.9
288	I	34.1	Very low	36.2	Very low	152 Å²	152	137.1 Å²	137.1	78%	0.779	75%	0.75	S	S	*	*			trans	167.9	111.8	135.7	-88.5	157.2	0	0	0	114.3
289	V	33.6	Very low	36.3	Very low	128 Å²	128	137.2 Å²	137.2	78%	0.776	75%	0.751	S	S	*	*				25.5	133.8	118.5	-177.1	0	0	0	0	117.2
290	S	31.7	Very low	36.2	Very low	100 Å²	100	137.5 Å²	137.5	70%	0.699	75%	0.749	S	S	*	*			cis	-175.7	-169	27.6	36.6	0	0	0	0	114.3
291	V	39.5	Very low	36.1	Very low	113 Å²	113	134.3 Å²	134.3	69%	0.685	74%	0.737	S	S	*	*			trans	94.1	81.3	152.2	-159.1	0	0	0	0	121
292	T	34.6	Very low	36	Very low	129 Å²	129	135.1 Å²	135.1	79%	0.791	74%	0.741	S	S	*	*				43.1	-176.9	114.1	79.2	0	0	0	0	121.3
293	P	43.3	Very low	35.9	Very low	104 Å²	104	134.6 Å²	134.6	68%	0.675	75%	0.751	S	S	*	*				-140.5	-169.6	-119	31.5	-3.1	0	0	0	118.6
294	T	30.4	Very low	35.7	Very low	129 Å²	129	136.7 Å²	136.7	79%	0.791	76%	0.758	S	S	*	*			trans	103.6	134.7	148.5	74.2	0	0	0	0	122.7
295	R	30.6	Very low	35.6	Very low	232 Å²	232	135.8 Å²	135.8	88%	0.875	76%	0.757	S	S	*	*			trans	87	117.1	137.5	-161.9	170.7	178.3	168.3	-1.6	122.2
296	S	33.4	Very low	35.3	Very low	98 Å²	98	134.8 Å²	134.8	69%	0.685	75%	0.75	S	S	*	*			trans	-5.8	149.4	142.2	-30.1	0	0	0	0	118.5
297	T	34.9	Very low	35.1	Very low	137 Å²	137	130.6 Å²	130.6	84%	0.84	75%	0.746	S	S	*	*			cis	-165.9	169.6	43.3	37.3	0	0	0	0	110.5
298	A	34.7	Very low	34.2	Very low	85 Å²	85	132.1 Å²	132.1	70%	0.702	75%	0.753	S	S	*	*			cis	-177.9	-176.1	-21.9	0	0	0	0	0	108.9
299	S	33.8	Very low	34.1	Very low	100 Å²	100	133.6 Å²	133.6	70%	0.699	76%	0.756	S	S	*	*			trans	68	142.8	172.9	-72.7	0	0	0	0	117.2
300	E	36.4	Very low	33.9	Very low	151 Å²	151	139.2 Å²	139.2	71%	0.706	76%	0.764	S	S	*	*			cis	-163.2	169.2	-9.9	-127	168.2	-117.6	0	0	114.4
301	N	35.8	Very low	34	Very low	100 Å²	100	140.6 Å²	140.6	54%	0.535	77%	0.768	S	S	.	*			trans	71.6	89.8	149.9	-59.6	-23.4	0	0	0	122.6
302	H	35.3	Very low	33.7	Very low	163 Å²	163	146.3 Å²	146.3	76%	0.755	78%	0.778	S	S	*	*				74.6	101.2	129.8	-41.7	-40	0	0	0	121.3
303	T	35.7	Very low	33.8	Very low	143 Å²	143	145.2 Å²	145.2	88%	0.877	78%	0.775	S	S	*	*			trans	-158.8	170.1	138.6	-7.5	0	0	0	0	112.8
304	N	32.8	Very low	33.5	Very low	141 Å²	141	147.1 Å²	147.1	75%	0.754	79%	0.785	S	S	*	*			trans	-70.4	140.5	-167.5	-46.9	-54.9	0	0	0	115.4
305	Q	35.7	Very low	33.7	Very low	184 Å²	184	145 Å²	145	86%	0.86	78%	0.78	S	S	*	*				177.9	162.4	116.5	-97.9	163.1	107.7	0	0	115.3
306	S	31.5	Very low	33.9	Very low	97 Å²	97	140.3 Å²	140.3	68%	0.678	78%	0.777	S	S	*	*			trans	22.8	134.1	158	58.6	0	0	0	0	122.8
307	D	30.9	Very low	34.1	Very low	149 Å²	149	141.9 Å²	141.9	80%	0.797	78%	0.782	S	S	*	*			trans	58.3	107.6	149.2	-62	-29.6	0	0	0	120.6
308	T	30.1	Very low	34.4	Very low	140 Å²	140	141.3 Å²	141.3	86%	0.859	78%	0.779	S	S	*	*				-167.4	161.5	117.5	14.9	0	0	0	0	113.4
309	H	30.8	Very low	34.9	Very low	182 Å²	182	141.8 Å²	141.8	84%	0.843	78%	0.775	S	S	*	*			trans	-59.6	137.9	-176.4	-56.9	-97.4	0	0	0	114.9
310	R	29.1	Very low	35.1	Very low	246 Å²	246	144.1 Å²	144.1	93%	0.928	78%	0.778	S	S	*	*			trans	-147.1	89.7	151.7	-164.2	169.7	-175.4	161	0.7	113.7
311	T	35.2	Very low	35.1	Very low	130 Å²	130	142.3 Å²	142.3	80%	0.798	77%	0.773	S	S	*	*			trans	-77.8	127.3	166.5	41.4	0	0	0	0	111.2
312	R	32.6	Very low	35.3	Very low	233 Å²	233	146.6 Å²	146.6	88%	0.879	78%	0.782	S	S	*	*			trans	-169.9	115.2	147.3	-110.8	175.6	82.1	166	4.2	114.6
313	S	37.8	Very low	35.4	Very low	105 Å²	105	145.9 Å²	145.9	73%	0.734	78%	0.784	S	S	*	*				50	104.7	129.3	-50.5	0	0	0	0	122.1
314	T	35.5	Very low	35.2	Very low	145 Å²	145	144 Å²	144	89%	0.89	77%	0.772	S	S	*	*			trans	-146.1	154.3	134.5	48.8	0	0	0	0	107.8
315	A	35.6	Very low	35.1	Very low	83 Å²	83	145 Å²	145	69%	0.686	78%	0.776	S	S	*	*			cis	-163.4	150.9	-19.7	0	0	0	0	0	111.9
316	V	34.8	Very low	35.1	Very low	134 Å²	134	140.5 Å²	140.5	81%	0.812	76%	0.763	S	S	*	*			trans	78.3	144.8	139	162.1	0	0	0	0	121.9
317	V	36.3	Very low	35.1	Very low	131 Å²	131	142.6 Å²	142.6	79%	0.794	76%	0.762	S	S	*	*			trans	54.4	92.4	178.3	-88	0	0	0	0	122.7
318	T	42.5	Very low	35.5	Very low	126 Å²	126	140 Å²	140	77%	0.773	75%	0.748	S	S	*	*				-47	-169	121.5	28.8	0	0	0	0	114.7
319	P	45.1	Very low	35.6	Very low	94 Å²	94	137.2 Å²	137.2	61%	0.61	73%	0.734	S	S	*	*			cis	-136.5	-159.6	-2.7	27.1	-0.5	0	0	0	114.9
320	L	37.5	Very low	36	Very low	149 Å²	149	134.3 Å²	134.3	78%	0.78	72%	0.724	S	S	*	*			trans	96.7	132.2	151.9	-66.3	142.4	0	0	0	118.4
321	L	36.8	Very low	36.4	Very low	114 Å²	114	130 Å²	130	60%	0.597	72%	0.72	S	S	*	*			cis	-176	125.7	-48.9	-95.9	155.5	0	0	0	104.8
322	R	40.6	Very low	36.5	Very low	189 Å²	189	128.7 Å²	128.7	71%	0.713	72%	0.716	S	S	*	*				67.9	138.7	86.4	-161	-150.5	-141.7	111	-1.7	114.5	V324	R322-V324 HydrophobicContact CG-CG2 4.34Å
323	N	35.6	Very low	36.7	Very low	149 Å²	149	123.3 Å²	123.3	80%	0.797	71%	0.714	S	S	*	*			trans	171.9	147.2	130.5	-84.8	-12.2	0	0	0	111.9
324	V	32.1	Very low	36.5	Very low	103 Å²	103	126.1 Å²	126.1	62%	0.624	72%	0.721	S	S	*	*			cis	-170.2	146.9	-31.7	116.8	0	0	0	0	108.7	R322	R322-V324 HydrophobicContact CG-CG2 4.34Å
325	L	31	Very low	36.3	Very low	162 Å²	162	125.1 Å²	125.1	85%	0.848	72%	0.72	S	S	*	*			trans	-161.2	117.2	165.2	-167	67.6	0	0	0	112.5
326	P	35.2	Very low	36.2	Very low	89 Å²	89	127.6 Å²	127.6	58%	0.578	73%	0.726	S	S	*	*			trans	-93.1	161.7	177.9	-7.3	28.5	0	0	0	114.5
327	E	32.5	Very low	36.1	Very low	142 Å²	142	127.8 Å²	127.8	66%	0.664	73%	0.727	S	S	*	*			cis	75.8	126.9	34.4	-51	160.4	120.5	0	0	113.5	P1137	E327-P1137 CarbonylContact C-O 3.59Å; E327-P1137 VanDerWaalsContact CA-O 3.25Å; E327-P1137 WeakPolarHBondContact CA-O 3.43Å; E327-P1137 PolarHBondContact N-O 2.83Å
328	L	38.1	Very low	35.9	Very low	95 Å²	95	126.6 Å²	126.6	50%	0.497	73%	0.725	S	S	.	*			cis	-130.2	-177.7	-8.7	-61.8	178.1	0	0	0	108.1	N1136 P1137 I1138 H1139	L328-N1136 WeakPolarHBondContact CD2-O 3.41Å; L328-P1137 WeakPolarHBondContact CA-O 3.3Å; L328-P1137 PolarHBondContact N-O 3.17Å; L328-I1138 CarbonylContact O-C 3.05Å; L328-I1138 WeakPolarHBondContact O-CA 3.2Å; L328-I1138 PolarHBondContact O-N 3.34Å; L328-I1138 VanDerWaalsContact O-N 3.16Å; L328-H1139 PolarHBondContact O-N 3.39Å
329	S	34	Very low	35.6	Very low	81 Å²	81	126.2 Å²	126.2	57%	0.566	72%	0.722	S	S	*	*			cis	-166.9	161.2	37.2	-60	0	0	0	0	113.9	P1137 I1138	S329-P1137 VanDerWaalsContact C-CG 3.45Å; S329-P1137 WeakPolarHBondContact O-CG 3.33Å; S329-I1138 PolarHBondContact N-O 2.9Å
330	D	38.8	Very low	35	Very low	120 Å²	120	128.1 Å²	128.1	64%	0.642	73%	0.728	S	S	*	*			trans	-106.7	163.8	175.7	-70.6	-59.3	0	0	0	113.1	P1137	D330-P1137 HydrophobicContact CB-CG 4.45Å; D330-P1137 WeakPolarHBondContact OD1-CG 2.97Å; D330-P1137 WeakPolarHBondContact OD2-CD 3.46Å
331	D	36	Very low	34.8	Very low	156 Å²	156	127.3 Å²	127.3	83%	0.834	72%	0.724	S	S	*	*			trans	175.5	141.2	139.5	-96.3	-32.9	0	0	0	108.9
332	S	38.2	Very low	34.8	Very low	102 Å²	102	125.9 Å²	125.9	71%	0.713	73%	0.729	S	S	*	*			cis	86.7	111.6	35.7	-163.4	0	0	0	0	114.9
333	S	36.5	Very low	34.5	Very low	120 Å²	120	122.6 Å²	122.6	84%	0.839	73%	0.725	S	S	*	*			trans	173.7	138.5	144	-79.6	0	0	0	0	111.9
334	D	34.6	Very low	34.4	Very low	165 Å²	165	120.9 Å²	120.9	88%	0.882	72%	0.715	S	S	*	*			trans	-79.2	151.6	169.2	-59.1	-78	0	0	0	112.2
335	S	30.7	Very low	34.6	Very low	123 Å²	123	119.8 Å²	119.8	86%	0.86	70%	0.702	S	S	*	*			trans	-159.4	145.4	139.2	46.7	0	0	0	0	112.3
336	V	34.5	Very low	34.8	Very low	136 Å²	136	115 Å²	115	82%	0.824	68%	0.679	S	S	*	*			trans	-82.8	154.2	174.7	-69.4	0	0	0	0	111.4
337	V	32.3	Very low	34.8	Very low	138 Å²	138	115.7 Å²	115.7	84%	0.836	68%	0.678	S	S	*	*			trans	-174.6	139.1	130.9	140.2	0	0	0	0	109.3
338	S	31.9	Very low	34.9	Very low	106 Å²	106	112.3 Å²	112.3	74%	0.741	67%	0.665	S	S	*	*			trans	-86.2	148.9	173.8	-54.3	0	0	0	0	111
339	T	34.9	Very low	34.9	Very low	118 Å²	118	113 Å²	113	72%	0.724	67%	0.674	S	S	*	*				176.4	135.2	124.4	26.1	0	0	0	0	111.4
340	N	33.6	Very low	35	Very low	134 Å²	134	115 Å²	115	72%	0.717	68%	0.678	S	S	*	*			trans	49.5	148.2	131.3	-60	39.8	0	0	0	120.7
341	D	33.7	Very low	34.9	Very low	132 Å²	132	116.1 Å²	116.1	71%	0.706	68%	0.684	S	S	*	*			cis	-159.4	166.8	3	-129.4	-48	0	0	0	112.1
342	A	36.6	Very low	34.9	Very low	84 Å²	84	116.3 Å²	116.3	69%	0.694	68%	0.677	S	S	*	*			trans	58.6	151.1	151.5	0	0	0	0	0	123.2
343	N	33.2	Very low	34.7	Very low	119 Å²	119	116.6 Å²	116.6	64%	0.636	67%	0.667	S	S	*	*			cis	-170.9	160.9	-34.2	-138.5	-22.1	0	0	0	113.6
344	L	34.9	Very low	34.5	Very low	113 Å²	113	117.9 Å²	117.9	59%	0.592	66%	0.657	S	S	*	*			trans	70.4	163.3	152.5	-58.8	168.6	0	0	0	123.1	P854	L344-P854 HydrophobicContact CD2-CG 4.25Å
345	K	36.1	Very low	34.3	Very low	81 Å²	81	117.9 Å²	117.9	35%	0.352	65%	0.652	S	S	.	*			cis	158.4	147.6	-48.3	177.8	-141.4	-175.5	163.3	0	117.6	P854 Y855	K345-P854 HydrophobicContact CB-CB 4.09Å; K345-P854 HydrophobicContact CD-CB 3.32Å; K345-P854 HydrophobicContact CD-CG 4.16Å; K345-P854 VanDerWaalsContact CE-CB 3.49Å; K345-P854 HydrophobicContact CG-CB 3.51Å; K345-Y855 WeakPolarHBondContact CA-O 3.05Å; K345-Y855 WeakPolarHBondContact CB-O 3.32Å
346	T	35.5	Very low	34.3	Very low	60 Å²	60	116.3 Å²	116.3	37%	0.368	64%	0.641	S	S	.	*			trans	105.5	127	149.3	17.9	0	0	0	0	127.4	V1211 I1212 N1213	T346-V1211 WeakPolarHBondContact O-CB 2.97Å; T346-V1211 WeakPolarHBondContact O-CG1 3.45Å; T346-I1212 CarbonylContact C-O 3.53Å; T346-I1212 WeakPolarHBondContact CA-O 3.31Å; T346-I1212 PolarHBondContact N-O 3.17Å; T346-I1212 PolarHBondContact O-N 2.95Å; T346-I1212 VanDerWaalsContact O-N 3.08Å; T346-N1213 HydrophobicContact CG2-CB 4.45Å
347	N	33.7	Very low	34.3	Very low	104 Å²	104	117.1 Å²	117.1	56%	0.556	64%	0.639	S	S	*	*			trans	24.1	130.7	-177.3	-64.1	-50.8	0	0	0	124.9	V1211 I1212 N1213	N347-V1211 CarbonylContact C-O 3.59Å; N347-V1211 CarbonylContact O-C 2.84Å; N347-I1212 VanDerWaalsContact CA-N 3.28Å; N347-I1212 WeakPolarHBondContact CA-O 3.23Å; N347-I1212 VanDerWaalsContact N-N 3.1Å; N347-I1212 PolarHBondContact N-O 2.75Å; N347-I1212 PolarHBondContact O-N 2.79Å; N347-I1212 VanDerWaalsContact O-N 3.13Å; N347-N1213 VanDerWaalsContact OD1-CB 3.29Å; N347-N1213 WeakPolarHBondContact OD1-CB 3.25Å
348	N	34.8	Very low	34.7	Very low	71 Å²	71	116.6 Å²	116.6	38%	0.38	63%	0.631	S	S	.	*			cis	106.1	171	26.7	-151.7	68.4	0	0	0	113.3	V1211 N1213	N348-V1211 PolarHBondContact N-O 3Å; N348-N1213 VanDerWaalsContact CG-O 3.3Å; N348-N1213 PolarHBondContact OD1-O 3.41Å
349	T	38.5	Very low	34.9	Very low	111 Å²	111	119.7 Å²	119.7	68%	0.681	63%	0.634	S	S	*	*			trans	72.2	160.8	175.4	76.4	0	0	0	0	117.7
350	D	37.1	Very low	35.1	Very low	122 Å²	122	121.9 Å²	121.9	65%	0.652	64%	0.636	S	S	*	*			cis	-166.5	163.6	-34.2	-95.9	-25.5	0	0	0	111.3
351	N	36.2	Very low	35.3	Very low	143 Å²	143	123.5 Å²	123.5	77%	0.765	64%	0.639	S	S	*	*			trans	65.6	158.2	150.3	-74.3	-37.9	0	0	0	119.8
352	K	36.5	Very low	35.2	Very low	160 Å²	160	120 Å²	120	70%	0.696	63%	0.628	S	S	*	*			cis	-171.4	176.2	-24.3	-173.2	167	169.4	-106.8	0	108.7
353	E	32.7	Very low	35.2	Very low	108 Å²	108	120 Å²	120	51%	0.505	63%	0.629	S	S	.	*			trans	90.6	101.1	144.3	-145.4	90.2	-160.9	0	0	120
354	K	33.5	Very low	35.6	Very low	147 Å²	147	124.3 Å²	124.3	64%	0.639	64%	0.642	S	S	*	*			trans	62	131.3	134.8	-70.4	175.6	-178	152.5	0	123.8
355	Q	29.8	Very low	35.6	Very low	166 Å²	166	125.9 Å²	125.9	78%	0.776	65%	0.651	S	S	*	*				68	150.3	129.1	-68	167.1	-26.2	0	0	119
356	S	31.5	Very low	35.5	Very low	89 Å²	89	128.6 Å²	128.6	62%	0.622	67%	0.669	S	S	*	*			cis	-174.8	165.6	-10.5	48	0	0	0	0	110.3
357	I	34.4	Very low	35.6	Very low	153 Å²	153	134.7 Å²	134.7	79%	0.785	69%	0.694	S	S	*	*			trans	69.1	154.3	156.9	-69.8	159	0	0	0	115.1
358	L	39.2	Very low	35.6	Very low	127 Å²	127	136.5 Å²	136.5	67%	0.665	70%	0.703	S	S	*	*			cis	-172.8	143.4	-45.3	-108.9	170.5	0	0	0	106.3
359	E	36.2	Very low	35.8	Very low	171 Å²	171	137.9 Å²	137.9	80%	0.799	72%	0.718	S	S	*	*			trans	56.9	170.4	159.5	-70.4	156.2	145.3	0	0	119.2
360	E	40.1	Very low	35.6	Very low	165 Å²	165	140 Å²	140	77%	0.771	73%	0.726	S	S	*	*			cis	-107.6	-117.5	-19.6	-154.9	-152.9	120.5	0	0	111.2
361	E	37.1	Very low	35.4	Very low	168 Å²	168	144.6 Å²	144.6	79%	0.785	73%	0.734	S	S	*	*			cis	-143.7	177.8	-8.7	-160.4	-112.7	96.9	0	0	108.5
362	A	32.9	Very low	35.3	Very low	57 Å²	57	143.3 Å²	143.3	47%	0.471	73%	0.727	S	S	.	*			trans	-140.9	160.2	-155.1	0	0	0	0	0	119.6
363	A	35.6	Very low	35.3	Very low	86 Å²	86	142 Å²	142	71%	0.711	73%	0.732	S	S	*	*			trans	70.8	126.1	147.8	0	0	0	0	0	122.2
364	K	41.2	Very low	35.2	Very low	208 Å²	208	147.3 Å²	147.3	90%	0.904	75%	0.749	S	S	*	*			trans	171.6	148.9	145.8	-90	140.3	-163.1	157.6	0	108.4
365	N	35.8	Very low	35.1	Very low	146 Å²	146	151.5 Å²	151.5	78%	0.781	76%	0.761	S	S	*	*			cis	-156.1	176.5	-24.6	-166.2	6.5	0	0	0	108.6
366	N	32.7	Very low	35.2	Very low	139 Å²	139	148.8 Å²	148.8	74%	0.743	76%	0.756	S	S	*	*			trans	-81.9	160	-175.1	-60.1	-89.7	0	0	0	115.1
367	Q	38.9	Very low	35.4	Very low	188 Å²	188	151.5 Å²	151.5	88%	0.879	76%	0.763	S	S	*	*			trans	162.4	161.4	137.6	-91.4	179.5	-12.9	0	0	110.5
368	D	33.2	Very low	35.3	Very low	141 Å²	141	149.2 Å²	149.2	75%	0.754	76%	0.761	S	S	*	*			cis	-166.5	178.8	-44.6	-146.1	-37.4	0	0	0	109.5
369	S	39.7	Very low	35.2	Very low	100 Å²	100	151.5 Å²	151.5	70%	0.699	77%	0.772	S	S	*	*			trans	79.2	116.6	156.2	71.5	0	0	0	0	122
370	N	33.4	Very low	34.9	Very low	156 Å²	156	154.1 Å²	154.1	83%	0.834	78%	0.775	S	S	*	*			trans	-4.9	154.7	143.5	-59.2	-60.8	0	0	0	119.4
371	R	33.5	Very low	34.9	Very low	218 Å²	218	153.9 Å²	153.9	82%	0.823	78%	0.778	S	S	*	*				179.4	152.3	71.8	-173.7	170.9	178.9	-174.8	-4.6	115.6
372	D	33	Very low	34.7	Very low	117 Å²	117	155.2 Å²	155.2	63%	0.626	78%	0.776	S	S	*	*			trans	2.8	145.3	156.9	-34.6	-36.7	0	0	0	119.8
373	T	37.1	Very low	34.7	Very low	131 Å²	131	161.8 Å²	161.8	80%	0.804	79%	0.789	S	S	*	*				-173.2	155.6	68.3	-58.4	0	0	0	0	113.1
374	Y	30	Very low	34.5	Very low	220 Å²	220	168.6 Å²	168.6	86%	0.863	80%	0.796	S	S	*	*			trans	-71.3	152.4	175.7	-51.9	-102.8	0	0	0	115.3
375	R	32	Very low	34.1	Very low	235 Å²	235	163.8 Å²	163.8	89%	0.887	79%	0.788	S	S	*	*				-163.8	156	111.9	-138.7	173.5	177.5	160.4	0.2	113.6
376	T	32.3	Very low	33.9	Very low	109 Å²	109	162 Å²	162	67%	0.669	79%	0.794	S	S	*	*			trans	-86.7	167.4	169.4	50	0	0	0	0	111.3
377	D	35.4	Very low	34.1	Very low	146 Å²	146	165.2 Å²	165.2	78%	0.781	80%	0.801	S	S	*	*				-167.1	166.5	105.1	-91.2	-4.1	0	0	0	112.4
378	S	31.1	Very low	33.8	Very low	106 Å²	106	166 Å²	166	74%	0.741	81%	0.805	S	S	*	*			trans	-143.4	134.6	-162.4	68.6	0	0	0	0	113.1
379	I	37.4	Very low	33.8	Very low	175 Å²	175	162.7 Å²	162.7	90%	0.897	80%	0.804	S	S	*	*			trans	-129.3	141.1	166.8	-62.2	-175.5	0	0	0	109.5
380	R	31.5	Very low	33.6	Very low	226 Å²	226	170 Å²	170	85%	0.853	82%	0.816	S	S	*	*			trans	-104	157.5	-172.5	-59.3	162.8	168.8	154.3	-6.5	111
381	L	38.2	Very low	33.6	Very low	160 Å²	160	173.7 Å²	173.7	84%	0.838	82%	0.82	S	S	*	*			trans	-175.3	121.1	135.3	-91.4	147.1	0	0	0	106.3
382	R	34	Very low	33.5	Very low	195 Å²	195	168 Å²	168	74%	0.736	81%	0.814	S	S	*	*				46.2	130.5	81.1	-78.7	-171.6	161.8	179.2	-3	112.6
383	R	33.8	Very low	33.7	Very low	196 Å²	196	167.9 Å²	167.9	74%	0.74	82%	0.818	S	S	*	*			cis	-158.6	161.7	16.3	-116.3	162.3	177.5	164	-7.8	111.7
384	R	30.8	Very low	33.7	Very low	228 Å²	228	169 Å²	169	86%	0.86	81%	0.814	S	S	*	*			trans	-5.9	158.3	147.5	-70.6	178.4	-178.2	174.4	-2.3	119.7
385	S	31.4	Very low	34.1	Very low	107 Å²	107	166.7 Å²	166.7	75%	0.748	81%	0.808	S	S	*	*			cis	168.1	132.3	-27	52.4	0	0	0	0	110
386	A	33.4	Very low	34.1	Very low	108 Å²	108	161.5 Å²	161.5	89%	0.893	80%	0.797	S	S	*	*			trans	-153.7	159.9	164.3	0	0	0	0	0	111.5
387	K	35.2	Very low	34.3	Very low	207 Å²	207	162.8 Å²	162.8	90%	0.9	80%	0.798	S	S	*	*			trans	-111.1	141.3	-178.2	-57.8	175.8	180	-179.3	0	111.3
388	Q	33.2	Very low	34.3	Very low	206 Å²	206	164.4 Å²	164.4	96%	0.963	80%	0.799	S	S	*	*				-157.3	148.3	117	-75.7	-143.3	14.3	0	0	108.5
389	G	33.7	Very low	34.3	Very low	71 Å²	71	165 Å²	165	73%	0.732	80%	0.798	S	S	*	*			trans	-170.4	124.3	179.3	0	0	0	0	0	111.6
390	R	36.4	Very low	34.1	Very low	253 Å²	253	163 Å²	163	96%	0.955	79%	0.789	S	S	*	*			trans	-87	137.6	173.1	-64.5	177.5	-179.8	166.6	-0.5	108.7
391	Y	31.5	Very low	34.3	Very low	233 Å²	233	158.4 Å²	158.4	91%	0.914	79%	0.786	S	S	*	*			trans	-77.2	130	167.2	-80.3	-95.6	0	0	0	109.4
392	S	33.1	Very low	34.5	Very low	99 Å²	99	159.9 Å²	159.9	69%	0.692	79%	0.786	S	S	*	*			trans	-123.3	130.9	162.6	-168.1	0	0	0	0	107.6
393	T	36.6	Very low	34.6	Very low	115 Å²	115	157.8 Å²	157.8	71%	0.706	79%	0.789	S	S	*	*			trans	-107.7	72.8	-173	-52.3	0	0	0	0	110	F395	T393-F395 HydrophobicContact CG2-CD2 4.16Å; T393-F395 PolarHBondContact O-N 3.44Å
394	E	36.6	Very low	34.5	Very low	155 Å²	155	152.9 Å²	152.9	72%	0.724	79%	0.785	S	S	*	*			trans	-68.5	102.5	170.7	-76.1	-69	155.4	0	0	110.3	I396	E394-I396 PolarHBondContact O-N 3.12Å
395	F	38.4	Very low	34.8	Very low	170 Å²	170	153.6 Å²	153.6	75%	0.746	79%	0.788	S	S	*	*			trans	-87.3	79.2	177.2	-125.7	-74.5	0	0	0	110.6	T393 I397	T393-F395 HydrophobicContact CG2-CD2 4.16Å; T393-F395 PolarHBondContact O-N 3.44Å; F395-I397 HydrophobicContact CD1-CD1 4.22Å; F395-I397 HydrophobicContact CD1-CG1 4Å; F395-I397 PolarHBondContact O-N 3.23Å
396	I	32.3	Very low	34.8	Very low	126 Å²	126	158 Å²	158	65%	0.646	79%	0.793	S	S	*	*			trans	-67.8	95.7	177.3	-55	177.1	0	0	0	109.8	E394 F398	E394-I396 PolarHBondContact O-N 3.12Å; I396-F398 HydrophobicContact CG2-CD2 4.15Å; I396-F398 HydrophobicContact CG2-CE2 3.81Å; I396-F398 HydrophobicContact CG2-CZ 4.22Å
397	I	37.4	Very low	35	Very low	137 Å²	137	165 Å²	165	70%	0.703	80%	0.796	S	S	*	*			trans	-96.8	107.8	173.7	-59.9	-179.4	0	0	0	108.9	F395 T399	F395-I397 HydrophobicContact CD1-CD1 4.22Å; F395-I397 HydrophobicContact CD1-CG1 4Å; F395-I397 PolarHBondContact O-N 3.23Å; I397-T399 PolarHBondContact O-N 3.11Å
398	F	33.8	Very low	34.9	Very low	180 Å²	180	160.4 Å²	160.4	79%	0.789	79%	0.79	S	S	*	*			trans	-68.1	121.4	-177.5	-74.1	-100.7	0	0	0	112.4	I396 N400	I396-F398 HydrophobicContact CG2-CD2 4.15Å; I396-F398 HydrophobicContact CG2-CE2 3.81Å; I396-F398 HydrophobicContact CG2-CZ 4.22Å; F398-N400 PolarHBondContact O-N 3.5Å
399	T	32	Very low	35.1	Very low	117 Å²	117	156.8 Å²	156.8	72%	0.718	79%	0.785	S	S	*	*			trans	-90.4	92.5	166.8	52.5	0	0	0	0	110.8	I397	I397-T399 PolarHBondContact O-N 3.11Å
400	N	33.6	Very low	34.9	Very low	134 Å²	134	158.3 Å²	158.3	72%	0.717	78%	0.784	S	S	*	*			trans	-154.1	115.9	162	-160.9	-11.7	0	0	0	111.4	F398	F398-N400 PolarHBondContact O-N 3.5Å
401	V	36.1	Very low	34.9	Very low	130 Å²	130	153.1 Å²	153.1	79%	0.788	78%	0.78	S	S	*	*			trans	-131.3	112.6	172.4	176.3	0	0	0	0	108
402	K	42.1	Very low	34.9	Very low	191 Å²	191	147.2 Å²	147.2	83%	0.83	77%	0.773	S	S	*	*			trans	-141.5	112.1	167.3	-77.9	-166.7	174	-175.7	0	111
403	N	35.6	Very low	35	Very low	150 Å²	150	148.1 Å²	148.1	80%	0.802	78%	0.777	S	S	*	*			trans	30	100.8	157.1	-67.3	0	0	0	0	121.9
404	S	32.1	Very low	34.6	Very low	94 Å²	94	151.7 Å²	151.7	66%	0.657	78%	0.782	S	S	*	*				74.5	148.6	113.6	92.4	0	0	0	0	123.1
405	R	36.6	Very low	34.3	Very low	243 Å²	243	150.8 Å²	150.8	92%	0.917	78%	0.782	S	S	*	*			trans	88.2	142.8	160.4	-62.2	171.4	-161.5	-152.8	0.2	118.3
406	K	31.9	Very low	33.9	Very low	200 Å²	200	145.6 Å²	145.6	87%	0.87	77%	0.767	S	S	*	*			trans	-108.6	139.8	-178.1	-56.2	169.3	-178.7	170.7	0	109.7
407	R	37.9	Very low	33.8	Very low	254 Å²	254	141.7 Å²	141.7	96%	0.958	75%	0.751	S	S	*	*			trans	-179.2	165.5	133.2	-98	164.4	-174.6	-160.3	0.9	109.5
408	S	32	Very low	33.4	Very low	110 Å²	110	138.3 Å²	138.3	77%	0.769	73%	0.729	S	S	*	*			trans	-142.1	173.8	-166.9	54.1	0	0	0	0	109.6
409	P	37.3	Very low	33.4	Very low	130 Å²	130	133.8 Å²	133.8	84%	0.844	72%	0.72	S	S	*	*			cis	-127.5	-153.2	5.3	41.2	-22.5	0	0	0	113.6
410	S	30.1	Very low	33.2	Very low	104 Å²	104	136.2 Å²	136.2	73%	0.727	72%	0.716	S	S	*	*			trans	-103.7	147.1	-165.3	55.8	0	0	0	0	116.5
411	V	35.2	Very low	33.1	Very low	144 Å²	144	136.6 Å²	136.6	87%	0.873	71%	0.713	S	S	*	*			trans	-138.6	154.8	146.4	-177.1	0	0	0	0	108.3
412	S	32.3	Very low	33	Very low	108 Å²	108	138.6 Å²	138.6	76%	0.755	71%	0.711	S	S	*	*			trans	-149.6	140.7	-178.8	-54.6	0	0	0	0	113.9
413	P	35.5	Very low	32.5	Very low	119 Å²	119	134.7 Å²	134.7	77%	0.773	71%	0.708	S	S	*	*			trans	-134.1	129.4	134.9	20.5	-0.6	0	0	0	111.6
414	K	28.7	Very low	32.8	Very low	189 Å²	189	133 Å²	133	82%	0.822	71%	0.706	S	S	*	*				76.7	106	75.9	-83.6	-171.1	174.9	-180	0	117
415	L	29.6	Very low	32.9	Very low	137 Å²	137	137.3 Å²	137.3	72%	0.717	72%	0.717	S	S	*	*			trans	98.9	138.6	131.9	-65.3	166.1	0	0	0	124.1	R874	L415-R874 PolarHBondContact O-NH2 3.27Å
416	S	28.8	Very low	32.7	Very low	61 Å²	61	131.7 Å²	131.7	43%	0.427	70%	0.702	S	S	.	*			trans	39.5	146.4	153.6	-56.9	0	0	0	0	123	R874 N876	S416-R874 VanDerWaalsContact O-CZ 3.24Å; S416-R874 PolarHBondContact O-NH1 3.34Å; S416-R874 PolarHBondContact O-NH2 3.41Å; S416-N876 WeakPolarHBondContact CB-OD1 3.48Å; S416-N876 PolarHBondContact O-ND2 2.86Å; S416-N876 VanDerWaalsContact O-ND2 3.15Å
417	S	31.2	Very low	32.9	Very low	44 Å²	44	128.6 Å²	128.6	31%	0.308	69%	0.694	S	S	.	*			cis	-178.7	-156.8	-17.1	57.9	0	0	0	0	107.9	Q875 N876 V877	S417-Q875 CarbonylContact C-O 3.49Å; S417-N876 PolarHBondContact N-ND2 3.43Å; S417-N876 WeakPolarHBondContact OG-CA 3.36Å; S417-N876 PolarHBondContact OG-OD1 3.32Å; S417-V877 WeakPolarHBondContact CB-O 3.32Å; S417-V877 PolarHBondContact OG-N 2.95Å; S417-V877 PolarHBondContact OG-O 3.26Å
418	R	29.7	Very low	32.7	Very low	65 Å²	65	122 Å²	122	25%	0.245	68%	0.682	C	S	.	*			trans	55.9	148.8	177.7	-124	-160.3	-86.1	174.2	-10.8	119.2	W420 Q875 N876 V877	R418-W420 VanDerWaalsContact NH1-CE2 3.3Å; R418-W420 VanDerWaalsContact NH1-CE3 3.3Å; R418-Q875 HydrophobicContact CB-CB 4.02Å; R418-Q875 HydrophobicContact CG-CB 4.4Å; R418-N876 VanDerWaalsContact CZ-O 3.24Å; R418-N876 PolarHBondContact NE-O 2.87Å; R418-N876 PolarHBondContact NH2-O 3.13Å; R418-V877 VanDerWaalsContact CA-O 3.29Å; R418-V877 WeakPolarHBondContact CA-O 3.03Å; R418-V877 HydrophobicContact CG-CB 3.79Å; R418-V877 HydrophobicContact CG-CG1 3.85Å; R418-V877 PolarHBondContact N-O 3.07Å
419	S	32.4	Very low	32.8	Very low	85 Å²	85	121.5 Å²	121.5	59%	0.594	68%	0.678	S	S	*	*			cis	88.7	153.8	6.6	139.7	0	0	0	0	120.2
420	W	29.1	Very low	32.8	Very low	168 Å²	168	125 Å²	125	64%	0.636	68%	0.68	S	S	*	*			trans	99.5	138.8	-170.3	-61.6	-6.9	0	0	0	114.9	R418 Q875	R418-W420 VanDerWaalsContact NH1-CE2 3.3Å; R418-W420 VanDerWaalsContact NH1-CE3 3.3Å; W420-Q875 VanDerWaalsContact CZ3-OE1 3.31Å
421	E	30.1	Very low	33	Very low	142 Å²	142	125 Å²	125	66%	0.664	68%	0.68	S	S	*	*			cis	-167.3	159.3	-44.4	-140.3	-163.9	150.2	0	0	110.1
422	K	34.3	Very low	33.1	Very low	172 Å²	172	125 Å²	125	75%	0.748	68%	0.68	S	S	*	*			trans	64.5	166.1	162.5	-69.7	149.6	179.7	148.4	0	117.3
423	S	31.9	Very low	33.4	Very low	109 Å²	109	123 Å²	123	76%	0.762	68%	0.677	S	S	*	*			cis	-167.7	151.2	-32.7	-174.4	0	0	0	0	109.1
424	P	41.8	Very low	33.4	Very low	116 Å²	116	123.6 Å²	123.6	75%	0.753	68%	0.678	S	S	*	*			trans	-106.6	157	-170.2	39.1	-34.9	0	0	0	117.1
425	M	35	Very low	33.7	Very low	183 Å²	183	125.7 Å²	125.7	90%	0.901	68%	0.681	S	S	*	*			trans	-154.6	-174.4	162.4	-69	-172.3	69.7	0	0	109.2
426	E	31.4	Very low	34.6	Very low	126 Å²	126	125.5 Å²	125.5	59%	0.589	69%	0.685	S	S	*	*				-150.3	178.1	-88.6	-161.9	-179.1	-107.8	0	0	110.9	L1146	E426-L1146 VanDerWaalsContact OE1-CD1 3.28Å; E426-L1146 WeakPolarHBondContact OE1-CD1 3.26Å
427	L	35.8	Very low	35.2	Very low	135 Å²	135	128.9 Å²	128.9	71%	0.707	71%	0.706	S	S	*	*			trans	98.6	120.1	154	-59.2	167.5	0	0	0	123.6
428	T	33.4	Very low	35.4	Very low	115 Å²	115	132.2 Å²	132.2	71%	0.706	73%	0.729	S	S	*	*			trans	72.1	92.1	132.5	58	0	0	0	0	126.5
429	S	34.6	Very low	35.7	Very low	99 Å²	99	135.6 Å²	135.6	69%	0.692	76%	0.757	S	S	*	*				60	142.9	110.4	72.1	0	0	0	0	126.5
430	K	38	Very low	36	Very low	204 Å²	204	137.8 Å²	137.8	89%	0.887	77%	0.766	S	S	*	*			trans	107.4	152.8	158.5	-64.4	168	-178	172.7	0	116.1
431	S	34.1	Very low	36.2	Very low	103 Å²	103	134.3 Å²	134.3	72%	0.72	77%	0.768	S	S	*	*			cis	-175	161.3	-30.6	-167	0	0	0	0	110.3
432	V	37.8	Very low	36.6	Very low	144 Å²	144	132.3 Å²	132.3	87%	0.873	77%	0.769	S	S	*	*			trans	70.1	147.5	175.6	-167.1	0	0	0	0	114.4
433	G	37.2	Very low	36.6	Very low	67 Å²	67	131.8 Å²	131.8	69%	0.691	78%	0.775	S	S	*	*			cis	142.9	157	-4.7	0	0	0	0	0	112
434	V	35.9	Very low	36.8	Very low	131 Å²	131	132.4 Å²	132.4	79%	0.794	78%	0.779	S	S	*	*			cis	-172.8	162.8	-8.8	73.1	0	0	0	0	111.7
435	R	36.1	Very low	36.4	Very low	234 Å²	234	132.6 Å²	132.6	88%	0.883	78%	0.778	S	S	*	*			trans	83.3	151.7	163.7	-76	177.8	-179.1	178.5	0	122.7
436	T	48.9	Very low	36.4	Very low	132 Å²	132	129.7 Å²	129.7	81%	0.81	77%	0.77	S	S	*	*			trans	-133.9	172.5	174.3	53.3	0	0	0	0	110.9
437	P	41.5	Very low	36.5	Very low	132 Å²	132	130 Å²	130	86%	0.857	78%	0.781	S	S	*	*			trans	-142.5	-173.6	137.8	35	-17.1	0	0	0	115.1
438	S	34.3	Very low	36.6	Very low	114 Å²	114	129.4 Å²	129.4	80%	0.797	78%	0.782	S	S	*	*			trans	-138.2	-151.6	-174.9	69.9	0	0	0	0	113.5
439	V	37.1	Very low	36.7	Very low	137 Å²	137	133.3 Å²	133.3	83%	0.83	79%	0.792	S	S	*	*			trans	98.2	130.2	-179.1	176.2	0	0	0	0	113.8
440	V	37.3	Very low	36.5	Very low	131 Å²	131	133 Å²	133	79%	0.794	79%	0.791	S	S	*	*			cis	-163.6	-171.4	-8.1	79.7	0	0	0	0	113.2
441	S	34.9	Very low	36.2	Very low	95 Å²	95	130.2 Å²	130.2	66%	0.664	79%	0.786	S	S	*	*			trans	-48.5	175.5	175	-46	0	0	0	0	118.6
442	S	37	Very low	36.2	Very low	100 Å²	100	131 Å²	131	70%	0.699	79%	0.786	S	S	*	*			cis	-163.7	153.7	29.9	-34.6	0	0	0	0	117.2
443	N	36	Very low	36.1	Very low	160 Å²	160	131.7 Å²	131.7	86%	0.856	78%	0.782	S	S	*	*			trans	42.9	123.4	140.9	-53.2	-5.2	0	0	0	123.5
444	S	36	Very low	35.9	Very low	122 Å²	122	133.3 Å²	133.3	85%	0.853	78%	0.782	S	S	*	*				-173.5	147	114.2	-172.1	0	0	0	0	114.4
445	T	33.2	Very low	35.9	Very low	120 Å²	120	130.6 Å²	130.6	74%	0.736	77%	0.766	S	S	*	*			trans	-68.1	169.7	166.9	-26.8	0	0	0	0	110.4
446	V	33.4	Very low	36	Very low	122 Å²	122	126.3 Å²	126.3	74%	0.739	75%	0.754	S	S	*	*			cis	-162.2	168.5	39.5	-164	0	0	0	0	112.4
447	V	34.7	Very low	35.7	Very low	134 Å²	134	123.5 Å²	123.5	81%	0.812	74%	0.74	S	S	*	*			trans	101.1	135.1	156.8	-172	0	0	0	0	117.6
448	V	36.5	Very low	35.7	Very low	121 Å²	121	120.7 Å²	120.7	73%	0.733	72%	0.718	S	S	*	*			trans	-107.8	142.8	179.6	171.8	0	0	0	0	110.2
449	Q	35.8	Very low	35.9	Very low	197 Å²	197	122.7 Å²	122.7	92%	0.921	71%	0.708	S	S	*	*			trans	-127.3	139.7	147.4	-72	-167.2	0.8	0	0	109.6
450	S	30.6	Very low	36.3	Very low	94 Å²	94	120.1 Å²	120.1	66%	0.657	69%	0.689	S	S	*	*			trans	-113.6	167	-177.5	52.3	0	0	0	0	111
451	N	32.1	Very low	37.2	Very low	145 Å²	145	118.9 Å²	118.9	78%	0.775	68%	0.677	S	S	*	*			trans	93.3	92	173	-49.4	-23.5	0	0	0	116.9
452	T	35.2	Very low	37.9	Very low	118 Å²	118	120 Å²	120	72%	0.724	67%	0.67	S	S	*	*			trans	-168.5	33.6	152	10.9	0	0	0	0	115.2
453	M	35	Very low	38.5	Very low	160 Å²	160	119.2 Å²	119.2	79%	0.788	66%	0.658	S	S	*	*			trans	-109.5	-8	-172.4	-77.5	-71.8	121.5	0	0	117	T455	M453-T455 PolarHBondContact O-N 3.13Å
454	S	33.3	Very low	39.5	Very low	101 Å²	101	117.4 Å²	117.4	71%	0.706	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81	-10.9	-173	50.3	0	0	0	0	115.8
455	T	36.1	Very low	40.4	Very low	73 Å²	73	115.8 Å²	115.8	45%	0.448	62%	0.621	S	S	.	*	T	Hydrogen-bonded Turn	trans	-105.1	-4.4	-166.9	53.9	0	0	0	0	115.5	M453 R459	M453-T455 PolarHBondContact O-N 3.13Å; T455-R459 PolarHBondContact O-NE 3.01Å
456	F	36.7	Very low	41.2	Very low	145 Å²	145	114.5 Å²	114.5	64%	0.636	61%	0.607	S	S	*	*	S	Bend	trans	-95.6	-32.7	-179.4	-81.7	-84.8	0	0	0	113.9
457	S	43.3	Very low	42	Very low	73 Å²	73	114.7 Å²	114.7	51%	0.51	60%	0.6	S	S	.	*	H	α-helix	trans	-64.5	-45.7	176	45.9	0	0	0	0	112.2	R459 N460 I461	S457-R459 VanDerWaalsContact C-N 3.31Å; S457-R459 PolarHBondContact O-N 2.79Å; S457-N460 WeakPolarHBondContact O-CB 3.28Å; S457-N460 PolarHBondContact O-N 3.38Å; S457-N460 VanDerWaalsContact O-N 3.12Å; S457-I461 PolarHBondContact O-N 3.07Å
458	D	41.9	Very low	43.1	Very low	73 Å²	73	111 Å²	111	39%	0.39	58%	0.575	S	S	.	*	H	α-helix	trans	-64.7	-31.8	-172.8	-165.5	53.8	0	0	0	113.3	K462	D458-K462 WeakPolarHBondContact O-CG 3.44Å; D458-K462 PolarHBondContact O-N 2.71Å; D458-K462 IonicContact OD1-NZ 3.94Å; D458-K462 IonicContact OD2-NZ 3.41Å; D458-K462 PolarHBondContact OD2-NZ 2.99Å
459	R	38.9	Very low	44	Very low	155 Å²	155	109.9 Å²	109.9	59%	0.585	56%	0.561	S	S	*	*	H	α-helix	trans	-66.1	-47.6	172.5	-60.6	179.6	-168.4	-157.5	-2.1	111	T455 S457 I461 K462 D463	T455-R459 PolarHBondContact O-NE 3.01Å; S457-R459 VanDerWaalsContact C-N 3.31Å; S457-R459 PolarHBondContact O-N 2.79Å; R459-I461 PolarHBondContact O-N 2.9Å; R459-K462 PolarHBondContact O-N 3.32Å; R459-D463 PolarHBondContact O-N 3.06Å
460	N	45.2	Very low	44.8	Very low	83 Å²	83	105.9 Å²	105.9	44%	0.444	55%	0.546	S	S	.	.	H	α-helix	trans	-65.2	-23.5	-178.1	-157.5	-95.2	0	0	0	113.4	S457 K464	S457-N460 WeakPolarHBondContact O-CB 3.28Å; S457-N460 PolarHBondContact O-N 3.38Å; S457-N460 VanDerWaalsContact O-N 3.12Å; N460-K464 WeakPolarHBondContact O-CD 3.49Å; N460-K464 WeakPolarHBondContact O-CG 3.44Å; N460-K464 WeakPolarHBondContact OD1-CE 3.32Å; N460-K464 PolarHBondContact OD1-NZ 3.4Å
461	I	56.5	Low	46.4	Very low	105 Å²	105	103.8 Å²	103.8	54%	0.538	53%	0.527	S	S	.	.	H	α-helix	trans	-74.7	-49.2	170.8	-64.7	168.6	0	0	0	110.1	S457 R459 D463 K464 E465	S457-I461 PolarHBondContact O-N 3.07Å; R459-I461 PolarHBondContact O-N 2.9Å; I461-D463 VanDerWaalsContact C-N 3.33Å; I461-D463 PolarHBondContact O-N 3.07Å; I461-K464 PolarHBondContact O-N 3.03Å; I461-K464 VanDerWaalsContact O-N 3.16Å; I461-E465 PolarHBondContact O-N 3.48Å
462	K	49.3	Very low	48.8	Very low	118 Å²	118	101.5 Å²	101.5	51%	0.513	51%	0.514	S	S	.	.	H	α-helix	trans	-60.7	-39.3	177.5	-74.3	163.1	179.6	162.2	0	112.5	D458 R459 K464 E465 Q466	D458-K462 WeakPolarHBondContact O-CG 3.44Å; D458-K462 PolarHBondContact O-N 2.71Å; D458-K462 IonicContact OD1-NZ 3.94Å; D458-K462 IonicContact OD2-NZ 3.41Å; D458-K462 PolarHBondContact OD2-NZ 2.99Å; R459-K462 PolarHBondContact O-N 3.32Å; K462-K464 VanDerWaalsContact C-N 3.32Å; K462-K464 PolarHBondContact O-N 2.93Å; K462-E465 PolarHBondContact O-N 3.11Å; K462-Q466 WeakPolarHBondContact O-CB 3.46Å; K462-Q466 PolarHBondContact O-N 3.34Å
463	D	49.1	Very low	51.2	Low	85 Å²	85	96.9 Å²	96.9	46%	0.455	49%	0.488	S	S	.	.	H	α-helix	trans	-61.8	-38.6	175.5	-62.8	-32.7	0	0	0	112.1	R459 I461 Q467	R459-D463 PolarHBondContact O-N 3.06Å; I461-D463 VanDerWaalsContact C-N 3.33Å; I461-D463 PolarHBondContact O-N 3.07Å; D463-Q467 WeakPolarHBondContact O-CB 3.41Å; D463-Q467 VanDerWaalsContact O-CG 3.24Å; D463-Q467 WeakPolarHBondContact O-CG 3.38Å; D463-Q467 PolarHBondContact O-N 3.31Å
464	K	56.2	Low	53.8	Low	122 Å²	122	92 Å²	92	53%	0.53	46%	0.463	S	S	.	.	H	α-helix	trans	-72.6	-39.4	176.6	-74.6	166.4	179.8	150.9	0	112.1	N460 I461 K462 Q466 L468	N460-K464 WeakPolarHBondContact O-CD 3.49Å; N460-K464 WeakPolarHBondContact O-CG 3.44Å; N460-K464 WeakPolarHBondContact OD1-CE 3.32Å; N460-K464 PolarHBondContact OD1-NZ 3.4Å; I461-K464 PolarHBondContact O-N 3.03Å; I461-K464 VanDerWaalsContact O-N 3.16Å; K462-K464 VanDerWaalsContact C-N 3.32Å; K462-K464 PolarHBondContact O-N 2.93Å; K464-Q466 VanDerWaalsContact C-N 3.31Å; K464-L468 WeakPolarHBondContact O-CB 3.35Å; K464-L468 PolarHBondContact O-N 3.27Å
465	E	55.8	Low	56.4	Low	87 Å²	87	91.8 Å²	91.8	41%	0.407	45%	0.452	S	S	.	.	H	α-helix	trans	-66.5	-35.3	174.3	-155.1	-161.4	141.1	0	0	111.4	I461 K462 L468 K469	I461-E465 PolarHBondContact O-N 3.48Å; K462-E465 PolarHBondContact O-N 3.11Å; E465-L468 WeakPolarHBondContact O-CB 3.32Å; E465-L468 PolarHBondContact O-N 3.38Å; E465-K469 VanDerWaalsContact O-CG 3.29Å; E465-K469 WeakPolarHBondContact O-CG 3.45Å; E465-K469 PolarHBondContact O-N 2.91Å; E465-K469 WeakPolarHBondContact OE1-CE 3.39Å; E465-K469 IonicContact OE1-NZ 3.33Å; E465-K469 PolarHBondContact OE1-NZ 2.81Å
466	Q	48.8	Very low	58.9	Low	93 Å²	93	91 Å²	91	44%	0.435	44%	0.44	S	S	.	.	H	α-helix	trans	-72.1	-43.1	175.3	-171.2	56.4	43.9	0	0	112.1	K462 K464 L468 K469 D470	K462-Q466 WeakPolarHBondContact O-CB 3.46Å; K462-Q466 PolarHBondContact O-N 3.34Å; K464-Q466 VanDerWaalsContact C-N 3.31Å; Q466-L468 PolarHBondContact O-N 3.39Å; Q466-K469 CarbonylContact O-C 3.16Å; Q466-K469 VanDerWaalsContact O-CA 3.26Å; Q466-K469 WeakPolarHBondContact O-CA 3.19Å; Q466-K469 WeakPolarHBondContact O-CB 3.31Å; Q466-K469 PolarHBondContact O-N 3.12Å; Q466-D470 PolarHBondContact NE2-OD1 3Å; Q466-D470 PolarHBondContact O-N 2.89Å
467	Q	51.8	Low	61.6	Low	126 Å²	126	84.2 Å²	84.2	59%	0.589	41%	0.411	S	S	*	.	H	α-helix	trans	-59.1	-37.3	172.2	-73.9	167.4	32.6	0	0	111.6	D463 K469 D470 L471	D463-Q467 WeakPolarHBondContact O-CB 3.41Å; D463-Q467 VanDerWaalsContact O-CG 3.24Å; D463-Q467 WeakPolarHBondContact O-CG 3.38Å; D463-Q467 PolarHBondContact O-N 3.31Å; Q467-K469 VanDerWaalsContact C-N 3.28Å; Q467-K469 PolarHBondContact O-N 2.98Å; Q467-D470 PolarHBondContact O-N 3.46Å; Q467-L471 WeakPolarHBondContact O-CG 3.45Å; Q467-L471 PolarHBondContact O-N 3.02Å
468	L	56	Low	63.9	Low	57 Å²	57	84.5 Å²	84.5	30%	0.298	41%	0.406	S	S	.	.	H	α-helix	trans	-64.3	-27.9	169.2	-88.6	161	0	0	0	113.7	K464 E465 Q466 L471 R476 L479	K464-L468 WeakPolarHBondContact O-CB 3.35Å; K464-L468 PolarHBondContact O-N 3.27Å; E465-L468 WeakPolarHBondContact O-CB 3.32Å; E465-L468 PolarHBondContact O-N 3.38Å; Q466-L468 PolarHBondContact O-N 3.39Å; L468-L471 HydrophobicContact CD2-CD1 4.46Å; L468-R476 VanDerWaalsContact O-CD 3.27Å; L468-R476 WeakPolarHBondContact O-CD 3.22Å; L468-R476 VanDerWaalsContact O-CZ 3.25Å; L468-R476 PolarHBondContact O-NE 3.14Å; L468-R476 VanDerWaalsContact O-NE 3.1Å; L468-L479 HydrophobicContact CD2-CD2 3.84Å
469	K	57.2	Low	66.3	Low	98 Å²	98	84.9 Å²	84.9	43%	0.426	41%	0.408	S	S	.	.	H	α-helix	trans	-81.6	-13.4	173.8	-71.5	164.5	-171.6	169.3	0	113.9	E465 Q466 Q467 R476	E465-K469 VanDerWaalsContact O-CG 3.29Å; E465-K469 WeakPolarHBondContact O-CG 3.45Å; E465-K469 PolarHBondContact O-N 2.91Å; E465-K469 WeakPolarHBondContact OE1-CE 3.39Å; E465-K469 IonicContact OE1-NZ 3.33Å; E465-K469 PolarHBondContact OE1-NZ 2.81Å; Q466-K469 CarbonylContact O-C 3.16Å; Q466-K469 VanDerWaalsContact O-CA 3.26Å; Q466-K469 WeakPolarHBondContact O-CA 3.19Å; Q466-K469 WeakPolarHBondContact O-CB 3.31Å; Q466-K469 PolarHBondContact O-N 3.12Å; Q467-K469 VanDerWaalsContact C-N 3.28Å; Q467-K469 PolarHBondContact O-N 2.98Å; K469-R476 VanDerWaalsContact C-NH2 3.3Å; K469-R476 PolarHBondContact O-NH2 2.94Å
470	D	51.5	Low	68.9	Low	113 Å²	113	77.9 Å²	77.9	60%	0.604	38%	0.382	S	S	*	.	H	α-helix	trans	-93.8	-14.9	177.9	-57.2	-24.4	0	0	0	113.1	Q466 Q467	Q466-D470 PolarHBondContact NE2-OD1 3Å; Q466-D470 PolarHBondContact O-N 2.89Å; Q467-D470 PolarHBondContact O-N 3.46Å
471	L	64.5	Low	71.2	Confident	50 Å²	50	74.6 Å²	74.6	26%	0.262	36%	0.364	S	S	.	.	S	Bend	trans	-72.4	149.8	174.7	-59	-177.5	0	0	0	112.6	Q467 L468 E475 R476	Q467-L471 WeakPolarHBondContact O-CG 3.45Å; Q467-L471 PolarHBondContact O-N 3.02Å; L468-L471 HydrophobicContact CD2-CD1 4.46Å; L471-E475 HydrophobicContact CB-CB 4.42Å; L471-E475 HydrophobicContact CD1-CG 4.26Å; L471-R476 HydrophobicContact CB-CG 3.94Å; L471-R476 VanDerWaalsContact O-CZ 3.23Å; L471-R476 PolarHBondContact O-NE 2.81Å; L471-R476 PolarHBondContact O-NH2 2.77Å
472	D	81.6	Confident	72.9	Confident	96 Å²	96	77.5 Å²	77.5	51%	0.513	37%	0.368	S	S	.	.			trans	-61.6	147.8	169.2	-167.2	-5.2	0	0	0	110.3	E474 E475 R476	D472-E474 PolarHBondContact O-N 2.98Å; D472-E475 PolarHBondContact O-N 3.22Å; D472-R476 PolarHBondContact O-N 3.14Å; D472-R476 VanDerWaalsContact O-N 3.08Å
473	A	86.6	Confident	75	Confident	21 Å²	21	72.9 Å²	72.9	17%	0.174	35%	0.351	C	S	.	.	H	α-helix	trans	-59.8	-31.8	-177.5	0	0	0	0	0	112.2	L477 I514	A473-L477 WeakPolarHBondContact O-CB 3.31Å; A473-L477 WeakPolarHBondContact O-CD1 3.41Å; A473-L477 VanDerWaalsContact O-CG 3.27Å; A473-L477 WeakPolarHBondContact O-CG 3.4Å; A473-L477 PolarHBondContact O-N 2.93Å; A473-I514 HydrophobicContact CB-CD1 4.22Å
474	E	88.5	Confident	77.2	Confident	57 Å²	57	68.9 Å²	68.9	27%	0.266	33%	0.329	S	S	.	.	H	α-helix	trans	-61.3	-40.1	171.4	173	159.8	-162.1	0	0	112.5	D472 L478 I514 R517	D472-E474 PolarHBondContact O-N 2.98Å; E474-L478 HydrophobicContact CG-CD1 4.43Å; E474-L478 WeakPolarHBondContact O-CG 3.49Å; E474-L478 PolarHBondContact O-N 3.03Å; E474-I514 HydrophobicContact CB-CG2 4.31Å; E474-R517 VanDerWaalsContact CD-CD 3.42Å; E474-R517 WeakPolarHBondContact OE1-CD 3.31Å; E474-R517 WeakPolarHBondContact OE2-CD 3.42Å; E474-R517 IonicContact OE2-CZ 2.75Å; E474-R517 IonicContact OE2-NE 3.59Å; E474-R517 IonicContact OE2-NH1 3.91Å; E474-R517 PolarHBondContact OE2-NH1 3.32Å
475	E	89	Confident	78.9	Confident	98 Å²	98	65.2 Å²	65.2	46%	0.458	31%	0.313	S	S	.	.	H	α-helix	trans	-74.6	-39.2	179.4	-170.9	167.3	-163.9	0	0	111.8	L471 D472 L477 L478 L479	L471-E475 HydrophobicContact CB-CB 4.42Å; L471-E475 HydrophobicContact CD1-CG 4.26Å; D472-E475 PolarHBondContact O-N 3.22Å; E475-L477 VanDerWaalsContact C-N 3.34Å; E475-L477 PolarHBondContact O-N 2.89Å; E475-L478 PolarHBondContact O-N 3.31Å; E475-L479 WeakPolarHBondContact O-CB 3.31Å; E475-L479 PolarHBondContact O-N 3.27Å
476	R	89.2	Confident	80.7	Confident	55 Å²	55	64.2 Å²	64.2	21%	0.208	32%	0.316	C	S	.	.	H	α-helix	trans	-59.1	-45.5	172	-59.6	-179.5	-145.6	-161.1	-0.8	111.5	L468 K469 L471 D472 L478 L479 I480 M508	L468-R476 VanDerWaalsContact O-CD 3.27Å; L468-R476 WeakPolarHBondContact O-CD 3.22Å; L468-R476 VanDerWaalsContact O-CZ 3.25Å; L468-R476 PolarHBondContact O-NE 3.14Å; L468-R476 VanDerWaalsContact O-NE 3.1Å; K469-R476 VanDerWaalsContact C-NH2 3.3Å; K469-R476 PolarHBondContact O-NH2 2.94Å; L471-R476 HydrophobicContact CB-CG 3.94Å; L471-R476 VanDerWaalsContact O-CZ 3.23Å; L471-R476 PolarHBondContact O-NE 2.81Å; L471-R476 PolarHBondContact O-NH2 2.77Å; D472-R476 PolarHBondContact O-N 3.14Å; D472-R476 VanDerWaalsContact O-N 3.08Å; R476-L478 VanDerWaalsContact C-N 3.34Å; R476-L478 PolarHBondContact O-N 2.88Å; R476-L479 PolarHBondContact O-N 3.38Å; R476-I480 WeakPolarHBondContact O-CD1 3.26Å; R476-I480 VanDerWaalsContact O-CG1 3.24Å; R476-I480 WeakPolarHBondContact O-CG1 3.36Å; R476-I480 PolarHBondContact O-N 3.28Å; R476-M508 HydrophobicContact CB-CE 4.43Å; R476-M508 HydrophobicContact CB-SD 4.04Å
477	L	92.4	Very high	82.7	Confident	3 Å²	3	60.1 Å²	60.1	2%	0.016	30%	0.298	C	S	.	.	H	α-helix	trans	-57.9	-44.2	177.5	-84.8	165.9	0	0	0	112.4	A473 E475 I480 D481 L505 M508 I510 I514 C518 V521	A473-L477 WeakPolarHBondContact O-CB 3.31Å; A473-L477 WeakPolarHBondContact O-CD1 3.41Å; A473-L477 VanDerWaalsContact O-CG 3.27Å; A473-L477 WeakPolarHBondContact O-CG 3.4Å; A473-L477 PolarHBondContact O-N 2.93Å; E475-L477 VanDerWaalsContact C-N 3.34Å; E475-L477 PolarHBondContact O-N 2.89Å; L477-I480 PolarHBondContact O-N 3.25Å; L477-D481 WeakPolarHBondContact O-CB 3.3Å; L477-D481 PolarHBondContact O-N 3.16Å; L477-L505 HydrophobicContact CD2-CD1 3.62Å; L477-M508 HydrophobicContact CD2-CE 3.81Å; L477-M508 HydrophobicContact CG-CE 3.78Å; L477-I510 HydrophobicContact CD1-CG2 4.34Å; L477-I510 HydrophobicContact CD2-CD1 3.98Å; L477-I514 HydrophobicContact CD1-CG2 3.57Å; L477-C518 HydrophobicContact CB-CB 4.21Å; L477-C518 HydrophobicContact CD1-CB 4.16Å; L477-V521 HydrophobicContact CB-CG2 4.14Å; L477-V521 HydrophobicContact CD2-CG1 4.1Å; L477-V521 HydrophobicContact CD2-CG2 4.36Å
478	L	91.4	Very high	84.6	Confident	79 Å²	79	54.1 Å²	54.1	41%	0.414	27%	0.27	S	S	.	.	H	α-helix	trans	-69.6	-35	177.2	-68	170.3	0	0	0	112.7	E474 E475 R476 R482	E474-L478 HydrophobicContact CG-CD1 4.43Å; E474-L478 WeakPolarHBondContact O-CG 3.49Å; E474-L478 PolarHBondContact O-N 3.03Å; E475-L478 PolarHBondContact O-N 3.31Å; R476-L478 VanDerWaalsContact C-N 3.34Å; R476-L478 PolarHBondContact O-N 2.88Å; L478-R482 WeakPolarHBondContact O-CB 3.21Å; L478-R482 PolarHBondContact O-N 3.44Å
479	L	92	Very high	86.1	Confident	82 Å²	82	54.1 Å²	54.1	43%	0.429	27%	0.269	S	S	.	.	H	α-helix	trans	-69.2	-38.5	175.1	-176	58.1	0	0	0	112.1	L468 E475 R476 R482 S483	L468-L479 HydrophobicContact CD2-CD2 3.84Å; E475-L479 WeakPolarHBondContact O-CB 3.31Å; E475-L479 PolarHBondContact O-N 3.27Å; R476-L479 PolarHBondContact O-N 3.38Å; L479-R482 PolarHBondContact O-N 3.24Å; L479-S483 WeakPolarHBondContact O-CB 3.48Å; L479-S483 PolarHBondContact O-N 3.11Å
480	I	93.8	Very high	87.3	Confident	8 Å²	8	54.5 Å²	54.5	4%	0.041	27%	0.273	C	S	.	.	H	α-helix	trans	-65	-46.1	173.4	-67.3	160.8	0	0	0	110.7	R476 L477 R482 S483 I484 R501 F504 L505 M508	R476-I480 WeakPolarHBondContact O-CD1 3.26Å; R476-I480 VanDerWaalsContact O-CG1 3.24Å; R476-I480 WeakPolarHBondContact O-CG1 3.36Å; R476-I480 PolarHBondContact O-N 3.28Å; L477-I480 PolarHBondContact O-N 3.25Å; I480-R482 VanDerWaalsContact C-N 3.32Å; I480-R482 PolarHBondContact O-N 2.92Å; I480-S483 WeakPolarHBondContact O-CB 3.47Å; I480-S483 PolarHBondContact O-N 3.45Å; I480-S483 VanDerWaalsContact O-N 3.1Å; I480-I484 HydrophobicContact CG2-CD1 3.7Å; I480-I484 HydrophobicContact CG2-CG1 4.33Å; I480-I484 WeakPolarHBondContact O-CG1 3.37Å; I480-I484 PolarHBondContact O-N 2.65Å; I480-R501 HydrophobicContact CG2-CB 4.48Å; I480-F504 HydrophobicContact CD1-CD1 3.75Å; I480-F504 HydrophobicContact CD1-CE1 3.97Å; I480-F504 HydrophobicContact CG1-CD1 4.34Å; I480-L505 HydrophobicContact CD1-CD1 4.11Å; I480-L505 HydrophobicContact CG2-CB 4.39Å; I480-L505 HydrophobicContact CG2-CD2 4.07Å; I480-M508 HydrophobicContact CD1-CE 3.73Å
481	D	93.6	Very high	88.7	Confident	13 Å²	13	52 Å²	52	7%	0.07	27%	0.273	C	S	.	.	H	α-helix	trans	-58.7	-41.2	175.4	174.7	59.3	0	0	0	112.4	L477 K485 V521 T524	L477-D481 WeakPolarHBondContact O-CB 3.3Å; L477-D481 PolarHBondContact O-N 3.16Å; D481-K485 WeakPolarHBondContact O-CD 3.47Å; D481-K485 WeakPolarHBondContact O-CG 3.45Å; D481-K485 PolarHBondContact O-N 3.31Å; D481-K485 VanDerWaalsContact OD1-CE 3.28Å; D481-K485 WeakPolarHBondContact OD1-CE 3.4Å; D481-K485 IonicContact OD1-NZ 3.69Å; D481-K485 PolarHBondContact OD1-NZ 2.87Å; D481-K485 IonicContact OD2-NZ 2.71Å; D481-K485 PolarHBondContact OD2-NZ 3.07Å; D481-V521 HydrophobicContact CB-CG2 3.98Å; D481-T524 WeakPolarHBondContact OD1-CB 3.22Å; D481-T524 PolarHBondContact OD1-OG1 3.34Å
482	R	92.8	Very high	89.7	Confident	166 Å²	166	57 Å²	57	63%	0.626	30%	0.295	S	S	*	.	H	α-helix	trans	-63.2	-45.4	171.8	-172.7	177.9	-177.7	-178.7	0.9	111.8	L478 L479 I480 K485 S486	L478-R482 WeakPolarHBondContact O-CB 3.21Å; L478-R482 PolarHBondContact O-N 3.44Å; L479-R482 PolarHBondContact O-N 3.24Å; I480-R482 VanDerWaalsContact C-N 3.32Å; I480-R482 PolarHBondContact O-N 2.92Å; R482-K485 PolarHBondContact O-N 2.95Å; R482-S486 PolarHBondContact O-N 3.27Å; R482-S486 PolarHBondContact O-OG 3.01Å; R482-S486 VanDerWaalsContact O-OG 3.08Å
483	S	93	Very high	90.1	Very high	21 Å²	21	54.9 Å²	54.9	15%	0.147	28%	0.282	C	S	.	.	H	α-helix	trans	-61.4	-47.1	-179.9	-165.7	0	0	0	0	111.8	L479 I480 K485 S486 S487 R501	L479-S483 WeakPolarHBondContact O-CB 3.48Å; L479-S483 PolarHBondContact O-N 3.11Å; I480-S483 WeakPolarHBondContact O-CB 3.47Å; I480-S483 PolarHBondContact O-N 3.45Å; I480-S483 VanDerWaalsContact O-N 3.1Å; S483-K485 VanDerWaalsContact C-N 3.33Å; S483-K485 PolarHBondContact O-N 3.39Å; S483-S486 WeakPolarHBondContact CA-OG 3.45Å; S483-S486 PolarHBondContact O-N 2.56Å; S483-S486 PolarHBondContact O-OG 3.21Å; S483-S487 WeakPolarHBondContact O-CB 3.4Å; S483-S487 PolarHBondContact O-N 2.87Å; S483-S487 PolarHBondContact O-OG 2.78Å; S483-R501 WeakPolarHBondContact OG-CD 3.2Å; S483-R501 PolarHBondContact OG-NE 3Å
484	I	95.1	Very high	90.4	Very high	1 Å²	1	57.1 Å²	57.1	1%	0.005	29%	0.291	C	S	.	.	H	α-helix	trans	-60.7	-42.7	179	-69.9	168.1	0	0	0	110.6	I480 S487 L488 R501 L502 T524	I480-I484 HydrophobicContact CG2-CD1 3.7Å; I480-I484 HydrophobicContact CG2-CG1 4.33Å; I480-I484 WeakPolarHBondContact O-CG1 3.37Å; I480-I484 PolarHBondContact O-N 2.65Å; I484-S487 PolarHBondContact O-N 3.12Å; I484-L488 HydrophobicContact CG2-CD1 4.24Å; I484-L488 WeakPolarHBondContact O-CG 3.47Å; I484-L488 PolarHBondContact O-N 2.94Å; I484-R501 HydrophobicContact CD1-CB 4.44Å; I484-R501 HydrophobicContact CG1-CB 3.89Å; I484-L502 HydrophobicContact CD1-CD2 3.79Å; I484-L502 HydrophobicContact CD1-CG 4.11Å; I484-T524 HydrophobicContact CG2-CG2 3.87Å
485	K	93.3	Very high	90.7	Very high	45 Å²	45	57.1 Å²	57.1	20%	0.196	29%	0.293	C	S	.	.	H	α-helix	trans	-62.2	-44.4	174.7	-75	164.7	178.5	156	0	112.3	D481 R482 S483 S487 L488 T524 L1316	D481-K485 WeakPolarHBondContact O-CD 3.47Å; D481-K485 WeakPolarHBondContact O-CG 3.45Å; D481-K485 PolarHBondContact O-N 3.31Å; D481-K485 VanDerWaalsContact OD1-CE 3.28Å; D481-K485 WeakPolarHBondContact OD1-CE 3.4Å; D481-K485 IonicContact OD1-NZ 3.69Å; D481-K485 PolarHBondContact OD1-NZ 2.87Å; D481-K485 IonicContact OD2-NZ 2.71Å; D481-K485 PolarHBondContact OD2-NZ 3.07Å; R482-K485 PolarHBondContact O-N 2.95Å; S483-K485 VanDerWaalsContact C-N 3.33Å; S483-K485 PolarHBondContact O-N 3.39Å; K485-S487 VanDerWaalsContact C-N 3.28Å; K485-S487 PolarHBondContact O-N 3.02Å; K485-L488 PolarHBondContact O-N 3.21Å; K485-T524 WeakPolarHBondContact CE-OG1 3.22Å; K485-T524 PolarHBondContact NZ-OG1 3.07Å; K485-L1316 HydrophobicContact CG-CB 4.41Å; K485-L1316 HydrophobicContact CG-CD2 4.09Å
486	S	91.9	Very high	91	Very high	67 Å²	67	55.3 Å²	55.3	47%	0.469	30%	0.295	S	S	.	.	H	α-helix	trans	-71.3	-18.8	177.5	53.7	0	0	0	0	114.7	R482 S483 I489	R482-S486 PolarHBondContact O-N 3.27Å; R482-S486 PolarHBondContact O-OG 3.01Å; R482-S486 VanDerWaalsContact O-OG 3.08Å; S483-S486 WeakPolarHBondContact CA-OG 3.45Å; S483-S486 PolarHBondContact O-N 2.56Å; S483-S486 PolarHBondContact O-OG 3.21Å; S486-I489 WeakPolarHBondContact O-CG1 3.19Å
487	S	92.5	Very high	91.2	Very high	6 Å²	6	54.4 Å²	54.4	4%	0.042	30%	0.295	C	S	.	.	H	α-helix	trans	-87.2	-12.7	174.2	-66.5	0	0	0	0	113.4	S483 I484 K485 E493 D494 T497	S483-S487 WeakPolarHBondContact O-CB 3.4Å; S483-S487 PolarHBondContact O-N 2.87Å; S483-S487 PolarHBondContact O-OG 2.78Å; I484-S487 PolarHBondContact O-N 3.12Å; K485-S487 VanDerWaalsContact C-N 3.28Å; K485-S487 PolarHBondContact O-N 3.02Å; S487-E493 CarbonylContact O-C 3.56Å; S487-E493 WeakPolarHBondContact O-CA 3.14Å; S487-D494 WeakPolarHBondContact CB-O 3.45Å; S487-D494 PolarHBondContact O-N 3.02Å; S487-T497 WeakPolarHBondContact OG-CG2 3.21Å
488	L	91	Very high	91.3	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	41.3	-179.1	-60.5	-179	0	0	0	111.9	I484 K485 C498 Y531 V537 Y1313 L1316 V1318	I484-L488 HydrophobicContact CG2-CD1 4.24Å; I484-L488 WeakPolarHBondContact O-CG 3.47Å; I484-L488 PolarHBondContact O-N 2.94Å; K485-L488 PolarHBondContact O-N 3.21Å; L488-C498 HydrophobicContact CD2-CB 4.03Å; L488-C498 HydrophobicContact CG-CB 4.37Å; L488-Y531 HydrophobicContact CD2-CE1 3.97Å; L488-Y531 HydrophobicContact CD2-CE2 4.42Å; L488-V537 HydrophobicContact CD1-CG1 4.23Å; L488-Y1313 WeakPolarHBondContact O-CD1 3.23Å; L488-Y1313 WeakPolarHBondContact O-CE1 3.46Å; L488-L1316 HydrophobicContact CB-CD1 4.22Å; L488-L1316 HydrophobicContact CD1-CD1 4.3Å; L488-V1318 WeakPolarHBondContact O-CG2 3.31Å
489	I	87.4	Confident	91.6	Very high	57 Å²	57	52.2 Å²	52.2	29%	0.292	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	134.5	174.4	-54	-176.6	0	0	0	109.4	S486 G491 H492 E493 V1318	S486-I489 WeakPolarHBondContact O-CG1 3.19Å; I489-G491 PolarHBondContact O-N 2.8Å; I489-H492 HydrophobicContact CB-CB 4.34Å; I489-H492 CarbonylContact O-C 3.58Å; I489-H492 VanDerWaalsContact O-C 3.3Å; I489-H492 PolarHBondContact O-N 2.61Å; I489-E493 WeakPolarHBondContact O-CG 3.4Å; I489-V1318 HydrophobicContact CB-CB 4.28Å; I489-V1318 HydrophobicContact CD1-CG1 4.42Å; I489-V1318 HydrophobicContact CG1-CB 3.94Å; I489-V1318 HydrophobicContact CG1-CG1 3.87Å; I489-V1318 HydrophobicContact CG2-CB 4.29Å
490	Q	81.6	Confident	91.8	Very high	106 Å²	106	52.8 Å²	52.8	50%	0.495	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	113.3	-175.7	-174.5	167.1	25.5	0	0	112	Y1313	Q490-Y1313 HydrophobicContact CB-CD1 3.87Å; Q490-Y1313 HydrophobicContact CB-CD2 4.01Å; Q490-Y1313 HydrophobicContact CB-CE1 4.06Å; Q490-Y1313 HydrophobicContact CB-CE2 4.21Å; Q490-Y1313 HydrophobicContact CB-CG 3.89Å; Q490-Y1313 HydrophobicContact CG-CD2 4.24Å; Q490-Y1313 HydrophobicContact CG-CE2 4.18Å
491	G	82.3	Confident	91.8	Very high	60 Å²	60	57 Å²	57	62%	0.619	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	90.4	-6.9	-178.2	0	0	0	0	0	115.3	I489	I489-G491 PolarHBondContact O-N 2.8Å
492	H	85.4	Confident	91.9	Very high	156 Å²	156	56.4 Å²	56.4	72%	0.722	30%	0.301	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128.6	57.8	169.9	-68.6	-53.5	0	0	0	109	I489	I489-H492 HydrophobicContact CB-CB 4.34Å; I489-H492 CarbonylContact O-C 3.58Å; I489-H492 VanDerWaalsContact O-C 3.3Å; I489-H492 PolarHBondContact O-N 2.61Å
493	E	89.8	Confident	92.1	Very high	51 Å²	51	52.7 Å²	52.7	24%	0.238	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	120.4	-174.4	-59.9	176.5	-141	0	0	110.6	S487 I489 Y531 R533 Y1313	S487-E493 CarbonylContact O-C 3.56Å; S487-E493 WeakPolarHBondContact O-CA 3.14Å; I489-E493 WeakPolarHBondContact O-CG 3.4Å; E493-Y531 PolarHBondContact OE2-OH 3.1Å; E493-R533 VanDerWaalsContact OE1-CD 3.25Å; E493-R533 WeakPolarHBondContact OE1-CD 3.24Å; E493-R533 IonicContact OE1-CZ 2.65Å; E493-R533 IonicContact OE1-NE 2.71Å; E493-R533 IonicContact OE1-NH1 3.89Å; E493-R533 PolarHBondContact OE1-NH1 2.85Å; E493-R533 WeakPolarHBondContact OE2-CD 3.45Å; E493-Y1313 PolarHBondContact OE1-OH 3.35Å
494	D	93	Very high	92.1	Very high	69 Å²	69	55.2 Å²	55.2	37%	0.369	30%	0.299	S	S	.	.			trans	-109	88.1	173.1	-175.5	-11.8	0	0	0	108.8	S487 A496 T497 C498	S487-D494 WeakPolarHBondContact CB-O 3.45Å; S487-D494 PolarHBondContact O-N 3.02Å; D494-A496 VanDerWaalsContact C-N 3.32Å; D494-A496 PolarHBondContact O-N 2.95Å; D494-A496 PolarHBondContact OD1-N 2.8Å; D494-T497 VanDerWaalsContact CG-OG1 3.24Å; D494-T497 PolarHBondContact OD1-N 3.07Å; D494-T497 PolarHBondContact OD1-OG1 2.68Å; D494-T497 WeakPolarHBondContact OD2-CB 3.31Å; D494-T497 PolarHBondContact OD2-OG1 2.93Å; D494-C498 WeakPolarHBondContact O-CB 3.31Å; D494-C498 PolarHBondContact O-N 3.08Å
495	I	94.2	Very high	92	Very high	57 Å²	57	55.1 Å²	55.1	29%	0.292	30%	0.299	S	S	.	.	H	α-helix	trans	-62.5	-41.7	-177.7	-64.4	169.3	0	0	0	110.4	C498 V499 S534 E536 V537	I495-C498 WeakPolarHBondContact O-CB 3.43Å; I495-C498 PolarHBondContact O-N 3.34Å; I495-V499 HydrophobicContact CG2-CG2 4.43Å; I495-V499 WeakPolarHBondContact O-CG2 3.27Å; I495-V499 PolarHBondContact O-N 2.84Å; I495-S534 WeakPolarHBondContact CG2-OG 3.39Å; I495-E536 WeakPolarHBondContact CG2-OE2 3.23Å; I495-V537 HydrophobicContact CG2-CG2 4.18Å
496	A	94.8	Very high	92.1	Very high	60 Å²	60	54.4 Å²	54.4	50%	0.496	30%	0.297	S	S	.	.	H	α-helix	trans	-63.1	-55.1	-178.8	0	0	0	0	0	111.2	D494 C498 V499 D500	D494-A496 VanDerWaalsContact C-N 3.32Å; D494-A496 PolarHBondContact O-N 2.95Å; D494-A496 PolarHBondContact OD1-N 2.8Å; A496-C498 PolarHBondContact O-N 2.71Å; A496-V499 PolarHBondContact O-N 3Å; A496-D500 PolarHBondContact O-N 3.43Å
497	T	94.5	Very high	92.1	Very high	36 Å²	36	57.7 Å²	57.7	22%	0.221	30%	0.303	C	S	.	.	H	α-helix	trans	-60.5	-33.1	176.5	-62.1	0	0	0	0	111.6	S487 D494 R501	S487-T497 WeakPolarHBondContact OG-CG2 3.21Å; D494-T497 VanDerWaalsContact CG-OG1 3.24Å; D494-T497 PolarHBondContact OD1-N 3.07Å; D494-T497 PolarHBondContact OD1-OG1 2.68Å; D494-T497 WeakPolarHBondContact OD2-CB 3.31Å; D494-T497 PolarHBondContact OD2-OG1 2.93Å; T497-R501 HydrophobicContact CG2-CG 4.17Å; T497-R501 WeakPolarHBondContact O-CB 3.38Å; T497-R501 WeakPolarHBondContact O-CG 3.21Å; T497-R501 PolarHBondContact O-N 3.31Å; T497-R501 VanDerWaalsContact O-N 3.08Å
498	C	94.8	Very high	91.9	Very high	0 Å²	0	58.3 Å²	58.3	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-65.3	-42.1	174.4	-171.7	0	0	0	0	112.5	L488 D494 I495 A496 L502 V537	L488-C498 HydrophobicContact CD2-CB 4.03Å; L488-C498 HydrophobicContact CG-CB 4.37Å; D494-C498 WeakPolarHBondContact O-CB 3.31Å; D494-C498 PolarHBondContact O-N 3.08Å; I495-C498 WeakPolarHBondContact O-CB 3.43Å; I495-C498 PolarHBondContact O-N 3.34Å; A496-C498 PolarHBondContact O-N 2.71Å; C498-L502 WeakPolarHBondContact O-CG 3.39Å; C498-L502 PolarHBondContact O-N 3.49Å; C498-L502 VanDerWaalsContact O-N 3.16Å; C498-V537 HydrophobicContact CB-CG2 4.05Å
499	V	96.3	Very high	91.8	Very high	36 Å²	36	64.5 Å²	64.5	22%	0.218	34%	0.343	C	S	.	.	H	α-helix	trans	-68.2	-46.6	178	171.9	0	0	0	0	110.4	I495 A496 R501 L502 E503 E536 V537	I495-V499 HydrophobicContact CG2-CG2 4.43Å; I495-V499 WeakPolarHBondContact O-CG2 3.27Å; I495-V499 PolarHBondContact O-N 2.84Å; A496-V499 PolarHBondContact O-N 3Å; V499-R501 VanDerWaalsContact C-N 3.27Å; V499-R501 PolarHBondContact O-N 3.18Å; V499-L502 CarbonylContact O-C 3.46Å; V499-L502 PolarHBondContact O-N 2.95Å; V499-E503 PolarHBondContact O-N 2.88Å; V499-E536 HydrophobicContact CG2-CB 3.78Å; V499-V537 HydrophobicContact CG2-CG2 3.95Å
500	D	96	Very high	91.9	Very high	93 Å²	93	62.4 Å²	62.4	50%	0.497	33%	0.332	S	S	.	.	H	α-helix	trans	-54.9	-42.4	176	-70.7	-8.8	0	0	0	112.2	A496 E503 F504	A496-D500 PolarHBondContact O-N 3.43Å; D500-E503 PolarHBondContact O-N 3.38Å; D500-F504 VanDerWaalsContact O-CB 3.31Å; D500-F504 WeakPolarHBondContact O-CB 3.24Å; D500-F504 PolarHBondContact O-N 3.22Å
501	R	95.2	Very high	92.4	Very high	96 Å²	96	59.3 Å²	59.3	36%	0.362	32%	0.322	S	S	.	.	H	α-helix	trans	-71.1	-31.2	179.1	-67.2	-75.1	-179.6	-105.6	-14.7	112.5	I480 S483 I484 T497 V499 L505	I480-R501 HydrophobicContact CG2-CB 4.48Å; S483-R501 WeakPolarHBondContact OG-CD 3.2Å; S483-R501 PolarHBondContact OG-NE 3Å; I484-R501 HydrophobicContact CD1-CB 4.44Å; I484-R501 HydrophobicContact CG1-CB 3.89Å; T497-R501 HydrophobicContact CG2-CG 4.17Å; T497-R501 WeakPolarHBondContact O-CB 3.38Å; T497-R501 WeakPolarHBondContact O-CG 3.21Å; T497-R501 PolarHBondContact O-N 3.31Å; T497-R501 VanDerWaalsContact O-N 3.08Å; V499-R501 VanDerWaalsContact C-N 3.27Å; V499-R501 PolarHBondContact O-N 3.18Å; R501-L505 WeakPolarHBondContact O-CB 3.47Å; R501-L505 PolarHBondContact O-N 3.24Å
502	L	96.1	Very high	92.9	Very high	1 Å²	1	56.5 Å²	56.5	1%	0.005	29%	0.293	C	S	.	.	H	α-helix	trans	-73.7	-38.7	172.3	-72.4	166.1	0	0	0	111.5	I484 C498 V499 L505 D506 I525 V537 A540 A541 V544	I484-L502 HydrophobicContact CD1-CD2 3.79Å; I484-L502 HydrophobicContact CD1-CG 4.11Å; C498-L502 WeakPolarHBondContact O-CG 3.39Å; C498-L502 PolarHBondContact O-N 3.49Å; C498-L502 VanDerWaalsContact O-N 3.16Å; V499-L502 CarbonylContact O-C 3.46Å; V499-L502 PolarHBondContact O-N 2.95Å; L502-L505 WeakPolarHBondContact O-CB 3.49Å; L502-L505 PolarHBondContact O-N 2.94Å; L502-D506 PolarHBondContact O-N 3.11Å; L502-I525 HydrophobicContact CD2-CG1 4.49Å; L502-V537 HydrophobicContact CD1-CG1 4.26Å; L502-A540 HydrophobicContact CB-CB 3.81Å; L502-A540 HydrophobicContact CD1-CB 3.93Å; L502-A541 HydrophobicContact CD1-CB 4.17Å; L502-A541 HydrophobicContact CD2-CB 4.29Å; L502-V544 WeakPolarHBondContact O-CG2 3.36Å
503	E	95.3	Very high	93.3	Very high	89 Å²	89	49.8 Å²	49.8	42%	0.416	26%	0.264	S	S	.	.	H	α-helix	trans	-70.3	-38.2	176.6	-154	-148.6	167.1	0	0	112	V499 D500 L505 D506 K507	V499-E503 PolarHBondContact O-N 2.88Å; D500-E503 PolarHBondContact O-N 3.38Å; E503-L505 VanDerWaalsContact C-N 3.26Å; E503-L505 PolarHBondContact O-N 2.97Å; E503-D506 WeakPolarHBondContact O-CB 3.48Å; E503-D506 PolarHBondContact O-N 2.89Å; E503-D506 VanDerWaalsContact O-N 3.15Å; E503-K507 VanDerWaalsContact CD-CE 3.49Å; E503-K507 WeakPolarHBondContact O-CG 3.49Å; E503-K507 PolarHBondContact O-N 3.07Å; E503-K507 WeakPolarHBondContact OE1-CE 3.5Å; E503-K507 IonicContact OE1-NZ 2.69Å; E503-K507 PolarHBondContact OE1-NZ 3.24Å; E503-K507 IonicContact OE2-NZ 3.82Å; E503-K507 PolarHBondContact OE2-NZ 3.11Å
504	F	93.6	Very high	93.4	Very high	73 Å²	73	48.6 Å²	48.6	32%	0.32	26%	0.259	S	S	.	.	H	α-helix	trans	-60.3	-37.5	170.3	-174.8	-95	0	0	0	111.8	I480 D500 K507 M508	I480-F504 HydrophobicContact CD1-CD1 3.75Å; I480-F504 HydrophobicContact CD1-CE1 3.97Å; I480-F504 HydrophobicContact CG1-CD1 4.34Å; D500-F504 VanDerWaalsContact O-CB 3.31Å; D500-F504 WeakPolarHBondContact O-CB 3.24Å; D500-F504 PolarHBondContact O-N 3.22Å; F504-K507 PolarHBondContact O-N 2.79Å; F504-M508 PolarHBondContact O-N 3.27Å
505	L	94	Very high	93.4	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-70.9	-30.5	175.4	-170.5	56.9	0	0	0	112.6	L477 I480 R501 L502 E503 K507 M508 I510 V521 I525 V544 K547 F548	L477-L505 HydrophobicContact CD2-CD1 3.62Å; I480-L505 HydrophobicContact CD1-CD1 4.11Å; I480-L505 HydrophobicContact CG2-CB 4.39Å; I480-L505 HydrophobicContact CG2-CD2 4.07Å; R501-L505 WeakPolarHBondContact O-CB 3.47Å; R501-L505 PolarHBondContact O-N 3.24Å; L502-L505 WeakPolarHBondContact O-CB 3.49Å; L502-L505 PolarHBondContact O-N 2.94Å; E503-L505 VanDerWaalsContact C-N 3.26Å; E503-L505 PolarHBondContact O-N 2.97Å; L505-K507 VanDerWaalsContact C-N 3.35Å; L505-M508 HydrophobicContact CD1-CE 3.67Å; L505-I510 HydrophobicContact CD1-CD1 3.72Å; L505-V521 HydrophobicContact CD2-CG1 4.14Å; L505-I525 HydrophobicContact CD2-CD1 3.82Å; L505-I525 HydrophobicContact CD2-CG1 4.39Å; L505-V544 HydrophobicContact CD2-CG1 3.97Å; L505-V544 HydrophobicContact CG-CG1 3.89Å; L505-K547 PolarHBondContact O-NZ 2.95Å; L505-F548 HydrophobicContact CD1-CZ 4.22Å; L505-F548 HydrophobicContact CD2-CZ 4.28Å; L505-F548 HydrophobicContact CG-CZ 4.13Å
506	D	94	Very high	93.3	Very high	30 Å²	30	42.8 Å²	42.8	16%	0.16	23%	0.228	C	C	.	.	H	α-helix	trans	-70.2	-29.9	170.1	-163.6	52.4	0	0	0	112.5	L502 E503 K543 V544 K547	L502-D506 PolarHBondContact O-N 3.11Å; E503-D506 WeakPolarHBondContact O-CB 3.48Å; E503-D506 PolarHBondContact O-N 2.89Å; E503-D506 VanDerWaalsContact O-N 3.15Å; D506-K543 WeakPolarHBondContact OD2-CD 3.46Å; D506-K543 WeakPolarHBondContact OD2-CE 3.2Å; D506-K543 IonicContact OD2-NZ 3.88Å; D506-K543 PolarHBondContact OD2-NZ 2.91Å; D506-V544 HydrophobicContact CB-CG2 3.92Å; D506-K547 PolarHBondContact O-NZ 3.18Å
507	K	92.1	Very high	93.2	Very high	136 Å²	136	44.1 Å²	44.1	59%	0.591	22%	0.22	S	C	*	.	H	α-helix	trans	-80.1	-27.6	174.9	-69.3	165.4	-176	167	0	113.6	E503 F504 L505	E503-K507 VanDerWaalsContact CD-CE 3.49Å; E503-K507 WeakPolarHBondContact O-CG 3.49Å; E503-K507 PolarHBondContact O-N 3.07Å; E503-K507 WeakPolarHBondContact OE1-CE 3.5Å; E503-K507 IonicContact OE1-NZ 2.69Å; E503-K507 PolarHBondContact OE1-NZ 3.24Å; E503-K507 IonicContact OE2-NZ 3.82Å; E503-K507 PolarHBondContact OE2-NZ 3.11Å; F504-K507 PolarHBondContact O-N 2.79Å; L505-K507 VanDerWaalsContact C-N 3.35Å
508	M	89.5	Confident	93	Very high	18 Å²	18	42.5 Å²	42.5	9%	0.089	21%	0.21	C	C	.	.	S	Bend	trans	-73.4	137.5	-176.1	-172.3	163.2	63.9	0	0	113.8	R476 L477 I480 F504 L505 I510 K547	R476-M508 HydrophobicContact CB-CE 4.43Å; R476-M508 HydrophobicContact CB-SD 4.04Å; L477-M508 HydrophobicContact CD2-CE 3.81Å; L477-M508 HydrophobicContact CG-CE 3.78Å; I480-M508 HydrophobicContact CD1-CE 3.73Å; F504-M508 PolarHBondContact O-N 3.27Å; L505-M508 HydrophobicContact CD1-CE 3.67Å; M508-I510 HydrophobicContact CE-CD1 4.03Å; M508-I510 HydrophobicContact CE-CG1 4.12Å; M508-I510 HydrophobicContact CG-CG1 4.23Å; M508-K547 PolarHBondContact O-NZ 2.83Å
509	T	88.4	Confident	92.9	Very high	131 Å²	131	44.5 Å²	44.5	80%	0.804	22%	0.218	S	C	*	.			trans	-78.1	128.6	171.2	43.9	0	0	0	0	111
510	I	90	Very high	92.7	Very high	13 Å²	13	45 Å²	45	7%	0.067	22%	0.221	C	C	.	.			trans	-141.5	128.3	-172.8	-61.9	159.1	0	0	0	108.3	L477 L505 M508 M515 F548 L551	L477-I510 HydrophobicContact CD1-CG2 4.34Å; L477-I510 HydrophobicContact CD2-CD1 3.98Å; L505-I510 HydrophobicContact CD1-CD1 3.72Å; M508-I510 HydrophobicContact CE-CD1 4.03Å; M508-I510 HydrophobicContact CE-CG1 4.12Å; M508-I510 HydrophobicContact CG-CG1 4.23Å; I510-M515 HydrophobicContact CG2-CB 4.3Å; I510-F548 HydrophobicContact CD1-CE1 3.64Å; I510-F548 HydrophobicContact CD1-CZ 3.79Å; I510-L551 WeakPolarHBondContact O-CD1 3.05Å
511	S	92.1	Very high	92.6	Very high	40 Å²	40	40.6 Å²	40.6	28%	0.28	20%	0.198	S	C	.	.			trans	-94.7	156.8	174.4	61.2	0	0	0	0	112.5	P513 I514 M515	S511-P513 VanDerWaalsContact C-CD 3.49Å; S511-I514 PolarHBondContact O-N 3.13Å; S511-I514 VanDerWaalsContact O-N 3.16Å; S511-I514 WeakPolarHBondContact OG-CD1 3.37Å; S511-M515 PolarHBondContact O-N 3.35Å
512	L	92.6	Very high	92.6	Very high	1 Å²	1	36.1 Å²	36.1	1%	0.005	18%	0.181	C	C	.	.	H	α-helix	trans	-57.1	-39.8	-175.1	-167.8	64.7	0	0	0	113.8	I514 M515 A516 Y552 A555 E559 L560 A563 M608	L512-I514 PolarHBondContact O-N 2.77Å; L512-M515 HydrophobicContact CD1-CE 3.52Å; L512-M515 PolarHBondContact O-N 2.95Å; L512-A516 PolarHBondContact O-N 2.89Å; L512-A516 VanDerWaalsContact O-N 3.12Å; L512-Y552 HydrophobicContact CD1-CD2 4.19Å; L512-Y552 HydrophobicContact CD2-CD2 4.11Å; L512-A555 HydrophobicContact CB-CB 4.39Å; L512-A555 HydrophobicContact CD2-CB 3.43Å; L512-A555 VanDerWaalsContact CD2-CB 3.43Å; L512-A555 HydrophobicContact CG-CB 4.46Å; L512-E559 HydrophobicContact CB-CB 4.5Å; L512-L560 HydrophobicContact CD2-CD1 4.2Å; L512-A563 HydrophobicContact CD2-CB 4.25Å; L512-A563 HydrophobicContact CG-CB 3.98Å; L512-M608 HydrophobicContact CD1-CE 3.35Å; L512-M608 HydrophobicContact CD2-CE 4.1Å; L512-M608 HydrophobicContact CG-CE 3.7Å
513	P	92.4	Very high	92.4	Very high	16 Å²	16	37.9 Å²	37.9	10%	0.104	19%	0.189	C	C	.	.	H	α-helix	trans	-68.3	-29.8	178.7	-22	35.5	0	0	0	114	S511 A516 R517 L562	S511-P513 VanDerWaalsContact C-CD 3.49Å; P513-A516 PolarHBondContact O-N 2.88Å; P513-R517 PolarHBondContact O-N 3.45Å; P513-L562 HydrophobicContact CB-CB 4.22Å; P513-L562 HydrophobicContact CG-CB 3.83Å
514	I	92.9	Very high	92.3	Very high	26 Å²	26	33.7 Å²	33.7	13%	0.133	17%	0.169	C	C	.	.	H	α-helix	trans	-73.6	-40.4	178.2	-59.5	176.7	0	0	0	109.6	A473 E474 L477 S511 L512 A516 R517 C518	A473-I514 HydrophobicContact CB-CD1 4.22Å; E474-I514 HydrophobicContact CB-CG2 4.31Å; L477-I514 HydrophobicContact CD1-CG2 3.57Å; S511-I514 PolarHBondContact O-N 3.13Å; S511-I514 VanDerWaalsContact O-N 3.16Å; S511-I514 WeakPolarHBondContact OG-CD1 3.37Å; L512-I514 PolarHBondContact O-N 2.77Å; I514-A516 PolarHBondContact O-N 2.97Å; I514-R517 WeakPolarHBondContact O-CB 3.48Å; I514-R517 PolarHBondContact O-N 2.89Å; I514-R517 VanDerWaalsContact O-N 3.11Å; I514-C518 PolarHBondContact O-N 3Å; I514-C518 PolarHBondContact O-SG 2.93Å; I514-C518 VanDerWaalsContact O-SG 3.32Å
515	M	92	Very high	92.3	Very high	3 Å²	3	30.2 Å²	30.2	2%	0.015	15%	0.154	C	C	.	.	H	α-helix	trans	-61	-32.2	172.6	-179.6	161.3	52.6	0	0	112.7	I510 S511 L512 C518 W519 V522 F548 F612	I510-M515 HydrophobicContact CG2-CB 4.3Å; S511-M515 PolarHBondContact O-N 3.35Å; L512-M515 HydrophobicContact CD1-CE 3.52Å; L512-M515 PolarHBondContact O-N 2.95Å; M515-C518 CarbonylContact O-C 3.45Å; M515-C518 PolarHBondContact O-N 3.15Å; M515-W519 WeakPolarHBondContact O-CA 3.47Å; M515-W519 PolarHBondContact O-N 3.32Å; M515-V522 HydrophobicContact CG-CG2 3.43Å; M515-V522 VanDerWaalsContact CG-CG2 3.43Å; M515-V522 HydrophobicContact SD-CG2 3.79Å; M515-F548 HydrophobicContact CE-CB 4.2Å; M515-F548 HydrophobicContact CE-CG 4.47Å; M515-F548 HydrophobicContact SD-CB 3.68Å; M515-F548 HydrophobicContact SD-CD1 4.28Å; M515-F548 HydrophobicContact SD-CD2 3.34Å; M515-F548 WeakPolarHBondContact SD-CD2 3.43Å; M515-F548 HydrophobicContact SD-CE2 3.97Å; M515-F548 HydrophobicContact SD-CG 3.51Å; M515-F548 VanDerWaalsContact SD-CG 3.51Å; M515-F612 HydrophobicContact CE-CE2 4.28Å; M515-F612 HydrophobicContact CE-CZ 3.68Å; M515-F612 HydrophobicContact SD-CZ 3.97Å
516	A	93.4	Very high	92.3	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-70.8	-30.8	173.1	0	0	0	0	0	113.9	L512 P513 I514 A563 E566 L567 M608	L512-A516 PolarHBondContact O-N 2.89Å; L512-A516 VanDerWaalsContact O-N 3.12Å; P513-A516 PolarHBondContact O-N 2.88Å; I514-A516 PolarHBondContact O-N 2.97Å; A516-A563 HydrophobicContact CB-CB 3.93Å; A516-E566 HydrophobicContact CB-CB 4.35Å; A516-L567 HydrophobicContact CB-CD2 4.41Å; A516-L567 HydrophobicContact CB-CG 4.27Å; A516-M608 HydrophobicContact CB-SD 4.37Å
517	R	91.4	Very high	92.1	Very high	89 Å²	89	30.8 Å²	30.8	34%	0.336	16%	0.155	S	C	.	.	H	α-helix	trans	-67.2	-53.4	168	-59.1	177.1	-158.7	170.5	8.9	110.1	E474 P513 I514 W519 E566	E474-R517 VanDerWaalsContact CD-CD 3.42Å; E474-R517 WeakPolarHBondContact OE1-CD 3.31Å; E474-R517 WeakPolarHBondContact OE2-CD 3.42Å; E474-R517 IonicContact OE2-CZ 2.75Å; E474-R517 IonicContact OE2-NE 3.59Å; E474-R517 IonicContact OE2-NH1 3.91Å; E474-R517 PolarHBondContact OE2-NH1 3.32Å; P513-R517 PolarHBondContact O-N 3.45Å; I514-R517 WeakPolarHBondContact O-CB 3.48Å; I514-R517 PolarHBondContact O-N 2.89Å; I514-R517 VanDerWaalsContact O-N 3.11Å; R517-W519 PolarHBondContact O-N 3.21Å; R517-E566 HydrophobicContact CB-CG 4.33Å; R517-E566 HydrophobicContact CG-CG 3.35Å
518	C	91.6	Very high	92.1	Very high	2 Å²	2	24.3 Å²	24.3	1%	0.014	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.2	36	-173.1	-49.8	0	0	0	0	112.2	L477 I514 M515 T520 V521	L477-C518 HydrophobicContact CB-CB 4.21Å; L477-C518 HydrophobicContact CD1-CB 4.16Å; I514-C518 PolarHBondContact O-N 3Å; I514-C518 PolarHBondContact O-SG 2.93Å; I514-C518 VanDerWaalsContact O-SG 3.32Å; M515-C518 CarbonylContact O-C 3.45Å; M515-C518 PolarHBondContact O-N 3.15Å; C518-T520 PolarHBondContact O-N 2.85Å; C518-V521 HydrophobicContact CB-CG2 3.72Å; C518-V521 VanDerWaalsContact O-CB 3.29Å; C518-V521 WeakPolarHBondContact O-CB 3.34Å; C518-V521 VanDerWaalsContact O-CG2 3.23Å; C518-V521 WeakPolarHBondContact O-CG2 3.43Å; C518-V521 PolarHBondContact O-N 2.78Å
519	W	93.1	Very high	92.4	Very high	42 Å²	42	26.5 Å²	26.5	16%	0.159	13%	0.134	C	C	.	.	H	α-helix	trans	-58.1	-25.4	-171.8	72.1	-92.6	0	0	0	113.4	M515 R517 V521 V522 E523 H570 P605 L611	M515-W519 WeakPolarHBondContact O-CA 3.47Å; M515-W519 PolarHBondContact O-N 3.32Å; R517-W519 PolarHBondContact O-N 3.21Å; W519-V521 VanDerWaalsContact C-N 3.26Å; W519-V521 PolarHBondContact O-N 3.41Å; W519-V522 PolarHBondContact O-N 2.95Å; W519-E523 HydrophobicContact CE3-CB 4.33Å; W519-E523 HydrophobicContact CZ3-CB 4.26Å; W519-E523 HydrophobicContact CZ3-CG 4.46Å; W519-E523 PolarHBondContact O-N 3.34Å; W519-E523 VanDerWaalsContact O-N 3.11Å; W519-H570 AromaticContact CE2-CE1 3.65Å; W519-H570 AromaticContact CZ2-CE1 3.83Å; W519-H570 AromaticContact NE1-CD2 3.72Å; W519-H570 AromaticContact NE1-CE1 3.04Å; W519-H570 PolarHBondContact NE1-CE1 2.86Å; W519-H570 AromaticContact NE1-CG 3.88Å; W519-H570 AromaticContact NE1-ND1 3.46Å; W519-H570 PolarHBondContact NE1-ND1 3.14Å; W519-H570 AromaticContact NE1-NE2 3.2Å; W519-H570 PolarHBondContact NE1-NE2 3.27Å; W519-P605 HydrophobicContact CB-CG 4.1Å; W519-P605 VanDerWaalsContact CD2-CD 3.44Å; W519-P605 HydrophobicContact CD2-CG 3.99Å; W519-P605 HydrophobicContact CE3-CG 3.92Å; W519-P605 HydrophobicContact CG-CG 4.08Å; W519-L611 HydrophobicContact CB-CD1 3.82Å
520	T	92.2	Very high	92.4	Very high	45 Å²	45	25.7 Å²	25.7	28%	0.276	12%	0.116	S	C	.	.	H	α-helix	trans	-61	-32.5	174.7	52.3	0	0	0	0	112.7	C518 E523 T524	C518-T520 PolarHBondContact O-N 2.85Å; T520-E523 PolarHBondContact O-N 3.31Å; T520-T524 PolarHBondContact O-N 3.45Å; T520-T524 PolarHBondContact O-OG1 2.94Å; T520-T524 VanDerWaalsContact O-OG1 3.07Å
521	V	93.6	Very high	92.5	Very high	2 Å²	2	25.2 Å²	25.2	1%	0.012	11%	0.113	C	C	.	.	H	α-helix	trans	-64.1	-46.3	175.9	-171.9	0	0	0	0	109.9	L477 D481 L505 C518 W519 E523 T524 I525	L477-V521 HydrophobicContact CB-CG2 4.14Å; L477-V521 HydrophobicContact CD2-CG1 4.1Å; L477-V521 HydrophobicContact CD2-CG2 4.36Å; D481-V521 HydrophobicContact CB-CG2 3.98Å; L505-V521 HydrophobicContact CD2-CG1 4.14Å; C518-V521 HydrophobicContact CB-CG2 3.72Å; C518-V521 VanDerWaalsContact O-CB 3.29Å; C518-V521 WeakPolarHBondContact O-CB 3.34Å; C518-V521 VanDerWaalsContact O-CG2 3.23Å; C518-V521 WeakPolarHBondContact O-CG2 3.43Å; C518-V521 PolarHBondContact O-N 2.78Å; W519-V521 VanDerWaalsContact C-N 3.26Å; W519-V521 PolarHBondContact O-N 3.41Å; V521-E523 VanDerWaalsContact C-N 3.32Å; V521-E523 PolarHBondContact O-N 3.03Å; V521-T524 WeakPolarHBondContact O-CB 3.29Å; V521-T524 PolarHBondContact O-N 3.09Å; V521-I525 HydrophobicContact CG1-CD1 4.05Å; V521-I525 WeakPolarHBondContact O-CD1 3.42Å; V521-I525 VanDerWaalsContact O-CG1 3.31Å; V521-I525 WeakPolarHBondContact O-CG1 3.27Å; V521-I525 PolarHBondContact O-N 2.81Å
522	V	93.8	Very high	92.2	Very high	1 Å²	1	27.8 Å²	27.8	1%	0.006	12%	0.119	C	C	.	.	H	α-helix	trans	-60.2	-45.6	176.9	-172.3	0	0	0	0	110	M515 W519 T524 I525 R526 F545 F548 L611	M515-V522 HydrophobicContact CG-CG2 3.43Å; M515-V522 VanDerWaalsContact CG-CG2 3.43Å; M515-V522 HydrophobicContact SD-CG2 3.79Å; W519-V522 PolarHBondContact O-N 2.95Å; V522-T524 VanDerWaalsContact C-N 3.34Å; V522-T524 PolarHBondContact O-N 3.33Å; V522-I525 PolarHBondContact O-N 3.13Å; V522-R526 WeakPolarHBondContact O-CB 3.48Å; V522-R526 VanDerWaalsContact O-CG 3.26Å; V522-R526 WeakPolarHBondContact O-CG 3.41Å; V522-R526 PolarHBondContact O-N 2.85Å; V522-F545 HydrophobicContact CG1-CE2 4.31Å; V522-F548 HydrophobicContact CG2-CD2 4.18Å; V522-F548 HydrophobicContact CG2-CE2 4.36Å; V522-L611 HydrophobicContact CB-CD1 3.85Å; V522-L611 HydrophobicContact CG1-CD1 4.02Å; V522-L611 HydrophobicContact CG1-CG 4.29Å; V522-L611 HydrophobicContact CG2-CD1 4.08Å
523	E	91.6	Very high	92	Very high	38 Å²	38	32.5 Å²	32.5	18%	0.178	14%	0.137	C	C	.	.	H	α-helix	trans	-67.9	-30.4	178.6	-175.8	49	-142	0	0	112.9	W519 T520 V521 R526 K527	W519-E523 HydrophobicContact CE3-CB 4.33Å; W519-E523 HydrophobicContact CZ3-CB 4.26Å; W519-E523 HydrophobicContact CZ3-CG 4.46Å; W519-E523 PolarHBondContact O-N 3.34Å; W519-E523 VanDerWaalsContact O-N 3.11Å; T520-E523 PolarHBondContact O-N 3.31Å; V521-E523 VanDerWaalsContact C-N 3.32Å; V521-E523 PolarHBondContact O-N 3.03Å; E523-R526 IonicContact OE2-NE 2.7Å; E523-K527 WeakPolarHBondContact O-CD 3.14Å; E523-K527 WeakPolarHBondContact O-CE 3.14Å; E523-K527 WeakPolarHBondContact O-CG 3.43Å; E523-K527 PolarHBondContact O-N 2.97Å; E523-K527 WeakPolarHBondContact OE1-CE 3.27Å
524	T	93.4	Very high	91.9	Very high	1 Å²	1	32.2 Å²	32.2	1%	0.006	14%	0.135	C	C	.	.	H	α-helix	trans	-64.7	-50.2	168.8	-66.3	0	0	0	0	111.4	D481 I484 K485 T520 V521 V522 R526 K527 C528 L1316	D481-T524 WeakPolarHBondContact OD1-CB 3.22Å; D481-T524 PolarHBondContact OD1-OG1 3.34Å; I484-T524 HydrophobicContact CG2-CG2 3.87Å; K485-T524 WeakPolarHBondContact CE-OG1 3.22Å; K485-T524 PolarHBondContact NZ-OG1 3.07Å; T520-T524 PolarHBondContact O-N 3.45Å; T520-T524 PolarHBondContact O-OG1 2.94Å; T520-T524 VanDerWaalsContact O-OG1 3.07Å; V521-T524 WeakPolarHBondContact O-CB 3.29Å; V521-T524 PolarHBondContact O-N 3.09Å; V522-T524 VanDerWaalsContact C-N 3.34Å; V522-T524 PolarHBondContact O-N 3.33Å; T524-R526 VanDerWaalsContact C-N 3.27Å; T524-R526 PolarHBondContact O-N 3.05Å; T524-K527 WeakPolarHBondContact O-CA 3.45Å; T524-K527 WeakPolarHBondContact O-CB 3.24Å; T524-K527 PolarHBondContact O-N 3.24Å; T524-C528 PolarHBondContact O-N 3.01Å; T524-C528 PolarHBondContact O-SG 3.33Å; T524-C528 VanDerWaalsContact O-SG 3.39Å; T524-L1316 HydrophobicContact CG2-CD2 3.85Å
525	I	94.8	Very high	92	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-59.5	-39.8	177.1	-62.1	156.6	0	0	0	110.8	L502 L505 V521 V522 K527 C528 R529 A541 V544 F545 F548	L502-I525 HydrophobicContact CD2-CG1 4.49Å; L505-I525 HydrophobicContact CD2-CD1 3.82Å; L505-I525 HydrophobicContact CD2-CG1 4.39Å; V521-I525 HydrophobicContact CG1-CD1 4.05Å; V521-I525 WeakPolarHBondContact O-CD1 3.42Å; V521-I525 VanDerWaalsContact O-CG1 3.31Å; V521-I525 WeakPolarHBondContact O-CG1 3.27Å; V521-I525 PolarHBondContact O-N 2.81Å; V522-I525 PolarHBondContact O-N 3.13Å; I525-K527 PolarHBondContact O-N 3.37Å; I525-C528 PolarHBondContact O-N 3.11Å; I525-R529 WeakPolarHBondContact O-CG 3.42Å; I525-R529 PolarHBondContact O-N 2.91Å; I525-A541 HydrophobicContact CG2-CB 4.07Å; I525-A541 WeakPolarHBondContact CG2-O 3.47Å; I525-V544 HydrophobicContact CD1-CG1 3.81Å; I525-F545 HydrophobicContact CG2-CB 3.95Å; I525-F548 HydrophobicContact CD1-CD2 4Å; I525-F548 HydrophobicContact CD1-CE2 3.34Å; I525-F548 HydrophobicContact CD1-CZ 3.96Å
526	R	92.8	Very high	92.1	Very high	24 Å²	24	42.1 Å²	42.1	9%	0.091	18%	0.184	C	C	.	.	H	α-helix	trans	-59.8	-25.1	174.3	-74.3	-175.7	72.3	74.8	9.8	113.6	V522 E523 T524 R530 F545 F612 Q613	V522-R526 WeakPolarHBondContact O-CB 3.48Å; V522-R526 VanDerWaalsContact O-CG 3.26Å; V522-R526 WeakPolarHBondContact O-CG 3.41Å; V522-R526 PolarHBondContact O-N 2.85Å; E523-R526 IonicContact OE2-NE 2.7Å; T524-R526 VanDerWaalsContact C-N 3.27Å; T524-R526 PolarHBondContact O-N 3.05Å; R526-R530 PolarHBondContact O-NH1 2.74Å; R526-F545 HydrophobicContact CG-CD2 3.98Å; R526-F545 HydrophobicContact CG-CE2 3.59Å; R526-F612 PolarHBondContact NH1-O 3.2Å; R526-Q613 VanDerWaalsContact CZ-CD 3.41Å; R526-Q613 VanDerWaalsContact NE-CD 3.32Å; R526-Q613 VanDerWaalsContact NE-NE2 3.18Å
527	K	90.7	Very high	92.2	Very high	19 Å²	19	42.1 Å²	42.1	8%	0.083	18%	0.184	C	C	.	.	H	α-helix	trans	-83.4	-44.3	172.9	-63.8	160.8	-162.9	168.6	0	111.2	E523 T524 I525 R529 R530 Y531 I1312 M1315 L1316	E523-K527 WeakPolarHBondContact O-CD 3.14Å; E523-K527 WeakPolarHBondContact O-CE 3.14Å; E523-K527 WeakPolarHBondContact O-CG 3.43Å; E523-K527 PolarHBondContact O-N 2.97Å; E523-K527 WeakPolarHBondContact OE1-CE 3.27Å; T524-K527 WeakPolarHBondContact O-CA 3.45Å; T524-K527 WeakPolarHBondContact O-CB 3.24Å; T524-K527 PolarHBondContact O-N 3.24Å; I525-K527 PolarHBondContact O-N 3.37Å; K527-R529 PolarHBondContact O-N 3.12Å; K527-R530 WeakPolarHBondContact O-CA 3.42Å; K527-R530 PolarHBondContact O-N 3.42Å; K527-Y531 PolarHBondContact O-N 2.71Å; K527-I1312 HydrophobicContact CB-CG2 4.31Å; K527-M1315 HydrophobicContact CD-CB 4.48Å; K527-M1315 HydrophobicContact CD-CE 4.27Å; K527-M1315 HydrophobicContact CD-CG 4.22Å; K527-M1315 HydrophobicContact CD-SD 4.46Å; K527-M1315 HydrophobicContact CG-CE 4.09Å; K527-M1315 PolarHBondContact NZ-O 3.19Å; K527-L1316 HydrophobicContact CB-CD2 4.34Å; K527-L1316 HydrophobicContact CD-CD2 3.87Å; K527-L1316 HydrophobicContact CD-CG 4.23Å
528	C	92.8	Very high	92.4	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-56.5	-35.5	175	-59.8	0	0	0	0	112.3	T524 I525 R530 Y531 V537 A541	T524-C528 PolarHBondContact O-N 3.01Å; T524-C528 PolarHBondContact O-SG 3.33Å; T524-C528 VanDerWaalsContact O-SG 3.39Å; I525-C528 PolarHBondContact O-N 3.11Å; C528-R530 PolarHBondContact O-N 3.33Å; C528-R530 VanDerWaalsContact O-N 3.11Å; C528-Y531 WeakPolarHBondContact O-CB 3.22Å; C528-Y531 PolarHBondContact O-N 3.21Å; C528-V537 HydrophobicContact CB-CG1 4.14Å; C528-A541 HydrophobicContact CB-CB 3.44Å; C528-A541 VanDerWaalsContact CB-CB 3.44Å
529	R	94.2	Very high	92.6	Very high	64 Å²	64	47.4 Å²	47.4	24%	0.242	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-16.4	170.8	-74	177.8	66.9	-152.7	-1.7	115.6	I525 K527 A541 Q542	I525-R529 WeakPolarHBondContact O-CG 3.42Å; I525-R529 PolarHBondContact O-N 2.91Å; K527-R529 PolarHBondContact O-N 3.12Å; R529-A541 HydrophobicContact CG-CB 4Å; R529-Q542 HydrophobicContact CG-CB 4.42Å; R529-Q542 VanDerWaalsContact NE-CD 3.32Å
530	R	89.9	Confident	92.7	Very high	114 Å²	114	46.2 Å²	46.2	43%	0.43	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107.9	-1.1	176.2	-64.5	-166.7	-64.8	-85.6	2.2	113.2	R526 K527 C528 K532 I1312	R526-R530 PolarHBondContact O-NH1 2.74Å; K527-R530 WeakPolarHBondContact O-CA 3.42Å; K527-R530 PolarHBondContact O-N 3.42Å; C528-R530 PolarHBondContact O-N 3.33Å; C528-R530 VanDerWaalsContact O-N 3.11Å; R530-K532 PolarHBondContact O-N 3.47Å; R530-I1312 VanDerWaalsContact C-CD1 3.46Å; R530-I1312 HydrophobicContact CB-CD1 3.87Å; R530-I1312 WeakPolarHBondContact O-CD1 3.28Å
531	Y	90.8	Very high	92.9	Very high	2 Å²	2	44.1 Å²	44.1	1%	0.008	20%	0.2	C	C	.	.			trans	-59.8	127.1	179.9	-158.7	-120	0	0	0	110.4	L488 E493 K527 C528 R533 V537 I1312 Y1313	L488-Y531 HydrophobicContact CD2-CE1 3.97Å; L488-Y531 HydrophobicContact CD2-CE2 4.42Å; E493-Y531 PolarHBondContact OE2-OH 3.1Å; K527-Y531 PolarHBondContact O-N 2.71Å; C528-Y531 WeakPolarHBondContact O-CB 3.22Å; C528-Y531 PolarHBondContact O-N 3.21Å; Y531-R533 HydrophobicContact CD1-CB 4.31Å; Y531-R533 HydrophobicContact CE1-CB 3.73Å; Y531-V537 HydrophobicContact CD1-CB 4.19Å; Y531-V537 HydrophobicContact CD1-CG1 4.03Å; Y531-V537 HydrophobicContact CG-CG1 4.41Å; Y531-I1312 HydrophobicContact CD2-CG2 4.08Å; Y531-Y1313 HydrophobicContact CE2-CE1 4.03Å; Y531-Y1313 AromaticContact CE2-CZ 3.85Å; Y531-Y1313 WeakPolarHBondContact CE2-OH 3.29Å; Y531-Y1313 PolarHBondContact OH-OH 3.05Å
532	K	87.3	Confident	93.1	Very high	94 Å²	94	46.9 Å²	46.9	41%	0.409	21%	0.213	S	C	.	.	S	Bend	trans	-94.6	-18.4	-180	-57.8	-176.5	-176.9	174.4	0	113.4	R530 N1305 D1308 D1309	R530-K532 PolarHBondContact O-N 3.47Å; K532-N1305 PolarHBondContact NZ-O 3.09Å; K532-N1305 PolarHBondContact NZ-OD1 3.35Å; K532-D1308 IonicContact NZ-OD2 3.55Å; K532-D1308 PolarHBondContact NZ-OD2 3.29Å; K532-D1309 VanDerWaalsContact CB-OD1 3.31Å; K532-D1309 WeakPolarHBondContact CB-OD1 3.28Å; K532-D1309 PolarHBondContact N-OD1 3.39Å; K532-D1309 VanDerWaalsContact N-OD1 3.12Å
533	R	87.2	Confident	93.2	Very high	101 Å²	101	52.6 Å²	52.6	38%	0.381	24%	0.237	S	C	.	.	S	Bend	trans	-86.3	-20.5	-169	-159.8	163.5	-60.9	149.6	21.2	115.4	E493 Y531 D1309 Y1313	E493-R533 VanDerWaalsContact OE1-CD 3.25Å; E493-R533 WeakPolarHBondContact OE1-CD 3.24Å; E493-R533 IonicContact OE1-CZ 2.65Å; E493-R533 IonicContact OE1-NE 2.71Å; E493-R533 IonicContact OE1-NH1 3.89Å; E493-R533 PolarHBondContact OE1-NH1 2.85Å; E493-R533 WeakPolarHBondContact OE2-CD 3.45Å; Y531-R533 HydrophobicContact CD1-CB 4.31Å; Y531-R533 HydrophobicContact CE1-CB 3.73Å; R533-D1309 IonicContact CZ-OD2 2.68Å; R533-D1309 IonicContact NE-OD2 2.92Å; R533-D1309 IonicContact NH2-OD2 3.67Å; R533-D1309 PolarHBondContact NH2-OD2 3.42Å; R533-Y1313 PolarHBondContact NH1-OH 3.26Å; R533-Y1313 PolarHBondContact NH2-OH 3.34Å
534	S	91.8	Very high	93.4	Very high	9 Å²	9	50.8 Å²	50.8	6%	0.063	23%	0.229	C	C	.	.			trans	-135	127.1	166.6	168.5	0	0	0	0	109.9	I495 E536 V537 K538	I495-S534 WeakPolarHBondContact CG2-OG 3.39Å; S534-E536 PolarHBondContact OG-N 2.83Å; S534-V537 PolarHBondContact OG-N 3.48Å; S534-K538 PolarHBondContact O-N 3.22Å
535	L	93.4	Very high	93.5	Very high	118 Å²	118	51.1 Å²	51.1	62%	0.618	23%	0.23	S	C	*	.	H	α-helix	trans	-73.6	-32.9	174	-178.1	58.7	0	0	0	111.4	K538 I539	L535-K538 HydrophobicContact CD1-CD 4.3Å; L535-K538 WeakPolarHBondContact O-CB 3.38Å; L535-K538 PolarHBondContact O-N 2.78Å; L535-I539 HydrophobicContact CD1-CD1 4.18Å; L535-I539 HydrophobicContact CD1-CG1 4.26Å; L535-I539 HydrophobicContact CD2-CD1 4.43Å; L535-I539 HydrophobicContact CG-CD1 3.84Å; L535-I539 HydrophobicContact CG-CG1 4.36Å; L535-I539 WeakPolarHBondContact O-CG1 3.46Å; L535-I539 PolarHBondContact O-N 3.23Å
536	E	94.7	Very high	93.5	Very high	120 Å²	120	55.3 Å²	55.3	56%	0.561	25%	0.252	S	S	*	.	H	α-helix	trans	-61.7	-49.9	176.9	-62.8	152	-157	0	0	111.1	I495 V499 S534 K538 I539 A540	I495-E536 WeakPolarHBondContact CG2-OE2 3.23Å; V499-E536 HydrophobicContact CG2-CB 3.78Å; S534-E536 PolarHBondContact OG-N 2.83Å; E536-K538 PolarHBondContact O-N 2.76Å; E536-I539 PolarHBondContact O-N 3.3Å; E536-I539 VanDerWaalsContact O-N 3.14Å; E536-A540 WeakPolarHBondContact O-CB 3.46Å; E536-A540 PolarHBondContact O-N 3.37Å
537	V	95.1	Very high	93.6	Very high	0 Å²	0	56.8 Å²	56.8	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-56.8	-40.3	175.4	170.4	0	0	0	0	110.9	L488 I495 C498 V499 L502 C528 Y531 S534 A541	L488-V537 HydrophobicContact CD1-CG1 4.23Å; I495-V537 HydrophobicContact CG2-CG2 4.18Å; C498-V537 HydrophobicContact CB-CG2 4.05Å; V499-V537 HydrophobicContact CG2-CG2 3.95Å; L502-V537 HydrophobicContact CD1-CG1 4.26Å; C528-V537 HydrophobicContact CB-CG1 4.14Å; Y531-V537 HydrophobicContact CD1-CB 4.19Å; Y531-V537 HydrophobicContact CD1-CG1 4.03Å; Y531-V537 HydrophobicContact CG-CG1 4.41Å; S534-V537 PolarHBondContact OG-N 3.48Å; V537-A541 WeakPolarHBondContact O-CB 3.25Å; V537-A541 PolarHBondContact O-N 2.87Å
538	K	95.1	Very high	93.8	Very high	94 Å²	94	56 Å²	56	41%	0.409	26%	0.256	S	S	.	.	H	α-helix	trans	-67.2	-42.7	177.5	179.7	-179.5	174.5	-168	0	112.3	S534 L535 E536 Q542	S534-K538 PolarHBondContact O-N 3.22Å; L535-K538 HydrophobicContact CD1-CD 4.3Å; L535-K538 WeakPolarHBondContact O-CB 3.38Å; L535-K538 PolarHBondContact O-N 2.78Å; E536-K538 PolarHBondContact O-N 2.76Å; K538-Q542 VanDerWaalsContact O-CB 3.25Å; K538-Q542 WeakPolarHBondContact O-CB 3.4Å; K538-Q542 PolarHBondContact O-N 3.4Å
539	I	96	Very high	93.8	Very high	107 Å²	107	58.6 Å²	58.6	55%	0.549	27%	0.27	S	S	.	.	H	α-helix	trans	-67.6	-49.3	177.8	-70.9	169.5	0	0	0	110.5	L535 E536 A541 Q542 K543	L535-I539 HydrophobicContact CD1-CD1 4.18Å; L535-I539 HydrophobicContact CD1-CG1 4.26Å; L535-I539 HydrophobicContact CD2-CD1 4.43Å; L535-I539 HydrophobicContact CG-CD1 3.84Å; L535-I539 HydrophobicContact CG-CG1 4.36Å; L535-I539 WeakPolarHBondContact O-CG1 3.46Å; L535-I539 PolarHBondContact O-N 3.23Å; E536-I539 PolarHBondContact O-N 3.3Å; E536-I539 VanDerWaalsContact O-N 3.14Å; I539-A541 PolarHBondContact O-N 3.17Å; I539-Q542 WeakPolarHBondContact O-CB 3.43Å; I539-Q542 PolarHBondContact O-N 3.43Å; I539-Q542 VanDerWaalsContact O-N 3.09Å; I539-K543 PolarHBondContact O-N 3.1Å
540	A	96.4	Very high	93.7	Very high	18 Å²	18	61.1 Å²	61.1	15%	0.149	28%	0.284	C	S	.	.	H	α-helix	trans	-59.9	-45.5	178.2	0	0	0	0	0	111.6	L502 E536 Q542 K543 V544	L502-A540 HydrophobicContact CB-CB 3.81Å; L502-A540 HydrophobicContact CD1-CB 3.93Å; E536-A540 WeakPolarHBondContact O-CB 3.46Å; E536-A540 PolarHBondContact O-N 3.37Å; A540-Q542 VanDerWaalsContact C-N 3.3Å; A540-Q542 PolarHBondContact O-N 3.44Å; A540-K543 WeakPolarHBondContact O-CB 3.37Å; A540-K543 PolarHBondContact O-N 2.9Å; A540-V544 WeakPolarHBondContact O-CG2 3.31Å; A540-V544 PolarHBondContact O-N 3.23Å
541	A	96.7	Very high	93.9	Very high	0 Å²	0	58 Å²	58	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-65.4	-31.1	174.9	0	0	0	0	0	113.2	L502 I525 C528 R529 V537 I539 F545	L502-A541 HydrophobicContact CD1-CB 4.17Å; L502-A541 HydrophobicContact CD2-CB 4.29Å; I525-A541 HydrophobicContact CG2-CB 4.07Å; I525-A541 WeakPolarHBondContact CG2-O 3.47Å; C528-A541 HydrophobicContact CB-CB 3.44Å; C528-A541 VanDerWaalsContact CB-CB 3.44Å; R529-A541 HydrophobicContact CG-CB 4Å; V537-A541 WeakPolarHBondContact O-CB 3.25Å; V537-A541 PolarHBondContact O-N 2.87Å; I539-A541 PolarHBondContact O-N 3.17Å; A541-F545 VanDerWaalsContact O-CB 3.26Å; A541-F545 WeakPolarHBondContact O-CB 3.36Å; A541-F545 PolarHBondContact O-N 3.44Å; A541-F545 VanDerWaalsContact O-N 3.07Å
542	Q	95.9	Very high	94	Very high	61 Å²	61	60.8 Å²	60.8	29%	0.285	29%	0.287	S	S	.	.	H	α-helix	trans	-70.9	-37	173.9	-175.4	60.5	77.7	0	0	111.9	R529 K538 I539 A540 N546	R529-Q542 HydrophobicContact CG-CB 4.42Å; R529-Q542 VanDerWaalsContact NE-CD 3.32Å; K538-Q542 VanDerWaalsContact O-CB 3.25Å; K538-Q542 WeakPolarHBondContact O-CB 3.4Å; K538-Q542 PolarHBondContact O-N 3.4Å; I539-Q542 WeakPolarHBondContact O-CB 3.43Å; I539-Q542 PolarHBondContact O-N 3.43Å; I539-Q542 VanDerWaalsContact O-N 3.09Å; A540-Q542 VanDerWaalsContact C-N 3.3Å; A540-Q542 PolarHBondContact O-N 3.44Å; Q542-N546 PolarHBondContact NE2-OD1 3.23Å; Q542-N546 WeakPolarHBondContact O-CB 3.25Å; Q542-N546 PolarHBondContact O-N 3.31Å; Q542-N546 PolarHBondContact O-OD1 2.79Å
543	K	96.1	Very high	94.3	Very high	120 Å²	120	59.9 Å²	59.9	52%	0.522	30%	0.297	S	S	.	.	H	α-helix	trans	-62.4	-54.5	174.7	-165.1	-171.7	-175.2	-156.2	0	111.2	D506 I539 A540 F545 N546 K547	D506-K543 WeakPolarHBondContact OD2-CD 3.46Å; D506-K543 WeakPolarHBondContact OD2-CE 3.2Å; D506-K543 IonicContact OD2-NZ 3.88Å; D506-K543 PolarHBondContact OD2-NZ 2.91Å; I539-K543 PolarHBondContact O-N 3.1Å; A540-K543 WeakPolarHBondContact O-CB 3.37Å; A540-K543 PolarHBondContact O-N 2.9Å; K543-F545 VanDerWaalsContact C-N 3.32Å; K543-F545 PolarHBondContact O-N 3.2Å; K543-N546 WeakPolarHBondContact O-CB 3.2Å; K543-N546 PolarHBondContact O-N 3.41Å; K543-N546 VanDerWaalsContact O-N 3.09Å; K543-K547 PolarHBondContact O-N 3.16Å
544	V	96.3	Very high	94.6	Very high	0 Å²	0	59.3 Å²	59.3	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-58.6	-42.6	177.8	179.4	0	0	0	0	111.4	L502 L505 D506 I525 A540 N546 K547 F548	L502-V544 WeakPolarHBondContact O-CG2 3.36Å; L505-V544 HydrophobicContact CD2-CG1 3.97Å; L505-V544 HydrophobicContact CG-CG1 3.89Å; D506-V544 HydrophobicContact CB-CG2 3.92Å; I525-V544 HydrophobicContact CD1-CG1 3.81Å; A540-V544 WeakPolarHBondContact O-CG2 3.31Å; A540-V544 PolarHBondContact O-N 3.23Å; V544-N546 VanDerWaalsContact C-N 3.34Å; V544-N546 PolarHBondContact O-N 2.87Å; V544-K547 WeakPolarHBondContact O-CB 3.45Å; V544-K547 PolarHBondContact O-N 3.17Å; V544-F548 HydrophobicContact CG1-CD1 4.1Å; V544-F548 HydrophobicContact CG1-CE1 3.62Å; V544-F548 HydrophobicContact CG1-CE2 4.12Å; V544-F548 HydrophobicContact CG1-CZ 3.64Å; V544-F548 VanDerWaalsContact O-CD1 3.3Å; V544-F548 WeakPolarHBondContact O-CD1 3.32Å; V544-F548 WeakPolarHBondContact O-CG 3.39Å; V544-F548 PolarHBondContact O-N 3.08Å
545	F	95.3	Very high	94.6	Very high	9 Å²	9	60.1 Å²	60.1	4%	0.039	31%	0.312	C	S	.	.	H	α-helix	trans	-65.6	-35.6	177.8	-174.1	-87.4	0	0	0	113	V522 I525 R526 A541 K543 F548 L549 F612	V522-F545 HydrophobicContact CG1-CE2 4.31Å; I525-F545 HydrophobicContact CG2-CB 3.95Å; R526-F545 HydrophobicContact CG-CD2 3.98Å; R526-F545 HydrophobicContact CG-CE2 3.59Å; A541-F545 VanDerWaalsContact O-CB 3.26Å; A541-F545 WeakPolarHBondContact O-CB 3.36Å; A541-F545 PolarHBondContact O-N 3.44Å; A541-F545 VanDerWaalsContact O-N 3.07Å; K543-F545 VanDerWaalsContact C-N 3.32Å; K543-F545 PolarHBondContact O-N 3.2Å; F545-F548 PolarHBondContact O-N 2.98Å; F545-L549 HydrophobicContact CE1-CB 4.5Å; F545-L549 WeakPolarHBondContact O-CB 3.36Å; F545-L549 PolarHBondContact O-N 3.23Å; F545-F612 HydrophobicContact CE1-CD1 4.44Å; F545-F612 AromaticContact CE2-CD1 3.95Å; F545-F612 HydrophobicContact CE2-CD1 3.95Å; F545-F612 HydrophobicContact CE2-CE1 4.36Å; F545-F612 AromaticContact CZ-CD1 3.69Å; F545-F612 HydrophobicContact CZ-CD1 3.69Å; F545-F612 HydrophobicContact CZ-CE1 4.4Å
546	N	94.8	Very high	94.6	Very high	87 Å²	87	60 Å²	60	47%	0.465	31%	0.312	S	S	.	.	H	α-helix	trans	-66	-42.9	174.8	-73.4	-2.1	0	0	0	111	Q542 K543 V544 F548 L549 Q550	Q542-N546 PolarHBondContact NE2-OD1 3.23Å; Q542-N546 WeakPolarHBondContact O-CB 3.25Å; Q542-N546 PolarHBondContact O-N 3.31Å; Q542-N546 PolarHBondContact O-OD1 2.79Å; K543-N546 WeakPolarHBondContact O-CB 3.2Å; K543-N546 PolarHBondContact O-N 3.41Å; K543-N546 VanDerWaalsContact O-N 3.09Å; V544-N546 VanDerWaalsContact C-N 3.34Å; V544-N546 PolarHBondContact O-N 2.87Å; N546-F548 VanDerWaalsContact C-N 3.31Å; N546-F548 PolarHBondContact O-N 3.08Å; N546-L549 PolarHBondContact O-N 3.14Å; N546-Q550 PolarHBondContact O-N 2.92Å
547	K	94.4	Very high	94.5	Very high	56 Å²	56	61.7 Å²	61.7	24%	0.243	32%	0.318	C	S	.	.	H	α-helix	trans	-56.9	-43.8	171.4	178.1	-175.3	171.1	-169.9	0	111.7	L505 D506 M508 K543 V544 Q550 L551	L505-K547 PolarHBondContact O-NZ 2.95Å; D506-K547 PolarHBondContact O-NZ 3.18Å; M508-K547 PolarHBondContact O-NZ 2.83Å; K543-K547 PolarHBondContact O-N 3.16Å; V544-K547 WeakPolarHBondContact O-CB 3.45Å; V544-K547 PolarHBondContact O-N 3.17Å; K547-Q550 PolarHBondContact O-N 3.44Å; K547-L551 HydrophobicContact CG-CD1 4.38Å; K547-L551 WeakPolarHBondContact O-CG 3.48Å; K547-L551 PolarHBondContact O-N 2.98Å
548	F	95	Very high	94.4	Very high	2 Å²	2	67.5 Å²	67.5	1%	0.009	35%	0.349	C	S	.	.	H	α-helix	trans	-67.1	-35.9	177.9	-73	11.8	0	0	0	112.5	L505 I510 M515 V522 I525 V544 F545 N546 L551 Y552 F612	L505-F548 HydrophobicContact CD1-CZ 4.22Å; L505-F548 HydrophobicContact CD2-CZ 4.28Å; L505-F548 HydrophobicContact CG-CZ 4.13Å; I510-F548 HydrophobicContact CD1-CE1 3.64Å; I510-F548 HydrophobicContact CD1-CZ 3.79Å; M515-F548 HydrophobicContact CE-CB 4.2Å; M515-F548 HydrophobicContact CE-CG 4.47Å; M515-F548 HydrophobicContact SD-CB 3.68Å; M515-F548 HydrophobicContact SD-CD1 4.28Å; M515-F548 HydrophobicContact SD-CD2 3.34Å; M515-F548 WeakPolarHBondContact SD-CD2 3.43Å; M515-F548 HydrophobicContact SD-CE2 3.97Å; M515-F548 HydrophobicContact SD-CG 3.51Å; M515-F548 VanDerWaalsContact SD-CG 3.51Å; V522-F548 HydrophobicContact CG2-CD2 4.18Å; V522-F548 HydrophobicContact CG2-CE2 4.36Å; I525-F548 HydrophobicContact CD1-CD2 4Å; I525-F548 HydrophobicContact CD1-CE2 3.34Å; I525-F548 HydrophobicContact CD1-CZ 3.96Å; V544-F548 HydrophobicContact CG1-CD1 4.1Å; V544-F548 HydrophobicContact CG1-CE1 3.62Å; V544-F548 HydrophobicContact CG1-CE2 4.12Å; V544-F548 HydrophobicContact CG1-CZ 3.64Å; V544-F548 VanDerWaalsContact O-CD1 3.3Å; V544-F548 WeakPolarHBondContact O-CD1 3.32Å; V544-F548 WeakPolarHBondContact O-CG 3.39Å; V544-F548 PolarHBondContact O-N 3.08Å; F545-F548 PolarHBondContact O-N 2.98Å; N546-F548 VanDerWaalsContact C-N 3.31Å; N546-F548 PolarHBondContact O-N 3.08Å; F548-L551 HydrophobicContact CD1-CD1 4.44Å; F548-Y552 PolarHBondContact O-N 3.33Å; F548-Y552 VanDerWaalsContact O-N 3.14Å; F548-F612 HydrophobicContact CB-CE1 3.94Å; F548-F612 HydrophobicContact CB-CZ 4.2Å; F548-F612 VanDerWaalsContact O-CZ 3.26Å; F548-F612 WeakPolarHBondContact O-CZ 3.43Å
549	L	93.4	Very high	94.4	Very high	54 Å²	54	66.2 Å²	66.2	28%	0.283	34%	0.344	S	S	.	.	H	α-helix	trans	-69.9	-37.3	174.6	-176.3	62.8	0	0	0	111.6	F545 N546 Y552 A553 F612 L614	F545-L549 HydrophobicContact CE1-CB 4.5Å; F545-L549 WeakPolarHBondContact O-CB 3.36Å; F545-L549 PolarHBondContact O-N 3.23Å; N546-L549 PolarHBondContact O-N 3.14Å; L549-Y552 HydrophobicContact CD1-CD1 4.36Å; L549-Y552 PolarHBondContact O-N 3.05Å; L549-A553 PolarHBondContact O-N 2.92Å; L549-F612 HydrophobicContact CB-CD1 4.44Å; L549-F612 HydrophobicContact CB-CE1 4.36Å; L549-F612 HydrophobicContact CD1-CD1 4.01Å; L549-F612 HydrophobicContact CD1-CG 4.3Å; L549-L614 HydrophobicContact CD1-CD1 4.15Å; L549-L614 HydrophobicContact CD1-CD2 4.08Å
550	Q	93.1	Very high	94.3	Very high	118 Å²	118	63.3 Å²	63.3	55%	0.551	33%	0.33	S	S	*	.	H	α-helix	trans	-62.6	-47.7	172.9	-170.5	65.8	19.5	0	0	110.8	N546 K547 Y552 A553 T554	N546-Q550 PolarHBondContact O-N 2.92Å; K547-Q550 PolarHBondContact O-N 3.44Å; Q550-Y552 PolarHBondContact O-N 2.91Å; Q550-A553 CarbonylContact O-C 3.59Å; Q550-A553 WeakPolarHBondContact O-CA 3.35Å; Q550-A553 PolarHBondContact O-N 2.88Å; Q550-T554 HydrophobicContact CG-CG2 4.25Å; Q550-T554 PolarHBondContact O-N 3.39Å; Q550-T554 PolarHBondContact O-OG1 3.43Å
551	L	92.6	Very high	94.1	Very high	49 Å²	49	66.5 Å²	66.5	26%	0.257	34%	0.344	S	S	.	.	H	α-helix	trans	-57.2	-32	174.7	-73.9	166.7	0	0	0	113	I510 K547 F548 A555	I510-L551 WeakPolarHBondContact O-CD1 3.05Å; K547-L551 HydrophobicContact CG-CD1 4.38Å; K547-L551 WeakPolarHBondContact O-CG 3.48Å; K547-L551 PolarHBondContact O-N 2.98Å; F548-L551 HydrophobicContact CD1-CD1 4.44Å; L551-A555 WeakPolarHBondContact O-CB 3.46Å; L551-A555 PolarHBondContact O-N 3.45Å
552	Y	93.7	Very high	94	Very high	59 Å²	59	71.4 Å²	71.4	23%	0.231	37%	0.37	C	S	.	.	H	α-helix	trans	-75.5	-33.2	172.5	173	-110.1	0	0	0	113	L512 F548 L549 Q550 L560 M608 F612 L614	L512-Y552 HydrophobicContact CD1-CD2 4.19Å; L512-Y552 HydrophobicContact CD2-CD2 4.11Å; F548-Y552 PolarHBondContact O-N 3.33Å; F548-Y552 VanDerWaalsContact O-N 3.14Å; L549-Y552 HydrophobicContact CD1-CD1 4.36Å; L549-Y552 PolarHBondContact O-N 3.05Å; Q550-Y552 PolarHBondContact O-N 2.91Å; Y552-L560 HydrophobicContact CD2-CD1 4.43Å; Y552-L560 HydrophobicContact CE2-CD1 3.8Å; Y552-M608 HydrophobicContact CD2-CB 4.03Å; Y552-M608 HydrophobicContact CD2-CE 4.1Å; Y552-M608 HydrophobicContact CE2-CB 3.36Å; Y552-M608 HydrophobicContact CE2-CG 4.04Å; Y552-F612 HydrophobicContact CD1-CD2 4.18Å; Y552-F612 HydrophobicContact CD1-CE2 4.44Å; Y552-F612 HydrophobicContact CD2-CD2 4.45Å; Y552-F612 HydrophobicContact CD2-CE2 4.25Å; Y552-F612 HydrophobicContact CG-CD2 4Å; Y552-F612 AromaticContact CG-CE2 3.84Å; Y552-F612 HydrophobicContact CG-CE2 3.84Å; Y552-L614 HydrophobicContact CD1-CD1 3.95Å; Y552-L614 HydrophobicContact CE1-CD1 3.5Å
553	A	92.9	Very high	94	Very high	76 Å²	76	68.5 Å²	68.5	63%	0.628	36%	0.356	S	S	*	.	H	α-helix	trans	-77.1	-27.6	178.7	0	0	0	0	0	113.6	L549 Q550	L549-A553 PolarHBondContact O-N 2.92Å; Q550-A553 CarbonylContact O-C 3.59Å; Q550-A553 WeakPolarHBondContact O-CA 3.35Å; Q550-A553 PolarHBondContact O-N 2.88Å
554	T	93.4	Very high	93.9	Very high	89 Å²	89	65.4 Å²	65.4	55%	0.546	34%	0.344	S	S	.	.	S	Bend	trans	-101	7.2	-179.8	63.7	0	0	0	0	114	Q550	Q550-T554 HydrophobicContact CG-CG2 4.25Å; Q550-T554 PolarHBondContact O-N 3.39Å; Q550-T554 PolarHBondContact O-OG1 3.43Å
555	A	92.5	Very high	93.8	Very high	26 Å²	26	67.3 Å²	67.3	22%	0.215	36%	0.359	C	S	.	.			trans	-78	134	-176	0	0	0	0	0	112.7	L512 L551 E559	L512-A555 HydrophobicContact CB-CB 4.39Å; L512-A555 HydrophobicContact CD2-CB 3.43Å; L512-A555 VanDerWaalsContact CD2-CB 3.43Å; L512-A555 HydrophobicContact CG-CB 4.46Å; L551-A555 WeakPolarHBondContact O-CB 3.46Å; L551-A555 PolarHBondContact O-N 3.45Å; A555-E559 HydrophobicContact CB-CB 4.3Å
556	D	94.2	Very high	93.7	Very high	115 Å²	115	67.5 Å²	67.5	62%	0.615	36%	0.36	S	S	*	.			trans	-57.9	151.2	169.8	-77	-21.6	0	0	0	111.8	N558 E559 L560	D556-N558 PolarHBondContact O-N 2.83Å; D556-N558 VanDerWaalsContact O-N 3.11Å; D556-E559 PolarHBondContact O-N 3.44Å; D556-L560 PolarHBondContact O-N 2.98Å
557	K	92.8	Very high	93.6	Very high	156 Å²	156	63.6 Å²	63.6	68%	0.678	34%	0.339	S	S	*	.	H	α-helix	trans	-49.5	-40.3	172.9	-176.2	-176.4	174.4	-171.1	0	112.3	L560 D561	K557-L560 PolarHBondContact O-N 2.75Å; K557-D561 WeakPolarHBondContact O-CB 3.32Å; K557-D561 PolarHBondContact O-N 2.91Å
558	N	92.8	Very high	93.5	Very high	121 Å²	121	65.1 Å²	65.1	65%	0.647	35%	0.349	S	S	*	.	H	α-helix	trans	-64.6	-41.5	178.8	-65.7	-23	0	0	0	112.3	D556 L562	D556-N558 PolarHBondContact O-N 2.83Å; D556-N558 VanDerWaalsContact O-N 3.11Å; N558-L562 WeakPolarHBondContact O-CB 3.29Å; N558-L562 WeakPolarHBondContact O-CD1 3.43Å; N558-L562 VanDerWaalsContact O-CG 3.24Å; N558-L562 WeakPolarHBondContact O-CG 3.26Å; N558-L562 PolarHBondContact O-N 2.84Å; N558-L562 VanDerWaalsContact O-N 3.1Å
559	E	93.6	Very high	93.3	Very high	68 Å²	68	68.9 Å²	68.9	32%	0.318	37%	0.365	S	S	.	.	H	α-helix	trans	-67.5	-40.6	174.3	-70.6	-138.9	134.7	0	0	111.8	L512 A555 D556 L562 A563	L512-E559 HydrophobicContact CB-CB 4.5Å; A555-E559 HydrophobicContact CB-CB 4.3Å; D556-E559 PolarHBondContact O-N 3.44Å; E559-L562 PolarHBondContact O-N 3.26Å; E559-A563 WeakPolarHBondContact O-CB 3.42Å; E559-A563 PolarHBondContact O-N 3.39Å
560	L	93.7	Very high	93	Very high	46 Å²	46	68.6 Å²	68.6	24%	0.241	36%	0.362	C	S	.	.	H	α-helix	trans	-64	-43.7	179	-178.6	59.8	0	0	0	111.9	L512 Y552 D556 K557 A563 H564 M608	L512-L560 HydrophobicContact CD2-CD1 4.2Å; Y552-L560 HydrophobicContact CD2-CD1 4.43Å; Y552-L560 HydrophobicContact CE2-CD1 3.8Å; D556-L560 PolarHBondContact O-N 2.98Å; K557-L560 PolarHBondContact O-N 2.75Å; L560-A563 PolarHBondContact O-N 3.32Å; L560-H564 WeakPolarHBondContact O-CB 3.45Å; L560-H564 PolarHBondContact O-N 2.92Å; L560-H564 PolarHBondContact O-ND1 2.67Å; L560-M608 HydrophobicContact CD1-CG 4.01Å
561	D	94.1	Very high	92.9	Very high	84 Å²	84	66.3 Å²	66.3	45%	0.449	35%	0.352	S	S	.	.	H	α-helix	trans	-67.2	-36	176.1	-76.2	-26.4	0	0	0	111.8	K557 H564 A565	K557-D561 WeakPolarHBondContact O-CB 3.32Å; K557-D561 PolarHBondContact O-N 2.91Å; D561-H564 PolarHBondContact O-N 3.09Å; D561-A565 WeakPolarHBondContact O-CB 3.2Å; D561-A565 PolarHBondContact O-N 3.49Å
562	L	94.1	Very high	92.8	Very high	103 Å²	103	69.5 Å²	69.5	54%	0.539	37%	0.365	S	S	.	.	H	α-helix	trans	-64.6	-41.5	171.2	-75.4	169.8	0	0	0	112.5	P513 N558 E559 A565 E566	P513-L562 HydrophobicContact CB-CB 4.22Å; P513-L562 HydrophobicContact CG-CB 3.83Å; N558-L562 WeakPolarHBondContact O-CB 3.29Å; N558-L562 WeakPolarHBondContact O-CD1 3.43Å; N558-L562 VanDerWaalsContact O-CG 3.24Å; N558-L562 WeakPolarHBondContact O-CG 3.26Å; N558-L562 PolarHBondContact O-N 2.84Å; N558-L562 VanDerWaalsContact O-N 3.1Å; E559-L562 PolarHBondContact O-N 3.26Å; L562-A565 PolarHBondContact O-N 2.84Å; L562-E566 PolarHBondContact O-N 3.13Å; L562-E566 VanDerWaalsContact O-N 3.09Å
563	A	94.7	Very high	92.5	Very high	0 Å²	0	72.3 Å²	72.3	0%	0	38%	0.375	C	S	.	.	H	α-helix	trans	-65.7	-42.6	175.8	0	0	0	0	0	112	L512 A516 E559 L560 E566 L567 M608	L512-A563 HydrophobicContact CD2-CB 4.25Å; L512-A563 HydrophobicContact CG-CB 3.98Å; A516-A563 HydrophobicContact CB-CB 3.93Å; E559-A563 WeakPolarHBondContact O-CB 3.42Å; E559-A563 PolarHBondContact O-N 3.39Å; L560-A563 PolarHBondContact O-N 3.32Å; A563-E566 PolarHBondContact O-N 2.9Å; A563-L567 PolarHBondContact O-N 3.22Å; A563-M608 HydrophobicContact CB-CE 4.11Å; A563-M608 HydrophobicContact CB-SD 4.01Å
564	H	94.1	Very high	92.1	Very high	56 Å²	56	70.6 Å²	70.6	26%	0.259	36%	0.355	S	S	.	.	H	α-helix	trans	-60	-47.3	172.3	-74.2	153.4	0	0	0	112.2	L560 D561 E566 L567 I568	L560-H564 WeakPolarHBondContact O-CB 3.45Å; L560-H564 PolarHBondContact O-N 2.92Å; L560-H564 PolarHBondContact O-ND1 2.67Å; D561-H564 PolarHBondContact O-N 3.09Å; H564-E566 PolarHBondContact O-N 3.44Å; H564-L567 PolarHBondContact O-N 3.06Å; H564-I568 VanDerWaalsContact O-CG1 3.3Å; H564-I568 WeakPolarHBondContact O-CG1 3.17Å; H564-I568 PolarHBondContact O-N 2.7Å
565	A	94.2	Very high	91.7	Very high	39 Å²	39	69.8 Å²	69.8	32%	0.322	35%	0.346	S	S	.	.	H	α-helix	trans	-59.2	-31.7	176.6	0	0	0	0	0	112.3	D561 L562 K569	D561-A565 WeakPolarHBondContact O-CB 3.2Å; D561-A565 PolarHBondContact O-N 3.49Å; L562-A565 PolarHBondContact O-N 2.84Å; A565-K569 WeakPolarHBondContact O-CB 3.44Å; A565-K569 WeakPolarHBondContact O-CE 3.44Å; A565-K569 WeakPolarHBondContact O-CG 3.42Å; A565-K569 PolarHBondContact O-N 3.28Å
566	E	93.3	Very high	91.5	Very high	13 Å²	13	75.2 Å²	75.2	6%	0.061	37%	0.365	C	S	.	.	H	α-helix	trans	-79.7	-37.7	179.9	-163.7	54.3	-129.9	0	0	113.6	A516 R517 L562 A563 H564 I568 K569 H570 R573	A516-E566 HydrophobicContact CB-CB 4.35Å; R517-E566 HydrophobicContact CB-CG 4.33Å; R517-E566 HydrophobicContact CG-CG 3.35Å; L562-E566 PolarHBondContact O-N 3.13Å; L562-E566 VanDerWaalsContact O-N 3.09Å; A563-E566 PolarHBondContact O-N 2.9Å; H564-E566 PolarHBondContact O-N 3.44Å; E566-I568 VanDerWaalsContact C-N 3.3Å; E566-I568 PolarHBondContact O-N 3.23Å; E566-K569 WeakPolarHBondContact O-CB 3.24Å; E566-K569 PolarHBondContact O-N 2.99Å; E566-K569 WeakPolarHBondContact OE2-CD 3.25Å; E566-K569 WeakPolarHBondContact OE2-CE 3.49Å; E566-K569 IonicContact OE2-NZ 4Å; E566-K569 PolarHBondContact OE2-NZ 3.39Å; E566-H570 PolarHBondContact O-N 2.77Å; E566-R573 IonicContact OE1-CZ 2.71Å; E566-R573 IonicContact OE1-NH1 3.19Å; E566-R573 PolarHBondContact OE1-NH1 3.2Å; E566-R573 IonicContact OE1-NH2 2.66Å; E566-R573 PolarHBondContact OE1-NH2 2.71Å
567	L	92.4	Very high	90.9	Very high	5 Å²	5	78.1 Å²	78.1	3%	0.026	37%	0.372	C	S	.	.	H	α-helix	trans	-59.4	-42.7	167	-71.8	-177.9	0	0	0	111.3	A516 A563 H564 H570 Q571 P605 M608	A516-L567 HydrophobicContact CB-CD2 4.41Å; A516-L567 HydrophobicContact CB-CG 4.27Å; A563-L567 PolarHBondContact O-N 3.22Å; H564-L567 PolarHBondContact O-N 3.06Å; L567-H570 WeakPolarHBondContact O-CB 3.31Å; L567-H570 PolarHBondContact O-N 2.97Å; L567-Q571 PolarHBondContact O-N 3.21Å; L567-P605 HydrophobicContact CD2-CG 4.09Å; L567-M608 HydrophobicContact CD1-CG 4.31Å; L567-M608 HydrophobicContact CD1-SD 3.65Å; L567-M608 HydrophobicContact CG-SD 4.33Å
568	I	92.3	Very high	90.2	Very high	88 Å²	88	74.6 Å²	74.6	45%	0.451	36%	0.358	S	S	.	.	H	α-helix	trans	-62.4	-43.3	174.9	-68.4	165.8	0	0	0	110.6	H564 E566 H570 Q571 Q572	H564-I568 VanDerWaalsContact O-CG1 3.3Å; H564-I568 WeakPolarHBondContact O-CG1 3.17Å; H564-I568 PolarHBondContact O-N 2.7Å; E566-I568 VanDerWaalsContact C-N 3.3Å; E566-I568 PolarHBondContact O-N 3.23Å; I568-H570 VanDerWaalsContact C-N 3.32Å; I568-H570 PolarHBondContact O-N 3.27Å; I568-Q571 PolarHBondContact O-N 3.24Å; I568-Q572 HydrophobicContact CG2-CG 4.41Å; I568-Q572 WeakPolarHBondContact O-CB 3.23Å; I568-Q572 VanDerWaalsContact O-CG 3.31Å; I568-Q572 WeakPolarHBondContact O-CG 3.34Å; I568-Q572 PolarHBondContact O-N 3.45Å
569	K	91.8	Very high	89.2	Confident	82 Å²	82	72.3 Å²	72.3	36%	0.357	34%	0.342	S	S	.	.	H	α-helix	trans	-58.8	-40.6	172.4	-82.9	172.5	-100	166.8	0	111.8	A565 E566 Q572 R573	A565-K569 WeakPolarHBondContact O-CB 3.44Å; A565-K569 WeakPolarHBondContact O-CE 3.44Å; A565-K569 WeakPolarHBondContact O-CG 3.42Å; A565-K569 PolarHBondContact O-N 3.28Å; E566-K569 WeakPolarHBondContact O-CB 3.24Å; E566-K569 PolarHBondContact O-N 2.99Å; E566-K569 WeakPolarHBondContact OE2-CD 3.25Å; E566-K569 WeakPolarHBondContact OE2-CE 3.49Å; E566-K569 IonicContact OE2-NZ 4Å; E566-K569 PolarHBondContact OE2-NZ 3.39Å; K569-Q572 PolarHBondContact O-N 3.25Å; K569-R573 WeakPolarHBondContact O-CB 3.42Å; K569-R573 VanDerWaalsContact O-CG 3.23Å; K569-R573 WeakPolarHBondContact O-CG 3.16Å; K569-R573 PolarHBondContact O-N 3.05Å
570	H	87.9	Confident	87.7	Confident	47 Å²	47	74.6 Å²	74.6	22%	0.218	36%	0.363	C	S	.	.	H	α-helix	trans	-63.9	-43.5	175.8	-178.9	-102.1	0	0	0	112.4	W519 E566 L567 I568 R573 H574 Y602	W519-H570 AromaticContact CE2-CE1 3.65Å; W519-H570 AromaticContact CZ2-CE1 3.83Å; W519-H570 AromaticContact NE1-CD2 3.72Å; W519-H570 AromaticContact NE1-CE1 3.04Å; W519-H570 PolarHBondContact NE1-CE1 2.86Å; W519-H570 AromaticContact NE1-CG 3.88Å; W519-H570 AromaticContact NE1-ND1 3.46Å; W519-H570 PolarHBondContact NE1-ND1 3.14Å; W519-H570 AromaticContact NE1-NE2 3.2Å; W519-H570 PolarHBondContact NE1-NE2 3.27Å; E566-H570 PolarHBondContact O-N 2.77Å; L567-H570 WeakPolarHBondContact O-CB 3.31Å; L567-H570 PolarHBondContact O-N 2.97Å; I568-H570 VanDerWaalsContact C-N 3.32Å; I568-H570 PolarHBondContact O-N 3.27Å; H570-R573 WeakPolarHBondContact O-CB 3.44Å; H570-R573 PolarHBondContact O-N 2.97Å; H570-H574 PolarHBondContact O-N 2.82Å; H570-Y602 AromaticContact CE1-CE2 3.65Å; H570-Y602 AromaticContact ND1-CE2 3.36Å; H570-Y602 WeakPolarHBondContact ND1-CE2 3.46Å; H570-Y602 AromaticContact ND1-CZ 3.56Å; H570-Y602 PolarHBondContact ND1-OH 3.13Å
571	Q	89.8	Confident	86	Confident	70 Å²	70	75.4 Å²	75.4	33%	0.327	38%	0.382	S	S	.	.	H	α-helix	trans	-63	-40.8	173.2	-172.7	178	-23.9	0	0	112.4	L567 I568 H574 I575 Y602	L567-Q571 PolarHBondContact O-N 3.21Å; I568-Q571 PolarHBondContact O-N 3.24Å; Q571-H574 WeakPolarHBondContact O-CB 3.41Å; Q571-H574 PolarHBondContact O-N 2.94Å; Q571-I575 HydrophobicContact CG-CD1 4.45Å; Q571-I575 WeakPolarHBondContact O-CG1 3.16Å; Q571-I575 PolarHBondContact O-N 2.95Å; Q571-I575 VanDerWaalsContact O-N 3.08Å; Q571-Y602 HydrophobicContact CB-CD2 4.41Å; Q571-Y602 HydrophobicContact CB-CE1 4.25Å; Q571-Y602 HydrophobicContact CB-CE2 4Å; Q571-Y602 HydrophobicContact CG-CD1 4.21Å; Q571-Y602 HydrophobicContact CG-CD2 4.27Å; Q571-Y602 HydrophobicContact CG-CE1 4.27Å; Q571-Y602 HydrophobicContact CG-CE2 4.33Å; Q571-Y602 HydrophobicContact CG-CG 4.2Å
572	Q	90.3	Very high	84	Confident	116 Å²	116	76.1 Å²	76.1	54%	0.542	38%	0.381	S	S	.	.	H	α-helix	trans	-64.9	-40.4	174.4	-71.8	175.8	6.4	0	0	112.5	I568 K569 H574 I575 K576	I568-Q572 HydrophobicContact CG2-CG 4.41Å; I568-Q572 WeakPolarHBondContact O-CB 3.23Å; I568-Q572 VanDerWaalsContact O-CG 3.31Å; I568-Q572 WeakPolarHBondContact O-CG 3.34Å; I568-Q572 PolarHBondContact O-N 3.45Å; K569-Q572 PolarHBondContact O-N 3.25Å; Q572-H574 VanDerWaalsContact C-N 3.29Å; Q572-H574 PolarHBondContact O-N 3.15Å; Q572-I575 PolarHBondContact O-N 3.02Å; Q572-K576 WeakPolarHBondContact O-CB 3.4Å; Q572-K576 PolarHBondContact O-N 3.16Å
573	R	87.5	Confident	81.9	Confident	118 Å²	118	78 Å²	78	45%	0.445	39%	0.392	S	S	.	.	H	α-helix	trans	-58.3	-41.5	172.9	-73.3	168.8	-167.8	131.8	7.1	110.9	E566 K569 H570 K576 K577	E566-R573 IonicContact OE1-CZ 2.71Å; E566-R573 IonicContact OE1-NH1 3.19Å; E566-R573 PolarHBondContact OE1-NH1 3.2Å; E566-R573 IonicContact OE1-NH2 2.66Å; E566-R573 PolarHBondContact OE1-NH2 2.71Å; K569-R573 WeakPolarHBondContact O-CB 3.42Å; K569-R573 VanDerWaalsContact O-CG 3.23Å; K569-R573 WeakPolarHBondContact O-CG 3.16Å; K569-R573 PolarHBondContact O-N 3.05Å; H570-R573 WeakPolarHBondContact O-CB 3.44Å; H570-R573 PolarHBondContact O-N 2.97Å; R573-K576 PolarHBondContact O-N 3.04Å; R573-K577 WeakPolarHBondContact O-CB 3.49Å; R573-K577 WeakPolarHBondContact O-CG 3.49Å; R573-K577 PolarHBondContact O-N 2.81Å
574	H	84.6	Confident	79.7	Confident	41 Å²	41	88.8 Å²	88.8	19%	0.19	44%	0.439	C	S	.	.	H	α-helix	trans	-62.5	-48.9	176.2	-172.6	-75.9	0	0	0	111.9	H570 Q571 Q572 K576 K577 H578 P600 Y602	H570-H574 PolarHBondContact O-N 2.82Å; Q571-H574 WeakPolarHBondContact O-CB 3.41Å; Q571-H574 PolarHBondContact O-N 2.94Å; Q572-H574 VanDerWaalsContact C-N 3.29Å; Q572-H574 PolarHBondContact O-N 3.15Å; H574-K576 VanDerWaalsContact C-N 3.35Å; H574-K576 PolarHBondContact O-N 3.44Å; H574-K577 PolarHBondContact O-N 2.87Å; H574-H578 AromaticContact CE1-CD2 3.6Å; H574-H578 AromaticContact CE1-NE2 3.73Å; H574-H578 AromaticContact ND1-CD2 3.72Å; H574-H578 AromaticContact NE2-NE2 4Å; H574-H578 PolarHBondContact O-CD2 3.29Å; H574-H578 VanDerWaalsContact O-CD2 3.29Å; H574-H578 PolarHBondContact O-N 2.61Å; H574-P600 PolarHBondContact CE1-O 2.88Å; H574-Y602 HydrophobicContact CB-CD2 3.77Å; H574-Y602 HydrophobicContact CB-CE2 4.26Å; H574-Y602 AromaticContact CD2-CD2 3.83Å; H574-Y602 AromaticContact CG-CD2 3.73Å
575	I	86.1	Confident	77.7	Confident	72 Å²	72	89.4 Å²	89.4	37%	0.369	46%	0.461	S	S	.	.	H	α-helix	trans	-58.8	-46.7	176.6	-64.7	164.8	0	0	0	110.5	Q571 Q572 K577 H578 F579	Q571-I575 HydrophobicContact CG-CD1 4.45Å; Q571-I575 WeakPolarHBondContact O-CG1 3.16Å; Q571-I575 PolarHBondContact O-N 2.95Å; Q571-I575 VanDerWaalsContact O-N 3.08Å; Q572-I575 PolarHBondContact O-N 3.02Å; I575-K577 PolarHBondContact O-N 2.96Å; I575-H578 PolarHBondContact O-N 3Å; I575-F579 PolarHBondContact O-N 2.69Å
576	K	86.5	Confident	75.3	Confident	140 Å²	140	93.6 Å²	93.6	61%	0.609	48%	0.478	S	S	*	.	H	α-helix	trans	-65.2	-33.6	179.4	-172.5	174	-179.7	179.9	0	113.5	Q572 R573 H574 H578 F579	Q572-K576 WeakPolarHBondContact O-CB 3.4Å; Q572-K576 PolarHBondContact O-N 3.16Å; R573-K576 PolarHBondContact O-N 3.04Å; H574-K576 VanDerWaalsContact C-N 3.35Å; H574-K576 PolarHBondContact O-N 3.44Å; K576-H578 VanDerWaalsContact C-N 3.28Å; K576-H578 PolarHBondContact O-N 3.22Å; K576-F579 CarbonylContact O-C 3.46Å; K576-F579 PolarHBondContact O-N 3.02Å
577	K	83.4	Confident	72.9	Confident	176 Å²	176	97.1 Å²	97.1	77%	0.765	50%	0.504	S	S	*	.	H	α-helix	trans	-62.9	-33.8	173.9	-81.5	-179.9	176.4	-173.9	0	112.4	R573 H574 I575	R573-K577 WeakPolarHBondContact O-CB 3.49Å; R573-K577 WeakPolarHBondContact O-CG 3.49Å; R573-K577 PolarHBondContact O-N 2.81Å; H574-K577 PolarHBondContact O-N 2.87Å; I575-K577 PolarHBondContact O-N 2.96Å
578	H	76.4	Confident	70.9	Confident	82 Å²	82	103.9 Å²	103.9	38%	0.38	54%	0.539	S	S	.	.	H	α-helix	trans	-90.7	-18.2	177	-66.5	-64.3	0	0	0	114	H574 I575 K576 I599	H574-H578 AromaticContact CE1-CD2 3.6Å; H574-H578 AromaticContact CE1-NE2 3.73Å; H574-H578 AromaticContact ND1-CD2 3.72Å; H574-H578 AromaticContact NE2-NE2 4Å; H574-H578 PolarHBondContact O-CD2 3.29Å; H574-H578 VanDerWaalsContact O-CD2 3.29Å; H574-H578 PolarHBondContact O-N 2.61Å; I575-H578 PolarHBondContact O-N 3Å; K576-H578 VanDerWaalsContact C-N 3.28Å; K576-H578 PolarHBondContact O-N 3.22Å; H578-I599 HydrophobicContact CB-CG2 4.15Å
579	F	71.6	Confident	68.8	Low	73 Å²	73	108.4 Å²	108.4	32%	0.32	56%	0.558	S	S	.	*			trans	-124.7	78.2	172.5	-69.6	-93.2	0	0	0	111.7	I575 K576 G581 F582 I599	I575-F579 PolarHBondContact O-N 2.69Å; K576-F579 CarbonylContact O-C 3.46Å; K576-F579 PolarHBondContact O-N 3.02Å; F579-G581 PolarHBondContact O-N 2.97Å; F579-F582 HydrophobicContact CB-CD2 4.22Å; F579-F582 PolarHBondContact O-N 2.82Å; F579-I599 HydrophobicContact CE2-CD1 3.65Å; F579-I599 HydrophobicContact CE2-CG1 3.71Å; F579-I599 HydrophobicContact CE2-CG2 4.22Å; F579-I599 HydrophobicContact CZ-CD1 4.14Å; F579-I599 HydrophobicContact CZ-CG1 4.07Å
580	P	62.5	Low	66.5	Low	116 Å²	116	107.2 Å²	107.2	75%	0.753	55%	0.554	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.4	-6.4	178.4	26.3	-34.8	0	0	0	114.6
581	G	57.8	Low	64.5	Low	62 Å²	62	109.4 Å²	109.4	64%	0.639	57%	0.571	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.6	-3.2	179.2	0	0	0	0	0	116.6	F579 N583	F579-G581 PolarHBondContact O-N 2.97Å; G581-N583 PolarHBondContact O-N 3.01Å
582	F	53.6	Low	62.4	Low	99 Å²	99	111.4 Å²	111.4	43%	0.434	60%	0.599	S	S	.	*			trans	-77.5	91.7	-178.2	-116.2	-84.1	0	0	0	111.6	F579	F579-F582 HydrophobicContact CB-CD2 4.22Å; F579-F582 PolarHBondContact O-N 2.82Å
583	N	49.9	Very low	60.2	Low	142 Å²	142	110.9 Å²	110.9	76%	0.759	61%	0.609	S	S	*	*			trans	-76.9	151.2	172.4	-77.7	-40	0	0	0	111.6	G581 G585	G581-N583 PolarHBondContact O-N 3.01Å; N583-G585 PolarHBondContact O-N 2.91Å
584	K	47.9	Very low	58.4	Low	227 Å²	227	112.5 Å²	112.5	99%	0.987	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.4	94.8	179.3	-73.6	-175.9	173.6	-175	0	110.7
585	G	51.1	Low	56.3	Low	70 Å²	70	114.4 Å²	114.4	72%	0.722	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-162.2	-51.6	175.3	0	0	0	0	0	112.9	N583	N583-G585 PolarHBondContact O-N 2.91Å
586	D	45.1	Very low	54.7	Low	127 Å²	127	115 Å²	115	68%	0.679	66%	0.656	S	S	*	*	S	Bend	trans	-75	135.5	-178.2	-72.3	-52.8	0	0	0	113.2
587	S	42.5	Very low	53.2	Low	87 Å²	87	115.8 Å²	115.8	61%	0.608	67%	0.667	S	S	*	*			trans	-74.8	130.8	-178.9	-156.4	0	0	0	0	111.4	E589	S587-E589 PolarHBondContact O-N 3.12Å
588	L	50	Low	52.4	Low	146 Å²	146	111.6 Å²	111.6	76%	0.764	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.6	51.7	-168.6	-164.7	93.5	0	0	0	113.9
589	E	48.9	Very low	52.1	Low	183 Å²	183	111 Å²	111	86%	0.855	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123.1	-0.9	176.2	-64.6	-166.3	130.3	0	0	113.7	S587	S587-E589 PolarHBondContact O-N 3.12Å
590	E	43.3	Very low	52.4	Low	57 Å²	57	110.4 Å²	110.4	27%	0.266	66%	0.663	S	S	.	*			trans	-147	61.8	-163.6	-159	-177.5	102.4	0	0	116.9	I175 K176	I175-E590 WeakPolarHBondContact CA-OE2 3.32Å; I175-E590 HydrophobicContact CG1-CG 4.44Å; K176-E590 VanDerWaalsContact CA-OE2 3.28Å; K176-E590 WeakPolarHBondContact CA-OE2 3.3Å; K176-E590 WeakPolarHBondContact CD-OE1 3.36Å; K176-E590 WeakPolarHBondContact CE-OE1 3.43Å; K176-E590 VanDerWaalsContact CG-OE1 3.28Å; K176-E590 WeakPolarHBondContact CG-OE1 3.22Å; K176-E590 WeakPolarHBondContact CG-OE2 3.39Å; K176-E590 PolarHBondContact N-OE2 3.27Å; K176-E590 IonicContact NZ-OE1 2.79Å; K176-E590 PolarHBondContact NZ-OE1 3.38Å
591	T	45.8	Very low	53.3	Low	94 Å²	94	109.2 Å²	109.2	58%	0.577	66%	0.655	S	S	*	*			trans	-131	17.7	163.5	49	0	0	0	0	113.2	S593 M594	T591-S593 PolarHBondContact O-N 2.86Å; T591-M594 PolarHBondContact O-N 2.84Å
592	A	45.7	Very low	54.6	Low	111 Å²	111	107.6 Å²	107.6	92%	0.917	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.4	-8.4	179.6	0	0	0	0	0	115.4
593	S	44.8	Very low	56.1	Low	106 Å²	106	110 Å²	110	74%	0.741	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.5	-4.3	-178.3	-167.5	0	0	0	0	114.8	T591	T591-S593 PolarHBondContact O-N 2.86Å
594	M	48.1	Very low	57.9	Low	151 Å²	151	103.6 Å²	103.6	74%	0.744	61%	0.612	S	S	*	*	S	Bend	trans	-111.4	88.2	-172.8	-74.4	-75.3	101.5	0	0	112.6	T591 A596	T591-M594 PolarHBondContact O-N 2.84Å; M594-A596 PolarHBondContact O-N 3.17Å
595	S	41.1	Very low	60	Low	82 Å²	82	93.2 Å²	93.2	57%	0.573	57%	0.568	S	S	*	*			trans	34.5	79.7	162.2	-178.8	0	0	0	0	116.6	N597 S598	S595-N597 PolarHBondContact O-N 3.49Å; S595-S598 PolarHBondContact O-N 3.02Å
596	A	51.9	Low	61.8	Low	83 Å²	83	96.6 Å²	96.6	69%	0.686	56%	0.563	S	S	*	*	G	3₁₀ helix	trans	-55.7	-13.2	174.5	0	0	0	0	0	114.9	M594 S598	M594-A596 PolarHBondContact O-N 3.17Å; A596-S598 PolarHBondContact O-N 3.31Å
597	N	55.8	Low	64.1	Low	157 Å²	157	92.8 Å²	92.8	84%	0.84	55%	0.546	S	S	*	.	G	3₁₀ helix	trans	-69.8	-8	-179.3	-58.5	-15.7	0	0	0	114.8	S595	S595-N597 PolarHBondContact O-N 3.49Å
598	S	66.6	Low	66.5	Low	89 Å²	89	88.6 Å²	88.6	62%	0.622	52%	0.517	S	S	*	.	G	3₁₀ helix	trans	-91.6	-11.1	-176.4	-168.8	0	0	0	0	114.6	S595 A596	S595-S598 PolarHBondContact O-N 3.02Å; A596-S598 PolarHBondContact O-N 3.31Å
599	I	70.2	Confident	68.4	Low	68 Å²	68	82.6 Å²	82.6	35%	0.349	49%	0.488	S	S	.	.	S	Bend	trans	-107.8	125.6	-175.9	-27.4	-174.6	0	0	0	108.5	H578 F579	H578-I599 HydrophobicContact CB-CG2 4.15Å; F579-I599 HydrophobicContact CE2-CD1 3.65Å; F579-I599 HydrophobicContact CE2-CG1 3.71Å; F579-I599 HydrophobicContact CE2-CG2 4.22Å; F579-I599 HydrophobicContact CZ-CD1 4.14Å; F579-I599 HydrophobicContact CZ-CG1 4.07Å
600	P	77.8	Confident	70.5	Confident	61 Å²	61	75.5 Å²	75.5	40%	0.396	46%	0.456	S	S	.	.			trans	-54.4	137.2	164	-26.6	37.5	0	0	0	109.7	H574 Y602	H574-P600 PolarHBondContact CE1-O 2.88Å; P600-Y602 PolarHBondContact O-N 2.95Å
601	P	81.1	Confident	72.8	Confident	92 Å²	92	73 Å²	73	60%	0.597	45%	0.445	S	S	*	.			trans	-65.6	134.5	179.4	27.5	-33.9	0	0	0	109.6	M603	P601-M603 HydrophobicContact CB-CE 3.81Å; P601-M603 HydrophobicContact CG-CE 3.8Å; P601-M603 WeakPolarHBondContact O-CG 3.2Å; P601-M603 PolarHBondContact O-N 3.16Å; P601-M603 VanDerWaalsContact O-N 3.1Å
602	Y	85.6	Confident	74.9	Confident	28 Å²	28	68.8 Å²	68.8	11%	0.11	42%	0.418	C	S	.	.			trans	-62.4	113.2	174.9	172.5	-102.5	0	0	0	110.2	H570 Q571 H574 P600 G604 P605 K606	H570-Y602 AromaticContact CE1-CE2 3.65Å; H570-Y602 AromaticContact ND1-CE2 3.36Å; H570-Y602 WeakPolarHBondContact ND1-CE2 3.46Å; H570-Y602 AromaticContact ND1-CZ 3.56Å; H570-Y602 PolarHBondContact ND1-OH 3.13Å; Q571-Y602 HydrophobicContact CB-CD2 4.41Å; Q571-Y602 HydrophobicContact CB-CE1 4.25Å; Q571-Y602 HydrophobicContact CB-CE2 4Å; Q571-Y602 HydrophobicContact CG-CD1 4.21Å; Q571-Y602 HydrophobicContact CG-CD2 4.27Å; Q571-Y602 HydrophobicContact CG-CE1 4.27Å; Q571-Y602 HydrophobicContact CG-CE2 4.33Å; Q571-Y602 HydrophobicContact CG-CG 4.2Å; H574-Y602 HydrophobicContact CB-CD2 3.77Å; H574-Y602 HydrophobicContact CB-CE2 4.26Å; H574-Y602 AromaticContact CD2-CD2 3.83Å; H574-Y602 AromaticContact CG-CD2 3.73Å; P600-Y602 PolarHBondContact O-N 2.95Å; Y602-G604 WeakPolarHBondContact CD1-O 3.03Å; Y602-G604 VanDerWaalsContact CE1-C 3.42Å; Y602-G604 WeakPolarHBondContact CE1-O 3.24Å; Y602-P605 WeakPolarHBondContact CE1-O 3.28Å; Y602-P605 PolarHBondContact OH-O 3.08Å; Y602-K606 HydrophobicContact CD1-CG 4.13Å; Y602-K606 HydrophobicContact CE1-CG 3.95Å
603	M	83.8	Confident	76.8	Confident	148 Å²	148	67.7 Å²	67.7	73%	0.729	39%	0.394	S	S	*	.			trans	-90.9	-3.9	-177.1	-61.6	-72.7	80.5	0	0	114.3	P601	P601-M603 HydrophobicContact CB-CE 3.81Å; P601-M603 HydrophobicContact CG-CE 3.8Å; P601-M603 WeakPolarHBondContact O-CG 3.2Å; P601-M603 PolarHBondContact O-N 3.16Å; P601-M603 VanDerWaalsContact O-N 3.1Å
604	G	87.7	Confident	78.5	Confident	9 Å²	9	67 Å²	67	9%	0.093	38%	0.381	C	S	.	.	S	Bend	trans	-78	167.1	176.6	0	0	0	0	0	113.1	Y602	Y602-G604 WeakPolarHBondContact CD1-O 3.03Å; Y602-G604 VanDerWaalsContact CE1-C 3.42Å; Y602-G604 WeakPolarHBondContact CE1-O 3.24Å
605	P	92	Very high	79.2	Confident	9 Å²	9	63.7 Å²	63.7	6%	0.058	37%	0.37	C	S	.	.			trans	-65	145.9	172.6	27	-33	0	0	0	110.9	W519 L567 Y602 D610 L611	W519-P605 HydrophobicContact CB-CG 4.1Å; W519-P605 VanDerWaalsContact CD2-CD 3.44Å; W519-P605 HydrophobicContact CD2-CG 3.99Å; W519-P605 HydrophobicContact CE3-CG 3.92Å; W519-P605 HydrophobicContact CG-CG 4.08Å; L567-P605 HydrophobicContact CD2-CG 4.09Å; Y602-P605 WeakPolarHBondContact CE1-O 3.28Å; Y602-P605 PolarHBondContact OH-O 3.08Å; P605-D610 WeakPolarHBondContact CA-OD2 3.37Å; P605-D610 HydrophobicContact CB-CB 4.36Å; P605-L611 HydrophobicContact CB-CB 4.02Å; P605-L611 HydrophobicContact CG-CB 4.29Å; P605-L611 HydrophobicContact CG-CD1 4.04Å
606	K	90	Very high	79.4	Confident	141 Å²	141	68.2 Å²	68.2	61%	0.613	38%	0.384	S	S	*	.	S	Bend	trans	-104.4	-7.6	-178.3	-63.1	174.6	-175.8	173.5	0	114.2	Y602 D610	Y602-K606 HydrophobicContact CD1-CG 4.13Å; Y602-K606 HydrophobicContact CE1-CG 3.95Å; K606-D610 PolarHBondContact N-OD2 2.84Å; K606-D610 VanDerWaalsContact N-OD2 3.08Å
607	S	92.8	Very high	79	Confident	46 Å²	46	73 Å²	73	32%	0.322	39%	0.385	S	S	.	.	S	Bend	trans	-160.8	159.4	-177.8	171.5	0	0	0	0	108.8	A609 D610 L611	S607-A609 PolarHBondContact O-N 3.49Å; S607-A609 PolarHBondContact OG-N 3.48Å; S607-D610 WeakPolarHBondContact O-CA 3.34Å; S607-D610 WeakPolarHBondContact O-CB 3.32Å; S607-D610 PolarHBondContact O-N 3.07Å; S607-L611 PolarHBondContact O-N 3.08Å
608	M	92.6	Very high	78.1	Confident	0 Å²	0	70.5 Å²	70.5	0%	0	38%	0.38	C	S	.	.	H	α-helix	trans	-59.9	-33.8	172.6	-60.1	-57.7	-75.3	0	0	112	L512 A516 Y552 L560 A563 L567 D610 L611 F612	L512-M608 HydrophobicContact CD1-CE 3.35Å; L512-M608 HydrophobicContact CD2-CE 4.1Å; L512-M608 HydrophobicContact CG-CE 3.7Å; A516-M608 HydrophobicContact CB-SD 4.37Å; Y552-M608 HydrophobicContact CD2-CB 4.03Å; Y552-M608 HydrophobicContact CD2-CE 4.1Å; Y552-M608 HydrophobicContact CE2-CB 3.36Å; Y552-M608 HydrophobicContact CE2-CG 4.04Å; L560-M608 HydrophobicContact CD1-CG 4.01Å; A563-M608 HydrophobicContact CB-CE 4.11Å; A563-M608 HydrophobicContact CB-SD 4.01Å; L567-M608 HydrophobicContact CD1-CG 4.31Å; L567-M608 HydrophobicContact CD1-SD 3.65Å; L567-M608 HydrophobicContact CG-SD 4.33Å; M608-D610 PolarHBondContact O-N 2.83Å; M608-L611 HydrophobicContact CE-CD2 3.83Å; M608-L611 WeakPolarHBondContact O-CB 3.31Å; M608-L611 PolarHBondContact O-N 2.96Å; M608-L611 HydrophobicContact SD-CD2 3.92Å; M608-F612 HydrophobicContact CE-CE2 4.21Å; M608-F612 WeakPolarHBondContact O-CD2 3.12Å; M608-F612 PolarHBondContact O-N 2.92Å
609	A	91.4	Very high	76.5	Confident	20 Å²	20	72.7 Å²	72.7	17%	0.165	39%	0.389	C	S	.	.	H	α-helix	trans	-67.7	-22	174	0	0	0	0	0	113.4	S607 Q613 L614 T615	S607-A609 PolarHBondContact O-N 3.49Å; S607-A609 PolarHBondContact OG-N 3.48Å; A609-Q613 CarbonylContact O-C 2.86Å; A609-Q613 VanDerWaalsContact O-CA 3.24Å; A609-Q613 WeakPolarHBondContact O-CA 3.41Å; A609-Q613 PolarHBondContact O-N 2.96Å; A609-Q613 VanDerWaalsContact O-N 3.12Å; A609-L614 PolarHBondContact O-N 3.47Å; A609-T615 WeakPolarHBondContact CB-OG1 3.4Å; A609-T615 PolarHBondContact O-N 3.12Å
610	D	91.4	Very high	74.9	Confident	33 Å²	33	77.3 Å²	77.3	18%	0.176	41%	0.407	C	S	.	.	H	α-helix	trans	-87.6	-36.1	175.1	-163.1	39.1	0	0	0	110.9	P605 K606 S607 M608 Q613 R617	P605-D610 WeakPolarHBondContact CA-OD2 3.37Å; P605-D610 HydrophobicContact CB-CB 4.36Å; K606-D610 PolarHBondContact N-OD2 2.84Å; K606-D610 VanDerWaalsContact N-OD2 3.08Å; S607-D610 WeakPolarHBondContact O-CA 3.34Å; S607-D610 WeakPolarHBondContact O-CB 3.32Å; S607-D610 PolarHBondContact O-N 3.07Å; M608-D610 PolarHBondContact O-N 2.83Å; D610-Q613 WeakPolarHBondContact O-CG 3.37Å; D610-Q613 PolarHBondContact O-N 2.81Å; D610-R617 IonicContact OD1-CZ 2.94Å; D610-R617 IonicContact OD1-NE 2.69Å; D610-R617 IonicContact OD1-NH2 3.86Å; D610-R617 PolarHBondContact OD1-NH2 2.83Å; D610-R617 IonicContact OD2-NH2 3.69Å
611	L	91.6	Very high	72.8	Confident	6 Å²	6	79.9 Å²	79.9	3%	0.031	43%	0.427	C	S	.	.	H	α-helix	trans	-58.3	-49.6	171	175.8	65.8	0	0	0	112	W519 V522 P605 S607 M608 Q613	W519-L611 HydrophobicContact CB-CD1 3.82Å; V522-L611 HydrophobicContact CB-CD1 3.85Å; V522-L611 HydrophobicContact CG1-CD1 4.02Å; V522-L611 HydrophobicContact CG1-CG 4.29Å; V522-L611 HydrophobicContact CG2-CD1 4.08Å; P605-L611 HydrophobicContact CB-CB 4.02Å; P605-L611 HydrophobicContact CG-CB 4.29Å; P605-L611 HydrophobicContact CG-CD1 4.04Å; S607-L611 PolarHBondContact O-N 3.08Å; M608-L611 HydrophobicContact CE-CD2 3.83Å; M608-L611 WeakPolarHBondContact O-CB 3.31Å; M608-L611 PolarHBondContact O-N 2.96Å; M608-L611 HydrophobicContact SD-CD2 3.92Å; L611-Q613 VanDerWaalsContact C-N 3.33Å
612	F	91.3	Very high	70.6	Confident	4 Å²	4	82 Å²	82	2%	0.018	43%	0.429	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-9.1	176	-73.3	-79.8	0	0	0	113.5	M515 R526 F545 F548 L549 Y552 M608 L614	M515-F612 HydrophobicContact CE-CE2 4.28Å; M515-F612 HydrophobicContact CE-CZ 3.68Å; M515-F612 HydrophobicContact SD-CZ 3.97Å; R526-F612 PolarHBondContact NH1-O 3.2Å; F545-F612 HydrophobicContact CE1-CD1 4.44Å; F545-F612 AromaticContact CE2-CD1 3.95Å; F545-F612 HydrophobicContact CE2-CD1 3.95Å; F545-F612 HydrophobicContact CE2-CE1 4.36Å; F545-F612 AromaticContact CZ-CD1 3.69Å; F545-F612 HydrophobicContact CZ-CD1 3.69Å; F545-F612 HydrophobicContact CZ-CE1 4.4Å; F548-F612 HydrophobicContact CB-CE1 3.94Å; F548-F612 HydrophobicContact CB-CZ 4.2Å; F548-F612 VanDerWaalsContact O-CZ 3.26Å; F548-F612 WeakPolarHBondContact O-CZ 3.43Å; L549-F612 HydrophobicContact CB-CD1 4.44Å; L549-F612 HydrophobicContact CB-CE1 4.36Å; L549-F612 HydrophobicContact CD1-CD1 4.01Å; L549-F612 HydrophobicContact CD1-CG 4.3Å; Y552-F612 HydrophobicContact CD1-CD2 4.18Å; Y552-F612 HydrophobicContact CD1-CE2 4.44Å; Y552-F612 HydrophobicContact CD2-CD2 4.45Å; Y552-F612 HydrophobicContact CD2-CE2 4.25Å; Y552-F612 HydrophobicContact CG-CD2 4Å; Y552-F612 AromaticContact CG-CE2 3.84Å; Y552-F612 HydrophobicContact CG-CE2 3.84Å; M608-F612 HydrophobicContact CE-CE2 4.21Å; M608-F612 WeakPolarHBondContact O-CD2 3.12Å; M608-F612 PolarHBondContact O-N 2.92Å; F612-L614 VanDerWaalsContact C-N 3.29Å; F612-L614 HydrophobicContact CB-CD1 3.9Å; F612-L614 HydrophobicContact CB-CD2 4.44Å; F612-L614 HydrophobicContact CB-CG 3.73Å; F612-L614 PolarHBondContact O-N 3.02Å
613	Q	85.5	Confident	68.3	Low	88 Å²	88	86.8 Å²	86.8	41%	0.411	46%	0.46	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.1	44.9	-173.6	-53.9	176.7	10.8	0	0	112.5	R526 A609 D610 L611	R526-Q613 VanDerWaalsContact CZ-CD 3.41Å; R526-Q613 VanDerWaalsContact NE-CD 3.32Å; R526-Q613 VanDerWaalsContact NE-NE2 3.18Å; A609-Q613 CarbonylContact O-C 2.86Å; A609-Q613 VanDerWaalsContact O-CA 3.24Å; A609-Q613 WeakPolarHBondContact O-CA 3.41Å; A609-Q613 PolarHBondContact O-N 2.96Å; A609-Q613 VanDerWaalsContact O-N 3.12Å; D610-Q613 WeakPolarHBondContact O-CG 3.37Å; D610-Q613 PolarHBondContact O-N 2.81Å; L611-Q613 VanDerWaalsContact C-N 3.33Å
614	L	79.1	Confident	66.1	Low	91 Å²	91	85.2 Å²	85.2	48%	0.476	46%	0.461	S	S	.	.			trans	-79.5	-23.1	174.4	-62.1	171.7	0	0	0	112	L549 Y552 A609 F612 M616	L549-L614 HydrophobicContact CD1-CD1 4.15Å; L549-L614 HydrophobicContact CD1-CD2 4.08Å; Y552-L614 HydrophobicContact CD1-CD1 3.95Å; Y552-L614 HydrophobicContact CE1-CD1 3.5Å; A609-L614 PolarHBondContact O-N 3.47Å; F612-L614 VanDerWaalsContact C-N 3.29Å; F612-L614 HydrophobicContact CB-CD1 3.9Å; F612-L614 HydrophobicContact CB-CD2 4.44Å; F612-L614 HydrophobicContact CB-CG 3.73Å; F612-L614 PolarHBondContact O-N 3.02Å; L614-M616 PolarHBondContact O-N 3.31Å
615	T	63.2	Low	63.7	Low	83 Å²	83	92 Å²	92	51%	0.509	50%	0.496	S	S	.	.	S	Bend	trans	-69.4	116.9	173.2	-54.4	0	0	0	0	110.3	A609 R617	A609-T615 WeakPolarHBondContact CB-OG1 3.4Å; A609-T615 PolarHBondContact O-N 3.12Å; T615-R617 PolarHBondContact O-N 3.06Å
616	M	46.5	Very low	61.3	Low	177 Å²	177	96.9 Å²	96.9	87%	0.872	53%	0.525	S	S	*	.			trans	-56.2	94.1	170.1	-74	-71.2	-154.9	0	0	111.1	L614 S618	L614-M616 PolarHBondContact O-N 3.31Å; M616-S618 VanDerWaalsContact C-N 3.32Å; M616-S618 PolarHBondContact O-N 2.66Å
617	R	43	Very low	58.9	Low	182 Å²	182	99.2 Å²	99.2	69%	0.687	54%	0.535	S	S	*	.			trans	-71.1	88.6	173.4	-72.7	-170.1	179.4	-168	2.6	109.4	D610 T615 T619	D610-R617 IonicContact OD1-CZ 2.94Å; D610-R617 IonicContact OD1-NE 2.69Å; D610-R617 IonicContact OD1-NH2 3.86Å; D610-R617 PolarHBondContact OD1-NH2 2.83Å; D610-R617 IonicContact OD2-NH2 3.69Å; T615-R617 PolarHBondContact O-N 3.06Å; R617-T619 PolarHBondContact O-N 2.73Å
618	S	36.3	Very low	56.3	Low	106 Å²	106	107.3 Å²	107.3	74%	0.741	56%	0.564	S	S	*	*			trans	-47.7	136.2	161.3	-68.1	0	0	0	0	109.2	M616 K620	M616-S618 VanDerWaalsContact C-N 3.32Å; M616-S618 PolarHBondContact O-N 2.66Å; S618-K620 PolarHBondContact O-N 2.82Å
619	T	32.7	Very low	53.6	Low	134 Å²	134	113.3 Å²	113.3	82%	0.822	60%	0.601	S	S	*	*			trans	-65	87	-166.5	49.2	0	0	0	0	112.5	R617 S621	R617-T619 PolarHBondContact O-N 2.73Å; T619-S621 VanDerWaalsContact C-N 3.28Å; T619-S621 PolarHBondContact O-N 2.75Å
620	K	38.2	Very low	50.8	Low	165 Å²	165	117.1 Å²	117.1	72%	0.717	63%	0.625	S	S	*	*			trans	-85	67.2	-176.7	-166.8	156.9	-178.2	152.6	0	112.3	S618 E622	S618-K620 PolarHBondContact O-N 2.82Å; K620-E622 WeakPolarHBondContact CE-OE2 3.38Å; K620-E622 HydrophobicContact CG-CB 3.95Å; K620-E622 IonicContact NZ-OE2 2.7Å; K620-E622 PolarHBondContact NZ-OE2 3.32Å; K620-E622 PolarHBondContact O-N 2.62Å; K620-E622 VanDerWaalsContact O-N 3.09Å
621	S	32.5	Very low	48.1	Very low	116 Å²	116	122.4 Å²	122.4	81%	0.811	65%	0.649	S	S	*	*			trans	-78	73.1	160.4	58.6	0	0	0	0	109.5	T619	T619-S621 VanDerWaalsContact C-N 3.28Å; T619-S621 PolarHBondContact O-N 2.75Å
622	E	35.2	Very low	45.3	Very low	137 Å²	137	130.3 Å²	130.3	64%	0.64	69%	0.686	S	S	*	*			trans	-119.5	88.6	177.3	-166.6	170.4	-120.1	0	0	108.8	K620 P624	K620-E622 WeakPolarHBondContact CE-OE2 3.38Å; K620-E622 HydrophobicContact CG-CB 3.95Å; K620-E622 IonicContact NZ-OE2 2.7Å; K620-E622 PolarHBondContact NZ-OE2 3.32Å; K620-E622 PolarHBondContact O-N 2.62Å; K620-E622 VanDerWaalsContact O-N 3.09Å; E622-P624 WeakPolarHBondContact O-CD 3.06Å
623	V	37.9	Very low	42.6	Very low	128 Å²	128	135 Å²	135	78%	0.776	72%	0.724	S	S	*	*			trans	-78.2	120.9	170.9	176.9	0	0	0	0	107.7	D625	V623-D625 VanDerWaalsContact C-N 3.34Å; V623-D625 PolarHBondContact O-N 2.95Å
624	P	38.1	Very low	40.2	Very low	114 Å²	114	134 Å²	134	74%	0.74	74%	0.739	S	S	*	*			trans	-78.3	84.9	176.3	31.9	-33.3	0	0	0	109.2	E622	E622-P624 WeakPolarHBondContact O-CD 3.06Å
625	D	35.8	Very low	38.3	Very low	153 Å²	153	139.2 Å²	139.2	82%	0.818	76%	0.757	S	S	*	*			trans	-77.3	127	178.4	-160.2	-0	0	0	0	111.3	V623	V623-D625 VanDerWaalsContact C-N 3.34Å; V623-D625 PolarHBondContact O-N 2.95Å
626	V	41.6	Very low	37.2	Very low	111 Å²	111	140.3 Å²	140.3	67%	0.673	77%	0.769	S	S	*	*			trans	-117.1	91.2	-170	179.9	0	0	0	0	109.5
627	K	40.7	Very low	36.7	Very low	189 Å²	189	139.1 Å²	139.1	82%	0.822	77%	0.765	S	S	*	*			trans	178	121.4	143.4	-90.3	138	-159.5	166.4	0	112.6
628	K	37.7	Very low	36.4	Very low	216 Å²	216	135.3 Å²	135.3	94%	0.939	77%	0.767	S	S	*	*			trans	-159.8	96.8	130.4	-112.6	173.9	-177.1	-179.8	0	109.4
629	T	35.3	Very low	36.4	Very low	127 Å²	127	138.6 Å²	138.6	78%	0.779	77%	0.771	S	S	*	*			trans	-98.4	165.6	170.6	42.2	0	0	0	0	110.6
630	C	33	Very low	36.5	Very low	99 Å²	99	138.8 Å²	138.8	67%	0.669	77%	0.765	S	S	*	*			trans	98.9	112.8	155.2	-72.1	0	0	0	0	119.8
631	H	35	Very low	36.4	Very low	145 Å²	145	137.3 Å²	137.3	67%	0.671	76%	0.764	S	S	*	*			trans	72.4	115.8	148.8	-53.2	-51.3	0	0	0	118.4
632	E	31.7	Very low	36.5	Very low	172 Å²	172	139.8 Å²	139.8	80%	0.804	76%	0.763	S	S	*	*				62.9	140	70.1	-64.4	175	104.2	0	0	112.6
633	A	34.7	Very low	36.4	Very low	101 Å²	101	138.4 Å²	138.4	84%	0.835	77%	0.768	S	S	*	*			cis	-159.4	161.1	34.8	0	0	0	0	0	115.5
634	G	36	Very low	36.9	Very low	69 Å²	69	137.3 Å²	137.3	71%	0.711	76%	0.764	S	S	*	*			trans	106.3	150	150.5	0	0	0	0	0	117.1
635	K	40.2	Very low	36.9	Very low	200 Å²	200	137 Å²	137	87%	0.87	77%	0.765	S	S	*	*			cis	-167.7	156.1	-14.7	-128.4	167.1	-173.1	177.3	0	109.5
636	S	39.5	Very low	37.1	Very low	106 Å²	106	134.6 Å²	134.6	74%	0.741	76%	0.76	S	S	*	*			trans	58.3	123.3	175.2	32.5	0	0	0	0	116.7
637	N	35.1	Very low	37.2	Very low	151 Å²	151	134.9 Å²	134.9	81%	0.807	76%	0.762	S	S	*	*			cis	88	146.4	36.2	-68.3	-1.3	0	0	0	114.9
638	S	38	Very low	37.1	Very low	103 Å²	103	132.3 Å²	132.3	72%	0.72	76%	0.757	S	S	*	*			trans	56.6	103.5	176.9	45.1	0	0	0	0	115.2
639	E	35.4	Very low	37.2	Very low	175 Å²	175	128.4 Å²	128.4	82%	0.818	75%	0.745	S	S	*	*				77.7	154.9	65.6	-74	-172.9	111.2	0	0	114.7
640	I	35.1	Very low	37.4	Very low	137 Å²	137	128.1 Å²	128.1	70%	0.703	74%	0.743	S	S	*	*			trans	81.4	97.8	150.8	-79	160.7	0	0	0	117.6
641	L	36	Very low	37.9	Very low	134 Å²	134	128.1 Å²	128.1	70%	0.702	74%	0.742	S	S	*	*			trans	98.8	134.8	135.1	-66	173.6	0	0	0	123.1
642	Q	35.6	Very low	37.8	Very low	168 Å²	168	128.2 Å²	128.2	79%	0.785	75%	0.747	S	S	*	*			trans	72.2	100.8	138.3	-74.8	157.8	-23.9	0	0	121.4
643	S	32.8	Very low	38	Very low	108 Å²	108	125.8 Å²	125.8	76%	0.755	74%	0.744	S	S	*	*			trans	-66.4	-179.7	139.3	59.5	0	0	0	0	110.9
644	P	47.3	Very low	38.2	Very low	106 Å²	106	125.2 Å²	125.2	69%	0.688	73%	0.734	S	S	*	*			cis	-146.1	-163.1	18.2	45.1	-24.6	0	0	0	116.8
645	S	38.2	Very low	38.3	Very low	107 Å²	107	130.9 Å²	130.9	75%	0.748	74%	0.742	S	S	*	*			trans	76.4	151.4	159.5	81.8	0	0	0	0	116.6
646	S	40.2	Very low	38.1	Very low	103 Å²	103	124.8 Å²	124.8	72%	0.72	73%	0.729	S	S	*	*			cis	-158.8	174.8	-8.6	-123.9	0	0	0	0	112.7
647	V	43.8	Very low	38.1	Very low	117 Å²	117	127.1 Å²	127.1	71%	0.709	73%	0.733	S	S	*	*			trans	-22.8	157.1	160.3	-69.1	0	0	0	0	118.1
648	D	38.1	Very low	38.4	Very low	134 Å²	134	126.4 Å²	126.4	72%	0.717	72%	0.724	S	S	*	*			cis	-164.4	-176.8	18.4	-136.1	-34.5	0	0	0	115.2
649	I	39.8	Very low	38.5	Very low	135 Å²	135	128.5 Å²	128.5	69%	0.692	72%	0.716	S	S	*	*			trans	70.8	97.9	149.1	-67.8	157.4	0	0	0	120
650	T	39.5	Very low	38.6	Very low	120 Å²	120	128 Å²	128	74%	0.736	71%	0.712	S	S	*	*				-0.6	171.1	125.8	54.5	0	0	0	0	121.8
651	P	43.4	Very low	38.8	Very low	99 Å²	99	128.1 Å²	128.1	64%	0.643	71%	0.71	S	S	*	*			cis	-139.4	-163.2	-41.9	40.9	-23.1	0	0	0	113.3
652	N	33	Very low	38.9	Very low	148 Å²	148	128.8 Å²	128.8	79%	0.791	71%	0.713	S	S	*	*			trans	82.4	148.8	152.3	-82.4	2	0	0	0	122
653	T	37.6	Very low	38.8	Very low	120 Å²	120	125.9 Å²	125.9	74%	0.736	71%	0.711	S	S	*	*			trans	81.4	102.1	149.9	-57.2	0	0	0	0	120.4
654	S	38.3	Very low	38.9	Very low	89 Å²	89	126.4 Å²	126.4	62%	0.622	71%	0.71	S	S	*	*			trans	68	129	135.8	-62.6	0	0	0	0	123.6
655	Q	37.5	Very low	38.5	Very low	188 Å²	188	127.6 Å²	127.6	88%	0.879	72%	0.715	S	S	*	*			trans	67	159.6	134.7	-66.7	172.7	6.1	0	0	118.5
656	A	36.2	Very low	38.4	Very low	73 Å²	73	129 Å²	129	60%	0.603	71%	0.714	S	S	*	*			cis	-171.2	-177.6	-28.4	0	0	0	0	0	107.9
657	L	40.4	Very low	38.3	Very low	155 Å²	155	131.9 Å²	131.9	81%	0.812	72%	0.718	S	S	*	*			trans	70	151.3	165.5	-51.1	164.6	0	0	0	114.6
658	E	39.9	Very low	37.9	Very low	135 Å²	135	133.3 Å²	133.3	63%	0.631	72%	0.722	S	S	*	*			cis	-162.2	171.4	-11	-123.3	-166.7	-142.8	0	0	108
659	R	40.9	Very low	37.9	Very low	147 Å²	147	132.2 Å²	132.2	56%	0.555	72%	0.72	S	S	*	*			cis	-158.5	-167.1	-3.7	-153.6	-163	-175	87.5	4.2	108.2
660	F	37.9	Very low	37.6	Very low	165 Å²	165	133.1 Å²	133.1	72%	0.724	73%	0.725	S	S	*	*			trans	68.7	101.8	168.2	-58	-70.6	0	0	0	115.7
661	E	37.9	Very low	37.5	Very low	140 Å²	140	133.1 Å²	133.1	65%	0.654	73%	0.726	S	S	*	*				75.4	136.9	63.9	-64.9	173.7	-167.5	0	0	112.8
662	L	38.2	Very low	36.9	Very low	147 Å²	147	134.1 Å²	134.1	77%	0.77	73%	0.734	S	S	*	*			cis	-134.4	150.3	24.8	-69.2	158.5	0	0	0	113.9
663	S	33.5	Very low	37.1	Very low	107 Å²	107	134.1 Å²	134.1	75%	0.748	74%	0.739	S	S	*	*			trans	41.9	135.8	143.5	71.7	0	0	0	0	121
664	T	36.5	Very low	37	Very low	119 Å²	119	132.4 Å²	132.4	73%	0.73	74%	0.737	S	S	*	*			cis	-161.9	140	31	-46.3	0	0	0	0	110.8
665	V	38.6	Very low	36.9	Very low	131 Å²	131	134 Å²	134	79%	0.794	74%	0.742	S	S	*	*			trans	35.8	120.5	165.5	-54.4	0	0	0	0	119.3
666	N	36.4	Very low	36.9	Very low	136 Å²	136	134.4 Å²	134.4	73%	0.727	74%	0.741	S	S	*	*				52.9	140.6	54.5	-73.8	10.1	0	0	0	114.9
667	M	36.5	Very low	36.7	Very low	165 Å²	165	136 Å²	136	81%	0.813	75%	0.748	S	S	*	*			cis	-125.5	158.8	12.5	-73.1	-71	-161	0	0	113.6
668	D	36.2	Very low	36.8	Very low	147 Å²	147	133.7 Å²	133.7	79%	0.786	74%	0.742	S	S	*	*			trans	-70.1	-176.2	158.1	-60	-78.5	0	0	0	111.2
669	T	38.9	Very low	36.7	Very low	110 Å²	110	132.8 Å²	132.8	68%	0.675	75%	0.746	S	S	*	*				179.9	109.8	87.2	-69.2	0	0	0	0	111.7
670	L	33.3	Very low	36.5	Very low	154 Å²	154	134.5 Å²	134.5	81%	0.806	76%	0.761	S	S	*	*			trans	55.2	-176.9	147.4	-46.8	174.8	0	0	0	117.5
671	T	37.2	Very low	36.3	Very low	121 Å²	121	134.2 Å²	134.2	74%	0.742	76%	0.761	S	S	*	*			cis	-139.1	154.9	-18.2	-22.3	0	0	0	0	109.4
672	C	31.3	Very low	36.2	Very low	120 Å²	120	133.6 Å²	133.6	81%	0.811	77%	0.766	S	S	*	*			trans	-93.3	134.3	153.1	-70.9	0	0	0	0	109.5
673	V	36.2	Very low	36.1	Very low	147 Å²	147	132.1 Å²	132.1	89%	0.891	76%	0.764	S	S	*	*			trans	-179.8	160.1	140.2	143	0	0	0	0	108.6
674	A	34.6	Very low	36.4	Very low	85 Å²	85	132.3 Å²	132.3	70%	0.702	76%	0.76	S	S	*	*			trans	-98.9	-167	-175.1	0	0	0	0	0	112.9
675	V	36.2	Very low	36.5	Very low	121 Å²	121	132.2 Å²	132.2	73%	0.733	76%	0.76	S	S	*	*			trans	100.6	92.7	159	-167.9	0	0	0	0	117.2
676	K	38	Very low	36.4	Very low	197 Å²	197	132.7 Å²	132.7	86%	0.857	76%	0.762	S	S	*	*			trans	74.5	148.5	141.8	-63.1	174.1	-176	178.6	0	121.2
677	S	32.9	Very low	36.3	Very low	106 Å²	106	130.8 Å²	130.8	74%	0.741	76%	0.759	S	S	*	*			trans	-82.2	-173.3	165	56.8	0	0	0	0	110.7
678	P	42.4	Very low	36.3	Very low	107 Å²	107	130.9 Å²	130.9	70%	0.695	76%	0.757	S	S	*	*			cis	-144.3	170.3	12	42.5	-22.2	0	0	0	119.6
679	T	37.6	Very low	36.4	Very low	117 Å²	117	128.1 Å²	128.1	72%	0.718	75%	0.75	S	S	*	*			trans	30.7	130.2	139.5	-46.3	0	0	0	0	122.5
680	Q	36.2	Very low	36.2	Very low	183 Å²	183	131.4 Å²	131.4	86%	0.855	76%	0.757	S	S	*	*			trans	155.8	152	137.8	-89.5	173.6	23.4	0	0	110.1
681	H	34	Very low	36.4	Very low	158 Å²	158	128.2 Å²	128.2	73%	0.731	75%	0.748	S	S	*	*			cis	-173.4	175.4	-28	-137	-91.4	0	0	0	108.3
682	V	36.4	Very low	36.4	Very low	127 Å²	127	130.5 Å²	130.5	77%	0.77	75%	0.75	S	S	*	*			trans	71.3	141.1	155.7	156.9	0	0	0	0	116.3
683	V	36.2	Very low	36.4	Very low	117 Å²	117	129.1 Å²	129.1	71%	0.709	74%	0.741	S	S	*	*			cis	-165.6	156.3	-14.9	105.8	0	0	0	0	107.1
684	T	38.1	Very low	36.2	Very low	110 Å²	110	127 Å²	127	68%	0.675	73%	0.733	S	S	*	*				179.3	149.7	78.6	-31.6	0	0	0	0	110
685	T	38.6	Very low	36.2	Very low	118 Å²	118	129.9 Å²	129.9	72%	0.724	74%	0.736	S	S	*	*			trans	47.5	126.2	153.1	47.3	0	0	0	0	119.3
686	V	38.2	Very low	36.2	Very low	140 Å²	140	132.1 Å²	132.1	85%	0.848	74%	0.738	S	S	*	*			cis	-151.3	147.4	34	173	0	0	0	0	109.7
687	C	34.4	Very low	36	Very low	97 Å²	97	127.3 Å²	127.3	66%	0.655	73%	0.729	S	S	*	*			cis	-160.3	-90	-28	-167.9	0	0	0	0	111.8
688	E	34.6	Very low	36.5	Very low	167 Å²	167	128.1 Å²	128.1	78%	0.78	73%	0.732	S	S	*	*			trans	-74.1	153.7	-172.1	-79.2	116.4	-116	0	0	116.3
689	S	38.4	Very low	36.1	Very low	89 Å²	89	131.5 Å²	131.5	62%	0.622	74%	0.743	S	S	*	*			cis	-165.4	136.6	-8.3	48.6	0	0	0	0	113.3
690	E	35.4	Very low	36	Very low	178 Å²	178	131.9 Å²	131.9	83%	0.832	74%	0.735	S	S	*	*			trans	67.5	151.2	139.5	-69.5	174.5	-168.3	0	0	120.1
691	S	37.7	Very low	36.1	Very low	88 Å²	88	129.4 Å²	129.4	62%	0.615	73%	0.732	S	S	*	*			cis	-160.6	144.3	0.1	32	0	0	0	0	114
692	H	37.1	Very low	36.2	Very low	169 Å²	169	124.5 Å²	124.5	78%	0.782	72%	0.724	S	S	*	*			trans	54.8	158.4	142	-53.6	-41.1	0	0	0	123.7
693	S	32	Very low	36.2	Very low	90 Å²	90	128.5 Å²	128.5	63%	0.629	73%	0.727	S	S	*	*				-178.8	145.2	-59.5	46.6	0	0	0	0	113.9
694	S	31.8	Very low	36.2	Very low	104 Å²	104	130.5 Å²	130.5	73%	0.727	73%	0.729	S	S	*	*			trans	69.2	167	148	70.9	0	0	0	0	119.3
695	L	34.1	Very low	35.9	Very low	145 Å²	145	129.8 Å²	129.8	76%	0.759	72%	0.724	S	S	*	*			cis	-145.6	156.7	14.3	-75.8	167.1	0	0	0	113.4
696	H	36.6	Very low	35.6	Very low	168 Å²	168	131.1 Å²	131.1	78%	0.778	73%	0.727	S	S	*	*			trans	30.1	162.8	138.5	-76	-105.2	0	0	0	125
697	S	34.1	Very low	35.5	Very low	96 Å²	96	131.7 Å²	131.7	67%	0.671	73%	0.73	S	S	*	*			cis	-177.3	159.2	-32.7	58.6	0	0	0	0	110.8
698	P	41.7	Very low	35.5	Very low	122 Å²	122	132 Å²	132	79%	0.792	73%	0.734	S	S	*	*			trans	-111.3	176.8	-164.2	42.2	-36.6	0	0	0	117.2
699	L	34.9	Very low	35.7	Very low	179 Å²	179	129.3 Å²	129.3	94%	0.937	73%	0.729	S	S	*	*			trans	-143.3	-179.4	163.5	-102.6	176.8	0	0	0	114.3
700	K	36	Very low	35.7	Very low	124 Å²	124	133 Å²	133	54%	0.539	74%	0.736	S	S	.	*			trans	-152.1	168.6	-147.2	-172.9	-176.3	179.5	-168.8	0	114.1	I126	I126-K700 HydrophobicContact CG2-CD 4Å
701	V	37.7	Very low	36	Very low	132 Å²	132	130.8 Å²	130.8	80%	0.8	73%	0.73	S	S	*	*			trans	122.9	141.4	164.9	170.9	0	0	0	0	112.3
702	G	36.7	Very low	36.1	Very low	55 Å²	55	133.9 Å²	133.9	57%	0.567	74%	0.738	S	S	*	*			cis	156.1	146.4	-13.5	0	0	0	0	0	115.3
703	Y	37	Very low	36.5	Very low	211 Å²	211	132 Å²	132	83%	0.827	74%	0.741	S	S	*	*			trans	71	157.3	167	-46	-79.4	0	0	0	117.4
704	Q	35.3	Very low	37.1	Very low	159 Å²	159	135.4 Å²	135.4	74%	0.743	75%	0.751	S	S	*	*			cis	-158.8	151.3	-13.7	-130.5	-177.2	-65.5	0	0	114.4
705	T	32.5	Very low	38.2	Very low	94 Å²	94	135.5 Å²	135.5	58%	0.577	75%	0.749	S	S	*	*			trans	30.9	125.1	147.6	46.8	0	0	0	0	125.6
706	D	31.9	Very low	38.6	Very low	147 Å²	147	137.2 Å²	137.2	79%	0.786	75%	0.753	S	S	*	*				78.2	153.3	125.9	-58.3	-26.2	0	0	0	125.4
707	V	36	Very low	38.8	Very low	151 Å²	151	136.9 Å²	136.9	92%	0.915	75%	0.752	S	S	*	*			trans	95.7	145.7	164.2	-166.1	0	0	0	0	118
708	S	33.9	Very low	39	Very low	105 Å²	105	138.2 Å²	138.2	73%	0.734	76%	0.756	S	S	*	*			trans	-102.5	177.4	-161.3	-178.4	0	0	0	0	114.1
709	V	40	Very low	38.9	Very low	110 Å²	110	136.8 Å²	136.8	67%	0.667	75%	0.747	S	S	*	*			trans	120.2	102	149.6	-180	0	0	0	0	118.5
710	Q	38.2	Very low	39	Very low	166 Å²	166	133.7 Å²	133.7	78%	0.776	74%	0.736	S	S	*	*			trans	69.3	159.3	134.5	-64.9	177.7	-55.9	0	0	125.6
711	D	40	Very low	39	Very low	132 Å²	132	135.5 Å²	135.5	71%	0.706	75%	0.746	S	S	*	*			trans	71.2	106.8	161.1	-52.6	-29.9	0	0	0	121.8
712	I	40.4	Very low	38.7	Very low	153 Å²	153	137.9 Å²	137.9	79%	0.785	75%	0.746	S	S	*	*				64.3	121.7	72.3	-64.3	178.8	0	0	0	112.1
713	P	46.8	Very low	38.7	Very low	129 Å²	129	143 Å²	143	84%	0.838	76%	0.758	S	S	*	*				-148.1	-178	62.6	39	-17.5	0	0	0	118.8
714	L	43.9	Very low	38.6	Very low	162 Å²	162	137.8 Å²	137.8	85%	0.848	75%	0.753	S	S	*	*			trans	-150.8	144	-177.7	-140	172	0	0	0	110.1
715	P	54	Low	38.8	Very low	106 Å²	106	136 Å²	136	69%	0.688	76%	0.755	S	S	*	*			trans	-139.2	169.8	159.3	39.9	-26.6	0	0	0	113.9
716	E	42.5	Very low	39.1	Very low	181 Å²	181	140.9 Å²	140.9	85%	0.846	77%	0.768	S	S	*	*			cis	-170.6	136.3	-26.1	-101.4	-175.6	143.8	0	0	107.8
717	E	41.3	Very low	39.2	Very low	160 Å²	160	141.7 Å²	141.7	75%	0.748	77%	0.767	S	S	*	*			trans	48.3	-171.4	161.7	-88.3	-68.4	87.3	0	0	119.4	P719	E717-P719 WeakPolarHBondContact OE2-CD 3.33Å
718	T	39.1	Very low	39.1	Very low	125 Å²	125	140.5 Å²	140.5	77%	0.767	76%	0.761	S	S	*	*			cis	-141.1	145	-2.7	-19.4	0	0	0	0	111.4
719	P	38.8	Very low	39	Very low	91 Å²	91	140.2 Å²	140.2	59%	0.591	76%	0.755	S	S	*	*			trans	-106	176.1	176.4	39.1	-34.5	0	0	0	114.4	E717	E717-P719 WeakPolarHBondContact OE2-CD 3.33Å
720	T	36.2	Very low	38.9	Very low	114 Å²	114	142.4 Å²	142.4	70%	0.699	76%	0.759	S	S	*	*			trans	149.8	108.9	136.9	-68.3	0	0	0	0	117.2
721	Q	36.7	Very low	38.6	Very low	162 Å²	162	140.6 Å²	140.6	76%	0.757	76%	0.755	S	S	*	*			trans	74.4	131.1	140.5	-65.8	178.3	30.9	0	0	126.8
722	F	31.5	Very low	38.5	Very low	182 Å²	182	139.3 Å²	139.3	80%	0.798	76%	0.757	S	S	*	*			trans	63.3	117.3	131.4	-87.5	-107.1	0	0	0	124.6
723	I	37.8	Very low	38.2	Very low	162 Å²	162	136.9 Å²	136.9	83%	0.831	75%	0.749	S	S	*	*				177	150.4	103.6	-95.5	148.9	0	0	0	114.5
724	S	34.8	Very low	37.8	Very low	103 Å²	103	137.8 Å²	137.8	72%	0.72	75%	0.747	S	S	*	*			trans	-30.8	148.6	-179.8	-165.4	0	0	0	0	121.6
725	P	39.1	Very low	37.4	Very low	120 Å²	120	136.1 Å²	136.1	78%	0.779	74%	0.738	S	S	*	*			trans	-89.4	178.1	167.1	39	-37.2	0	0	0	113.9
726	K	38	Very low	36.4	Very low	197 Å²	197	137.4 Å²	137.4	86%	0.857	74%	0.738	S	S	*	*			trans	-153.9	158.7	162.1	-134.2	178.2	-176.7	-176.2	0	112.5
727	E	33.9	Very low	36.1	Very low	164 Å²	164	133 Å²	133	77%	0.766	73%	0.733	S	S	*	*			trans	-82.2	163.2	-172	-47.1	117.2	120.3	0	0	114.6
728	T	35	Very low	35.8	Very low	126 Å²	126	132.6 Å²	132.6	77%	0.773	73%	0.734	S	S	*	*				-174.1	114.8	126.7	-73.7	0	0	0	0	112.4
729	T	31.3	Very low	35.6	Very low	100 Å²	100	129.7 Å²	129.7	61%	0.613	73%	0.729	S	S	*	*			trans	18.5	136	134.1	-32.5	0	0	0	0	121
730	M	37.5	Very low	35.7	Very low	155 Å²	155	133.8 Å²	133.8	76%	0.764	74%	0.737	S	S	*	*				168.2	99.1	118.4	-84.8	-58.7	175.6	0	0	114.3
731	N	32.1	Very low	35.8	Very low	128 Å²	128	133.6 Å²	133.6	68%	0.684	73%	0.732	S	S	*	*				48.6	136.2	122	-55.4	2.3	0	0	0	124.4
732	S	36.9	Very low	35.8	Very low	105 Å²	105	133 Å²	133	73%	0.734	73%	0.733	S	S	*	*			trans	109.1	103.1	131.4	-69.6	0	0	0	0	122.1
733	T	36	Very low	35.8	Very low	103 Å²	103	129.7 Å²	129.7	63%	0.632	73%	0.73	S	S	*	*				48.8	119.5	111.7	-28.7	0	0	0	0	121.4	L735	T733-L735 HydrophobicContact CG2-CD1 4.27Å; T733-L735 HydrophobicContact CG2-CG 4.21Å
734	D	38.5	Very low	35.7	Very low	147 Å²	147	131.3 Å²	131.3	79%	0.786	74%	0.735	S	S	*	*				170.7	158	114.8	-89.1	-26.9	0	0	0	110.2
735	L	33.8	Very low	35.7	Very low	128 Å²	128	134.4 Å²	134.4	67%	0.67	74%	0.74	S	S	*	*				-178.4	136.2	-51.2	-104.2	-177	0	0	0	105.8	T733	T733-L735 HydrophobicContact CG2-CD1 4.27Å; T733-L735 HydrophobicContact CG2-CG 4.21Å
736	I	33	Very low	35.8	Very low	133 Å²	133	133.5 Å²	133.5	68%	0.682	73%	0.734	S	S	*	*			trans	58.2	114.1	149.7	-56.1	162.5	0	0	0	120.5	I738	I736-I738 HydrophobicContact CG2-CD1 3.56Å; I736-I738 HydrophobicContact CG2-CG1 4.04Å
737	A	36.2	Very low	35.7	Very low	89 Å²	89	129.8 Å²	129.8	74%	0.736	73%	0.728	S	S	*	*				-169.8	113.9	119.8	0	0	0	0	0	108
738	I	35.5	Very low	35.6	Very low	150 Å²	150	130.5 Å²	130.5	77%	0.769	73%	0.731	S	S	*	*				52.7	110.7	74.1	-52.3	168.2	0	0	0	110.7	I736	I736-I738 HydrophobicContact CG2-CD1 3.56Å; I736-I738 HydrophobicContact CG2-CG1 4.04Å
739	G	34.9	Very low	35.9	Very low	64 Å²	64	132.1 Å²	132.1	66%	0.66	73%	0.73	S	S	*	*			cis	146.8	-174.5	5.8	0	0	0	0	0	109.8
740	K	41.6	Very low	36.5	Very low	178 Å²	178	135.2 Å²	135.2	77%	0.774	74%	0.737	S	S	*	*			trans	72.1	149.5	166.2	-60.7	-178.2	151.7	-85.6	0	117.1
741	D	37.1	Very low	36.6	Very low	109 Å²	109	134.6 Å²	134.6	58%	0.583	74%	0.737	S	S	*	*			cis	-165.6	158.3	-14.3	-105.4	-17.5	0	0	0	110.2
742	I	36.6	Very low	37.1	Very low	151 Å²	151	135.2 Å²	135.2	77%	0.774	75%	0.745	S	S	*	*			trans	76.2	135.2	148	-71	162.2	0	0	0	119.5
743	C	32.8	Very low	37.2	Very low	111 Å²	111	138.7 Å²	138.7	75%	0.75	75%	0.75	S	S	*	*			trans	-91.1	168	171.4	-45.8	0	0	0	0	109.9
744	E	35.6	Very low	37.6	Very low	197 Å²	197	142.8 Å²	142.8	92%	0.921	76%	0.762	S	S	*	*			trans	-139.5	159.4	144.3	-134.2	153.2	-135.1	0	0	112.3
745	M	34.9	Very low	38.1	Very low	168 Å²	168	143.1 Å²	143.1	83%	0.828	76%	0.759	S	S	*	*			trans	-106.7	-172.5	-154.2	-96.3	-91.4	82.5	0	0	111.5
746	P	40.2	Very low	38.3	Very low	100 Å²	100	146.9 Å²	146.9	65%	0.649	77%	0.77	S	S	*	*			trans	-92.3	-176.3	-155.3	41.2	-36.5	0	0	0	113.4
747	T	36.5	Very low	39.1	Very low	120 Å²	120	147.7 Å²	147.7	74%	0.736	77%	0.771	S	S	*	*			trans	-129.6	152.3	162.8	-45.6	0	0	0	0	108.4
748	E	31.9	Very low	39.3	Very low	179 Å²	179	150 Å²	150	84%	0.836	77%	0.77	S	S	*	*			trans	-96.7	-140.4	-176.1	-57.7	-175.3	167.4	0	0	109.8
749	E	42.2	Very low	39.6	Very low	159 Å²	159	149.4 Å²	149.4	74%	0.743	77%	0.768	S	S	*	*			trans	74.3	137.6	179.3	-54.9	157.4	-138	0	0	114.5
750	E	42.9	Very low	39.7	Very low	166 Å²	166	153 Å²	153	78%	0.776	77%	0.772	S	S	*	*			cis	-155.8	167.4	-10.6	-125	173.7	-163.7	0	0	111
751	D	39.9	Very low	39.7	Very low	141 Å²	141	150 Å²	150	75%	0.754	77%	0.768	S	S	*	*			trans	-9.1	144	171.5	-59.1	-17.6	0	0	0	122.5
752	V	42.6	Very low	39.8	Very low	141 Å²	141	156.1 Å²	156.1	86%	0.855	79%	0.785	S	S	*	*				177	142	99.2	157.4	0	0	0	0	110.5
753	E	38.5	Very low	40.1	Very low	179 Å²	179	157 Å²	157	84%	0.836	79%	0.786	S	S	*	*			trans	-87.4	148.5	175.6	-53.7	177.8	129.8	0	0	111.5
754	E	45.6	Very low	40.7	Very low	188 Å²	188	160.4 Å²	160.4	88%	0.879	79%	0.79	S	S	*	*				-173.2	144.4	114.3	-104.9	-177.1	163.4	0	0	115.1
755	E	47.6	Very low	41.3	Very low	155 Å²	155	156.8 Å²	156.8	72%	0.724	78%	0.784	S	S	*	*			trans	-45.5	146.6	163.2	172.9	174.3	-147.7	0	0	115.5
756	F	39.5	Very low	41.4	Very low	206 Å²	206	157.5 Å²	157.5	90%	0.904	79%	0.785	S	S	*	*			trans	-157.6	116.5	130.3	-114.9	-71.2	0	0	0	111.9
757	E	48.1	Very low	41.8	Very low	150 Å²	150	161.6 Å²	161.6	70%	0.701	80%	0.796	S	S	*	*			trans	-107.1	173.9	170.2	-152.5	-177.2	-179.1	0	0	109.9
758	L	41.1	Very low	42.3	Very low	138 Å²	138	160.7 Å²	160.7	72%	0.723	79%	0.792	S	S	*	*			trans	69.5	130.9	-175.2	-72.3	65.4	0	0	0	114.4
759	L	41.7	Very low	42.6	Very low	137 Å²	137	160.6 Å²	160.6	72%	0.717	80%	0.797	S	S	*	*			cis	87.2	131.9	40	-79.3	145.7	0	0	0	115.2
760	D	37.6	Very low	42.5	Very low	141 Å²	141	160.8 Å²	160.8	75%	0.754	80%	0.803	S	S	*	*			trans	81.9	126.9	150.3	-70.9	-16.3	0	0	0	121.9
761	V	40.3	Very low	42.5	Very low	113 Å²	113	157.2 Å²	157.2	69%	0.685	80%	0.802	S	S	*	*			trans	66	106.3	160.4	-173.5	0	0	0	0	118.1
762	Y	39.6	Very low	42.6	Very low	238 Å²	238	155 Å²	155	93%	0.933	80%	0.804	S	S	*	*				-129	151	124.3	-110.7	-84.6	0	0	0	110
763	E	42.8	Very low	42.4	Very low	171 Å²	171	155.1 Å²	155.1	80%	0.799	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-81.9	163	-162.1	-94	165.2	122.3	0	0	116.4
764	E	45.5	Very low	42.4	Very low	181 Å²	181	153.5 Å²	153.5	85%	0.846	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-79.6	124.9	175.7	177.2	171.8	-139.7	0	0	110.6
765	P	47.8	Very low	42	Very low	121 Å²	121	152.2 Å²	152.2	79%	0.786	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-85.9	124.1	168.1	31.6	-29.6	0	0	0	110.9
766	E	37.4	Very low	41.7	Very low	184 Å²	184	153.2 Å²	153.2	86%	0.86	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-68.8	152.2	175.7	-54.5	-179.2	134.2	0	0	112.8
767	E	49.6	Very low	41.9	Very low	186 Å²	186	147.9 Å²	147.9	87%	0.869	78%	0.78	S	S	*	*			trans	179.1	155.2	141.9	-104.7	-155.4	-171.5	0	0	110.5
768	P	45.9	Very low	41.6	Very low	100 Å²	100	147.9 Å²	147.9	65%	0.649	79%	0.785	S	S	*	*			cis	-134.9	138.8	-47.9	29.9	-11.3	0	0	0	113.1
769	D	39.2	Very low	41.4	Very low	178 Å²	178	145.9 Å²	145.9	95%	0.952	78%	0.782	S	S	*	*			trans	-102.7	100.8	159.9	-104.9	-26.9	0	0	0	108
770	D	39.4	Very low	41.4	Very low	163 Å²	163	147 Å²	147	87%	0.872	78%	0.78	S	S	*	*			trans	-133.1	129.3	173.6	-145.2	-13.4	0	0	0	111.8
771	A	42.3	Very low	41.6	Very low	91 Å²	91	148.9 Å²	148.9	75%	0.752	78%	0.782	S	S	*	*			trans	-109.6	161.9	-162.6	0	0	0	0	0	113	I773	A771-I773 PolarHBondContact O-N 3.38Å
772	A	42.1	Very low	41.6	Very low	95 Å²	95	149 Å²	149	79%	0.785	79%	0.785	S	S	*	*			trans	-69.2	117.9	-169.5	0	0	0	0	0	114.5
773	I	39	Very low	41.5	Very low	142 Å²	142	144.4 Å²	144.4	73%	0.728	78%	0.776	S	S	*	*				60.4	98.1	127.5	-59.2	178.9	0	0	0	117.1	A771	A771-I773 PolarHBondContact O-N 3.38Å
774	I	37.7	Very low	41.2	Very low	146 Å²	146	142 Å²	142	75%	0.749	78%	0.775	S	S	*	*			trans	51.4	111.3	137.5	-32.2	169.1	0	0	0	118.6
775	Q	38.8	Very low	40.4	Very low	161 Å²	161	141.6 Å²	141.6	75%	0.752	77%	0.773	S	S	*	*				175	124.3	108	-91.4	-179.3	11.7	0	0	113
776	Q	39.6	Very low	39.9	Very low	176 Å²	176	145.9 Å²	145.9	82%	0.822	78%	0.779	S	S	*	*			trans	42.1	138.3	137.9	-64.1	170	-2.3	0	0	120.4
777	S	44.3	Very low	39.8	Very low	93 Å²	93	142.2 Å²	142.2	65%	0.65	77%	0.774	S	S	*	*			cis	-173.1	152.4	3.3	45.6	0	0	0	0	111
778	D	42.9	Very low	39.1	Very low	150 Å²	150	141.8 Å²	141.8	80%	0.802	77%	0.772	S	S	*	*			trans	62.1	142.1	160.2	-61.4	-42.3	0	0	0	118.9
779	C	35.2	Very low	39.3	Very low	96 Å²	96	142.3 Å²	142.3	65%	0.649	78%	0.776	S	S	*	*			cis	-169.4	166.2	-2.7	-110.8	0	0	0	0	108.6
780	K	42.5	Very low	39.3	Very low	160 Å²	160	139.9 Å²	139.9	70%	0.696	76%	0.763	S	S	*	*			cis	173.4	125.8	-20.2	167.7	172.4	177.1	177	0	112.3
781	F	41.5	Very low	39.4	Very low	181 Å²	181	138 Å²	138	79%	0.794	75%	0.753	S	S	*	*			trans	66.8	165.9	160.4	-73.8	-40.3	0	0	0	121.5
782	P	40	Very low	39.2	Very low	115 Å²	115	142 Å²	142	75%	0.747	75%	0.754	S	S	*	*			cis	-134.6	177	-21.3	30.9	-9.9	0	0	0	116.6
783	I	37.6	Very low	39.1	Very low	143 Å²	143	142.5 Å²	142.5	73%	0.733	75%	0.746	S	S	*	*			trans	-82.6	175.4	166.7	-26.9	177.2	0	0	0	110.6
784	P	37.6	Very low	39.2	Very low	119 Å²	119	144.1 Å²	144.1	77%	0.773	75%	0.748	S	S	*	*				-147	155.5	95.7	38.2	-22.1	0	0	0	116.8
785	Q	28.5	Very low	39.2	Very low	174 Å²	174	142.5 Å²	142.5	81%	0.813	75%	0.745	S	S	*	*			trans	-96	165.7	162.1	-64.8	168.8	-47.1	0	0	110.4
786	F	36.9	Very low	39.2	Very low	210 Å²	210	143.5 Å²	143.5	92%	0.921	75%	0.747	S	S	*	*			trans	-152	165.3	155.9	-109.5	-75.9	0	0	0	111.4
787	S	36.2	Very low	38.9	Very low	107 Å²	107	139.5 Å²	139.5	75%	0.748	74%	0.738	S	S	*	*			trans	-117.7	-175.8	-151.5	56.7	0	0	0	0	116.4
788	E	34.7	Very low	38.6	Very low	177 Å²	177	142.4 Å²	142.4	83%	0.827	75%	0.745	S	S	*	*			trans	-57.9	176.4	176.4	-50.9	179.1	119.3	0	0	115
789	P	49.3	Very low	38.2	Very low	112 Å²	112	139.7 Å²	139.7	73%	0.727	74%	0.738	S	S	*	*				-153.6	159.2	93	42.6	-25.3	0	0	0	119.1
790	D	39.4	Very low	38.1	Very low	127 Å²	127	143.2 Å²	143.2	68%	0.679	75%	0.75	S	S	*	*				83.9	133.5	129.4	-89.2	18.6	0	0	0	126.9
791	N	41.1	Very low	37.7	Very low	124 Å²	124	140 Å²	140	66%	0.663	75%	0.747	S	S	*	*			trans	73.7	141.7	144.2	-59.9	-35.4	0	0	0	120.1
792	F	38.1	Very low	37.2	Very low	175 Å²	175	137 Å²	137	77%	0.768	74%	0.743	S	S	*	*			cis	-159.7	131.6	4.1	-140.4	-132.6	0	0	0	113.6
793	V	40.7	Very low	37	Very low	104 Å²	104	137.6 Å²	137.6	63%	0.63	75%	0.745	S	S	*	*			trans	50.7	127.6	132.3	-178.6	0	0	0	0	119.6
794	K	39.9	Very low	37.1	Very low	176 Å²	176	136.1 Å²	136.1	77%	0.765	75%	0.745	S	S	*	*				-175.7	131.7	68.5	-151	157.8	-175.6	174.9	0	117.3
795	T	39.4	Very low	36.9	Very low	113 Å²	113	138 Å²	138	69%	0.693	74%	0.744	S	S	*	*			trans	57.3	148.9	149	53.3	0	0	0	0	121.4
796	K	38.9	Very low	37.1	Very low	182 Å²	182	137.3 Å²	137.3	79%	0.791	74%	0.74	S	S	*	*			cis	-161	130.2	-1.7	-105.9	169.4	174.1	-170.1	0	105.4
797	S	33.3	Very low	37	Very low	91 Å²	91	132 Å²	132	64%	0.636	74%	0.736	S	S	*	*				56.7	111.3	68.4	82.2	0	0	0	0	114.1
798	I	37.9	Very low	36.9	Very low	155 Å²	155	129.8 Å²	129.8	80%	0.795	73%	0.729	S	S	*	*				179.7	164.1	79.2	-97	158.4	0	0	0	108.6
799	S	33.3	Very low	36.8	Very low	93 Å²	93	130.9 Å²	130.9	65%	0.65	73%	0.731	S	S	*	*			cis	153.6	148.4	-33.9	-79.2	0	0	0	0	110.9
800	L	34	Very low	36	Very low	170 Å²	170	130.8 Å²	130.8	89%	0.89	73%	0.729	S	S	*	*			trans	72.2	157.4	171.2	-60.3	158.5	0	0	0	116.1
801	S	33	Very low	35.6	Very low	93 Å²	93	130.4 Å²	130.4	65%	0.65	73%	0.731	S	S	*	*			cis	-169.8	170.3	-19.2	52.5	0	0	0	0	112
802	T	32.2	Very low	35.2	Very low	116 Å²	116	130.5 Å²	130.5	71%	0.712	74%	0.736	S	S	*	*			trans	-9.7	154.5	152.6	58	0	0	0	0	119.3
803	T	34.8	Very low	35.3	Very low	128 Å²	128	126.9 Å²	126.9	79%	0.785	73%	0.73	S	S	*	*			cis	-171.1	179.9	40.7	-6.8	0	0	0	0	110.7
804	P	40.9	Very low	34.9	Very low	112 Å²	112	130 Å²	130	73%	0.727	74%	0.74	S	S	*	*			trans	-102.1	-147.1	-170.9	43.5	-37.9	0	0	0	114.9
805	E	33.2	Very low	34.7	Very low	160 Å²	160	126.5 Å²	126.5	75%	0.748	74%	0.738	S	S	*	*			trans	89	154.2	179.1	-56.1	-149.4	112	0	0	117
806	Q	32.3	Very low	34.3	Very low	159 Å²	159	127.5 Å²	127.5	74%	0.743	74%	0.739	S	S	*	*			cis	-162.7	156	-28.7	-107.5	-153	62.8	0	0	109.4
807	A	34	Very low	34.2	Very low	99 Å²	99	126.8 Å²	126.8	82%	0.818	74%	0.742	S	S	*	*			trans	59.9	157.1	162.3	0	0	0	0	0	119.1
808	G	34.4	Very low	34	Very low	59 Å²	59	128.9 Å²	128.9	61%	0.608	75%	0.746	S	S	*	*			cis	167.3	162.4	-9.7	0	0	0	0	0	112.9
809	F	33.2	Very low	33.6	Very low	200 Å²	200	127 Å²	127	88%	0.877	75%	0.745	S	S	*	*			trans	65.4	153.8	174.2	-58.8	-83	0	0	0	116.1
810	T	31.7	Very low	33.6	Very low	111 Å²	111	125.4 Å²	125.4	68%	0.681	74%	0.744	S	S	*	*			cis	-151.9	138.4	-3.5	7.8	0	0	0	0	106.7
811	V	31	Very low	33.5	Very low	119 Å²	119	123 Å²	123	72%	0.721	74%	0.742	S	S	*	*				55	115.3	79.7	177.6	0	0	0	0	109.6
812	T	33.8	Very low	33.3	Very low	125 Å²	125	124 Å²	124	77%	0.767	75%	0.748	S	S	*	*			cis	-178.1	-164.4	31.2	18.9	0	0	0	0	108.5
813	P	39.1	Very low	33.2	Very low	100 Å²	100	122.2 Å²	122.2	65%	0.649	75%	0.745	S	S	*	*				-136.1	-162.4	-51.7	38.9	-20.5	0	0	0	112.9
814	M	32.7	Very low	33	Very low	168 Å²	168	121.8 Å²	121.8	83%	0.828	74%	0.743	S	S	*	*			trans	72	150.4	155.1	-67.4	-71.1	-171.4	0	0	117.6
815	S	36	Very low	32.4	Very low	104 Å²	104	125.7 Å²	125.7	73%	0.727	74%	0.744	S	S	*	*			cis	-151.1	166.4	-4.3	42.7	0	0	0	0	112.5
816	D	30.3	Very low	32.3	Very low	134 Å²	134	125.7 Å²	125.7	72%	0.717	75%	0.746	S	S	*	*			trans	-63.2	160	-176	-42.9	-98.7	0	0	0	116.6
817	I	37.7	Very low	32.2	Very low	166 Å²	166	120.9 Å²	120.9	85%	0.851	74%	0.74	S	S	*	*			trans	175.2	112.2	137.7	-87.6	148.9	0	0	0	105.3
818	N	29.2	Very low	32	Very low	135 Å²	135	120 Å²	120	72%	0.722	73%	0.732	S	S	*	*			cis	90.7	131.4	22	-160.8	26.7	0	0	0	116.1
819	C	28.8	Very low	31.8	Very low	115 Å²	115	127.2 Å²	127.2	78%	0.777	74%	0.742	S	S	*	*			trans	59.5	148.9	177.6	-67.3	0	0	0	0	117.4
820	G	34.1	Very low	31.6	Very low	60 Å²	60	125.9 Å²	125.9	62%	0.619	74%	0.738	S	S	*	*			cis	-139.1	169.5	-6.7	0	0	0	0	0	109.9
821	S	30.7	Very low	31.4	Very low	121 Å²	121	126.5 Å²	126.5	85%	0.846	75%	0.747	S	S	*	*			cis	56.9	128.8	49.9	-49.4	0	0	0	0	111.5
822	S	29.3	Very low	31.5	Very low	113 Å²	113	129 Å²	129	79%	0.79	75%	0.751	S	S	*	*			cis	-155.3	167.1	22.4	-160.8	0	0	0	0	112.6
823	A	29.1	Very low	31.6	Very low	78 Å²	78	128.6 Å²	128.6	65%	0.645	75%	0.75	S	S	*	*			trans	27.8	155.7	144.5	0	0	0	0	0	121.7
824	T	32.2	Very low	31.3	Very low	120 Å²	120	129.5 Å²	129.5	74%	0.736	75%	0.754	S	S	*	*			cis	-166.6	156.1	35.1	-30.7	0	0	0	0	111.9
825	Y	28.4	Very low	31.1	Very low	193 Å²	193	128.6 Å²	128.6	76%	0.757	75%	0.751	S	S	*	*			trans	62.2	126.5	139.7	-110.6	-141.9	0	0	0	122.9
826	M	30.7	Very low	30.9	Very low	160 Å²	160	128.4 Å²	128.4	79%	0.788	75%	0.745	S	S	*	*			trans	60.5	151.9	139.3	-56	-68.4	-120.9	0	0	119
827	G	30.8	Very low	30.8	Very low	59 Å²	59	129.5 Å²	129.5	61%	0.608	75%	0.751	S	S	*	*			cis	-176.9	122.9	-7.9	0	0	0	0	0	107.4
828	A	29.3	Very low	30.6	Very low	79 Å²	79	130.9 Å²	130.9	65%	0.653	75%	0.751	S	S	*	*				85.2	148.6	99.4	0	0	0	0	0	114.3
829	Y	30.2	Very low	30.7	Very low	212 Å²	212	129.5 Å²	129.5	83%	0.831	75%	0.752	S	S	*	*			trans	69	109.6	178	-47.9	-68.3	0	0	0	115.5
830	H	29.1	Very low	30.8	Very low	171 Å²	171	130.7 Å²	130.7	79%	0.792	75%	0.75	S	S	*	*				63.4	112.3	77.4	-80.6	75.8	0	0	0	114.6
831	S	27.4	Very low	30.7	Very low	124 Å²	124	137.2 Å²	137.2	87%	0.867	76%	0.757	S	S	*	*			trans	-168.1	136.4	132	-84.5	0	0	0	0	112.1
832	H	33.2	Very low	31.2	Very low	172 Å²	172	137.2 Å²	137.2	80%	0.796	75%	0.754	S	S	*	*			trans	-81.9	152.3	164.5	-62.9	-96.7	0	0	0	110.5
833	P	36.1	Very low	31.6	Very low	116 Å²	116	141.8 Å²	141.8	75%	0.753	76%	0.755	S	S	*	*			trans	-101.3	99.3	157.2	33.6	-26.4	0	0	0	111.3
834	V	31.1	Very low	32.4	Very low	119 Å²	119	143.3 Å²	143.3	72%	0.721	76%	0.759	S	S	*	*			trans	-102	85.9	160.7	178.8	0	0	0	0	108.5	T836	V834-T836 HydrophobicContact CG1-CG2 4.41Å
835	I	29.6	Very low	32.4	Very low	150 Å²	150	144.2 Å²	144.2	77%	0.769	76%	0.757	S	S	*	*			trans	-139.3	114.5	178	-54.7	179.1	0	0	0	105.6
836	T	32.8	Very low	32.7	Very low	100 Å²	100	143.3 Å²	143.3	61%	0.613	76%	0.758	S	S	*	*			cis	71.3	82.3	32.2	84.8	0	0	0	0	115.4	V834	V834-T836 HydrophobicContact CG1-CG2 4.41Å
837	N	26.9	Very low	33.1	Very low	156 Å²	156	140.2 Å²	140.2	83%	0.834	75%	0.75	S	S	*	*				-171.1	-179.1	118.8	-108	-69.3	0	0	0	115.3
838	K	33.1	Very low	33	Very low	196 Å²	196	143.7 Å²	143.7	85%	0.852	76%	0.755	S	S	*	*			trans	-108.2	147.1	-166.3	-51.4	160.5	-176.6	169.3	0	113
839	S	30.9	Very low	33.2	Very low	105 Å²	105	147.4 Å²	147.4	73%	0.734	76%	0.763	S	S	*	*			trans	-161.9	129.7	145.4	-159.2	0	0	0	0	107.2
840	L	31	Very low	33.1	Very low	141 Å²	141	144.5 Å²	144.5	74%	0.738	76%	0.756	S	S	*	*			cis	98.3	145.4	26.7	-155.5	76.3	0	0	0	113.5
841	Y	32.9	Very low	33.1	Very low	197 Å²	197	142.6 Å²	142.6	77%	0.773	75%	0.75	S	S	*	*			trans	82.5	155	178.5	-60	-76.2	0	0	0	118.5
842	P	41.3	Very low	33.2	Very low	120 Å²	120	144.4 Å²	144.4	78%	0.779	74%	0.744	S	S	*	*			cis	-128.3	172.5	-18.6	26.7	-4.9	0	0	0	115.6
843	Y	37.2	Very low	33.4	Very low	210 Å²	210	142 Å²	142	82%	0.824	74%	0.737	S	S	*	*			trans	-101.6	167	175	-103.9	-82.5	0	0	0	112.8
844	P	46.4	Very low	33.2	Very low	110 Å²	110	138.4 Å²	138.4	71%	0.714	71%	0.714	S	S	*	*				-132.4	152.5	112.2	38.8	-31	0	0	0	112.9
845	I	31.9	Very low	33.1	Very low	138 Å²	138	134.9 Å²	134.9	71%	0.708	69%	0.688	S	S	*	*			cis	78.6	124.7	35.1	-60.2	167.3	0	0	0	110.5
846	F	36	Very low	33.1	Very low	174 Å²	174	132.5 Å²	132.5	76%	0.763	67%	0.669	S	S	*	*			cis	-157.4	-161.1	9.2	-133.8	-3.1	0	0	0	108.5
847	P	38.7	Very low	33	Very low	96 Å²	96	132.7 Å²	132.7	62%	0.623	67%	0.667	S	S	*	*			cis	-134.8	172.4	-23.6	38.1	-19.6	0	0	0	116.4
848	N	28.2	Very low	33	Very low	132 Å²	132	130.9 Å²	130.9	71%	0.706	65%	0.653	S	S	*	*			trans	27.8	125.7	145.9	-62.1	-26.5	0	0	0	124
849	L	33.6	Very low	32.7	Very low	157 Å²	157	124.2 Å²	124.2	82%	0.822	64%	0.64	S	S	*	*				178.4	105.8	114.9	-92.7	164	0	0	0	107.3
850	Q	28.5	Very low	32.7	Very low	150 Å²	150	126.3 Å²	126.3	70%	0.701	64%	0.643	S	S	*	*				91.6	132.4	60.4	-166.4	-171.1	-38.5	0	0	112.9
851	M	29.1	Very low	32.5	Very low	132 Å²	132	126.2 Å²	126.2	65%	0.65	64%	0.642	S	S	*	*			trans	71.4	150.2	179.6	-48.9	-66.5	65.6	0	0	116.7
852	Q	29	Very low	32.3	Very low	162 Å²	162	123.7 Å²	123.7	76%	0.757	64%	0.642	S	S	*	*			cis	-164.5	126.7	-40.6	-140.8	174.9	26.6	0	0	106.8
853	N	37.6	Very low	31.5	Very low	121 Å²	121	122.8 Å²	122.8	65%	0.647	63%	0.634	S	S	*	*			trans	-87.3	135	-175.7	-178.6	-5.4	0	0	0	112.6	Y855	N853-Y855 PolarHBondContact OD1-N 3.32Å
854	P	32	Very low	31.1	Very low	40 Å²	40	118.7 Å²	118.7	26%	0.26	63%	0.626	S	S	.	*			trans	-150.5	99.9	148.7	32.2	-9.9	0	0	0	119.7	L344 K345	L344-P854 HydrophobicContact CD2-CG 4.25Å; K345-P854 HydrophobicContact CB-CB 4.09Å; K345-P854 HydrophobicContact CD-CB 3.32Å; K345-P854 HydrophobicContact CD-CG 4.16Å; K345-P854 VanDerWaalsContact CE-CB 3.49Å; K345-P854 HydrophobicContact CG-CB 3.51Å
855	Y	27.9	Very low	30.4	Very low	46 Å²	46	124.2 Å²	124.2	18%	0.18	64%	0.635	C	S	.	*				37.3	126.2	118.2	-77.5	-81.5	0	0	0	126.4	K345 N853 N1213 S1214 Y1215	K345-Y855 WeakPolarHBondContact CA-O 3.05Å; K345-Y855 WeakPolarHBondContact CB-O 3.32Å; N853-Y855 PolarHBondContact OD1-N 3.32Å; Y855-N1213 WeakPolarHBondContact CB-OD1 3.01Å; Y855-N1213 VanDerWaalsContact CD2-ND2 3.35Å; Y855-N1213 WeakPolarHBondContact CD2-ND2 3.5Å; Y855-S1214 VanDerWaalsContact CE2-O 3.29Å; Y855-S1214 WeakPolarHBondContact CE2-O 3.38Å; Y855-S1214 WeakPolarHBondContact OH-CA 3.29Å; Y855-S1214 WeakPolarHBondContact OH-CB 3.35Å; Y855-S1214 PolarHBondContact OH-O 2.75Å; Y855-Y1215 VanDerWaalsContact OH-CB 3.25Å; Y855-Y1215 WeakPolarHBondContact OH-CB 3.34Å; Y855-Y1215 WeakPolarHBondContact OH-CD2 3.48Å; Y855-Y1215 PolarHBondContact OH-N 2.66Å
856	R	30.7	Very low	30.2	Very low	100 Å²	100	122.4 Å²	122.4	38%	0.377	63%	0.634	S	S	.	*				67.2	124.5	109.4	-149.9	-114.9	-70.4	168.8	-3.7	120.8	I1212 N1213 S1214	R856-I1212 HydrophobicContact CB-CG2 3.28Å; R856-I1212 HydrophobicContact CG-CG2 3.6Å; R856-I1212 VanDerWaalsContact NE-CG2 3.28Å; R856-I1212 VanDerWaalsContact NH1-CG1 3.27Å; R856-I1212 WeakPolarHBondContact O-CG2 3.45Å; R856-N1213 PolarHBondContact NH2-O 3.04Å; R856-S1214 PolarHBondContact NH2-OG 3.41Å
857	N	30	Very low	29.7	Very low	104 Å²	104	118.4 Å²	118.4	56%	0.556	63%	0.627	S	S	*	*			trans	23.4	178.5	-178.7	-4.7	-18.5	0	0	0	121.2	I1212	N857-I1212 HydrophobicContact CB-CD1 3.24Å; N857-I1212 WeakPolarHBondContact ND2-CD1 3.4Å
858	H	28	Very low	29.5	Very low	117 Å²	117	120.4 Å²	120.4	54%	0.542	64%	0.64	S	S	.	*			cis	-124.1	-179.6	12.4	-97.6	-123.2	0	0	0	110.2	N1209 I1210 V1211 I1212	H858-N1209 PolarHBondContact CE1-OD1 2.98Å; H858-I1210 HydrophobicContact CB-CD1 4.43Å; H858-I1210 HydrophobicContact CB-CG1 3.55Å; H858-V1211 HydrophobicContact CB-CG2 3.92Å; H858-V1211 VanDerWaalsContact CD2-CG2 3.47Å; H858-V1211 WeakPolarHBondContact CD2-CG2 3.44Å; H858-I1212 WeakPolarHBondContact CD2-CD1 3.48Å
859	G	26.2	Very low	29.4	Very low	57 Å²	57	117.2 Å²	117.2	59%	0.588	63%	0.629	S	S	*	*			cis	-173.8	-162.4	8.6	0	0	0	0	0	111.3
860	N	31.8	Very low	29.1	Very low	148 Å²	148	117.8 Å²	117.8	79%	0.791	63%	0.627	S	S	*	*			trans	-79	152.7	-178.2	-66.6	-36.2	0	0	0	113.4
861	L	26.5	Very low	29	Very low	139 Å²	139	115.2 Å²	115.2	73%	0.728	63%	0.625	S	S	*	*			trans	-179.7	133.8	132.6	-87.8	156.5	0	0	0	104.5
862	L	27.3	Very low	28.9	Very low	145 Å²	145	116.8 Å²	116.8	76%	0.759	63%	0.631	S	S	*	*				50.4	128.5	73	-71.8	157.1	0	0	0	111.5
863	T	26.1	Very low	28.9	Very low	100 Å²	100	115.9 Å²	115.9	61%	0.613	63%	0.63	S	S	*	*			cis	-150.8	171.5	24	-31	0	0	0	0	110.5
864	D	27.3	Very low	28.3	Very low	124 Å²	124	118.2 Å²	118.2	66%	0.663	63%	0.63	S	S	*	*			trans	68.7	144.3	165.8	-45.5	-45.3	0	0	0	116.4
865	Y	32.1	Very low	28.3	Very low	227 Å²	227	120 Å²	120	89%	0.89	64%	0.635	S	S	*	*			cis	-121.4	156.1	18.5	-93.7	-104.2	0	0	0	115.3
866	S	27.5	Very low	28.3	Very low	99 Å²	99	121.7 Å²	121.7	69%	0.692	65%	0.647	S	S	*	*			trans	-55	154.4	179.6	-53.5	0	0	0	0	117
867	S	26.1	Very low	28.3	Very low	90 Å²	90	119.5 Å²	119.5	63%	0.629	65%	0.645	S	S	*	*			trans	25.1	130.4	132.5	-59.9	0	0	0	0	119
868	P	34	Very low	28.3	Very low	138 Å²	138	121.8 Å²	121.8	90%	0.896	66%	0.657	S	S	*	*				-97.6	113.1	77.6	-23.1	36.5	0	0	0	116
869	S	26	Very low	28.4	Very low	66 Å²	66	120.2 Å²	120.2	46%	0.462	67%	0.665	S	S	.	*			trans	-64.1	177.4	140.1	47.1	0	0	0	0	110.4
870	H	27.8	Very low	28.9	Very low	169 Å²	169	122.7 Å²	122.7	78%	0.782	67%	0.668	S	S	*	*			trans	77.3	139.4	-178.3	-45.9	-77.1	0	0	0	114.9
871	S	26.4	Very low	29.2	Very low	95 Å²	95	120.9 Å²	120.9	66%	0.664	66%	0.664	S	S	*	*			cis	-161.6	144.2	-15	43.7	0	0	0	0	113.2
872	H	25.9	Very low	29.9	Very low	166 Å²	166	120.2 Å²	120.2	77%	0.769	67%	0.669	S	S	*	*			trans	-3.2	128.7	149	-37.1	-73.1	0	0	0	119.4
873	L	29.9	Very low	30.2	Very low	143 Å²	143	121.8 Å²	121.8	75%	0.749	67%	0.672	S	S	*	*				170.6	128.7	127.8	-108.4	80.7	0	0	0	105.5	Q875	L873-Q875 HydrophobicContact CD2-CG 4.39Å
874	R	26.1	Very low	30.5	Very low	169 Å²	169	121.7 Å²	121.7	64%	0.638	68%	0.676	S	S	*	*			cis	65	113.8	6.2	-135.5	-171	-157.8	-72.7	-4.2	116.7	L415 S416	L415-R874 PolarHBondContact O-NH2 3.27Å; S416-R874 VanDerWaalsContact O-CZ 3.24Å; S416-R874 PolarHBondContact O-NH1 3.34Å; S416-R874 PolarHBondContact O-NH2 3.41Å
875	Q	31	Very low	31	Very low	78 Å²	78	121 Å²	121	36%	0.364	68%	0.68	S	S	.	*			trans	-143.2	-153.8	157.9	-99.2	172.5	-11.5	0	0	108.4	S417 R418 W420 L873	S417-Q875 CarbonylContact C-O 3.49Å; R418-Q875 HydrophobicContact CB-CB 4.02Å; R418-Q875 HydrophobicContact CG-CB 4.4Å; W420-Q875 VanDerWaalsContact CZ3-OE1 3.31Å; L873-Q875 HydrophobicContact CD2-CG 4.39Å
876	N	27.9	Very low	31	Very low	81 Å²	81	115.1 Å²	115.1	43%	0.433	67%	0.673	S	S	.	*			trans	-140.6	115.7	177.8	-114.6	-117.4	0	0	0	114.9	S416 S417 R418	S416-N876 WeakPolarHBondContact CB-OD1 3.48Å; S416-N876 PolarHBondContact O-ND2 2.86Å; S416-N876 VanDerWaalsContact O-ND2 3.15Å; S417-N876 PolarHBondContact N-ND2 3.43Å; S417-N876 WeakPolarHBondContact OG-CA 3.36Å; S417-N876 PolarHBondContact OG-OD1 3.32Å; R418-N876 VanDerWaalsContact CZ-O 3.24Å; R418-N876 PolarHBondContact NE-O 2.87Å; R418-N876 PolarHBondContact NH2-O 3.13Å
877	V	31.1	Very low	31.4	Very low	55 Å²	55	121.4 Å²	121.4	33%	0.333	68%	0.681	S	S	.	*			trans	179.8	141.3	170.9	120.2	0	0	0	0	106.2	S417 R418	S417-V877 WeakPolarHBondContact CB-O 3.32Å; S417-V877 PolarHBondContact OG-N 2.95Å; S417-V877 PolarHBondContact OG-O 3.26Å; R418-V877 VanDerWaalsContact CA-O 3.29Å; R418-V877 WeakPolarHBondContact CA-O 3.03Å; R418-V877 HydrophobicContact CG-CB 3.79Å; R418-V877 HydrophobicContact CG-CG1 3.85Å; R418-V877 PolarHBondContact N-O 3.07Å
878	D	29.3	Very low	31.7	Very low	151 Å²	151	120.6 Å²	120.6	81%	0.807	68%	0.68	S	S	*	*			cis	79.8	71.5	16.4	-151	19.1	0	0	0	115.6
879	A	29.9	Very low	31.6	Very low	85 Å²	85	124.9 Å²	124.9	70%	0.702	68%	0.68	S	S	*	*			trans	-131.9	109.5	173	0	0	0	0	0	109.7
880	T	37.8	Very low	32.3	Very low	108 Å²	108	127.1 Å²	127.1	66%	0.663	69%	0.685	S	S	*	*			trans	-32.4	128.9	173.7	-42.6	0	0	0	0	114.1
881	P	37.7	Very low	32.9	Very low	110 Å²	110	124 Å²	124	71%	0.714	68%	0.68	S	S	*	*			trans	-61.4	132.5	165.2	28.3	-33.3	0	0	0	108.2	Q883	P881-Q883 PolarHBondContact O-N 3.24Å
882	P	41	Very low	33.5	Very low	126 Å²	126	128.1 Å²	128.1	82%	0.818	69%	0.688	S	S	*	*			trans	-61.7	106.1	-163.4	21.6	-33.3	0	0	0	112.6	S884	P882-S884 PolarHBondContact O-N 3Å
883	Q	33.2	Very low	34.1	Very low	178 Å²	178	124.7 Å²	124.7	83%	0.832	68%	0.683	S	S	*	*			trans	-68	124.7	161.2	-74.1	-170	-19.2	0	0	108.4	P881	P881-Q883 PolarHBondContact O-N 3.24Å
884	S	32.5	Very low	34.5	Very low	98 Å²	98	125.9 Å²	125.9	69%	0.685	69%	0.689	S	S	*	*			trans	65.2	130.8	-176.4	-148.2	0	0	0	0	113.1	P882	P882-S884 PolarHBondContact O-N 3Å
885	S	37.4	Very low	35.5	Very low	108 Å²	108	126 Å²	126	76%	0.755	70%	0.697	S	S	*	*			cis	-98.2	101.2	28.5	-168.2	0	0	0	0	114.3	R887	S885-R887 PolarHBondContact O-N 3.1Å
886	S	33.5	Very low	36	Very low	105 Å²	105	127 Å²	127	73%	0.734	71%	0.71	S	S	*	*			trans	-72	76	155	-58.8	0	0	0	0	108	A888	S886-A888 PolarHBondContact O-N 3.22Å
887	R	35.8	Very low	36.8	Very low	230 Å²	230	127.2 Å²	127.2	87%	0.868	72%	0.718	S	S	*	*			trans	-69.8	75.2	161.5	-171.6	170	-177.1	156.4	1.3	107.5	S885 Y889	S885-R887 PolarHBondContact O-N 3.1Å; R887-Y889 PolarHBondContact O-N 2.85Å; R887-Y889 VanDerWaalsContact O-N 3.15Å
888	A	32.1	Very low	37.5	Very low	73 Å²	73	133.5 Å²	133.5	60%	0.603	74%	0.744	S	S	*	*			trans	-51.2	121.9	175.7	0	0	0	0	0	107.6	S886 I890	S886-A888 PolarHBondContact O-N 3.22Å; A888-I890 PolarHBondContact O-N 3.05Å
889	Y	32.5	Very low	38.8	Very low	228 Å²	228	132.2 Å²	132.2	89%	0.894	74%	0.737	S	S	*	*			trans	-68.8	94.8	167.5	-139	-82.7	0	0	0	105.5	R887 P891	R887-Y889 PolarHBondContact O-N 2.85Å; R887-Y889 VanDerWaalsContact O-N 3.15Å; Y889-P891 WeakPolarHBondContact O-CD 3.4Å
890	I	39.4	Very low	40.8	Very low	114 Å²	114	133.2 Å²	133.2	59%	0.585	74%	0.736	S	S	*	*			trans	-58.5	111.9	-174.2	-63.2	171.9	0	0	0	107.2	A888 H892	A888-I890 PolarHBondContact O-N 3.05Å; I890-H892 VanDerWaalsContact C-N 3.3Å; I890-H892 PolarHBondContact O-N 2.66Å
891	P	39.9	Very low	42.1	Very low	103 Å²	103	133.5 Å²	133.5	67%	0.669	74%	0.74	S	S	*	*			trans	-74.7	96.9	167.4	30.5	-25.3	0	0	0	104.8	Y889 S893	Y889-P891 WeakPolarHBondContact O-CD 3.4Å; P891-S893 PolarHBondContact O-N 2.98Å; P891-S893 PolarHBondContact O-OG 3.29Å
892	H	40.4	Very low	43.3	Very low	181 Å²	181	133.9 Å²	133.9	84%	0.838	74%	0.742	S	S	*	*			trans	-50.9	101.5	-174.5	-87.5	-90.9	0	0	0	110	I890	I890-H892 VanDerWaalsContact C-N 3.3Å; I890-H892 PolarHBondContact O-N 2.66Å
893	S	37.9	Very low	44.4	Very low	94 Å²	94	133.3 Å²	133.3	66%	0.657	74%	0.739	S	S	*	*			trans	-107.4	143.4	-179.9	-59.6	0	0	0	0	106.4	P891	P891-S893 PolarHBondContact O-N 2.98Å; P891-S893 PolarHBondContact O-OG 3.29Å
894	L	37.7	Very low	45.1	Very low	168 Å²	168	135.5 Å²	135.5	88%	0.88	74%	0.741	S	S	*	*			trans	71.6	65.8	-173.1	-44.2	179.9	0	0	0	114.2
895	H	47	Very low	46.2	Very low	172 Å²	172	141.7 Å²	141.7	80%	0.796	75%	0.749	S	S	*	*				-135.8	132.7	113	-132.2	-82	0	0	0	109.4	S897	H895-S897 PolarHBondContact O-N 3.39Å
896	P	41.7	Very low	47	Very low	98 Å²	98	140.8 Å²	140.8	64%	0.636	74%	0.741	S	S	*	*			trans	-69.3	118.5	148	30.4	-27.3	0	0	0	106.6
897	S	44.7	Very low	47.4	Very low	86 Å²	86	146 Å²	146	60%	0.601	75%	0.746	S	S	*	*			trans	-82.8	128.6	153.1	62.6	0	0	0	0	106.7	H895 D899	H895-S897 PolarHBondContact O-N 3.39Å; S897-D899 WeakPolarHBondContact CB-OD2 3.41Å; S897-D899 PolarHBondContact O-N 3.22Å; S897-D899 PolarHBondContact OG-OD2 2.84Å
898	E	46.1	Very low	47.9	Very low	188 Å²	188	141.2 Å²	141.2	88%	0.879	74%	0.736	S	S	*	*			trans	-81.4	54.1	177.8	-63.5	-173.5	131.3	0	0	110	P900	E898-P900 WeakPolarHBondContact O-CD 3.35Å
899	D	56.8	Low	48.4	Very low	124 Å²	124	142.3 Å²	142.3	66%	0.663	74%	0.737	S	S	*	*			trans	-78.8	107.4	171.9	-69.4	-67	0	0	0	108.4	S897	S897-D899 WeakPolarHBondContact CB-OD2 3.41Å; S897-D899 PolarHBondContact O-N 3.22Å; S897-D899 PolarHBondContact OG-OD2 2.84Å
900	P	72.4	Confident	48.8	Very low	106 Å²	106	136.8 Å²	136.8	69%	0.688	73%	0.732	S	S	*	*	P	Polyproline II helix	trans	-63.8	144.9	178.2	27.9	-34.7	0	0	0	109.7	E898	E898-P900 WeakPolarHBondContact O-CD 3.35Å
901	P	64.8	Low	48.9	Very low	113 Å²	113	142.7 Å²	142.7	73%	0.734	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-56.4	134.5	173.8	25.4	-33.8	0	0	0	109
902	P	63	Low	48.6	Very low	118 Å²	118	143.9 Å²	143.9	77%	0.766	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-55.2	127.8	-175.2	21.4	-32.9	0	0	0	109.3	Y904	P902-Y904 PolarHBondContact O-N 3.41Å
903	P	64.9	Low	48.3	Very low	115 Å²	115	143.3 Å²	143.3	75%	0.747	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-58.4	126.1	-164.8	20.1	-32.5	0	0	0	110.3	R905	P903-R905 VanDerWaalsContact C-N 3.28Å; P903-R905 PolarHBondContact O-N 3.27Å
904	Y	46.5	Very low	48.5	Very low	224 Å²	224	148.3 Å²	148.3	88%	0.878	76%	0.764	S	S	*	*			trans	-66.1	84.3	-172.6	-164.1	-84.9	0	0	0	110.1	P902 P906	P902-Y904 PolarHBondContact O-N 3.41Å; Y904-P906 WeakPolarHBondContact O-CD 3.07Å; Y904-P906 VanDerWaalsContact O-N 3.15Å
905	R	55.2	Low	48.4	Very low	227 Å²	227	147.4 Å²	147.4	86%	0.857	76%	0.755	S	S	*	*			trans	-62.6	114.2	174.9	-79.7	-168.5	173.2	-158.2	-1.3	108	P903	P903-R905 VanDerWaalsContact C-N 3.28Å; P903-R905 PolarHBondContact O-N 3.27Å
906	P	54.3	Low	48	Very low	89 Å²	89	148 Å²	148	58%	0.578	76%	0.758	S	S	*	*			trans	-61.1	143.7	169.2	27.7	-33.4	0	0	0	108.5	Y904 I908	Y904-P906 WeakPolarHBondContact O-CD 3.07Å; Y904-P906 VanDerWaalsContact O-N 3.15Å; P906-I908 VanDerWaalsContact C-N 3.27Å; P906-I908 HydrophobicContact CG-CD1 4.47Å; P906-I908 HydrophobicContact CG-CG1 4.26Å; P906-I908 PolarHBondContact O-N 3.08Å
907	Y	43.4	Very low	47.6	Very low	214 Å²	214	148.2 Å²	148.2	84%	0.839	76%	0.757	S	S	*	*			trans	-70.8	88	173.2	-176.9	-96.9	0	0	0	109	P909	Y907-P909 HydrophobicContact CD1-CG 4.4Å; Y907-P909 HydrophobicContact CE1-CG 4.25Å; Y907-P909 WeakPolarHBondContact O-CD 3.43Å
908	I	46.1	Very low	47.2	Very low	131 Å²	131	151.9 Å²	151.9	67%	0.672	77%	0.765	S	S	*	*			trans	-79	117.6	169.2	-60.2	173.3	0	0	0	106.7	P906 S910	P906-I908 VanDerWaalsContact C-N 3.27Å; P906-I908 HydrophobicContact CG-CD1 4.47Å; P906-I908 HydrophobicContact CG-CG1 4.26Å; P906-I908 PolarHBondContact O-N 3.08Å; I908-S910 PolarHBondContact O-N 2.88Å
909	P	43.3	Very low	46.8	Very low	96 Å²	96	150.4 Å²	150.4	62%	0.623	76%	0.758	S	S	*	*			trans	-67.1	106.4	172.3	-17.2	32.3	0	0	0	108.7	Y907 R911	Y907-P909 HydrophobicContact CD1-CG 4.4Å; Y907-P909 HydrophobicContact CE1-CG 4.25Å; Y907-P909 WeakPolarHBondContact O-CD 3.43Å; P909-R911 PolarHBondContact O-N 3.03Å; P909-R911 VanDerWaalsContact O-N 3.07Å
910	S	40.7	Very low	45.9	Very low	112 Å²	112	151.1 Å²	151.1	78%	0.783	76%	0.761	S	S	*	*			trans	-65	109.7	177.7	53.4	0	0	0	0	109.9	I908	I908-S910 PolarHBondContact O-N 2.88Å
911	R	39.7	Very low	44.1	Very low	238 Å²	238	153.3 Å²	153.3	90%	0.898	76%	0.764	S	S	*	*			trans	-59.1	166.8	152.4	-84.3	-177.9	165.9	177.2	-5.2	109.4	P909	P909-R911 PolarHBondContact O-N 3.03Å; P909-R911 VanDerWaalsContact O-N 3.07Å
912	C	33.7	Very low	42.7	Very low	128 Å²	128	153.9 Å²	153.9	87%	0.865	77%	0.766	S	S	*	*			trans	-39	138.7	-178.3	-54.1	0	0	0	0	114.1
913	D	35.3	Very low	41.3	Very low	168 Å²	168	152.5 Å²	152.5	90%	0.898	76%	0.759	S	S	*	*			trans	-145.4	163.8	148.3	-124.9	-36.6	0	0	0	111.7
914	R	41.5	Very low	40	Very low	200 Å²	200	153.6 Å²	153.6	76%	0.755	76%	0.758	S	S	*	*			trans	-134.1	164.7	-163	-160	-176.7	115.8	148.8	-2.6	110.7
915	E	36.6	Very low	39.3	Very low	148 Å²	148	151 Å²	151	69%	0.692	75%	0.753	S	S	*	*			trans	75.2	127.3	160.2	-47.5	-164.5	155	0	0	120.4
916	Q	36.8	Very low	38.3	Very low	186 Å²	186	145 Å²	145	87%	0.869	75%	0.747	S	S	*	*			trans	-171.8	139.5	138.5	-105.3	176.4	29.7	0	0	106.3
917	T	35.2	Very low	37.3	Very low	101 Å²	101	145.5 Å²	145.5	62%	0.62	75%	0.752	S	S	*	*			cis	-154.8	169.2	6.2	-25.5	0	0	0	0	110.1
918	Q	36.4	Very low	36.9	Very low	163 Å²	163	140.5 Å²	140.5	76%	0.762	74%	0.744	S	S	*	*			trans	71.3	136	161	-67.7	143.7	-6.1	0	0	116.3
919	E	37.1	Very low	36.6	Very low	158 Å²	158	143.3 Å²	143.3	74%	0.738	75%	0.752	S	S	*	*			cis	-153.1	152.5	4.7	-119	165.5	-144.9	0	0	114
920	L	37.5	Very low	36	Very low	138 Å²	138	146.4 Å²	146.4	72%	0.723	76%	0.762	S	S	*	*			trans	58.7	101.6	153.4	-61.6	168.2	0	0	0	123.4
921	M	35	Very low	35.9	Very low	153 Å²	153	146.2 Å²	146.2	75%	0.754	76%	0.758	S	S	*	*				83.3	132.1	123.5	-64.6	-169.5	75.2	0	0	124.1
922	T	35.8	Very low	35.7	Very low	125 Å²	125	143.1 Å²	143.1	77%	0.767	75%	0.751	S	S	*	*			trans	69.3	146.3	150.1	51.6	0	0	0	0	120.2
923	S	33.6	Very low	35.9	Very low	89 Å²	89	143.2 Å²	143.2	62%	0.622	74%	0.739	S	S	*	*			cis	-173.4	140.7	-17.7	-177.3	0	0	0	0	111.3
924	L	36	Very low	35.9	Very low	138 Å²	138	141.6 Å²	141.6	72%	0.723	73%	0.729	S	S	*	*			trans	60.3	142.8	163.8	-84.7	32.4	0	0	0	116.7
925	E	33.4	Very low	35.6	Very low	168 Å²	168	136.7 Å²	136.7	79%	0.785	73%	0.726	S	S	*	*			cis	71.3	139.4	47.6	-66	-176.4	140.9	0	0	113.7
926	S	33.3	Very low	35.6	Very low	103 Å²	103	138.1 Å²	138.1	72%	0.72	73%	0.732	S	S	*	*			cis	-165.5	171.9	-5.5	54.6	0	0	0	0	112.1
927	S	32.6	Very low	35.6	Very low	98 Å²	98	134.2 Å²	134.2	69%	0.685	73%	0.726	S	S	*	*			trans	36.6	129	141.4	-162.4	0	0	0	0	121.6
928	T	35.6	Very low	35.6	Very low	110 Å²	110	133.9 Å²	133.9	68%	0.675	73%	0.728	S	S	*	*				177.3	141.8	104	30.4	0	0	0	0	116.5
929	K	39.3	Very low	35.4	Very low	190 Å²	190	133.1 Å²	133.1	83%	0.826	73%	0.729	S	S	*	*			trans	61.8	113.7	138.1	-64.6	169.9	-175.6	176.1	0	123.1
930	L	31.9	Very low	35.4	Very low	161 Å²	161	132.9 Å²	132.9	84%	0.843	73%	0.731	S	S	*	*			trans	-24.1	160	131.3	-78.8	165.6	0	0	0	116
931	P	37.7	Very low	35.2	Very low	107 Å²	107	131.8 Å²	131.8	70%	0.695	73%	0.73	S	S	*	*			cis	-159.2	-178.5	48	48.9	-28.1	0	0	0	119.6
932	K	36.4	Very low	35.4	Very low	174 Å²	174	130.6 Å²	130.6	76%	0.757	73%	0.727	S	S	*	*				46.5	146	129.7	-80.2	-167.5	164.5	-139.9	0	122.5
933	E	36.3	Very low	35.4	Very low	129 Å²	129	132.3 Å²	132.3	60%	0.603	73%	0.731	S	S	*	*			cis	-151	171.9	1	-61.2	-150.5	130.8	0	0	113.6
934	L	35.2	Very low	35.6	Very low	135 Å²	135	131.9 Å²	131.9	71%	0.707	74%	0.741	S	S	*	*			trans	62.2	136	136.7	-107.9	70	0	0	0	124.1
935	S	37.1	Very low	35.7	Very low	97 Å²	97	131.7 Å²	131.7	68%	0.678	75%	0.746	S	S	*	*			trans	51.6	144.2	138.6	63.4	0	0	0	0	121.7
936	Q	36	Very low	36	Very low	178 Å²	178	130 Å²	130	83%	0.832	74%	0.741	S	S	*	*			cis	-173.5	175.8	-18.5	-121.8	176.6	2.6	0	0	107.2
937	S	35.4	Very low	36.2	Very low	104 Å²	104	133 Å²	133	73%	0.727	74%	0.743	S	S	*	*			trans	63.2	121.3	156.8	55.9	0	0	0	0	122.1
938	S	35.7	Very low	36.4	Very low	94 Å²	94	135.9 Å²	135.9	66%	0.657	75%	0.746	S	S	*	*			trans	69.1	106.7	134.3	64.5	0	0	0	0	123.2
939	N	32.5	Very low	36.6	Very low	147 Å²	147	138.4 Å²	138.4	79%	0.786	75%	0.754	S	S	*	*				78.1	142.4	116.1	-61	-6.3	0	0	0	122.6
940	I	37.2	Very low	36.3	Very low	152 Å²	152	134.8 Å²	134.8	78%	0.779	75%	0.748	S	S	*	*			trans	73	95.4	156.6	-64.3	155.2	0	0	0	115.2
941	T	34	Very low	36.7	Very low	115 Å²	115	132.4 Å²	132.4	71%	0.706	75%	0.745	S	S	*	*				93.5	141.7	72.1	-60.4	0	0	0	0	113.2
942	N	37.8	Very low	36.7	Very low	129 Å²	129	134 Å²	134	69%	0.69	75%	0.753	S	S	*	*			trans	86.3	105.6	171.8	-63	-42.7	0	0	0	120.1
943	N	37.2	Very low	36.6	Very low	160 Å²	160	131.2 Å²	131.2	86%	0.856	75%	0.751	S	S	*	*				40.2	122.6	119.6	-50.2	-14.3	0	0	0	120.1
944	G	37.9	Very low	36.7	Very low	80 Å²	80	133.7 Å²	133.7	83%	0.825	76%	0.759	S	S	*	*			trans	-179	72.1	171.2	0	0	0	0	0	116.6
945	T	38.1	Very low	37.1	Very low	135 Å²	135	135.2 Å²	135.2	83%	0.828	76%	0.763	S	S	*	*			trans	-57.6	154.8	172.6	-41.2	0	0	0	0	114.2
946	I	37.8	Very low	37.2	Very low	133 Å²	133	134.9 Å²	134.9	68%	0.682	76%	0.761	S	S	*	*			trans	145	138.5	134.5	-77.4	172	0	0	0	115.7
947	Q	39.1	Very low	37.2	Very low	164 Å²	164	133.6 Å²	133.6	77%	0.766	76%	0.76	S	S	*	*			trans	57.6	135.3	163.8	-74.5	145.8	14.3	0	0	119.4
948	E	35.2	Very low	37.5	Very low	159 Å²	159	136.4 Å²	136.4	74%	0.743	77%	0.766	S	S	*	*			cis	85.1	120.2	30.6	-172.2	-180	-149.5	0	0	114.6
949	L	39.7	Very low	37.7	Very low	164 Å²	164	138.6 Å²	138.6	86%	0.859	77%	0.77	S	S	*	*				-175.7	139.3	129.8	-99.6	165.5	0	0	0	114.7
950	T	34.5	Very low	38.4	Very low	113 Å²	113	136.4 Å²	136.4	69%	0.693	76%	0.764	S	S	*	*			trans	-70.8	156.5	-174.2	54.3	0	0	0	0	117.7
951	S	39.1	Very low	38.6	Very low	111 Å²	111	134.2 Å²	134.2	78%	0.776	75%	0.754	S	S	*	*			trans	174.8	153.9	138	38.1	0	0	0	0	112.6
952	T	38.7	Very low	38.8	Very low	140 Å²	140	136.4 Å²	136.4	86%	0.859	75%	0.749	S	S	*	*			cis	-156.2	148.5	-23.5	19.2	0	0	0	0	113.4
953	T	33.3	Very low	38.9	Very low	116 Å²	116	139.7 Å²	139.7	71%	0.712	75%	0.752	S	S	*	*			trans	-51.2	147.9	175.3	-52.5	0	0	0	0	119.9
954	K	40	Very low	39	Very low	181 Å²	181	141.1 Å²	141.1	79%	0.787	75%	0.751	S	S	*	*			trans	-173.9	120.6	130.9	-98.1	153.7	-175.6	178.7	0	110.7
955	Q	41.7	Very low	39	Very low	167 Å²	167	142.6 Å²	142.6	78%	0.78	74%	0.743	S	S	*	*				73.4	138.7	82.2	-75.7	-179.3	-12.1	0	0	113.5
956	S	40.2	Very low	38.7	Very low	91 Å²	91	141.1 Å²	141.1	64%	0.636	74%	0.737	S	S	*	*			cis	-162.5	151.2	12.8	55.2	0	0	0	0	114.4
957	N	36.8	Very low	38.5	Very low	150 Å²	150	140.5 Å²	140.5	80%	0.802	74%	0.744	S	S	*	*			trans	55.8	154.2	139.9	-54.7	-12	0	0	0	120.2
958	L	41.9	Very low	38.4	Very low	164 Å²	164	136.5 Å²	136.5	86%	0.859	74%	0.739	S	S	*	*			cis	-132.5	163.4	11.5	-78	168.9	0	0	0	112.2
959	N	38.7	Very low	38.5	Very low	139 Å²	139	134.1 Å²	134.1	74%	0.743	74%	0.741	S	S	*	*			trans	-107.5	168.5	166	-160.5	-4	0	0	0	108.4
960	P	47.9	Very low	38.2	Very low	102 Å²	102	133.8 Å²	133.8	66%	0.662	74%	0.74	S	S	*	*				-154.3	154.9	90.6	40.6	-22.6	0	0	0	117.7
961	D	39.9	Very low	38.6	Very low	106 Å²	106	137.1 Å²	137.1	57%	0.567	74%	0.744	S	S	*	*			trans	62.8	144.3	138.7	-73.1	-9.5	0	0	0	120.8
962	R	38.5	Very low	38.6	Very low	161 Å²	161	139 Å²	139	61%	0.608	75%	0.746	S	S	*	*			cis	-165.3	137.2	1.9	-121.1	170.8	-152.8	-173.9	19	112.7
963	R	40.5	Very low	38.4	Very low	198 Å²	198	139.2 Å²	139.2	75%	0.747	74%	0.742	S	S	*	*			trans	55.1	154.2	140.5	-62.9	163.9	-164.7	177.8	4.9	117.5
964	K	39.4	Very low	38.7	Very low	190 Å²	190	141.6 Å²	141.6	83%	0.826	75%	0.748	S	S	*	*			cis	-158.2	171.1	-5.5	-133	-166.5	170.5	-171	0	104.9
965	V	37.5	Very low	38.6	Very low	110 Å²	110	138.6 Å²	138.6	67%	0.667	75%	0.75	S	S	*	*			cis	-155.6	-174.8	4.4	66.4	0	0	0	0	109
966	C	32	Very low	38.2	Very low	105 Å²	105	141.8 Å²	141.8	71%	0.709	76%	0.755	S	S	*	*			trans	-64.3	171.9	173.2	-29.5	0	0	0	0	112.5
967	S	34.4	Very low	38.2	Very low	119 Å²	119	146 Å²	146	83%	0.832	77%	0.765	S	S	*	*			cis	-166.2	168.6	21.6	-96.1	0	0	0	0	107.9
968	A	36.4	Very low	38.4	Very low	80 Å²	80	145.7 Å²	145.7	66%	0.661	76%	0.762	S	S	*	*			cis	-165.7	169.5	-14.9	0	0	0	0	0	109
969	S	36.9	Very low	38.1	Very low	110 Å²	110	149.7 Å²	149.7	77%	0.769	77%	0.765	S	S	*	*			trans	41.7	109.6	165.8	55.5	0	0	0	0	118.8
970	N	34.8	Very low	38.5	Very low	156 Å²	156	148.6 Å²	148.6	83%	0.834	76%	0.764	S	S	*	*			cis	69	151.1	36.8	-154.4	5.9	0	0	0	115
971	K	42.4	Very low	38.4	Very low	183 Å²	183	149.2 Å²	149.2	80%	0.796	77%	0.768	S	S	*	*			trans	87.9	127.8	-163.8	-58.2	176.1	-176.7	179.9	0	113.1
972	N	38.8	Very low	38.7	Very low	150 Å²	150	150 Å²	150	80%	0.802	78%	0.779	S	S	*	*			cis	-142.9	162.9	-1.2	-95	-18.1	0	0	0	112.3
973	N	33.9	Very low	39.1	Very low	145 Å²	145	151.3 Å²	151.3	78%	0.775	79%	0.792	S	S	*	*			trans	-87.4	-173.4	175.9	-73.2	-63.4	0	0	0	112.3
974	I	39.7	Very low	39.5	Very low	166 Å²	166	153.5 Å²	153.5	85%	0.851	80%	0.8	S	S	*	*			trans	87.1	128.2	168.4	-52.1	154.6	0	0	0	112.3
975	S	38.9	Very low	39.8	Very low	119 Å²	119	147.9 Å²	147.9	83%	0.832	80%	0.795	S	S	*	*			cis	-130.9	170.2	4.4	-148.7	0	0	0	0	113.4
976	R	33.8	Very low	40.7	Very low	234 Å²	234	150 Å²	150	88%	0.883	79%	0.791	S	S	*	*			trans	-126.5	105.6	-174.3	175.8	-152.9	-71.3	-170.1	-2.4	110.8
977	E	39.8	Very low	42	Very low	179 Å²	179	148.2 Å²	148.2	84%	0.836	78%	0.78	S	S	*	*			trans	-148.9	151.3	169.4	-117	176.7	-172.1	0	0	115.5
978	I	39.8	Very low	43.4	Very low	143 Å²	143	148.7 Å²	148.7	73%	0.733	78%	0.781	S	S	*	*			trans	35.2	87.1	165.9	-42.2	-174.2	0	0	0	117.4	T980	I978-T980 PolarHBondContact O-N 2.93Å
979	R	36.4	Very low	44.4	Very low	248 Å²	248	152.9 Å²	152.9	94%	0.936	79%	0.786	S	S	*	*			trans	-77.7	108	169.2	-158.6	178.9	-158.1	164.8	5.6	110.5
980	T	47.9	Very low	46.1	Very low	116 Å²	116	150 Å²	150	71%	0.712	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-65.5	148.4	174.6	40.2	0	0	0	0	112	I978	I978-T980 PolarHBondContact O-N 2.93Å
981	P	43.8	Very low	47.8	Very low	115 Å²	115	149.9 Å²	149.9	75%	0.747	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-63.5	143.1	176.4	-20.8	33	0	0	0	111.4	H983	P981-H983 PolarHBondContact O-N 2.87Å
982	P	47.4	Very low	49.3	Very low	122 Å²	122	144.1 Å²	144.1	79%	0.792	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-62.8	133.5	179.4	26.5	-34.1	0	0	0	110.6	R984	P982-R984 PolarHBondContact O-N 3.13Å; P982-R984 VanDerWaalsContact O-N 3.12Å
983	H	46.4	Very low	51.1	Low	190 Å²	190	142 Å²	142	88%	0.88	73%	0.734	S	S	*	*	P	Polyproline II helix	trans	-51.5	120.8	169.9	-109.9	-87.5	0	0	0	109.1	P981 G985	P981-H983 PolarHBondContact O-N 2.87Å; H983-G985 PolarHBondContact O-N 2.64Å
984	R	49	Very low	53.3	Low	244 Å²	244	138.3 Å²	138.3	92%	0.921	72%	0.718	S	S	*	*			trans	-58.8	105.5	167.3	-90.7	-175.9	169.5	171.1	-2.9	107.7	P982 R986	P982-R984 PolarHBondContact O-N 3.13Å; P982-R984 VanDerWaalsContact O-N 3.12Å; R984-R986 PolarHBondContact O-N 3.42Å
985	G	46.5	Very low	55.1	Low	71 Å²	71	134.8 Å²	134.8	73%	0.732	70%	0.7	S	S	*	*	P	Polyproline II helix	trans	-54	133.8	177.1	0	0	0	0	0	110	H983 S987	H983-G985 PolarHBondContact O-N 2.64Å; G985-S987 PolarHBondContact O-N 2.82Å
986	R	56	Low	57	Low	155 Å²	155	132 Å²	132	59%	0.585	67%	0.674	S	S	*	*	P	Polyproline II helix	trans	-59.2	140.4	167.6	-73	-168.5	-177.2	168.3	12	108	R984 A990 E996	R984-R986 PolarHBondContact O-N 3.42Å; R986-A990 HydrophobicContact CB-CB 4.13Å; R986-E996 IonicContact CZ-OE1 2.84Å; R986-E996 IonicContact CZ-OE2 2.76Å; R986-E996 IonicContact NH1-OE1 2.64Å; R986-E996 PolarHBondContact NH1-OE1 3.47Å; R986-E996 VanDerWaalsContact NH1-OE1 3.14Å; R986-E996 IonicContact NH1-OE2 3.73Å; R986-E996 PolarHBondContact NH1-OE2 2.87Å; R986-E996 IonicContact NH2-OE1 3.58Å; R986-E996 PolarHBondContact NH2-OE1 3.48Å; R986-E996 IonicContact NH2-OE2 3.63Å
987	S	59.6	Low	59.2	Low	68 Å²	68	126.7 Å²	126.7	48%	0.476	66%	0.659	S	S	.	*	P	Polyproline II helix	trans	-52	142.5	172.9	172.7	0	0	0	0	110.2	G985 H989 A990	G985-S987 PolarHBondContact O-N 2.82Å; S987-H989 PolarHBondContact O-N 3.39Å; S987-H989 PolarHBondContact OG-N 3Å; S987-A990 VanDerWaalsContact O-CB 3.31Å; S987-A990 WeakPolarHBondContact O-CB 3.34Å; S987-A990 PolarHBondContact O-N 3.03Å
988	P	62.8	Low	61.2	Low	129 Å²	129	124.6 Å²	124.6	84%	0.838	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.1	-17.6	172.6	-27.3	35.9	0	0	0	114.5
989	H	58.6	Low	63.1	Low	168 Å²	168	122.5 Å²	122.5	78%	0.778	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.7	2.9	177.7	-53.2	-70.2	0	0	0	113.9	S987 L991	S987-H989 PolarHBondContact O-N 3.39Å; S987-H989 PolarHBondContact OG-N 3Å; H989-L991 PolarHBondContact O-N 3.49Å
990	A	70.9	Confident	65	Low	49 Å²	49	119 Å²	119	41%	0.405	62%	0.618	S	S	.	*			trans	-81.1	101.9	175.3	0	0	0	0	0	110.1	R986 S987	R986-A990 HydrophobicContact CB-CB 4.13Å; S987-A990 VanDerWaalsContact O-CB 3.31Å; S987-A990 WeakPolarHBondContact O-CB 3.34Å; S987-A990 PolarHBondContact O-N 3.03Å
991	L	70.8	Confident	66.5	Low	154 Å²	154	120.7 Å²	120.7	81%	0.806	61%	0.612	S	S	*	*	P	Polyproline II helix	trans	-49.7	141.9	175.1	-69.1	172.2	0	0	0	111.5	H989	H989-L991 PolarHBondContact O-N 3.49Å
992	P	73.7	Confident	68.2	Low	62 Å²	62	118.2 Å²	118.2	40%	0.403	59%	0.593	S	S	.	*	P	Polyproline II helix	trans	-52.9	144.6	172	-25.2	34.2	0	0	0	111.4
993	H	78	Confident	69.5	Low	105 Å²	105	117.5 Å²	117.5	49%	0.486	58%	0.582	S	S	.	*	P	Polyproline II helix	trans	-61.7	139.1	170.1	-172.9	-111.1	0	0	0	108.4	L995 E996 H997	H993-L995 WeakPolarHBondContact ND1-CB 3.35Å; H993-L995 PolarHBondContact O-N 3.27Å; H993-E996 HydrophobicContact CB-CB 4.32Å; H993-E996 VanDerWaalsContact CB-CD 3.45Å; H993-E996 HydrophobicContact CB-CG 3.85Å; H993-E996 WeakPolarHBondContact CB-OE2 3.49Å; H993-E996 PolarHBondContact N-OE2 3.14Å; H993-E996 WeakPolarHBondContact O-CA 3.14Å; H993-E996 WeakPolarHBondContact O-CB 3.39Å; H993-E996 PolarHBondContact O-N 2.82Å; H993-H997 PolarHBondContact O-N 2.79Å; H993-H997 VanDerWaalsContact O-N 3.13Å
994	P	79.9	Confident	70.9	Confident	68 Å²	68	112.3 Å²	112.3	44%	0.442	57%	0.567	S	S	.	*	H	α-helix	trans	-55.9	-31	-176.4	-29.1	36.5	0	0	0	113.7	H997 Y998	P994-H997 PolarHBondContact O-N 2.81Å; P994-Y998 PolarHBondContact O-N 3.36Å
995	L	77.6	Confident	72.1	Confident	92 Å²	92	103.3 Å²	103.3	48%	0.482	55%	0.545	S	S	.	.	H	α-helix	trans	-69.3	-35.2	173.7	-139.8	81.4	0	0	0	113.1	H993 H997 Y998 Q999	H993-L995 WeakPolarHBondContact ND1-CB 3.35Å; H993-L995 PolarHBondContact O-N 3.27Å; L995-H997 VanDerWaalsContact C-N 3.33Å; L995-Y998 PolarHBondContact O-N 3.03Å; L995-Q999 WeakPolarHBondContact O-CB 3.33Å; L995-Q999 VanDerWaalsContact O-CG 3.26Å; L995-Q999 WeakPolarHBondContact O-CG 3.35Å; L995-Q999 PolarHBondContact O-N 3.21Å; L995-Q999 PolarHBondContact O-OE1 2.9Å
996	E	79.1	Confident	72.8	Confident	60 Å²	60	106.6 Å²	106.6	28%	0.28	55%	0.545	S	S	.	.	H	α-helix	trans	-66.9	-36.1	174.6	-66.4	161.2	179.6	0	0	110.7	R986 H993 R1000	R986-E996 IonicContact CZ-OE1 2.84Å; R986-E996 IonicContact CZ-OE2 2.76Å; R986-E996 IonicContact NH1-OE1 2.64Å; R986-E996 PolarHBondContact NH1-OE1 3.47Å; R986-E996 VanDerWaalsContact NH1-OE1 3.14Å; R986-E996 IonicContact NH1-OE2 3.73Å; R986-E996 PolarHBondContact NH1-OE2 2.87Å; R986-E996 IonicContact NH2-OE1 3.58Å; R986-E996 PolarHBondContact NH2-OE1 3.48Å; R986-E996 IonicContact NH2-OE2 3.63Å; H993-E996 HydrophobicContact CB-CB 4.32Å; H993-E996 VanDerWaalsContact CB-CD 3.45Å; H993-E996 HydrophobicContact CB-CG 3.85Å; H993-E996 WeakPolarHBondContact CB-OE2 3.49Å; H993-E996 PolarHBondContact N-OE2 3.14Å; H993-E996 WeakPolarHBondContact O-CA 3.14Å; H993-E996 WeakPolarHBondContact O-CB 3.39Å; H993-E996 PolarHBondContact O-N 2.82Å; E996-R1000 WeakPolarHBondContact O-CB 3.33Å; E996-R1000 VanDerWaalsContact O-CG 3.31Å; E996-R1000 WeakPolarHBondContact O-CG 3.36Å; E996-R1000 PolarHBondContact O-N 2.97Å
997	H	78.4	Confident	72.7	Confident	122 Å²	122	104.1 Å²	104.1	57%	0.565	55%	0.552	S	S	*	*	H	α-helix	trans	-69.5	-41.9	174	-168.5	-54.7	0	0	0	111.9	H993 P994 L995 R1000 Y1001	H993-H997 PolarHBondContact O-N 2.79Å; H993-H997 VanDerWaalsContact O-N 3.13Å; P994-H997 PolarHBondContact O-N 2.81Å; L995-H997 VanDerWaalsContact C-N 3.33Å; H997-R1000 PolarHBondContact O-N 3.42Å; H997-Y1001 WeakPolarHBondContact O-CB 3.49Å; H997-Y1001 PolarHBondContact O-N 2.62Å
998	Y	81.8	Confident	71.9	Confident	136 Å²	136	105 Å²	105	53%	0.533	56%	0.557	S	S	.	*	H	α-helix	trans	-66.9	-41.4	177.1	-173.6	-114.7	0	0	0	111.9	P994 L995 Y1001 L1002	P994-Y998 PolarHBondContact O-N 3.36Å; L995-Y998 PolarHBondContact O-N 3.03Å; Y998-Y1001 PolarHBondContact O-N 3.38Å; Y998-L1002 HydrophobicContact CD1-CD1 4Å; Y998-L1002 HydrophobicContact CD1-CG 4.47Å; Y998-L1002 HydrophobicContact CE1-CD1 3.51Å; Y998-L1002 HydrophobicContact CE1-CG 4.13Å; Y998-L1002 HydrophobicContact CE2-CD2 4.41Å; Y998-L1002 HydrophobicContact CE2-CG 4.3Å; Y998-L1002 WeakPolarHBondContact O-CG 2.89Å; Y998-L1002 PolarHBondContact O-N 3.31Å
999	Q	79.7	Confident	71.1	Confident	99 Å²	99	107.5 Å²	107.5	46%	0.463	56%	0.558	S	S	.	*	H	α-helix	trans	-62.7	-41	173	-74.8	174.5	-44.1	0	0	112.3	L995 N1003	L995-Q999 WeakPolarHBondContact O-CB 3.33Å; L995-Q999 VanDerWaalsContact O-CG 3.26Å; L995-Q999 WeakPolarHBondContact O-CG 3.35Å; L995-Q999 PolarHBondContact O-N 3.21Å; L995-Q999 PolarHBondContact O-OE1 2.9Å; Q999-N1003 WeakPolarHBondContact O-CB 3.03Å; Q999-N1003 PolarHBondContact O-N 2.69Å; Q999-N1003 PolarHBondContact O-OD1 2.68Å
1000	R	77.5	Confident	70.3	Confident	174 Å²	174	107 Å²	107	66%	0.657	56%	0.561	S	S	*	*	H	α-helix	trans	-63	-42.9	172.2	-77.1	178.4	-175.8	-171.9	1	112.4	E996 H997 N1003 S1004	E996-R1000 WeakPolarHBondContact O-CB 3.33Å; E996-R1000 VanDerWaalsContact O-CG 3.31Å; E996-R1000 WeakPolarHBondContact O-CG 3.36Å; E996-R1000 PolarHBondContact O-N 2.97Å; H997-R1000 PolarHBondContact O-N 3.42Å; R1000-N1003 PolarHBondContact O-N 2.89Å; R1000-S1004 WeakPolarHBondContact O-CB 3.18Å; R1000-S1004 PolarHBondContact O-N 3.39Å; R1000-S1004 PolarHBondContact O-OG 3.16Å
1001	Y	79	Confident	68.8	Low	151 Å²	151	113 Å²	113	59%	0.592	58%	0.581	S	S	*	*	H	α-helix	trans	-63.7	-45.3	179	-179.3	-100.8	0	0	0	111.8	H997 Y998 S1004 A1005	H997-Y1001 WeakPolarHBondContact O-CB 3.49Å; H997-Y1001 PolarHBondContact O-N 2.62Å; Y998-Y1001 PolarHBondContact O-N 3.38Å; Y1001-S1004 PolarHBondContact O-N 3.19Å; Y1001-A1005 WeakPolarHBondContact O-CB 3.37Å; Y1001-A1005 PolarHBondContact O-N 3.42Å
1002	L	78.6	Confident	67.1	Low	63 Å²	63	111.1 Å²	111.1	33%	0.33	58%	0.576	S	S	.	*	H	α-helix	trans	-61.7	-47.4	173.1	-71.3	-178.4	0	0	0	111.7	Y998 S1004 A1005 L1006	Y998-L1002 HydrophobicContact CD1-CD1 4Å; Y998-L1002 HydrophobicContact CD1-CG 4.47Å; Y998-L1002 HydrophobicContact CE1-CD1 3.51Å; Y998-L1002 HydrophobicContact CE1-CG 4.13Å; Y998-L1002 HydrophobicContact CE2-CD2 4.41Å; Y998-L1002 HydrophobicContact CE2-CG 4.3Å; Y998-L1002 WeakPolarHBondContact O-CG 2.89Å; Y998-L1002 PolarHBondContact O-N 3.31Å; L1002-S1004 VanDerWaalsContact C-N 3.28Å; L1002-S1004 PolarHBondContact O-N 2.84Å; L1002-A1005 PolarHBondContact O-N 3.33Å; L1002-A1005 VanDerWaalsContact O-N 3.17Å; L1002-L1006 VanDerWaalsContact O-CB 3.29Å; L1002-L1006 WeakPolarHBondContact O-CB 3.29Å; L1002-L1006 VanDerWaalsContact O-CG 3.26Å; L1002-L1006 WeakPolarHBondContact O-CG 3.45Å; L1002-L1006 PolarHBondContact O-N 3.38Å
1003	N	76.5	Confident	65.2	Low	108 Å²	108	112.9 Å²	112.9	58%	0.578	59%	0.59	S	S	*	*	H	α-helix	trans	-61.5	-36.4	177.6	-71.9	23.1	0	0	0	112.1	Q999 R1000 S1007	Q999-N1003 WeakPolarHBondContact O-CB 3.03Å; Q999-N1003 PolarHBondContact O-N 2.69Å; Q999-N1003 PolarHBondContact O-OD1 2.68Å; R1000-N1003 PolarHBondContact O-N 2.89Å; N1003-S1007 VanDerWaalsContact O-CB 3.23Å; N1003-S1007 WeakPolarHBondContact O-CB 3.22Å; N1003-S1007 PolarHBondContact O-N 2.73Å; N1003-S1007 PolarHBondContact O-OG 3.28Å; N1003-S1007 VanDerWaalsContact O-OG 3.09Å
1004	S	75.8	Confident	63.4	Low	81 Å²	81	116.8 Å²	116.8	57%	0.566	61%	0.605	S	S	*	*	H	α-helix	trans	-70.6	-36.4	174.6	-69.3	0	0	0	0	113	R1000 Y1001 L1002 S1008	R1000-S1004 WeakPolarHBondContact O-CB 3.18Å; R1000-S1004 PolarHBondContact O-N 3.39Å; R1000-S1004 PolarHBondContact O-OG 3.16Å; Y1001-S1004 PolarHBondContact O-N 3.19Å; L1002-S1004 VanDerWaalsContact C-N 3.28Å; L1002-S1004 PolarHBondContact O-N 2.84Å; S1004-S1008 WeakPolarHBondContact O-CB 3.37Å; S1004-S1008 PolarHBondContact O-N 3.19Å; S1004-S1008 PolarHBondContact O-OG 3.3Å
1005	A	73.2	Confident	61.4	Low	55 Å²	55	120.6 Å²	120.6	46%	0.455	62%	0.622	S	S	.	*	H	α-helix	trans	-77.3	-20.2	176.7	0	0	0	0	0	113.6	Y1001 L1002	Y1001-A1005 WeakPolarHBondContact O-CB 3.37Å; Y1001-A1005 PolarHBondContact O-N 3.42Å; L1002-A1005 PolarHBondContact O-N 3.33Å; L1002-A1005 VanDerWaalsContact O-N 3.17Å
1006	L	60.9	Low	59.3	Low	139 Å²	139	123.4 Å²	123.4	73%	0.728	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.4	16.8	175.1	-61.8	171.1	0	0	0	112.1	L1002	L1002-L1006 VanDerWaalsContact O-CB 3.29Å; L1002-L1006 WeakPolarHBondContact O-CB 3.29Å; L1002-L1006 VanDerWaalsContact O-CG 3.26Å; L1002-L1006 WeakPolarHBondContact O-CG 3.45Å; L1002-L1006 PolarHBondContact O-N 3.38Å
1007	S	54	Low	57.1	Low	104 Å²	104	127 Å²	127	73%	0.727	66%	0.664	S	S	*	*	S	Bend	trans	-142.6	24.3	174.1	-60.6	0	0	0	0	111.5	N1003	N1003-S1007 VanDerWaalsContact O-CB 3.23Å; N1003-S1007 WeakPolarHBondContact O-CB 3.22Å; N1003-S1007 PolarHBondContact O-N 2.73Å; N1003-S1007 PolarHBondContact O-OG 3.28Å; N1003-S1007 VanDerWaalsContact O-OG 3.09Å
1008	S	43.1	Very low	54.9	Low	85 Å²	85	126.4 Å²	126.4	59%	0.594	67%	0.674	S	S	*	*			trans	-119.7	64.3	175	65	0	0	0	0	110.1	S1004	S1004-S1008 WeakPolarHBondContact O-CB 3.37Å; S1004-S1008 PolarHBondContact O-N 3.19Å; S1004-S1008 PolarHBondContact O-OG 3.3Å
1009	E	46.5	Very low	52.6	Low	182 Å²	182	128.7 Å²	128.7	85%	0.85	69%	0.686	S	S	*	*			trans	-92.4	161	159.3	-63.6	-171.5	170.1	0	0	109.1	E1011	E1009-E1011 PolarHBondContact O-N 3.07Å
1010	D	41.7	Very low	50.4	Low	157 Å²	157	131.8 Å²	131.8	84%	0.84	70%	0.7	S	S	*	*			trans	-74.9	93.7	-156.8	-68.5	-75.7	0	0	0	115.8
1011	E	39.4	Very low	48.4	Very low	175 Å²	175	132.2 Å²	132.2	82%	0.818	71%	0.707	S	S	*	*			trans	-103.1	83.6	163	-89.8	-64.9	166.5	0	0	111.9	E1009	E1009-E1011 PolarHBondContact O-N 3.07Å
1012	T	34.5	Very low	46.1	Very low	115 Å²	115	130 Å²	130	71%	0.706	71%	0.71	S	S	*	*			trans	-120.1	129.5	164.4	58.2	0	0	0	0	111.5
1013	S	33.6	Very low	43.9	Very low	100 Å²	100	134.2 Å²	134.2	70%	0.699	73%	0.733	S	S	*	*			trans	70.9	87.6	173.8	74.4	0	0	0	0	118.3
1014	K	42.1	Very low	41.9	Very low	186 Å²	186	140.3 Å²	140.3	81%	0.809	75%	0.748	S	S	*	*				-163.8	149.8	123.1	-97.9	136.2	-157.4	163.2	0	114.5
1015	N	36.9	Very low	40	Very low	148 Å²	148	141.9 Å²	141.9	79%	0.791	76%	0.756	S	S	*	*			trans	63.5	86.4	148.4	-57.4	-6.9	0	0	0	120.7
1016	N	33.3	Very low	38.1	Very low	152 Å²	152	146.6 Å²	146.6	81%	0.813	77%	0.773	S	S	*	*				1.1	141.6	122.8	-71.8	-27.3	0	0	0	119.2
1017	T	32.7	Very low	36.8	Very low	136 Å²	136	147.2 Å²	147.2	83%	0.834	78%	0.776	S	S	*	*			trans	67.7	97.3	147	-49.5	0	0	0	0	118.3
1018	S	33.2	Very low	35.8	Very low	109 Å²	109	145.8 Å²	145.8	76%	0.762	77%	0.766	S	S	*	*				-164.1	166.1	95	-160.9	0	0	0	0	112.6
1019	K	33.2	Very low	35.6	Very low	184 Å²	184	149.3 Å²	149.3	80%	0.8	77%	0.773	S	S	*	*			trans	-121	154.7	163.2	-76.6	-175.6	176.5	-179.5	0	108.2
1020	Q	33.7	Very low	34.9	Very low	163 Å²	163	146.9 Å²	146.9	76%	0.762	77%	0.766	S	S	*	*			trans	72.3	151.3	-178.3	-42.5	168.7	67.8	0	0	111.2
1021	F	33.8	Very low	34.7	Very low	183 Å²	183	145.6 Å²	145.6	80%	0.803	76%	0.764	S	S	*	*			cis	-130.6	172.9	15.4	-116.9	-84.6	0	0	0	113.4
1022	T	31.5	Very low	34.4	Very low	105 Å²	105	144.8 Å²	144.8	64%	0.644	76%	0.764	S	S	*	*			trans	-94.8	152.7	173.8	48.6	0	0	0	0	112.4
1023	D	33.4	Very low	34.6	Very low	151 Å²	151	144.4 Å²	144.4	81%	0.807	76%	0.764	S	S	*	*			trans	58.9	140.5	162.8	-50.4	-35.2	0	0	0	116.4
1024	R	33.5	Very low	34.5	Very low	236 Å²	236	145.9 Å²	145.9	89%	0.891	76%	0.764	S	S	*	*			cis	-173.2	157.1	34.4	-150.5	173.7	-173.8	-150.3	2.6	109.3
1025	P	36.4	Very low	34.2	Very low	115 Å²	115	143.3 Å²	143.3	75%	0.747	76%	0.759	S	S	*	*			trans	-92.9	154.1	173.9	35.8	-35.8	0	0	0	114.2
1026	L	33.1	Very low	34	Very low	153 Å²	153	143.4 Å²	143.4	80%	0.801	76%	0.755	S	S	*	*			trans	-164.6	132.5	154.3	-88.5	-176.1	0	0	0	107.5
1027	L	33.6	Very low	34	Very low	152 Å²	152	141.8 Å²	141.8	80%	0.796	76%	0.755	S	S	*	*				51.6	140.1	102.6	-88.9	76.1	0	0	0	116.1
1028	S	33.6	Very low	33.9	Very low	75 Å²	75	140 Å²	140	52%	0.524	75%	0.749	S	S	.	*			cis	-171.5	177.5	-6.6	38.1	0	0	0	0	110.7
1029	H	39.3	Very low	34.1	Very low	158 Å²	158	140 Å²	140	73%	0.731	74%	0.744	S	S	*	*			trans	75.4	151.6	166	-51.2	-62.9	0	0	0	117.8
1030	D	31.5	Very low	34.1	Very low	132 Å²	132	137.8 Å²	137.8	71%	0.706	74%	0.74	S	S	*	*			cis	-169.7	172.2	-34.9	-108.9	-43	0	0	0	109.4
1031	T	36	Very low	34.2	Very low	130 Å²	130	136.2 Å²	136.2	80%	0.798	74%	0.737	S	S	*	*			trans	86	104.4	159.1	-16.2	0	0	0	0	120
1032	L	34.1	Very low	34.3	Very low	157 Å²	157	132.3 Å²	132.3	82%	0.822	73%	0.733	S	S	*	*			trans	-30.4	-177.6	138.7	-65	167.1	0	0	0	117.6
1033	P	38.2	Very low	34.5	Very low	108 Å²	108	135.8 Å²	135.8	70%	0.701	74%	0.739	S	S	*	*			cis	-133.9	-169.3	-3.4	24.9	1.2	0	0	0	115.6
1034	N	30.7	Very low	34.6	Very low	131 Å²	131	133.9 Å²	133.9	70%	0.701	73%	0.733	S	S	*	*			trans	1.6	146.8	147.7	-65.2	11.1	0	0	0	119.7
1035	D	37.2	Very low	34.8	Very low	131 Å²	131	128 Å²	128	70%	0.701	72%	0.719	S	S	*	*				-150	141.1	59.1	-90.7	-47	0	0	0	111.6
1036	Q	32.6	Very low	34.8	Very low	151 Å²	151	130.1 Å²	130.1	71%	0.706	72%	0.717	S	S	*	*				68.4	132.5	75.2	-72.6	-164.7	99.6	0	0	117.1
1037	S	33.6	Very low	35	Very low	117 Å²	117	129.1 Å²	129.1	82%	0.818	72%	0.717	S	S	*	*			trans	70.8	155.1	166.8	80.9	0	0	0	0	117.9
1038	S	30.5	Very low	35.2	Very low	100 Å²	100	129.5 Å²	129.5	70%	0.699	71%	0.712	S	S	*	*			cis	-174.5	172.7	-33	56.4	0	0	0	0	110.3
1039	V	36.8	Very low	35.4	Very low	109 Å²	109	132.3 Å²	132.3	66%	0.661	73%	0.726	S	S	*	*			trans	69.6	94.3	154.7	-177.7	0	0	0	0	119
1040	N	32.4	Very low	35.1	Very low	137 Å²	137	131.6 Å²	131.6	73%	0.733	72%	0.722	S	S	*	*				64.4	163.6	119.7	-51.2	0.8	0	0	0	124.7
1041	D	36.6	Very low	35.3	Very low	130 Å²	130	133.7 Å²	133.7	70%	0.695	73%	0.732	S	S	*	*			trans	86.5	66.5	141.9	-65.3	-36.1	0	0	0	122.9
1042	S	34.8	Very low	35.1	Very low	101 Å²	101	132.6 Å²	132.6	71%	0.706	73%	0.729	S	S	*	*				86.6	160.4	107.3	80.1	0	0	0	0	122.3
1043	K	36.7	Very low	35.6	Very low	177 Å²	177	130.3 Å²	130.3	77%	0.77	72%	0.724	S	S	*	*			trans	93.4	98.1	142.6	-117.7	170.5	177.6	168.9	0	121.2
1044	T	35.7	Very low	35.5	Very low	111 Å²	111	131 Å²	131	68%	0.681	73%	0.726	S	S	*	*				79.4	143.4	127.8	47.9	0	0	0	0	122.9
1045	D	36.6	Very low	35.8	Very low	114 Å²	114	131.8 Å²	131.8	61%	0.61	73%	0.73	S	S	*	*			trans	76.1	142.7	142.7	-78.2	21.7	0	0	0	119.8
1046	K	37.7	Very low	35.8	Very low	159 Å²	159	131.6 Å²	131.6	69%	0.691	73%	0.729	S	S	*	*			cis	-169.7	-175.1	-21.2	-122.9	-175.2	-160.6	85.1	0	107.7
1047	V	37.7	Very low	36.1	Very low	132 Å²	132	132.5 Å²	132.5	80%	0.8	74%	0.739	S	S	*	*			trans	73.8	119.3	168.5	-166.3	0	0	0	0	114.2
1048	K	36.1	Very low	36.2	Very low	159 Å²	159	133.1 Å²	133.1	69%	0.691	73%	0.732	S	S	*	*			cis	93.4	97.8	22.4	-168.1	-172.2	174.5	175.5	0	116.5	H1050	K1048-H1050 VanDerWaalsContact CE-NE2 3.31Å; K1048-H1050 WeakPolarHBondContact CE-NE2 3.32Å
1049	T	38.4	Very low	36.7	Very low	134 Å²	134	137.4 Å²	137.4	82%	0.822	74%	0.741	S	S	*	*			trans	-164.9	112.2	139.9	22.9	0	0	0	0	107.5
1050	H	32.9	Very low	36.8	Very low	143 Å²	143	138.6 Å²	138.6	66%	0.662	74%	0.744	S	S	*	*				52.3	109.1	83	-76.4	-82.4	0	0	0	115.7	K1048	K1048-H1050 VanDerWaalsContact CE-NE2 3.31Å; K1048-H1050 WeakPolarHBondContact CE-NE2 3.32Å
1051	I	35.8	Very low	37.2	Very low	177 Å²	177	140.9 Å²	140.9	91%	0.908	75%	0.75	S	S	*	*				-169.7	149.1	124.7	-93	151.5	0	0	0	108.9
1052	S	31.9	Very low	37.8	Very low	106 Å²	106	142.1 Å²	142.1	74%	0.741	75%	0.754	S	S	*	*			trans	-163.6	-175.1	179.7	68.3	0	0	0	0	107.8
1053	P	44.9	Very low	38.2	Very low	109 Å²	109	142 Å²	142	71%	0.708	75%	0.751	S	S	*	*			cis	-133.4	-143	-7.4	35.1	-11.8	0	0	0	112.1
1054	V	35.2	Very low	38.8	Very low	124 Å²	124	143.9 Å²	143.9	75%	0.752	76%	0.759	S	S	*	*			trans	82.6	126.4	168.2	-172.5	0	0	0	0	114.1
1055	N	38.1	Very low	39.8	Very low	146 Å²	146	142 Å²	142	78%	0.781	75%	0.747	S	S	*	*			cis	-148.4	163.3	39.3	-145.2	-1.7	0	0	0	114.5
1056	D	35.6	Very low	40.6	Very low	128 Å²	128	139.9 Å²	139.9	68%	0.684	74%	0.741	S	S	*	*			trans	-86	161.3	-175.1	-58.1	-79.7	0	0	0	115.7
1057	N	39.3	Very low	41.9	Very low	170 Å²	170	136.7 Å²	136.7	91%	0.909	74%	0.737	S	S	*	*			trans	-163.9	144.4	135.7	-107.8	-68.6	0	0	0	112.7
1058	L	37	Very low	43	Very low	129 Å²	129	135.7 Å²	135.7	68%	0.675	74%	0.735	S	S	*	*			trans	-91.4	146.6	-171.3	-97.2	63.4	0	0	0	114.3
1059	H	40.5	Very low	44.7	Very low	191 Å²	191	131.8 Å²	131.8	88%	0.884	73%	0.733	S	S	*	*			trans	-136.8	137.8	144.6	-106.1	32.3	0	0	0	110
1060	N	38	Very low	46.7	Very low	133 Å²	133	126.4 Å²	126.4	71%	0.711	70%	0.698	S	S	*	*	P	Polyproline II helix	trans	-86.4	116	-172.7	-70.7	-5.8	0	0	0	111.4
1061	E	41.5	Very low	49.2	Very low	185 Å²	185	124.5 Å²	124.5	86%	0.864	69%	0.693	S	S	*	*	P	Polyproline II helix	trans	-68.9	129.3	161	-71.9	-66.2	115.2	0	0	109.7
1062	M	49.2	Very low	51.4	Low	157 Å²	157	121.1 Å²	121.1	77%	0.773	68%	0.676	S	S	*	*	P	Polyproline II helix	trans	-91.1	148.1	172.6	-88	-86.6	96.5	0	0	110.4
1063	P	44.4	Very low	53.9	Low	99 Å²	99	121.5 Å²	121.5	64%	0.643	67%	0.67	S	S	*	*	P	Polyproline II helix	trans	-64.2	146.2	-172.6	26.7	-35.2	0	0	0	112.7	V1065	P1063-V1065 PolarHBondContact O-N 3.49Å
1064	F	48.7	Very low	55.9	Low	216 Å²	216	119.7 Å²	119.7	95%	0.947	66%	0.657	S	S	*	*			trans	-74.3	85	-175.6	-136.5	-92.1	0	0	0	111.2
1065	V	56.3	Low	58.3	Low	72 Å²	72	118 Å²	118	44%	0.436	64%	0.637	S	S	.	*			trans	-70.7	135.7	175.7	179.4	0	0	0	0	110.3	P1063 E1070	P1063-V1065 PolarHBondContact O-N 3.49Å; V1065-E1070 HydrophobicContact CG1-CG 4.26Å
1066	S	52.4	Low	60.6	Low	68 Å²	68	115.2 Å²	115.2	48%	0.476	62%	0.622	S	S	.	*			trans	-71.6	134.4	179.8	49.7	0	0	0	0	112.1	S1068 A1069	S1066-S1068 PolarHBondContact O-N 2.89Å; S1066-A1069 PolarHBondContact O-N 2.7Å
1067	P	65.4	Low	63	Low	93 Å²	93	111.8 Å²	111.8	60%	0.604	61%	0.611	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.1	-16.9	-174	-29.5	36.5	0	0	0	116.8	R1075	P1067-R1075 PolarHBondContact O-NH2 3.2Å
1068	S	61.2	Low	65.4	Low	110 Å²	110	108.5 Å²	108.5	77%	0.769	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.5	-25.9	179.9	51.5	0	0	0	0	114.3	S1066	S1066-S1068 PolarHBondContact O-N 2.89Å
1069	A	72.3	Confident	67.7	Low	77 Å²	77	107.7 Å²	107.7	64%	0.636	58%	0.582	S	S	*	*	S	Bend	trans	-91.6	-1.9	-177.8	0	0	0	0	0	113.8	S1066	S1066-A1069 PolarHBondContact O-N 2.7Å
1070	E	80.3	Confident	69.8	Low	22 Å²	22	106.2 Å²	106.2	10%	0.103	57%	0.569	C	S	.	*			trans	-86.9	125.2	-170	-59.3	168.2	174.4	0	0	113	V1065 R1075 R1078	V1065-E1070 HydrophobicContact CG1-CG 4.26Å; E1070-R1075 PolarHBondContact O-NH2 3Å; E1070-R1075 IonicContact OE2-CZ 3.04Å; E1070-R1075 IonicContact OE2-NE 2.62Å; E1070-R1075 PolarHBondContact OE2-NE 3.13Å; E1070-R1078 IonicContact OE1-CZ 2.66Å; E1070-R1078 IonicContact OE1-NH1 2.68Å; E1070-R1078 PolarHBondContact OE1-NH1 3.34Å; E1070-R1078 IonicContact OE1-NH2 2.64Å; E1070-R1078 PolarHBondContact OE1-NH2 2.99Å; E1070-R1078 IonicContact OE2-NH2 2.66Å
1071	D	84.6	Confident	72	Confident	102 Å²	102	103.7 Å²	103.7	55%	0.545	56%	0.556	S	S	.	*			trans	-60.5	150.9	163.7	177.8	47.1	0	0	0	111.9	D1073 T1074 R1075	D1071-D1073 PolarHBondContact O-N 3.29Å; D1071-T1074 WeakPolarHBondContact O-CB 3.46Å; D1071-T1074 PolarHBondContact O-N 3.47Å; D1071-R1075 PolarHBondContact O-N 2.92Å
1072	L	82.4	Confident	74.1	Confident	106 Å²	106	99.6 Å²	99.6	56%	0.555	54%	0.539	S	S	*	.	H	α-helix	trans	-61.3	-43	-171.4	-177.9	60.1	0	0	0	112.2	T1074 R1075 I1076	L1072-T1074 VanDerWaalsContact C-N 3.33Å; L1072-T1074 PolarHBondContact O-N 2.93Å; L1072-R1075 PolarHBondContact O-N 3.32Å; L1072-I1076 HydrophobicContact CD1-CD1 4.14Å; L1072-I1076 HydrophobicContact CD1-CG1 4.37Å; L1072-I1076 HydrophobicContact CG-CD1 3.87Å; L1072-I1076 VanDerWaalsContact O-CG1 3.31Å; L1072-I1076 WeakPolarHBondContact O-CG1 3.33Å; L1072-I1076 PolarHBondContact O-N 2.75Å
1073	D	85.4	Confident	75.4	Confident	114 Å²	114	94.4 Å²	94.4	61%	0.61	52%	0.521	S	S	*	.	H	α-helix	trans	-69.6	-34.3	-178.4	-73.6	-12.6	0	0	0	111.3	D1071 R1075 I1076 A1077	D1071-D1073 PolarHBondContact O-N 3.29Å; D1073-R1075 VanDerWaalsContact C-N 3.35Å; D1073-R1075 PolarHBondContact O-N 2.89Å; D1073-I1076 PolarHBondContact O-N 2.79Å; D1073-A1077 VanDerWaalsContact O-CB 3.32Å; D1073-A1077 WeakPolarHBondContact O-CB 3.2Å; D1073-A1077 PolarHBondContact O-N 3.07Å
1074	T	85.9	Confident	77.1	Confident	72 Å²	72	94.2 Å²	94.2	44%	0.442	51%	0.513	S	S	.	.	H	α-helix	trans	-64	-40.2	172.8	-61.6	0	0	0	0	111.3	D1071 L1072 R1078	D1071-T1074 WeakPolarHBondContact O-CB 3.46Å; D1071-T1074 PolarHBondContact O-N 3.47Å; L1072-T1074 VanDerWaalsContact C-N 3.33Å; L1072-T1074 PolarHBondContact O-N 2.93Å; T1074-R1078 PolarHBondContact O-N 2.83Å; T1074-R1078 VanDerWaalsContact O-N 3.08Å
1075	R	86.5	Confident	78.2	Confident	88 Å²	88	90.9 Å²	90.9	33%	0.332	49%	0.494	S	S	.	.	H	α-helix	trans	-71.7	-37.7	178	-161.7	179.6	-62.2	121.3	-4.3	112.2	P1067 E1070 D1071 L1072 D1073 L1079	P1067-R1075 PolarHBondContact O-NH2 3.2Å; E1070-R1075 PolarHBondContact O-NH2 3Å; E1070-R1075 IonicContact OE2-CZ 3.04Å; E1070-R1075 IonicContact OE2-NE 2.62Å; E1070-R1075 PolarHBondContact OE2-NE 3.13Å; D1071-R1075 PolarHBondContact O-N 2.92Å; L1072-R1075 PolarHBondContact O-N 3.32Å; D1073-R1075 VanDerWaalsContact C-N 3.35Å; D1073-R1075 PolarHBondContact O-N 2.89Å; R1075-L1079 WeakPolarHBondContact O-CG 3.27Å; R1075-L1079 PolarHBondContact O-N 3.24Å; R1075-L1079 VanDerWaalsContact O-N 3.08Å
1076	I	85.3	Confident	78.4	Confident	88 Å²	88	95.3 Å²	95.3	45%	0.451	51%	0.508	S	S	.	.	H	α-helix	trans	-63.6	-47.4	173	-70.8	168.1	0	0	0	110.4	L1072 D1073 R1078 L1079 Y1080	L1072-I1076 HydrophobicContact CD1-CD1 4.14Å; L1072-I1076 HydrophobicContact CD1-CG1 4.37Å; L1072-I1076 HydrophobicContact CG-CD1 3.87Å; L1072-I1076 VanDerWaalsContact O-CG1 3.31Å; L1072-I1076 WeakPolarHBondContact O-CG1 3.33Å; L1072-I1076 PolarHBondContact O-N 2.75Å; D1073-I1076 PolarHBondContact O-N 2.79Å; I1076-R1078 PolarHBondContact O-N 2.87Å; I1076-L1079 PolarHBondContact O-N 3.39Å; I1076-Y1080 PolarHBondContact O-N 2.94Å
1077	A	87.1	Confident	78.4	Confident	56 Å²	56	97.8 Å²	97.8	46%	0.463	52%	0.516	S	S	.	.	H	α-helix	trans	-56.8	-48.2	177.1	0	0	0	0	0	111.4	D1073 L1079 Y1080 D1081	D1073-A1077 VanDerWaalsContact O-CB 3.32Å; D1073-A1077 WeakPolarHBondContact O-CB 3.2Å; D1073-A1077 PolarHBondContact O-N 3.07Å; A1077-L1079 PolarHBondContact O-N 3.41Å; A1077-Y1080 WeakPolarHBondContact O-CB 3.07Å; A1077-Y1080 PolarHBondContact O-N 3.25Å; A1077-Y1080 VanDerWaalsContact O-N 3.16Å; A1077-D1081 PolarHBondContact O-N 3.35Å
1078	R	89.5	Confident	77.6	Confident	100 Å²	100	98.9 Å²	98.9	38%	0.377	52%	0.516	S	S	.	.	H	α-helix	trans	-63.5	-36.5	178.7	-119.9	-172.4	-70.1	153.4	-2.5	113.6	E1070 T1074 I1076 D1081 L1082	E1070-R1078 IonicContact OE1-CZ 2.66Å; E1070-R1078 IonicContact OE1-NH1 2.68Å; E1070-R1078 PolarHBondContact OE1-NH1 3.34Å; E1070-R1078 IonicContact OE1-NH2 2.64Å; E1070-R1078 PolarHBondContact OE1-NH2 2.99Å; E1070-R1078 IonicContact OE2-NH2 2.66Å; T1074-R1078 PolarHBondContact O-N 2.83Å; T1074-R1078 VanDerWaalsContact O-N 3.08Å; I1076-R1078 PolarHBondContact O-N 2.87Å; R1078-D1081 PolarHBondContact O-N 2.68Å; R1078-L1082 WeakPolarHBondContact O-CB 3.19Å; R1078-L1082 VanDerWaalsContact O-CG 3.28Å; R1078-L1082 WeakPolarHBondContact O-CG 3.07Å; R1078-L1082 PolarHBondContact O-N 2.92Å
1079	L	85.3	Confident	76.7	Confident	113 Å²	113	99.7 Å²	99.7	59%	0.592	51%	0.511	S	S	*	.	H	α-helix	trans	-66.9	-37.5	173.7	-77.5	168.1	0	0	0	112.3	R1075 I1076 A1077 A1083	R1075-L1079 WeakPolarHBondContact O-CG 3.27Å; R1075-L1079 PolarHBondContact O-N 3.24Å; R1075-L1079 VanDerWaalsContact O-N 3.08Å; I1076-L1079 PolarHBondContact O-N 3.39Å; A1077-L1079 PolarHBondContact O-N 3.41Å; L1079-A1083 WeakPolarHBondContact O-CB 3.37Å; L1079-A1083 PolarHBondContact O-N 2.88Å
1080	Y	84.7	Confident	75.1	Confident	159 Å²	159	102 Å²	102	62%	0.624	52%	0.517	S	S	*	.	H	α-helix	trans	-65.4	-44.6	174.6	-136.9	-98.4	0	0	0	111.2	I1076 A1077 A1083 M1084	I1076-Y1080 PolarHBondContact O-N 2.94Å; A1077-Y1080 WeakPolarHBondContact O-CB 3.07Å; A1077-Y1080 PolarHBondContact O-N 3.25Å; A1077-Y1080 VanDerWaalsContact O-N 3.16Å; Y1080-A1083 PolarHBondContact O-N 3.12Å; Y1080-M1084 HydrophobicContact CD1-CE 3.98Å; Y1080-M1084 HydrophobicContact CD1-CG 4.47Å; Y1080-M1084 HydrophobicContact CE1-CE 3.49Å; Y1080-M1084 VanDerWaalsContact CE1-CE 3.49Å; Y1080-M1084 WeakPolarHBondContact O-CG 3.41Å; Y1080-M1084 PolarHBondContact O-N 2.91Å
1081	D	83.5	Confident	73	Confident	80 Å²	80	107 Å²	107	43%	0.428	55%	0.549	S	S	.	.	H	α-helix	trans	-61.9	-44.4	176.9	-121.7	52.6	0	0	0	112.3	A1077 R1078 A1083 M1084 R1085	A1077-D1081 PolarHBondContact O-N 3.35Å; R1078-D1081 PolarHBondContact O-N 2.68Å; D1081-A1083 VanDerWaalsContact C-N 3.34Å; D1081-A1083 PolarHBondContact O-N 3.05Å; D1081-M1084 PolarHBondContact O-N 3.22Å; D1081-R1085 VanDerWaalsContact O-CG 3.29Å; D1081-R1085 WeakPolarHBondContact O-CG 3.14Å; D1081-R1085 PolarHBondContact O-N 3.2Å; D1081-R1085 IonicContact OD2-CZ 3.44Å; D1081-R1085 IonicContact OD2-NE 3.39Å; D1081-R1085 PolarHBondContact OD2-NE 3.2Å; D1081-R1085 IonicContact OD2-NH2 3.14Å; D1081-R1085 PolarHBondContact OD2-NH2 3.4Å
1082	L	85.4	Confident	70.4	Confident	99 Å²	99	106.1 Å²	106.1	52%	0.518	55%	0.551	S	S	.	*	H	α-helix	trans	-62.1	-39.8	175	-77	167	0	0	0	112.1	R1078 K1086	R1078-L1082 WeakPolarHBondContact O-CB 3.19Å; R1078-L1082 VanDerWaalsContact O-CG 3.28Å; R1078-L1082 WeakPolarHBondContact O-CG 3.07Å; R1078-L1082 PolarHBondContact O-N 2.92Å; L1082-K1086 VanDerWaalsContact O-CB 3.25Å; L1082-K1086 WeakPolarHBondContact O-CB 3.27Å; L1082-K1086 PolarHBondContact O-N 3.33Å
1083	A	77.6	Confident	68	Low	48 Å²	48	108.7 Å²	108.7	40%	0.397	57%	0.566	S	S	.	*	H	α-helix	trans	-65.2	-42.5	175.1	0	0	0	0	0	112	L1079 Y1080 D1081 K1086 N1087	L1079-A1083 WeakPolarHBondContact O-CB 3.37Å; L1079-A1083 PolarHBondContact O-N 2.88Å; Y1080-A1083 PolarHBondContact O-N 3.12Å; D1081-A1083 VanDerWaalsContact C-N 3.34Å; D1081-A1083 PolarHBondContact O-N 3.05Å; A1083-K1086 PolarHBondContact O-N 3.41Å; A1083-N1087 VanDerWaalsContact O-CG 3.28Å; A1083-N1087 PolarHBondContact O-N 2.76Å; A1083-N1087 VanDerWaalsContact O-N 3.1Å; A1083-N1087 PolarHBondContact O-ND2 3.45Å
1084	M	78.8	Confident	65.5	Low	95 Å²	95	110.6 Å²	110.6	47%	0.468	58%	0.582	S	S	.	*	H	α-helix	trans	-67.8	-40.3	178.3	-67.6	-59.4	170.9	0	0	112.5	Y1080 D1081 N1087 N1088	Y1080-M1084 HydrophobicContact CD1-CE 3.98Å; Y1080-M1084 HydrophobicContact CD1-CG 4.47Å; Y1080-M1084 HydrophobicContact CE1-CE 3.49Å; Y1080-M1084 VanDerWaalsContact CE1-CE 3.49Å; Y1080-M1084 WeakPolarHBondContact O-CG 3.41Å; Y1080-M1084 PolarHBondContact O-N 2.91Å; D1081-M1084 PolarHBondContact O-N 3.22Å; M1084-N1087 PolarHBondContact O-N 3.45Å; M1084-N1088 PolarHBondContact O-N 3.44Å
1085	R	71.8	Confident	63	Low	146 Å²	146	112.6 Å²	112.6	55%	0.551	60%	0.598	S	S	*	*	H	α-helix	trans	-63.2	-46.5	172.9	-66.8	174.5	-151.8	-172.7	5.4	111.1	D1081 N1087 N1088 I1089	D1081-R1085 VanDerWaalsContact O-CG 3.29Å; D1081-R1085 WeakPolarHBondContact O-CG 3.14Å; D1081-R1085 PolarHBondContact O-N 3.2Å; D1081-R1085 IonicContact OD2-CZ 3.44Å; D1081-R1085 IonicContact OD2-NE 3.39Å; D1081-R1085 PolarHBondContact OD2-NE 3.2Å; D1081-R1085 IonicContact OD2-NH2 3.14Å; D1081-R1085 PolarHBondContact OD2-NH2 3.4Å; R1085-N1087 PolarHBondContact O-N 3.27Å; R1085-N1088 PolarHBondContact O-N 3.35Å; R1085-I1089 WeakPolarHBondContact O-CD1 3.27Å; R1085-I1089 WeakPolarHBondContact O-CG1 3.4Å; R1085-I1089 PolarHBondContact O-N 2.82Å
1086	K	61.8	Low	60.9	Low	166 Å²	166	115.4 Å²	115.4	72%	0.722	63%	0.625	S	S	*	*	H	α-helix	trans	-64	-27.3	-178.4	-165	164.7	-174.5	171.5	0	113.5	L1082 A1083	L1082-K1086 VanDerWaalsContact O-CB 3.25Å; L1082-K1086 WeakPolarHBondContact O-CB 3.27Å; L1082-K1086 PolarHBondContact O-N 3.33Å; A1083-K1086 PolarHBondContact O-N 3.41Å
1087	N	52.3	Low	58.4	Low	120 Å²	120	118.5 Å²	118.5	64%	0.642	64%	0.642	S	S	*	*	H	α-helix	trans	-80	-17.3	174.7	-70.1	-14.2	0	0	0	114.2	A1083 M1084 R1085	A1083-N1087 VanDerWaalsContact O-CG 3.28Å; A1083-N1087 PolarHBondContact O-N 2.76Å; A1083-N1087 VanDerWaalsContact O-N 3.1Å; A1083-N1087 PolarHBondContact O-ND2 3.45Å; M1084-N1087 PolarHBondContact O-N 3.45Å; R1085-N1087 PolarHBondContact O-N 3.27Å
1088	N	47.7	Very low	56.1	Low	115 Å²	115	122.7 Å²	122.7	62%	0.615	66%	0.662	S	S	*	*	H	α-helix	trans	-98.1	-12.1	-179	-75.4	-9.8	0	0	0	114.2	M1084 R1085 T1090	M1084-N1088 PolarHBondContact O-N 3.44Å; R1085-N1088 PolarHBondContact O-N 3.35Å; N1088-T1090 VanDerWaalsContact C-N 3.28Å; N1088-T1090 PolarHBondContact O-N 2.83Å
1089	I	43.6	Very low	53.5	Low	127 Å²	127	122.5 Å²	122.5	65%	0.651	68%	0.677	S	S	*	*	G	3₁₀ helix	trans	-74.5	-13.7	-173.9	-76.1	164.2	0	0	0	113.4	R1085 T1091	R1085-I1089 WeakPolarHBondContact O-CD1 3.27Å; R1085-I1089 WeakPolarHBondContact O-CG1 3.4Å; R1085-I1089 PolarHBondContact O-N 2.82Å; I1089-T1091 VanDerWaalsContact C-N 3.32Å; I1089-T1091 PolarHBondContact O-N 3.17Å
1090	T	37.3	Very low	51.1	Low	127 Å²	127	124 Å²	124	78%	0.779	69%	0.685	S	S	*	*	G	3₁₀ helix	trans	-81.4	-2.7	-177.2	-40.9	0	0	0	0	114.2	N1088	N1088-T1090 VanDerWaalsContact C-N 3.28Å; N1088-T1090 PolarHBondContact O-N 2.83Å
1091	T	36.5	Very low	48.8	Very low	125 Å²	125	123.7 Å²	123.7	77%	0.767	69%	0.689	S	S	*	*	G	3₁₀ helix	trans	-132.4	35.1	-169.7	52.7	0	0	0	0	115.7	I1089	I1089-T1091 VanDerWaalsContact C-N 3.32Å; I1089-T1091 PolarHBondContact O-N 3.17Å
1092	S	30.8	Very low	46.5	Very low	85 Å²	85	126 Å²	126	59%	0.594	70%	0.701	S	S	*	*			trans	-158	112.9	168.5	56.1	0	0	0	0	112.4
1093	N	32.2	Very low	44.2	Very low	160 Å²	160	130.7 Å²	130.7	86%	0.856	72%	0.718	S	S	*	*			trans	170	87.2	149.5	-91	-21	0	0	0	112
1094	T	32.4	Very low	42.1	Very low	154 Å²	154	132.9 Å²	132.9	95%	0.945	73%	0.73	S	S	*	*			trans	-177.2	84.5	144.8	27.8	0	0	0	0	111
1095	S	33.4	Very low	40.1	Very low	113 Å²	113	136.9 Å²	136.9	79%	0.79	75%	0.748	S	S	*	*			trans	-160.2	116.7	157.4	54.6	0	0	0	0	108.4
1096	V	41.2	Very low	38.3	Very low	148 Å²	148	139.3 Å²	139.3	90%	0.897	76%	0.762	S	S	*	*			trans	-120.5	124.5	172.8	-173.8	0	0	0	0	106.9
1097	D	34.4	Very low	37	Very low	152 Å²	152	137.7 Å²	137.7	81%	0.813	77%	0.769	S	S	*	*			trans	-78.4	144.6	-178.2	-75.5	-62.1	0	0	0	112.6
1098	T	38.9	Very low	36.3	Very low	144 Å²	144	138.3 Å²	138.3	88%	0.883	78%	0.777	S	S	*	*			trans	-139	130.6	149.1	51.8	0	0	0	0	108.5
1099	S	33.8	Very low	35.8	Very low	97 Å²	97	136.4 Å²	136.4	68%	0.678	78%	0.784	S	S	*	*			trans	-108.6	173.2	-166.2	54.6	0	0	0	0	114.1
1100	N	34.3	Very low	35.5	Very low	143 Å²	143	137.4 Å²	137.4	77%	0.765	79%	0.791	S	S	*	*			trans	70.5	130.4	174.1	-47	-28.2	0	0	0	113.5
1101	E	37.8	Very low	35.7	Very low	154 Å²	154	137 Å²	137	72%	0.72	79%	0.791	S	S	*	*			cis	-142.5	153.9	42.3	-98.9	-79.8	108.3	0	0	113.4
1102	N	35.1	Very low	35.8	Very low	127 Å²	127	138.9 Å²	138.9	68%	0.679	79%	0.794	S	S	*	*			trans	-1.5	133.4	155.3	-62.2	-58.5	0	0	0	118
1103	K	37.5	Very low	36.6	Very low	198 Å²	198	141.3 Å²	141.3	86%	0.861	81%	0.806	S	S	*	*				176.8	124.8	62.7	-172	168.3	-174.9	170.9	0	113.6
1104	S	33.2	Very low	37.4	Very low	94 Å²	94	138.1 Å²	138.1	66%	0.657	80%	0.796	S	S	*	*			trans	69.3	129.7	151.2	-160.9	0	0	0	0	122
1105	Q	35.5	Very low	39.1	Very low	180 Å²	180	136 Å²	136	84%	0.841	78%	0.784	S	S	*	*			trans	79.2	111.4	146.8	-80.6	167.5	0.8	0	0	122.6
1106	K	34.1	Very low	40.8	Very low	197 Å²	197	136.1 Å²	136.1	86%	0.857	78%	0.783	S	S	*	*			trans	92	110.6	142.6	-143.9	169.6	-170.6	175.5	0	116.3	T1108	K1106-T1108 PolarHBondContact O-N 2.83Å
1107	P	36	Very low	42.3	Very low	132 Å²	132	134.7 Å²	134.7	86%	0.857	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-75.7	126.5	-174.7	30.5	-34.3	0	0	0	111.9
1108	T	36	Very low	44.3	Very low	133 Å²	133	133 Å²	133	82%	0.816	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-81.8	147.7	161.7	41	0	0	0	0	110	K1106	K1106-T1108 PolarHBondContact O-N 2.83Å
1109	G	36.8	Very low	46.2	Very low	74 Å²	74	131.5 Å²	131.5	76%	0.763	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-72.3	143.9	-175.4	0	0	0	0	0	113.3
1110	N	39.1	Very low	48.2	Very low	149 Å²	149	132.4 Å²	132.4	80%	0.797	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-57	139.9	174.8	-65.3	-8.7	0	0	0	111	I1112	N1110-I1112 PolarHBondContact O-N 3.36Å; N1110-I1112 VanDerWaalsContact O-N 3.17Å
1111	P	41.7	Very low	50.1	Low	119 Å²	119	130 Å²	130	77%	0.773	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-67.2	116.3	174	28.2	-33	0	0	0	109.5	T1113	P1111-T1113 PolarHBondContact O-N 3.06Å; P1111-T1113 VanDerWaalsContact O-N 3.08Å
1112	I	37.9	Very low	51.8	Low	164 Å²	164	128 Å²	128	84%	0.841	76%	0.756	S	S	*	*			trans	-67.6	107.8	169	-62.7	174.2	0	0	0	107	N1110 S1114	N1110-I1112 PolarHBondContact O-N 3.36Å; N1110-I1112 VanDerWaalsContact O-N 3.17Å; I1112-S1114 PolarHBondContact O-N 3.07Å
1113	T	48.1	Very low	53.3	Low	135 Å²	135	125.7 Å²	125.7	83%	0.828	75%	0.748	S	S	*	*			trans	-62.7	101.7	174.4	-48.1	0	0	0	0	108.8	P1111	P1111-T1113 PolarHBondContact O-N 3.06Å; P1111-T1113 VanDerWaalsContact O-N 3.08Å
1114	S	47.5	Very low	54.1	Low	93 Å²	93	121.5 Å²	121.5	65%	0.65	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-64.9	138.2	-177.4	54.3	0	0	0	0	110.6	I1112	I1112-S1114 PolarHBondContact O-N 3.07Å
1115	P	69.3	Low	55.1	Low	109 Å²	109	121.5 Å²	121.5	71%	0.708	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-58.1	151	172.5	26.9	-34.5	0	0	0	110.1
1116	P	68.9	Low	56	Low	117 Å²	117	118 Å²	118	76%	0.76	72%	0.723	S	S	*	*	P	Polyproline II helix	trans	-58.5	143.6	-179.1	24.6	-34.2	0	0	0	110.8
1117	P	73.1	Confident	56.7	Low	117 Å²	117	115.2 Å²	115.2	76%	0.76	71%	0.707	S	S	*	*	P	Polyproline II helix	trans	-61.8	142.9	-179	26.4	-34.4	0	0	0	110.6
1118	P	75.9	Confident	57.3	Low	116 Å²	116	114.6 Å²	114.6	75%	0.753	70%	0.695	S	S	*	*	P	Polyproline II helix	trans	-61.2	146.3	177.2	26.6	-34.5	0	0	0	110.5
1119	P	77.6	Confident	57.8	Low	114 Å²	114	115.1 Å²	115.1	74%	0.74	69%	0.692	S	S	*	*	P	Polyproline II helix	trans	-59.5	144.6	-178.6	24.8	-34.3	0	0	0	111.1
1120	P	77.4	Confident	58.3	Low	116 Å²	116	120.7 Å²	120.7	75%	0.753	70%	0.696	S	S	*	*	P	Polyproline II helix	trans	-60.2	141.4	-177.6	25.1	-34.2	0	0	0	110.7	L1122	P1120-L1122 PolarHBondContact O-N 3.5Å
1121	P	74.5	Confident	58.2	Low	91 Å²	91	117.7 Å²	117.7	59%	0.591	68%	0.683	S	S	*	*	P	Polyproline II helix	trans	-61.4	136.3	-178.6	25	-33.8	0	0	0	111
1122	L	72.3	Confident	58.2	Low	112 Å²	112	121.3 Å²	121.3	59%	0.586	69%	0.689	S	S	*	*	P	Polyproline II helix	trans	-49.7	140.7	177.9	-65.8	169.6	0	0	0	111.3	P1120 Q1126	P1120-L1122 PolarHBondContact O-N 3.5Å; L1122-Q1126 HydrophobicContact CB-CB 4.38Å
1123	P	66.3	Low	58.4	Low	79 Å²	79	124.7 Å²	124.7	51%	0.513	69%	0.691	S	S	.	*	P	Polyproline II helix	trans	-50.4	145	178.2	-27.9	34.8	0	0	0	112.3	S1125 Q1126 R1127	P1123-S1125 PolarHBondContact O-N 3.22Å; P1123-Q1126 PolarHBondContact O-N 3.25Å; P1123-R1127 PolarHBondContact O-N 3.48Å
1124	T	54.7	Low	57.9	Low	111 Å²	111	123.6 Å²	123.6	68%	0.681	69%	0.687	S	S	*	*	H	α-helix	trans	-53.3	-31.5	-172.6	-46.4	0	0	0	0	113.4	Q1126 R1127 I1128	T1124-Q1126 VanDerWaalsContact C-N 3.32Å; T1124-Q1126 PolarHBondContact O-N 3.4Å; T1124-R1127 PolarHBondContact O-N 3.42Å; T1124-I1128 HydrophobicContact CG2-CD1 4.5Å; T1124-I1128 WeakPolarHBondContact O-CD1 3.41Å; T1124-I1128 WeakPolarHBondContact O-CG1 3.39Å; T1124-I1128 PolarHBondContact O-N 2.87Å
1125	S	53.6	Low	57.3	Low	93 Å²	93	127.6 Å²	127.6	65%	0.65	70%	0.695	S	S	*	*	H	α-helix	trans	-62.4	-30.1	174.6	51.2	0	0	0	0	114.7	P1123	P1123-S1125 PolarHBondContact O-N 3.22Å
1126	Q	55	Low	55.8	Low	108 Å²	108	127.5 Å²	127.5	51%	0.505	69%	0.688	S	S	.	*	H	α-helix	trans	-89.6	-27.6	177.5	-67.4	178	-13.1	0	0	112.1	L1122 P1123 T1124 I1128	L1122-Q1126 HydrophobicContact CB-CB 4.38Å; P1123-Q1126 PolarHBondContact O-N 3.25Å; T1124-Q1126 VanDerWaalsContact C-N 3.32Å; T1124-Q1126 PolarHBondContact O-N 3.4Å; Q1126-I1128 VanDerWaalsContact C-N 3.33Å; Q1126-I1128 PolarHBondContact O-N 2.98Å
1127	R	50	Low	54.1	Low	137 Å²	137	122.7 Å²	122.7	52%	0.517	66%	0.657	S	S	.	*	H	α-helix	trans	-67.1	-32.8	-180	-137.1	168.1	-175.9	171.6	-0.1	112.9	P1123 T1124 L1129 F1130 T1131	P1123-R1127 PolarHBondContact O-N 3.48Å; T1124-R1127 PolarHBondContact O-N 3.42Å; R1127-L1129 PolarHBondContact O-N 3.25Å; R1127-F1130 PolarHBondContact O-N 3.04Å; R1127-T1131 HydrophobicContact CG-CG2 4.35Å; R1127-T1131 PolarHBondContact O-OG1 2.89Å
1128	I	48.1	Very low	52.2	Low	119 Å²	119	122.6 Å²	122.6	61%	0.61	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.6	-22.7	-177	-70.6	162.3	0	0	0	113.6	T1124 Q1126	T1124-I1128 HydrophobicContact CG2-CD1 4.5Å; T1124-I1128 WeakPolarHBondContact O-CD1 3.41Å; T1124-I1128 WeakPolarHBondContact O-CG1 3.39Å; T1124-I1128 PolarHBondContact O-N 2.87Å; Q1126-I1128 VanDerWaalsContact C-N 3.33Å; Q1126-I1128 PolarHBondContact O-N 2.98Å
1129	L	46.6	Very low	50.2	Low	144 Å²	144	124.8 Å²	124.8	75%	0.754	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.3	-7.2	178.6	-81.6	167.4	0	0	0	114.7	R1127	R1127-L1129 PolarHBondContact O-N 3.25Å
1130	F	46.5	Very low	48.1	Very low	191 Å²	191	123.8 Å²	123.8	84%	0.838	64%	0.644	S	S	*	*	S	Bend	trans	-135.2	9.2	-171.5	-80.4	-79.8	0	0	0	115.9	R1127	R1127-F1130 PolarHBondContact O-N 3.04Å
1131	T	36.7	Very low	45.9	Very low	86 Å²	86	125.6 Å²	125.6	53%	0.528	65%	0.648	S	S	.	*			trans	-125.8	89.1	-176.3	60.5	0	0	0	0	114.5	R1127	R1127-T1131 HydrophobicContact CG-CG2 4.35Å; R1127-T1131 PolarHBondContact O-OG1 2.89Å
1132	H	41.5	Very low	44	Very low	195 Å²	195	127.4 Å²	127.4	90%	0.903	66%	0.657	S	S	*	*			trans	-137.3	90.7	159.6	-86.9	-64.4	0	0	0	111.7
1133	R	43.7	Very low	42.2	Very low	236 Å²	236	126.1 Å²	126.1	89%	0.891	66%	0.657	S	S	*	*			trans	-151.6	118.3	163.9	-172.9	-178.6	-165.5	170.5	6.8	110.2
1134	P	36.8	Very low	40.9	Very low	112 Å²	112	131.8 Å²	131.8	73%	0.727	67%	0.674	S	S	*	*			trans	-103.3	-177.1	159.3	-2.8	24.5	0	0	0	111.8
1135	Q	34.3	Very low	40	Very low	176 Å²	176	131 Å²	131	82%	0.822	67%	0.673	S	S	*	*			trans	-108.4	176.3	-177.4	-68.7	170.4	-92.3	0	0	112.9
1136	N	37.5	Very low	39	Very low	107 Å²	107	132 Å²	132	57%	0.572	67%	0.67	S	S	*	*			trans	-93.7	-150.9	-177.1	-141.9	33.9	0	0	0	110.2	L328	L328-N1136 WeakPolarHBondContact CD2-O 3.41Å
1137	P	34.2	Very low	38.2	Very low	16 Å²	16	132.5 Å²	132.5	10%	0.104	68%	0.681	C	S	.	*			cis	-64.8	-148.3	-33.8	-26	37.1	0	0	0	115.4	E327 L328 S329 D330	E327-P1137 CarbonylContact C-O 3.59Å; E327-P1137 VanDerWaalsContact CA-O 3.25Å; E327-P1137 WeakPolarHBondContact CA-O 3.43Å; E327-P1137 PolarHBondContact N-O 2.83Å; L328-P1137 WeakPolarHBondContact CA-O 3.3Å; L328-P1137 PolarHBondContact N-O 3.17Å; S329-P1137 VanDerWaalsContact C-CG 3.45Å; S329-P1137 WeakPolarHBondContact O-CG 3.33Å; D330-P1137 HydrophobicContact CB-CG 4.45Å; D330-P1137 WeakPolarHBondContact OD1-CG 2.97Å; D330-P1137 WeakPolarHBondContact OD2-CD 3.46Å
1138	I	33.9	Very low	38	Very low	115 Å²	115	131.3 Å²	131.3	59%	0.59	69%	0.691	S	S	*	*			cis	88.7	100.3	1.5	-33.5	165.6	0	0	0	121	L328 S329	L328-I1138 CarbonylContact O-C 3.05Å; L328-I1138 WeakPolarHBondContact O-CA 3.2Å; L328-I1138 PolarHBondContact O-N 3.34Å; L328-I1138 VanDerWaalsContact O-N 3.16Å; S329-I1138 PolarHBondContact N-O 2.9Å
1139	H	34	Very low	37.2	Very low	163 Å²	163	133.5 Å²	133.5	76%	0.755	70%	0.703	S	S	*	*			trans	-166	132.8	131.8	-116.1	-78.6	0	0	0	117.3	L328	L328-H1139 PolarHBondContact O-N 3.39Å
1140	S	31.9	Very low	36.4	Very low	92 Å²	92	131.9 Å²	131.9	64%	0.643	70%	0.704	S	S	*	*			trans	51	113.4	157.5	54.5	0	0	0	0	124.2
1141	N	31.2	Very low	35.9	Very low	155 Å²	155	127.9 Å²	127.9	83%	0.829	70%	0.699	S	S	*	*				38.4	132	121.5	-52.8	-21.2	0	0	0	119.8
1142	V	34.8	Very low	35.6	Very low	129 Å²	129	128.7 Å²	128.7	78%	0.782	71%	0.709	S	S	*	*				-158.5	139.2	50.9	163.5	0	0	0	0	112.8
1143	S	34.2	Very low	35.3	Very low	85 Å²	85	127.5 Å²	127.5	59%	0.594	70%	0.704	S	S	*	*			trans	18.7	130.2	150.4	-61.3	0	0	0	0	123.8
1144	K	39.4	Very low	34.6	Very low	197 Å²	197	123.6 Å²	123.6	86%	0.857	70%	0.695	S	S	*	*				63.9	151.5	124	-54.5	168.6	-167.7	174	0	117.2
1145	S	35.5	Very low	34.3	Very low	94 Å²	94	124.4 Å²	124.4	66%	0.657	69%	0.69	S	S	*	*			cis	-169	148.6	40.9	57.1	0	0	0	0	113.9
1146	L	33.3	Very low	34.1	Very low	115 Å²	115	122.1 Å²	122.1	60%	0.602	68%	0.682	S	S	*	*			trans	63	152.2	137.8	-64.3	168.6	0	0	0	119.9	E426	E426-L1146 VanDerWaalsContact OE1-CD1 3.28Å; E426-L1146 WeakPolarHBondContact OE1-CD1 3.26Å
1147	T	38.6	Very low	33.7	Very low	118 Å²	118	121.2 Å²	121.2	72%	0.724	67%	0.671	S	S	*	*			cis	-160.7	165.5	-34	10.2	0	0	0	0	108.2
1148	P	45	Very low	33.6	Very low	112 Å²	112	125.5 Å²	125.5	73%	0.727	69%	0.692	S	S	*	*			trans	-96.4	149.5	-172.6	36.7	-33.2	0	0	0	115.2
1149	L	32.8	Very low	33.6	Very low	166 Å²	166	126 Å²	126	87%	0.869	71%	0.706	S	S	*	*			trans	-115.6	140.2	145.3	-85.4	79.8	0	0	0	106.6
1150	S	29.4	Very low	33.6	Very low	110 Å²	110	123.8 Å²	123.8	77%	0.769	71%	0.709	S	S	*	*			cis	81.9	146.6	46	-161.2	0	0	0	0	113.1
1151	S	35.7	Very low	33.5	Very low	106 Å²	106	127 Å²	127	74%	0.741	71%	0.713	S	S	*	*			trans	69.3	118	-161.6	-57.7	0	0	0	0	113.5
1152	S	30.3	Very low	33.5	Very low	103 Å²	103	126.9 Å²	126.9	72%	0.72	71%	0.705	S	S	*	*			cis	78.9	151.4	26.8	104.2	0	0	0	0	115
1153	Q	34.1	Very low	33.5	Very low	171 Å²	171	126.5 Å²	126.5	80%	0.799	70%	0.698	S	S	*	*			trans	69.3	145.9	-171.2	-57.8	-176.5	-4.8	0	0	114.6
1154	Q	29	Very low	33.5	Very low	153 Å²	153	126.9 Å²	126.9	72%	0.715	69%	0.693	S	S	*	*			cis	169.6	124.2	-31.5	-114.5	178.1	-59.6	0	0	104.9
1155	E	30.6	Very low	33.5	Very low	130 Å²	130	120.3 Å²	120.3	61%	0.607	67%	0.672	S	S	*	*			trans	61.2	155.3	159.4	-60.1	-158.8	-164.8	0	0	116.9	R1157	E1155-R1157 IonicContact OE2-CZ 2.92Å; E1155-R1157 IonicContact OE2-NE 2.67Å; E1155-R1157 PolarHBondContact OE2-NE 2.85Å; E1155-R1157 IonicContact OE2-NH2 3.21Å; E1155-R1157 PolarHBondContact OE2-NH2 2.91Å
1156	L	31.2	Very low	33.6	Very low	128 Å²	128	122.1 Å²	122.1	67%	0.67	68%	0.675	S	S	*	*				-160.6	121.9	55.9	-79.8	164.7	0	0	0	113
1157	R	29.8	Very low	33.8	Very low	88 Å²	88	122.1 Å²	122.1	33%	0.332	68%	0.675	S	S	.	*				52.4	100.8	124.9	-59.6	-179.6	-156.7	161.3	5.6	117.4	E1155 K1162 N1164	E1155-R1157 IonicContact OE2-CZ 2.92Å; E1155-R1157 IonicContact OE2-NE 2.67Å; E1155-R1157 PolarHBondContact OE2-NE 2.85Å; E1155-R1157 IonicContact OE2-NH2 3.21Å; E1155-R1157 PolarHBondContact OE2-NH2 2.91Å; R1157-K1162 PolarHBondContact O-N 3.34Å; R1157-N1164 PolarHBondContact NH1-OD1 3.3Å; R1157-N1164 PolarHBondContact NH2-OD1 3.42Å
1158	L	31.1	Very low	33.8	Very low	105 Å²	105	126.1 Å²	126.1	55%	0.55	68%	0.677	S	S	.	*	T	Hydrogen-bonded Turn		95.3	136	91.4	-89.8	163.3	0	0	0	110.8	H1161 K1162 I1163	L1158-H1161 CarbonylContact O-C 3.22Å; L1158-H1161 WeakPolarHBondContact O-CA 3.48Å; L1158-H1161 PolarHBondContact O-N 3.19Å; L1158-K1162 PolarHBondContact O-N 2.64Å; L1158-I1163 WeakPolarHBondContact CD1-O 3.49Å
1159	S	34.9	Very low	33.3	Very low	127 Å²	127	127.8 Å²	127.8	89%	0.888	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	48.2	-152.1	174.6	-162.6	0	0	0	0	112.8	H1161	S1159-H1161 VanDerWaalsContact C-N 3.26Å; S1159-H1161 PolarHBondContact O-N 3.33Å
1160	S	34.1	Very low	33.6	Very low	116 Å²	116	126.5 Å²	126.5	81%	0.811	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.9	83	144.7	-65.7	0	0	0	0	109.1
1161	H	29.8	Very low	33.9	Very low	159 Å²	159	128.2 Å²	128.2	74%	0.736	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	69	141.6	-175.9	-60.1	-56	0	0	0	119.6	L1158 S1159	L1158-H1161 CarbonylContact O-C 3.22Å; L1158-H1161 WeakPolarHBondContact O-CA 3.48Å; L1158-H1161 PolarHBondContact O-N 3.19Å; S1159-H1161 VanDerWaalsContact C-N 3.26Å; S1159-H1161 PolarHBondContact O-N 3.33Å
1162	K	30	Very low	34	Very low	152 Å²	152	128.3 Å²	128.3	66%	0.661	66%	0.661	S	S	*	*			trans	84.8	141.3	145.2	-83.7	174	178.4	177.5	0	121.7	R1157 L1158	R1157-K1162 PolarHBondContact O-N 3.34Å; L1158-K1162 PolarHBondContact O-N 2.64Å
1163	I	35.5	Very low	34.2	Very low	122 Å²	122	129.7 Å²	129.7	63%	0.626	66%	0.66	S	S	*	*			trans	69.2	131.8	144.7	-69.1	164.3	0	0	0	120.4	L1158	L1158-I1163 WeakPolarHBondContact CD1-O 3.49Å
1164	N	34.4	Very low	34.2	Very low	92 Å²	92	128.1 Å²	128.1	49%	0.492	66%	0.662	S	S	.	*			cis	-172.8	146.4	-17.3	-169.3	27.1	0	0	0	112.4	R1157	R1157-N1164 PolarHBondContact NH1-OD1 3.3Å; R1157-N1164 PolarHBondContact NH2-OD1 3.42Å
1165	S	39.2	Very low	34.7	Very low	60 Å²	60	124 Å²	124	42%	0.42	66%	0.662	S	S	.	*			trans	56.5	127.3	141.1	-77.6	0	0	0	0	125.7
1166	N	38	Very low	35.1	Very low	132 Å²	132	126.6 Å²	126.6	71%	0.706	67%	0.673	S	S	*	*				70.5	142.3	118.1	-54.1	-3.2	0	0	0	120.2
1167	N	36.5	Very low	35.2	Very low	114 Å²	114	131.4 Å²	131.4	61%	0.61	68%	0.683	S	S	*	*				-167.5	149.3	72.5	-102.5	-84.3	0	0	0	118.3
1168	R	39.2	Very low	35.6	Very low	202 Å²	202	130.9 Å²	130.9	76%	0.762	70%	0.704	S	S	*	*			trans	71.9	126.6	152.3	-62.7	151.7	-158	-167.4	-0.4	116.9
1169	N	34.3	Very low	36.1	Very low	148 Å²	148	131.2 Å²	131.2	79%	0.791	71%	0.713	S	S	*	*			cis	78.9	160.3	29.9	-58.4	-22.6	0	0	0	115.8
1170	L	38	Very low	36.1	Very low	139 Å²	139	132.3 Å²	132.3	73%	0.728	71%	0.707	S	S	*	*			trans	86.9	135.2	176	-75.6	69.1	0	0	0	115.6
1171	E	37.2	Very low	36.1	Very low	145 Å²	145	133.2 Å²	133.2	68%	0.678	70%	0.703	S	S	*	*			cis	-170	172.1	-17.2	-130.7	-179.2	146.1	0	0	113.6
1172	N	36.6	Very low	36.5	Very low	108 Å²	108	136.6 Å²	136.6	58%	0.578	71%	0.709	S	S	*	*			trans	67.3	97.9	141	-71.8	-28.4	0	0	0	125.2
1173	N	34.6	Very low	36.8	Very low	132 Å²	132	133.9 Å²	133.9	71%	0.706	71%	0.709	S	S	*	*				89.1	147	95.9	-98	-42.8	0	0	0	126.4
1174	T	35	Very low	36.7	Very low	138 Å²	138	135.1 Å²	135.1	85%	0.847	72%	0.717	S	S	*	*			trans	80.5	142	144.2	45.5	0	0	0	0	125.3
1175	G	38.5	Very low	36.9	Very low	68 Å²	68	138.8 Å²	138.8	70%	0.701	73%	0.731	S	S	*	*			trans	112.3	96.3	165.8	0	0	0	0	0	115
1176	H	39.8	Very low	36.8	Very low	184 Å²	184	142.3 Å²	142.3	85%	0.852	74%	0.744	S	S	*	*				66.3	146.6	62.8	-74.3	-25.6	0	0	0	117
1177	R	33.3	Very low	36.6	Very low	229 Å²	229	141.3 Å²	141.3	86%	0.864	75%	0.747	S	S	*	*			cis	-175.8	113.7	-27.6	-170	-176.6	-157.7	-132.7	8.7	111.5
1178	G	37	Very low	36.4	Very low	76 Å²	76	141.3 Å²	141.3	78%	0.784	76%	0.757	S	S	*	*			trans	68.7	-171.9	171	0	0	0	0	0	115.8
1179	P	43.1	Very low	36.3	Very low	113 Å²	113	137.1 Å²	137.1	73%	0.734	76%	0.758	S	S	*	*			cis	-126.9	150	-2.2	45	-30.7	0	0	0	114.3
1180	I	34.3	Very low	36.2	Very low	149 Å²	149	134.9 Å²	134.9	76%	0.764	75%	0.754	S	S	*	*				87	129	99.1	-65.1	175.9	0	0	0	118.4
1181	D	34.4	Very low	36	Very low	136 Å²	136	135.5 Å²	135.5	73%	0.727	76%	0.757	S	S	*	*			trans	22.6	141.2	155.3	-50.8	-16.4	0	0	0	124.9
1182	R	38.3	Very low	35.8	Very low	229 Å²	229	135.2 Å²	135.2	86%	0.864	76%	0.756	S	S	*	*				176.6	116.9	99.4	-93.4	175.2	-173.1	-176.5	1.1	111.2
1183	S	36.4	Very low	35.7	Very low	95 Å²	95	136.8 Å²	136.8	66%	0.664	76%	0.76	S	S	*	*				72.2	142.2	83.6	84	0	0	0	0	114.3
1184	N	33.6	Very low	35.7	Very low	149 Å²	149	136.7 Å²	136.7	80%	0.797	76%	0.755	S	S	*	*			cis	-173.9	-173.7	-12.7	-113	-10.8	0	0	0	107.7
1185	Q	37.9	Very low	35.7	Very low	168 Å²	168	134.7 Å²	134.7	79%	0.785	74%	0.738	S	S	*	*			trans	81.1	146	155.3	-56.4	-149.5	78.9	0	0	119.5
1186	I	36.8	Very low	35.4	Very low	135 Å²	135	140 Å²	140	69%	0.692	74%	0.737	S	S	*	*			cis	-162	160	-31.5	-139	162.9	0	0	0	112.5
1187	S	33.7	Very low	35.2	Very low	110 Å²	110	140.3 Å²	140.3	77%	0.769	73%	0.732	S	S	*	*			trans	50	141.4	155.6	-59.4	0	0	0	0	124.9
1188	S	33.1	Very low	35.4	Very low	115 Å²	115	136.8 Å²	136.8	80%	0.804	73%	0.73	S	S	*	*			trans	-97.8	151.9	173.8	52.6	0	0	0	0	114.9
1189	S	35.8	Very low	35.6	Very low	113 Å²	113	138.6 Å²	138.6	79%	0.79	73%	0.728	S	S	*	*			trans	-157.4	139.5	142.1	52	0	0	0	0	107.1
1190	S	33.8	Very low	35.1	Very low	102 Å²	102	139 Å²	139	71%	0.713	73%	0.733	S	S	*	*			cis	73	95.9	30.8	-169.1	0	0	0	0	114.4
1191	L	33.8	Very low	35	Very low	151 Å²	151	135.3 Å²	135.3	79%	0.791	73%	0.731	S	S	*	*				-179.4	138.8	114.4	-99.6	173.9	0	0	0	115.5
1192	H	33.1	Very low	35	Very low	140 Å²	140	134.5 Å²	134.5	65%	0.648	74%	0.737	S	S	*	*			trans	62.5	153.7	135.2	-113.2	17.6	0	0	0	125.7
1193	E	34.5	Very low	34.8	Very low	141 Å²	141	132.7 Å²	132.7	66%	0.659	74%	0.737	S	S	*	*			trans	71	143.3	144.3	-75.2	178.5	135.2	0	0	122.8
1194	Q	34.4	Very low	35.1	Very low	130 Å²	130	133.9 Å²	133.9	61%	0.607	74%	0.743	S	S	*	*			cis	-168.6	174.3	-27.9	-129.8	-178.7	53.2	0	0	111.9
1195	I	34.5	Very low	35.4	Very low	95 Å²	95	132.8 Å²	132.8	49%	0.487	74%	0.744	S	S	.	*			trans	74.6	108.9	143.6	-83.7	176	0	0	0	121
1196	R	31.5	Very low	35.3	Very low	179 Å²	179	128 Å²	128	68%	0.675	74%	0.74	S	S	*	*			trans	60.6	161.4	134.8	-47.7	174.4	-152.5	168.9	6.5	118.3
1197	Y	36.2	Very low	35.7	Very low	191 Å²	191	126.8 Å²	126.8	75%	0.749	74%	0.74	S	S	*	*			cis	-129.6	153.4	10.5	-95.6	-87	0	0	0	113.6
1198	L	37.9	Very low	35.7	Very low	156 Å²	156	127 Å²	127	82%	0.817	73%	0.733	S	S	*	*			trans	-91.4	161.2	164.4	-83.4	166.7	0	0	0	109.4
1199	P	40.7	Very low	35.7	Very low	114 Å²	114	125.1 Å²	125.1	74%	0.74	71%	0.714	S	S	*	*				-150.2	146.3	83.8	37.7	-18	0	0	0	118.9
1200	S	32.5	Very low	35.5	Very low	122 Å²	122	125.2 Å²	125.2	85%	0.853	71%	0.705	S	S	*	*			trans	38.8	138.3	130.8	-49.9	0	0	0	0	123.8
1201	G	32.7	Very low	35.6	Very low	70 Å²	70	121.7 Å²	121.7	72%	0.722	68%	0.679	S	S	*	*			trans	-171.7	71.8	166.3	0	0	0	0	0	116.3
1202	S	33.8	Very low	35.8	Very low	120 Å²	120	114.8 Å²	114.8	84%	0.839	64%	0.643	S	S	*	*			trans	51.2	121.4	161.5	52.1	0	0	0	0	120.9
1203	H	33.5	Very low	35.8	Very low	191 Å²	191	109.5 Å²	109.5	88%	0.884	62%	0.619	S	S	*	*			trans	-81.3	154.4	179.1	-73.6	-121.5	0	0	0	114.6
1204	P	43.5	Very low	35.8	Very low	119 Å²	119	105.3 Å²	105.3	77%	0.773	61%	0.605	S	S	*	*			trans	-105.8	148.4	166.1	37.6	-31	0	0	0	113.9
1205	P	40.4	Very low	35.7	Very low	127 Å²	127	108.9 Å²	108.9	83%	0.825	61%	0.614	S	S	*	*			trans	-113.2	176.1	168.6	40.3	-31.9	0	0	0	113.9
1206	G	36.2	Very low	35.6	Very low	68 Å²	68	111.4 Å²	111.4	70%	0.701	63%	0.627	S	S	*	*			trans	-113.4	-143.8	155	0	0	0	0	0	109.5
1207	P	44	Very low	35.5	Very low	108 Å²	108	107.8 Å²	107.8	70%	0.701	63%	0.629	S	S	*	*			cis	-134.9	-161.6	-1	41.2	-21.7	0	0	0	113.1
1208	D	33.4	Very low	35.1	Very low	116 Å²	116	102.6 Å²	102.6	62%	0.62	62%	0.621	S	S	*	*			trans	66.8	149.8	147.8	-73.3	6.9	0	0	0	119.9
1209	N	32.7	Very low	34.8	Very low	74 Å²	74	102.9 Å²	102.9	40%	0.396	62%	0.619	S	S	.	*			cis	-162.6	169.3	-11.2	-128	-38.4	0	0	0	110.2	H858	H858-N1209 PolarHBondContact CE1-OD1 2.98Å
1210	I	33.1	Very low	34.2	Very low	116 Å²	116	103.8 Å²	103.8	60%	0.595	61%	0.613	S	S	*	*			trans	57.9	134.5	142.9	-72.8	157.5	0	0	0	120.3	H858	H858-I1210 HydrophobicContact CB-CD1 4.43Å; H858-I1210 HydrophobicContact CB-CG1 3.55Å
1211	V	35.8	Very low	34.2	Very low	28 Å²	28	105 Å²	105	17%	0.17	61%	0.605	C	S	.	*			cis	-145.5	-125.9	-6.6	148.7	0	0	0	0	108.9	T346 N347 N348 H858	T346-V1211 WeakPolarHBondContact O-CB 2.97Å; T346-V1211 WeakPolarHBondContact O-CG1 3.45Å; N347-V1211 CarbonylContact C-O 3.59Å; N347-V1211 CarbonylContact O-C 2.84Å; N348-V1211 PolarHBondContact N-O 3Å; H858-V1211 HydrophobicContact CB-CG2 3.92Å; H858-V1211 VanDerWaalsContact CD2-CG2 3.47Å; H858-V1211 WeakPolarHBondContact CD2-CG2 3.44Å
1212	I	37	Very low	34	Very low	6 Å²	6	106.7 Å²	106.7	3%	0.031	60%	0.602	C	S	.	*			trans	-170.1	144.5	-130.1	-87.4	145.3	0	0	0	119.6	T346 N347 R856 N857 H858	T346-I1212 CarbonylContact C-O 3.53Å; T346-I1212 WeakPolarHBondContact CA-O 3.31Å; T346-I1212 PolarHBondContact N-O 3.17Å; T346-I1212 PolarHBondContact O-N 2.95Å; T346-I1212 VanDerWaalsContact O-N 3.08Å; N347-I1212 VanDerWaalsContact CA-N 3.28Å; N347-I1212 WeakPolarHBondContact CA-O 3.23Å; N347-I1212 VanDerWaalsContact N-N 3.1Å; N347-I1212 PolarHBondContact N-O 2.75Å; N347-I1212 PolarHBondContact O-N 2.79Å; N347-I1212 VanDerWaalsContact O-N 3.13Å; R856-I1212 HydrophobicContact CB-CG2 3.28Å; R856-I1212 HydrophobicContact CG-CG2 3.6Å; R856-I1212 VanDerWaalsContact NE-CG2 3.28Å; R856-I1212 VanDerWaalsContact NH1-CG1 3.27Å; R856-I1212 WeakPolarHBondContact O-CG2 3.45Å; N857-I1212 HydrophobicContact CB-CD1 3.24Å; N857-I1212 WeakPolarHBondContact ND2-CD1 3.4Å; H858-I1212 WeakPolarHBondContact CD2-CD1 3.48Å
1213	N	33.2	Very low	33.8	Very low	28 Å²	28	110.9 Å²	110.9	15%	0.15	60%	0.599	C	S	.	*			trans	-176	164.1	151.1	-112	36.8	0	0	0	116.7	T346 N347 N348 Y855 R856	T346-N1213 HydrophobicContact CG2-CB 4.45Å; N347-N1213 VanDerWaalsContact OD1-CB 3.29Å; N347-N1213 WeakPolarHBondContact OD1-CB 3.25Å; N348-N1213 VanDerWaalsContact CG-O 3.3Å; N348-N1213 PolarHBondContact OD1-O 3.41Å; Y855-N1213 WeakPolarHBondContact CB-OD1 3.01Å; Y855-N1213 VanDerWaalsContact CD2-ND2 3.35Å; Y855-N1213 WeakPolarHBondContact CD2-ND2 3.5Å; R856-N1213 PolarHBondContact NH2-O 3.04Å
1214	S	35.4	Very low	33.7	Very low	53 Å²	53	107.9 Å²	107.9	37%	0.371	59%	0.589	S	S	.	*			trans	-144.3	-174.5	-179.6	-28.7	0	0	0	0	112.7	Y855 R856	Y855-S1214 VanDerWaalsContact CE2-O 3.29Å; Y855-S1214 WeakPolarHBondContact CE2-O 3.38Å; Y855-S1214 WeakPolarHBondContact OH-CA 3.29Å; Y855-S1214 WeakPolarHBondContact OH-CB 3.35Å; Y855-S1214 PolarHBondContact OH-O 2.75Å; R856-S1214 PolarHBondContact NH2-OG 3.41Å
1215	Y	32.5	Very low	33.3	Very low	205 Å²	205	108.3 Å²	108.3	80%	0.804	58%	0.584	S	S	*	*			trans	46.4	127.1	171.4	-53	-50.9	0	0	0	117.1	Y855	Y855-Y1215 VanDerWaalsContact OH-CB 3.25Å; Y855-Y1215 WeakPolarHBondContact OH-CB 3.34Å; Y855-Y1215 WeakPolarHBondContact OH-CD2 3.48Å; Y855-Y1215 PolarHBondContact OH-N 2.66Å
1216	I	31.9	Very low	32.7	Very low	148 Å²	148	108.3 Å²	108.3	76%	0.759	58%	0.584	S	S	*	*				-154.5	131.8	70.9	-89.3	159.1	0	0	0	106.2
1217	S	29.3	Very low	32.6	Very low	103 Å²	103	111.4 Å²	111.4	72%	0.72	58%	0.583	S	S	*	*				44	138.8	94.6	-117	0	0	0	0	113.8
1218	S	28.8	Very low	31.8	Very low	83 Å²	83	110.5 Å²	110.5	58%	0.58	58%	0.579	S	S	*	*			cis	-151.4	174.3	3.2	-66	0	0	0	0	107.2
1219	E	29.7	Very low	31.6	Very low	162 Å²	162	113.3 Å²	113.3	76%	0.757	59%	0.589	S	S	*	*			trans	67	165.1	157.4	-74	172.5	88.9	0	0	115.6
1220	Q	29.8	Very low	31.4	Very low	133 Å²	133	114.8 Å²	114.8	62%	0.621	60%	0.604	S	S	*	*			cis	-145	173.8	4.1	-140.3	165	62.9	0	0	110.2
1221	Q	30.8	Very low	31.3	Very low	148 Å²	148	114 Å²	114	69%	0.692	62%	0.615	S	S	*	*			trans	62.6	111.8	154.5	-80.4	173.3	19.4	0	0	117.9
1222	T	28.6	Very low	31.2	Very low	105 Å²	105	120.5 Å²	120.5	64%	0.644	65%	0.648	S	S	*	*				57.2	133.3	105.5	69.5	0	0	0	0	115.7
1223	R	31	Very low	30.8	Very low	207 Å²	207	122.9 Å²	122.9	78%	0.781	67%	0.674	S	S	*	*			cis	-149.9	164.5	37.8	-113.3	116.3	-176.5	-157.6	1.6	112
1224	N	30	Very low	30.8	Very low	128 Å²	128	130.9 Å²	130.9	68%	0.684	71%	0.708	S	S	*	*				14.4	135.3	124.4	-38.8	6.8	0	0	0	115.1
1225	I	36.3	Very low	30.5	Very low	129 Å²	129	133.6 Å²	133.6	66%	0.662	73%	0.727	S	S	*	*			cis	-154.1	152	44.2	-90.1	103	0	0	0	109.6	I1227	I1225-I1227 HydrophobicContact CG2-CD1 4.01Å; I1225-I1227 HydrophobicContact CG2-CG1 3.46Å; I1225-I1227 VanDerWaalsContact CG2-CG1 3.46Å
1226	P	27.7	Very low	30.6	Very low	126 Å²	126	127.3 Å²	127.3	82%	0.818	72%	0.724	S	S	*	*			trans	-86	131.7	160	34.5	-30.5	0	0	0	112.3
1227	I	33.7	Very low	30.6	Very low	134 Å²	134	128.4 Å²	128.4	69%	0.687	73%	0.73	S	S	*	*			trans	-138.2	111.4	168.9	-31.9	-178.1	0	0	0	103	I1225	I1225-I1227 HydrophobicContact CG2-CD1 4.01Å; I1225-I1227 HydrophobicContact CG2-CG1 3.46Å; I1225-I1227 VanDerWaalsContact CG2-CG1 3.46Å
1228	S	28.5	Very low	30.9	Very low	89 Å²	89	128 Å²	128	62%	0.622	73%	0.728	S	S	*	*				63.8	142.8	56.5	81.7	0	0	0	0	113.1
1229	E	28.5	Very low	31.1	Very low	175 Å²	175	128.6 Å²	128.6	82%	0.818	73%	0.732	S	S	*	*			trans	63.6	158.8	172.6	-57.8	-170.7	106.5	0	0	116.4
1230	S	29.1	Very low	31.4	Very low	104 Å²	104	128.2 Å²	128.2	73%	0.727	73%	0.734	S	S	*	*			cis	-156.3	169.2	-29	-98	0	0	0	0	108.4	L1232	S1230-L1232 PolarHBondContact O-N 3.08Å
1231	A	30.1	Very low	31.5	Very low	99 Å²	99	126.8 Å²	126.8	82%	0.818	74%	0.74	S	S	*	*			trans	-70	122.2	-173.3	0	0	0	0	0	114.2
1232	L	32.9	Very low	31.9	Very low	166 Å²	166	128 Å²	128	87%	0.869	75%	0.749	S	S	*	*			trans	-143.7	149.2	153.1	-68.6	178.7	0	0	0	106.8	S1230	S1230-L1232 PolarHBondContact O-N 3.08Å
1233	G	28.2	Very low	32.2	Very low	56 Å²	56	131.5 Å²	131.5	58%	0.577	76%	0.757	S	S	*	*			cis	114.2	133.4	14.2	0	0	0	0	0	109.7
1234	F	34.2	Very low	32.7	Very low	195 Å²	195	126.8 Å²	126.8	86%	0.855	75%	0.754	S	S	*	*			trans	67.3	117.3	-172.7	-58.3	-92	0	0	0	113.6
1235	S	29.9	Very low	33.1	Very low	111 Å²	111	125.5 Å²	125.5	78%	0.776	76%	0.761	S	S	*	*			cis	85.6	117.6	46.4	80.4	0	0	0	0	114
1236	G	33.6	Very low	32.9	Very low	72 Å²	72	125.9 Å²	125.9	74%	0.742	77%	0.77	S	S	*	*			trans	-171.4	94.3	179.2	0	0	0	0	0	114.6
1237	I	32.2	Very low	33.3	Very low	172 Å²	172	126 Å²	126	88%	0.882	77%	0.771	S	S	*	*			trans	-11.1	148	144.9	30	171.1	0	0	0	117.2
1238	S	34.6	Very low	33.4	Very low	95 Å²	95	124.5 Å²	124.5	66%	0.664	77%	0.773	S	S	*	*			cis	-160.1	171	13.4	-150.2	0	0	0	0	112.2
1239	S	33.1	Very low	33.8	Very low	95 Å²	95	128.6 Å²	128.6	66%	0.664	78%	0.776	S	S	*	*			trans	40.9	142.5	141.1	-56.3	0	0	0	0	121.6
1240	D	35.8	Very low	34.5	Very low	153 Å²	153	126.7 Å²	126.7	82%	0.818	78%	0.779	S	S	*	*			cis	-151.2	170.5	21.8	-126.5	-40.9	0	0	0	115.1
1241	S	31.9	Very low	35	Very low	104 Å²	104	130.2 Å²	130.2	73%	0.727	78%	0.776	S	S	*	*			trans	-89.9	156.4	-179.1	-59.5	0	0	0	0	114
1242	I	39.5	Very low	35.3	Very low	174 Å²	174	135.7 Å²	135.7	89%	0.892	78%	0.776	S	S	*	*			trans	-162.3	150.4	139	-101.5	149.3	0	0	0	109.3
1243	H	34.7	Very low	35.6	Very low	177 Å²	177	132.5 Å²	132.5	82%	0.819	77%	0.765	S	S	*	*			trans	-138.6	-162.7	-166.2	-145.5	-8.5	0	0	0	111.9
1244	P	41.4	Very low	36	Very low	109 Å²	109	137.2 Å²	137.2	71%	0.708	78%	0.776	S	S	*	*				-103.5	175.3	-124.7	42	-31.5	0	0	0	116.4
1245	A	38.5	Very low	35.8	Very low	100 Å²	100	134 Å²	134	83%	0.826	77%	0.768	S	S	*	*			trans	-146.8	147	161.4	0	0	0	0	0	112.9
1246	T	33.7	Very low	36.1	Very low	138 Å²	138	135.8 Å²	135.8	85%	0.847	77%	0.769	S	S	*	*			trans	-144.1	133.5	177.6	52.6	0	0	0	0	112
1247	C	35.4	Very low	36.1	Very low	127 Å²	127	140.3 Å²	140.3	86%	0.858	77%	0.771	S	S	*	*			trans	-171.3	159.1	172	-108.8	0	0	0	0	109.5
1248	S	36.2	Very low	36.3	Very low	103 Å²	103	138 Å²	138	72%	0.72	77%	0.767	S	S	*	*			cis	-164	177.6	-22.2	-118.7	0	0	0	0	111.5
1249	Y	36.1	Very low	36.2	Very low	176 Å²	176	141.8 Å²	141.8	69%	0.69	77%	0.774	S	S	*	*			trans	-68.6	168	-172.9	-71.1	-91.9	0	0	0	116.3	R1251	Y1249-R1251 HydrophobicContact CD1-CG 4.08Å
1250	P	44.2	Very low	36.2	Very low	135 Å²	135	143 Å²	143	88%	0.877	78%	0.782	S	S	*	*				-116.4	176.8	99	-9.1	28.6	0	0	0	115.8
1251	R	38.1	Very low	36.1	Very low	178 Å²	178	139.8 Å²	139.8	67%	0.672	78%	0.778	S	S	*	*			trans	-147.5	157.1	-168.2	-110.5	-171.7	177.6	-157	0.9	114	Y1249	Y1249-R1251 HydrophobicContact CD1-CG 4.08Å
1252	R	37.1	Very low	36.3	Very low	213 Å²	213	145.9 Å²	145.9	80%	0.804	78%	0.784	S	S	*	*			trans	70	171.4	151.3	-87.2	-175.3	172.6	-173.5	-3.2	117.3
1253	P	39.6	Very low	36.2	Very low	100 Å²	100	146 Å²	146	65%	0.649	78%	0.781	S	S	*	*			cis	-129.8	170.7	2.5	21.8	3	0	0	0	117.8
1254	L	35.3	Very low	36.1	Very low	155 Å²	155	147.7 Å²	147.7	81%	0.812	78%	0.782	S	S	*	*			trans	45.5	115.5	141.7	-64	167.6	0	0	0	119.8
1255	N	31.6	Very low	36.3	Very low	127 Å²	127	148.3 Å²	148.3	68%	0.679	79%	0.786	S	S	*	*				82.2	114	71.8	179.5	66.5	0	0	0	114.6
1256	N	35	Very low	36.1	Very low	149 Å²	149	151.8 Å²	151.8	80%	0.797	79%	0.787	S	S	*	*			trans	-177.6	132	136.6	-93.2	-16.2	0	0	0	111.2
1257	Q	33.4	Very low	36.3	Very low	167 Å²	167	151.3 Å²	151.3	78%	0.78	78%	0.779	S	S	*	*			trans	-106.4	150.4	161.6	-156.6	178	26.1	0	0	107.2
1258	P	37.9	Very low	36.8	Very low	124 Å²	124	151 Å²	151	81%	0.805	78%	0.776	S	S	*	*				-148.7	-174.6	116.3	37.7	-20.9	0	0	0	114.4
1259	Q	31.8	Very low	36.7	Very low	173 Å²	173	156.5 Å²	156.5	81%	0.808	78%	0.781	S	S	*	*			trans	-103.6	140.2	-172.8	-56.4	156.9	-14.6	0	0	112.3
1260	S	33.8	Very low	37	Very low	120 Å²	120	155.9 Å²	155.9	84%	0.839	78%	0.784	S	S	*	*			trans	-179.7	127	148.8	-84.8	0	0	0	0	108.5
1261	A	32.1	Very low	36.5	Very low	87 Å²	87	156.1 Å²	156.1	72%	0.719	78%	0.778	S	S	*	*				86.9	151	54.6	0	0	0	0	0	113.4
1262	R	36.2	Very low	36.5	Very low	231 Å²	231	156.4 Å²	156.4	87%	0.872	78%	0.78	S	S	*	*			trans	75.1	148.7	-168.7	-47.8	178	177.7	177.6	-1	114.5
1263	H	37.5	Very low	36.6	Very low	176 Å²	176	154.4 Å²	154.4	82%	0.815	78%	0.78	S	S	*	*			cis	-159.9	161.5	-31.1	-104.9	-56.1	0	0	0	108.9
1264	Y	32.5	Very low	36.6	Very low	213 Å²	213	155.9 Å²	155.9	84%	0.835	79%	0.787	S	S	*	*			trans	-74.1	157.2	170.7	-68.5	-84.1	0	0	0	112
1265	P	45.4	Very low	37.3	Very low	122 Å²	122	154.3 Å²	154.3	79%	0.792	79%	0.786	S	S	*	*				-126.3	148.4	91.8	36.7	-30.3	0	0	0	112.1
1266	M	35.8	Very low	37.6	Very low	174 Å²	174	153.8 Å²	153.8	86%	0.857	79%	0.79	S	S	*	*			cis	89.1	145.4	46.8	-88.1	-63.5	168.5	0	0	116.1
1267	N	37.6	Very low	37.7	Very low	128 Å²	128	153.1 Å²	153.1	68%	0.684	79%	0.791	S	S	*	*			trans	-93.2	170.9	-159.6	-155.3	-7.8	0	0	0	111.8
1268	P	44.6	Very low	38	Very low	121 Å²	121	149.6 Å²	149.6	79%	0.786	79%	0.79	S	S	*	*				-145.3	164.3	105.2	37.6	-22.7	0	0	0	117.2
1269	R	35.9	Very low	37.9	Very low	217 Å²	217	152.4 Å²	152.4	82%	0.819	79%	0.793	S	S	*	*			trans	-74.5	164	176.6	-54.9	161.3	172.7	155.4	-6.2	112.2
1270	H	41.5	Very low	38.6	Very low	163 Å²	163	150.1 Å²	150.1	76%	0.755	79%	0.793	S	S	*	*				-145.1	152.5	128.3	-109.6	-73.3	0	0	0	111.2	Y1272	H1270-Y1272 AromaticContact CE1-CE2 3.99Å; H1270-Y1272 AromaticContact ND1-CE2 3.5Å; H1270-Y1272 WeakPolarHBondContact ND1-CE2 3.48Å
1271	N	33.1	Very low	38.7	Very low	140 Å²	140	152.1 Å²	152.1	75%	0.749	79%	0.789	S	S	*	*			trans	-155.9	117.1	-170.6	175.5	65.1	0	0	0	110.7
1272	Y	39.3	Very low	39.1	Very low	184 Å²	184	157.7 Å²	157.7	72%	0.722	80%	0.797	S	S	*	*			trans	-158.9	160.4	171.9	-61.2	-68.3	0	0	0	108.5	H1270	H1270-Y1272 AromaticContact CE1-CE2 3.99Å; H1270-Y1272 AromaticContact ND1-CE2 3.5Å; H1270-Y1272 WeakPolarHBondContact ND1-CE2 3.48Å
1273	Q	38.9	Very low	39.1	Very low	172 Å²	172	152.6 Å²	152.6	80%	0.804	78%	0.783	S	S	*	*			cis	-165.3	146.6	-39	-177.3	150.7	-21.5	0	0	106.1
1274	T	38.4	Very low	39.2	Very low	131 Å²	131	152.9 Å²	152.9	80%	0.804	78%	0.784	S	S	*	*			trans	-90.5	148.7	-173.6	50	0	0	0	0	114.3
1275	P	50	Low	39.3	Very low	121 Å²	121	147 Å²	147	79%	0.786	78%	0.775	S	S	*	*			trans	-119.2	140.1	147.2	36	-26.5	0	0	0	112.7
1276	P	38.6	Very low	38.9	Very low	117 Å²	117	148.7 Å²	148.7	76%	0.76	78%	0.777	S	S	*	*			trans	-107.7	-177.3	171.9	39.2	-31.8	0	0	0	113.1
1277	T	38.3	Very low	39	Very low	134 Å²	134	144.8 Å²	144.8	82%	0.822	77%	0.766	S	S	*	*			trans	125	151.3	147	-49	0	0	0	0	116.3
1278	A	39.1	Very low	39	Very low	93 Å²	93	145.8 Å²	145.8	77%	0.769	77%	0.772	S	S	*	*			trans	80.9	112.9	163.9	0	0	0	0	0	120.1
1279	H	35.9	Very low	38.5	Very low	184 Å²	184	149.3 Å²	149.3	85%	0.852	77%	0.77	S	S	*	*			trans	-76.5	167.7	147.6	-81.5	-95.3	0	0	0	110.3
1280	P	45.5	Very low	38.6	Very low	124 Å²	124	145.5 Å²	145.5	81%	0.805	76%	0.763	S	S	*	*				-120.1	166.2	123.5	35.5	-33.6	0	0	0	113.3
1281	H	36.7	Very low	38.5	Very low	163 Å²	163	145.4 Å²	145.4	76%	0.755	76%	0.76	S	S	*	*			trans	-117	136.1	-174	171.2	68.8	0	0	0	109.2	Q1283	H1281-Q1283 WeakPolarHBondContact NE2-CG 3.31Å; H1281-Q1283 PolarHBondContact NE2-NE2 3.08Å
1282	F	39.5	Very low	38.8	Very low	204 Å²	204	145 Å²	145	90%	0.895	76%	0.757	S	S	*	*			trans	-142.1	136.9	165.6	-104.3	-79.3	0	0	0	110.6
1283	Q	36.9	Very low	38.7	Very low	124 Å²	124	142.6 Å²	142.6	58%	0.579	76%	0.757	S	S	*	*			trans	-105	152.5	-176	-62.7	171.5	-35.4	0	0	110.6	H1281	H1281-Q1283 WeakPolarHBondContact NE2-CG 3.31Å; H1281-Q1283 PolarHBondContact NE2-NE2 3.08Å
1284	H	39	Very low	38.7	Very low	181 Å²	181	142.5 Å²	142.5	84%	0.838	76%	0.762	S	S	*	*			trans	174.4	120	140.4	-79	-44.4	0	0	0	104.9
1285	S	36.2	Very low	38.7	Very low	91 Å²	91	142.6 Å²	142.6	64%	0.636	76%	0.757	S	S	*	*				58.9	120	62.9	-53.4	0	0	0	0	111.5
1286	N	35.8	Very low	38.2	Very low	156 Å²	156	142.7 Å²	142.7	83%	0.834	76%	0.758	S	S	*	*			cis	-161.1	165.7	3.7	-89	-31.8	0	0	0	108.6
1287	S	38.3	Very low	38.1	Very low	92 Å²	92	144.8 Å²	144.8	64%	0.643	76%	0.762	S	S	*	*			cis	-175.7	-179.7	-23	-172.2	0	0	0	0	108.2
1288	N	36.6	Very low	38	Very low	149 Å²	149	147.3 Å²	147.3	80%	0.797	76%	0.764	S	S	*	*			trans	67.7	148.9	170.6	-72.1	-39.6	0	0	0	117.8
1289	R	35.1	Very low	37.9	Very low	196 Å²	196	148 Å²	148	74%	0.74	76%	0.763	S	S	*	*			cis	-171.4	130.3	-11.8	164.8	179.3	178.4	177.5	2.7	110.9
1290	M	37.9	Very low	37.9	Very low	137 Å²	137	142.7 Å²	142.7	68%	0.675	76%	0.758	S	S	*	*			trans	65.8	152.9	164.4	-67.1	173.9	162.4	0	0	117.3
1291	K	39.8	Very low	37.7	Very low	161 Å²	161	146.5 Å²	146.5	70%	0.7	76%	0.756	S	S	*	*			cis	-157	138.3	-6.2	-122.7	172.3	174.9	-179.6	0	111.8
1292	L	38.6	Very low	37.9	Very low	131 Å²	131	147.2 Å²	147.2	69%	0.686	75%	0.753	S	S	*	*			trans	54.5	113.3	145.2	-64.6	165.8	0	0	0	122.5
1293	N	37.1	Very low	37.9	Very low	134 Å²	134	144.3 Å²	144.3	72%	0.717	74%	0.741	S	S	*	*				47.6	123.1	123.7	-53.9	13.7	0	0	0	121.1
1294	N	38.8	Very low	38.2	Very low	169 Å²	169	141.2 Å²	141.2	90%	0.904	73%	0.733	S	S	*	*			trans	-132.1	104.4	157	-88.7	-56.3	0	0	0	110
1295	D	38.6	Very low	38.6	Very low	133 Å²	133	139 Å²	139	71%	0.711	73%	0.728	S	S	*	*			trans	-90.3	146.8	167.8	-86.7	-59	0	0	0	111.2	L1297	D1295-L1297 VanDerWaalsContact C-N 3.33Å; D1295-L1297 PolarHBondContact O-N 3.43Å
1296	P	38.9	Very low	39.1	Very low	123 Å²	123	143.3 Å²	143.3	80%	0.799	73%	0.73	S	S	*	*			trans	-78.8	73.4	-172.5	32.7	-36.6	0	0	0	113
1297	L	37.4	Very low	40	Very low	162 Å²	162	137.6 Å²	137.6	85%	0.848	70%	0.7	S	S	*	*			trans	-66.2	140.1	175.7	-75.4	178.7	0	0	0	112.7	D1295 S1299	D1295-L1297 VanDerWaalsContact C-N 3.33Å; D1295-L1297 PolarHBondContact O-N 3.43Å; L1297-S1299 PolarHBondContact O-N 3.05Å
1298	H	37.1	Very low	40.9	Very low	187 Å²	187	136.9 Å²	136.9	87%	0.866	69%	0.689	S	S	*	*			trans	-56.3	123.1	-172.4	-70.7	14.2	0	0	0	113.3	G1300	H1298-G1300 PolarHBondContact O-N 3.16Å
1299	S	36.1	Very low	42.2	Very low	106 Å²	106	130.4 Å²	130.4	74%	0.741	65%	0.654	S	S	*	*			trans	-73.9	68.1	168.5	176.3	0	0	0	0	111.4	L1297 R1301	L1297-S1299 PolarHBondContact O-N 3.05Å; S1299-R1301 PolarHBondContact O-N 2.94Å
1300	G	35.7	Very low	43.5	Very low	73 Å²	73	128.2 Å²	128.2	75%	0.753	65%	0.646	S	S	*	*			trans	-69.5	48.3	166.5	0	0	0	0	0	112.5	H1298 R1302	H1298-G1300 PolarHBondContact O-N 3.16Å; G1300-R1302 PolarHBondContact O-N 3.41Å; G1300-R1302 VanDerWaalsContact O-N 3.13Å
1301	R	41	Very low	44.6	Very low	204 Å²	204	125.7 Å²	125.7	77%	0.77	64%	0.635	S	S	*	*			trans	-71.3	105.6	-179.1	-177.8	-179.9	-73.4	-133.5	1	108.2	S1299 H1303	S1299-R1301 PolarHBondContact O-N 2.94Å; R1301-H1303 PolarHBondContact O-N 3.47Å; R1301-H1303 VanDerWaalsContact O-N 3.13Å; R1301-H1303 PolarHBondContact O-ND1 2.91Å
1302	R	40.6	Very low	45.8	Very low	178 Å²	178	118.1 Å²	118.1	67%	0.672	60%	0.602	S	S	*	*	P	Polyproline II helix	trans	-48.2	122.5	176.5	-58.2	-172.7	-150.4	169.1	16.1	109	G15 G1300	G15-R1302 VanDerWaalsContact CA-NH2 3.29Å; G15-R1302 VanDerWaalsContact O-CZ 3.31Å; G15-R1302 PolarHBondContact O-NH1 2.82Å; G15-R1302 PolarHBondContact O-NH2 2.77Å; G1300-R1302 PolarHBondContact O-N 3.41Å; G1300-R1302 VanDerWaalsContact O-N 3.13Å
1303	H	41	Very low	47.2	Very low	143 Å²	143	112 Å²	112	66%	0.662	57%	0.57	S	S	*	*	P	Polyproline II helix	trans	-62.9	146.3	170.8	-75.8	26.6	0	0	0	108.8	R1301 D1307	R1301-H1303 PolarHBondContact O-N 3.47Å; R1301-H1303 VanDerWaalsContact O-N 3.13Å; R1301-H1303 PolarHBondContact O-ND1 2.91Å; H1303-D1307 HydrophobicContact CB-CB 4.01Å
1304	S	41.8	Very low	48.5	Very low	59 Å²	59	109.7 Å²	109.7	41%	0.413	57%	0.565	S	S	.	*	P	Polyproline II helix	trans	-76.7	159	-178.8	75.3	0	0	0	0	109.7	R1306 D1307	S1304-R1306 PolarHBondContact O-N 2.95Å; S1304-D1307 WeakPolarHBondContact CA-OD2 3.32Å; S1304-D1307 VanDerWaalsContact CB-OD2 3.32Å; S1304-D1307 WeakPolarHBondContact CB-OD2 3.29Å; S1304-D1307 PolarHBondContact N-OD2 3.25Å; S1304-D1307 PolarHBondContact O-N 3.22Å; S1304-D1307 PolarHBondContact OG-OD2 2.93Å
1305	N	47.8	Very low	49.3	Very low	135 Å²	135	105.8 Å²	105.8	72%	0.722	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-12.5	179.8	-113	-38.5	0	0	0	114.1	K532	K532-N1305 PolarHBondContact NZ-O 3.09Å; K532-N1305 PolarHBondContact NZ-OD1 3.35Å
1306	R	47.5	Very low	50.4	Low	181 Å²	181	100 Å²	100	68%	0.683	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	-22.4	172.3	-88.5	-179.5	157.3	174.5	-7.7	114.1	S1304 R1310	S1304-R1306 PolarHBondContact O-N 2.95Å; R1306-R1310 PolarHBondContact O-N 2.96Å
1307	D	55.3	Low	51.3	Low	37 Å²	37	97.2 Å²	97.2	20%	0.198	50%	0.504	C	S	.	.	H	α-helix	trans	-79.2	-27.5	-171.7	-63.1	-58.9	0	0	0	112.1	H1303 S1304 D1309 R1310 D1311	H1303-D1307 HydrophobicContact CB-CB 4.01Å; S1304-D1307 WeakPolarHBondContact CA-OD2 3.32Å; S1304-D1307 VanDerWaalsContact CB-OD2 3.32Å; S1304-D1307 WeakPolarHBondContact CB-OD2 3.29Å; S1304-D1307 PolarHBondContact N-OD2 3.25Å; S1304-D1307 PolarHBondContact O-N 3.22Å; S1304-D1307 PolarHBondContact OG-OD2 2.93Å; D1307-D1309 PolarHBondContact O-N 3.47Å; D1307-R1310 CarbonylContact O-C 3.6Å; D1307-R1310 WeakPolarHBondContact O-CA 3.26Å; D1307-R1310 VanDerWaalsContact O-CB 3.26Å; D1307-R1310 WeakPolarHBondContact O-CB 3.4Å; D1307-R1310 PolarHBondContact O-N 3.5Å; D1307-R1310 IonicContact OD1-NH1 2.87Å; D1307-D1311 PolarHBondContact O-N 3.48Å
1308	D	57.2	Low	51.7	Low	77 Å²	77	92.4 Å²	92.4	41%	0.412	48%	0.481	S	S	.	.	H	α-helix	trans	-62.4	-39.6	173.8	-58.9	-65.9	0	0	0	112.7	K532 R1310 I1312	K532-D1308 IonicContact NZ-OD2 3.55Å; K532-D1308 PolarHBondContact NZ-OD2 3.29Å; D1308-R1310 VanDerWaalsContact C-N 3.3Å; D1308-I1312 WeakPolarHBondContact O-CG1 3.33Å; D1308-I1312 PolarHBondContact O-N 2.91Å; D1308-I1312 VanDerWaalsContact O-N 3.12Å
1309	D	62	Low	52.4	Low	13 Å²	13	87.7 Å²	87.7	7%	0.07	46%	0.462	C	S	.	.	H	α-helix	trans	-64.5	-38.7	171.7	-93.4	2.9	0	0	0	110.2	K532 R533 D1307 I1312 Y1313	K532-D1309 VanDerWaalsContact CB-OD1 3.31Å; K532-D1309 WeakPolarHBondContact CB-OD1 3.28Å; K532-D1309 PolarHBondContact N-OD1 3.39Å; K532-D1309 VanDerWaalsContact N-OD1 3.12Å; R533-D1309 IonicContact CZ-OD2 2.68Å; R533-D1309 IonicContact NE-OD2 2.92Å; R533-D1309 IonicContact NH2-OD2 3.67Å; R533-D1309 PolarHBondContact NH2-OD2 3.42Å; D1307-D1309 PolarHBondContact O-N 3.47Å; D1309-I1312 WeakPolarHBondContact O-CA 3.42Å; D1309-I1312 WeakPolarHBondContact O-CB 3.44Å; D1309-I1312 PolarHBondContact O-N 3.1Å; D1309-I1312 VanDerWaalsContact O-N 3.08Å; D1309-Y1313 HydrophobicContact CB-CE2 4.08Å; D1309-Y1313 WeakPolarHBondContact O-CD2 3.44Å; D1309-Y1313 WeakPolarHBondContact O-CE2 3.47Å; D1309-Y1313 PolarHBondContact O-N 2.68Å
1310	R	64	Low	53.3	Low	149 Å²	149	86.7 Å²	86.7	56%	0.562	45%	0.447	S	S	*	.	H	α-helix	trans	-67.1	-36.5	179.6	-159.2	-176.1	-162	169.7	3.5	112.5	R1306 D1307 D1308 I1312 S1314	R1306-R1310 PolarHBondContact O-N 2.96Å; D1307-R1310 CarbonylContact O-C 3.6Å; D1307-R1310 WeakPolarHBondContact O-CA 3.26Å; D1307-R1310 VanDerWaalsContact O-CB 3.26Å; D1307-R1310 WeakPolarHBondContact O-CB 3.4Å; D1307-R1310 PolarHBondContact O-N 3.5Å; D1307-R1310 IonicContact OD1-NH1 2.87Å; D1308-R1310 VanDerWaalsContact C-N 3.3Å; R1310-I1312 VanDerWaalsContact C-N 3.3Å; R1310-S1314 VanDerWaalsContact O-CB 3.25Å; R1310-S1314 WeakPolarHBondContact O-CB 3.25Å; R1310-S1314 PolarHBondContact O-N 3.42Å; R1310-S1314 PolarHBondContact O-OG 3.48Å
1311	D	61.1	Low	54.3	Low	84 Å²	84	87.4 Å²	87.4	45%	0.449	43%	0.43	S	S	.	.	H	α-helix	trans	-65.2	-35.9	169.6	-75.8	-16.9	0	0	0	110.5	D1307 M1315	D1307-D1311 PolarHBondContact O-N 3.48Å; D1311-M1315 WeakPolarHBondContact O-CB 3.46Å; D1311-M1315 PolarHBondContact O-N 3.39Å
1312	I	64.3	Low	55.1	Low	3 Å²	3	80.6 Å²	80.6	2%	0.015	41%	0.411	C	S	.	.	H	α-helix	trans	-65	-50.4	173.6	-67.6	165.1	0	0	0	111.2	K527 R530 Y531 D1308 D1309 R1310 M1315 L1316	K527-I1312 HydrophobicContact CB-CG2 4.31Å; R530-I1312 VanDerWaalsContact C-CD1 3.46Å; R530-I1312 HydrophobicContact CB-CD1 3.87Å; R530-I1312 WeakPolarHBondContact O-CD1 3.28Å; Y531-I1312 HydrophobicContact CD2-CG2 4.08Å; D1308-I1312 WeakPolarHBondContact O-CG1 3.33Å; D1308-I1312 PolarHBondContact O-N 2.91Å; D1308-I1312 VanDerWaalsContact O-N 3.12Å; D1309-I1312 WeakPolarHBondContact O-CA 3.42Å; D1309-I1312 WeakPolarHBondContact O-CB 3.44Å; D1309-I1312 PolarHBondContact O-N 3.1Å; D1309-I1312 VanDerWaalsContact O-N 3.08Å; R1310-I1312 VanDerWaalsContact C-N 3.3Å; I1312-M1315 CarbonylContact O-C 3.59Å; I1312-M1315 PolarHBondContact O-N 3.03Å; I1312-L1316 HydrophobicContact CG2-CD1 3.61Å; I1312-L1316 HydrophobicContact CG2-CG 4.12Å; I1312-L1316 VanDerWaalsContact O-CB 3.32Å; I1312-L1316 WeakPolarHBondContact O-CB 3.36Å; I1312-L1316 VanDerWaalsContact O-CG 3.23Å; I1312-L1316 WeakPolarHBondContact O-CG 3.37Å; I1312-L1316 PolarHBondContact O-N 2.94Å
1313	Y	67.7	Low	56	Low	3 Å²	3	74.5 Å²	74.5	1%	0.012	39%	0.394	C	S	.	.	H	α-helix	trans	-58.2	-54.7	176	-63.2	-62.7	0	0	0	111.5	L488 Q490 E493 Y531 R533 D1309 M1315 L1316 G1317 V1318	L488-Y1313 WeakPolarHBondContact O-CD1 3.23Å; L488-Y1313 WeakPolarHBondContact O-CE1 3.46Å; Q490-Y1313 HydrophobicContact CB-CD1 3.87Å; Q490-Y1313 HydrophobicContact CB-CD2 4.01Å; Q490-Y1313 HydrophobicContact CB-CE1 4.06Å; Q490-Y1313 HydrophobicContact CB-CE2 4.21Å; Q490-Y1313 HydrophobicContact CB-CG 3.89Å; Q490-Y1313 HydrophobicContact CG-CD2 4.24Å; Q490-Y1313 HydrophobicContact CG-CE2 4.18Å; E493-Y1313 PolarHBondContact OE1-OH 3.35Å; Y531-Y1313 HydrophobicContact CE2-CE1 4.03Å; Y531-Y1313 AromaticContact CE2-CZ 3.85Å; Y531-Y1313 WeakPolarHBondContact CE2-OH 3.29Å; Y531-Y1313 PolarHBondContact OH-OH 3.05Å; R533-Y1313 PolarHBondContact NH1-OH 3.26Å; R533-Y1313 PolarHBondContact NH2-OH 3.34Å; D1309-Y1313 HydrophobicContact CB-CE2 4.08Å; D1309-Y1313 WeakPolarHBondContact O-CD2 3.44Å; D1309-Y1313 WeakPolarHBondContact O-CE2 3.47Å; D1309-Y1313 PolarHBondContact O-N 2.68Å; Y1313-M1315 PolarHBondContact O-N 3.08Å; Y1313-L1316 PolarHBondContact O-N 3.17Å; Y1313-L1316 VanDerWaalsContact O-N 3.07Å; Y1313-G1317 PolarHBondContact O-N 3.44Å; Y1313-V1318 CarbonylContact C-O 3.4Å; Y1313-V1318 WeakPolarHBondContact CB-O 3.35Å; Y1313-V1318 HydrophobicContact CD1-CG2 4.48Å; Y1313-V1318 PolarHBondContact O-N 3.48Å; Y1313-V1318 VanDerWaalsContact O-N 3.11Å
1314	S	65.3	Low	57	Low	85 Å²	85	69.9 Å²	69.9	59%	0.594	38%	0.376	S	S	*	.	H	α-helix	trans	-57.9	-28.1	-179.7	-52.2	0	0	0	0	113.8	R1310	R1310-S1314 VanDerWaalsContact O-CB 3.25Å; R1310-S1314 WeakPolarHBondContact O-CB 3.25Å; R1310-S1314 PolarHBondContact O-N 3.42Å; R1310-S1314 PolarHBondContact O-OG 3.48Å
1315	M	55.7	Low	58	Low	86 Å²	86	70.7 Å²	70.7	42%	0.424	37%	0.374	S	S	.	.	H	α-helix	trans	-101.7	-11.5	-178.2	-165.5	-177.3	22.1	0	0	113.4	K527 D1311 I1312 Y1313	K527-M1315 HydrophobicContact CD-CB 4.48Å; K527-M1315 HydrophobicContact CD-CE 4.27Å; K527-M1315 HydrophobicContact CD-CG 4.22Å; K527-M1315 HydrophobicContact CD-SD 4.46Å; K527-M1315 HydrophobicContact CG-CE 4.09Å; K527-M1315 PolarHBondContact NZ-O 3.19Å; D1311-M1315 WeakPolarHBondContact O-CB 3.46Å; D1311-M1315 PolarHBondContact O-N 3.39Å; I1312-M1315 CarbonylContact O-C 3.59Å; I1312-M1315 PolarHBondContact O-N 3.03Å; Y1313-M1315 PolarHBondContact O-N 3.08Å
1316	L	61.3	Low	58.8	Low	13 Å²	13	65.8 Å²	65.8	7%	0.068	35%	0.347	C	S	.	.	H	α-helix	trans	-80.5	-26.3	160.3	-73.3	174.2	0	0	0	110.9	K485 L488 T524 K527 I1312 Y1313 V1318	K485-L1316 HydrophobicContact CG-CB 4.41Å; K485-L1316 HydrophobicContact CG-CD2 4.09Å; L488-L1316 HydrophobicContact CB-CD1 4.22Å; L488-L1316 HydrophobicContact CD1-CD1 4.3Å; T524-L1316 HydrophobicContact CG2-CD2 3.85Å; K527-L1316 HydrophobicContact CB-CD2 4.34Å; K527-L1316 HydrophobicContact CD-CD2 3.87Å; K527-L1316 HydrophobicContact CD-CG 4.23Å; I1312-L1316 HydrophobicContact CG2-CD1 3.61Å; I1312-L1316 HydrophobicContact CG2-CG 4.12Å; I1312-L1316 VanDerWaalsContact O-CB 3.32Å; I1312-L1316 WeakPolarHBondContact O-CB 3.36Å; I1312-L1316 VanDerWaalsContact O-CG 3.23Å; I1312-L1316 WeakPolarHBondContact O-CG 3.37Å; I1312-L1316 PolarHBondContact O-N 2.94Å; Y1313-L1316 PolarHBondContact O-N 3.17Å; Y1313-L1316 VanDerWaalsContact O-N 3.07Å; L1316-V1318 HydrophobicContact CB-CG2 3.73Å
1317	G	56.8	Low	59.8	Low	64 Å²	64	56.2 Å²	56.2	66%	0.66	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	96.4	30.3	177.7	0	0	0	0	0	113.6	Y1313	Y1313-G1317 PolarHBondContact O-N 3.44Å
1318	V	46.9	Very low	60.2	Low	60 Å²	60	57.9 Å²	57.9	36%	0.364	33%	0.33	S	S	.	.			trans	-146.4	0	-168.9	-68.5	0	0	0	0	112	L488 I489 Y1313 L1316	L488-V1318 WeakPolarHBondContact O-CG2 3.31Å; I489-V1318 HydrophobicContact CB-CB 4.28Å; I489-V1318 HydrophobicContact CD1-CG1 4.42Å; I489-V1318 HydrophobicContact CG1-CB 3.94Å; I489-V1318 HydrophobicContact CG1-CG1 3.87Å; I489-V1318 HydrophobicContact CG2-CB 4.29Å; Y1313-V1318 CarbonylContact C-O 3.4Å; Y1313-V1318 WeakPolarHBondContact CB-O 3.35Å; Y1313-V1318 HydrophobicContact CD1-CG2 4.48Å; Y1313-V1318 PolarHBondContact O-N 3.48Å; Y1313-V1318 VanDerWaalsContact O-N 3.11Å; L1316-V1318 HydrophobicContact CB-CG2 3.73Å

Retrieved 1,318 of 1,318 residues in 323.5 ms (Link to these results)

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