A0A077ZKD2_TRITR Loading...

BCSC C and TPR 11 and TPR 19 and TPR 16 domain co ntaining protein

AlphaFold DB , UniProt , Accession A0A077ZKD2, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 995 aa.

						>A0A077ZKD2_TRITR|A0A077ZKD2
MPMVEAAPTAQQQLLEQVRLGEATHREDLVQQSLYRLELIDPNNPDVVAARFRSLLRQGDIDGAQKQLDRLSQLAPSSNAYKSSRTTMLLSTPDGRQALQQARLQATTGHAEEAVASYNKLFNGAPPEGDIAVEYWSTVAKIPARRGEAINQLKRINADTPGNTGLQNNLALLLFSSDRRDEGFAVLEQMAKSNAGREGASKIWYGQIKDMPVSDASVSALKKYLSIFSDGDSVAAAQSQLAEQQKQLADPAFRARAQGLAAVDSGMAGKAIPELQQAVRANPKDSEALGALGQAYSQKGDRANAVANLEKALALDPHSSNNDKWNSLLKVNRYWLAIQQGDAALKANNPDRAERLFQQARNVDNTDSYAVLGLGDVAMARKDYPAAERYYQQTLRMDSGNTNAVRGLANIYRQQSPEKAEAFIASLSASQRRSIDDIERSLQNDRLAQQAEALENQGKWAQAAALQRQRLALDPGSVWITYRLSQDLWQAGQRSQADTLMRNLAQQKPNDPEQVYAYGLYLSGHDQDRAALAHINSLPRAQWNSNIQELVNRLQSDQVLETANRLRESGKEAEAEAMLRQQPPSTRIDLTLADWAQQRRDYTAARAAYQNVLTREPANADAILGLTEVDIAAGDKAAARSQLAKLPATDNASLNTQRRVALAQAQLGDTAAAQRTFNKLIPQAKSQPPSMESAMVLRDGAKFEAQAGDPTQALETYKDAMVASGVTTTRPQDNDTFTRLTRNDEKDDWLKRGVRSDAADLYRQQDLNVTLEHDYWGSSGTGGYSDLKAHTTMLQVDAPYSDGRMFFRSDFVNMNVGSFSTNADGKWDDNWGTCTLQDCSGNRSQSDSGASVAVGWRNDGGYYSPQEYLSFAIPVMWRERTENWSWELGASGSWSHSRTKTMPRYPLMNLIPTDWQEEAARQSNDGGSSQGFGYTARALLERRVTSNWFVGTAIDIQQAKDYAPSHFLLYVRYSAAGWQGDMDLPPQPLIPYADW
					

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	29	Very low	53	Low	231 Å²	231	115.1 Å²	115.1	100%	1.138	68%	0.679	S	S	*	*				0	116.3	0	-66.9	178.5	175.1	0	0	106.8	M3	M1-M3 PolarHBondContact O-N 3.1Å
2	P	36.7	Very low	55.6	Low	119 Å²	119	113.8 Å²	113.8	77%	0.773	66%	0.661	S	S	*	*			trans	-63.1	130.2	163.8	1.7	13.8	0	0	0	106.1	V4	P2-V4 VanDerWaalsContact C-N 3.3Å; P2-V4 PolarHBondContact O-N 3.1Å
3	M	37.3	Very low	57.8	Low	188 Å²	188	112.2 Å²	112.2	93%	0.926	64%	0.644	S	S	*	*			trans	-56.8	103.5	165.8	-78.1	-176.6	172.8	0	0	106	M1 E5	M1-M3 PolarHBondContact O-N 3.1Å; M3-E5 PolarHBondContact O-N 3.03Å
4	V	37.4	Very low	59.9	Low	131 Å²	131	105.4 Å²	105.4	79%	0.794	60%	0.604	S	S	*	*			trans	-64.7	99.1	166.3	178.6	0	0	0	0	103.6	P2 A6	P2-V4 VanDerWaalsContact C-N 3.3Å; P2-V4 PolarHBondContact O-N 3.1Å; V4-A6 PolarHBondContact O-N 3.04Å
5	E	39.7	Very low	61.7	Low	183 Å²	183	99.4 Å²	99.4	86%	0.855	57%	0.569	S	S	*	*			trans	-51	109.3	165.1	-84.8	177.9	154.4	0	0	105.8	M3 A7	M3-E5 PolarHBondContact O-N 3.03Å; E5-A7 PolarHBondContact O-N 3.33Å; E5-A7 VanDerWaalsContact O-N 3.15Å
6	A	43.1	Very low	63	Low	87 Å²	87	99.3 Å²	99.3	72%	0.719	56%	0.562	S	S	*	*	P	Polyproline II helix	trans	-55.1	125.6	175.6	0	0	0	0	0	106.6	V4	V4-A6 PolarHBondContact O-N 3.04Å
7	A	50.8	Low	64.3	Low	84 Å²	84	97.7 Å²	97.7	69%	0.694	55%	0.549	S	S	*	.	P	Polyproline II helix	trans	-48	133	177.5	0	0	0	0	0	108.8	E5 T9	E5-A7 PolarHBondContact O-N 3.33Å; E5-A7 VanDerWaalsContact O-N 3.15Å; A7-T9 PolarHBondContact O-N 3.01Å
8	P	64	Low	65.5	Low	53 Å²	53	92.3 Å²	92.3	34%	0.344	52%	0.519	S	S	.	.	P	Polyproline II helix	trans	-54.2	129.6	-174.6	18.9	-30	0	0	0	108.9	Q12 Q13	P8-Q12 HydrophobicContact CB-CB 3.97Å; P8-Q13 HydrophobicContact CB-CG 4.05Å; P8-Q13 HydrophobicContact CG-CG 4Å
9	T	82.6	Confident	66.3	Low	71 Å²	71	91.8 Å²	91.8	44%	0.436	51%	0.508	S	S	.	.	P	Polyproline II helix	trans	-55.4	154.4	177.9	58.2	0	0	0	0	109.9	A7 Q11 Q12 Q13	A7-T9 PolarHBondContact O-N 3.01Å; T9-Q11 PolarHBondContact O-N 3.49Å; T9-Q12 WeakPolarHBondContact O-CA 3.37Å; T9-Q12 WeakPolarHBondContact O-CB 3.3Å; T9-Q12 PolarHBondContact O-N 3.33Å; T9-Q12 WeakPolarHBondContact OG1-CB 3.41Å; T9-Q12 VanDerWaalsContact OG1-CG 3.27Å; T9-Q12 WeakPolarHBondContact OG1-CG 3.48Å; T9-Q12 PolarHBondContact OG1-N 3.05Å; T9-Q12 PolarHBondContact OG1-OE1 2.97Å; T9-Q12 VanDerWaalsContact OG1-OE1 3.08Å; T9-Q13 PolarHBondContact O-N 3.36Å
10	A	79.7	Confident	66.8	Low	65 Å²	65	91.9 Å²	91.9	54%	0.537	51%	0.507	S	S	.	.	H	α-helix	trans	-53.3	-33.1	176.3	0	0	0	0	0	112.3	L14	A10-L14 VanDerWaalsContact O-CG 3.29Å; A10-L14 WeakPolarHBondContact O-CG 3.47Å; A10-L14 PolarHBondContact O-N 2.89Å; A10-L14 VanDerWaalsContact O-N 3.11Å
11	Q	83	Confident	67.4	Low	54 Å²	54	87.5 Å²	87.5	25%	0.252	48%	0.483	S	S	.	.	H	α-helix	trans	-64.6	-47	171.4	-75.1	-179.8	-41.3	0	0	112.9	T9 Q13 L14 L15 L37 I40	T9-Q11 PolarHBondContact O-N 3.49Å; Q11-Q13 PolarHBondContact O-N 3.14Å; Q11-L14 PolarHBondContact O-N 3.31Å; Q11-L15 WeakPolarHBondContact O-CG 3.37Å; Q11-L15 PolarHBondContact O-N 3.46Å; Q11-L37 HydrophobicContact CB-CD2 4.36Å; Q11-L37 HydrophobicContact CG-CD2 4.48Å; Q11-I40 HydrophobicContact CG-CB 4.38Å; Q11-I40 HydrophobicContact CG-CG2 3.55Å
12	Q	83.7	Confident	69.9	Low	99 Å²	99	78.1 Å²	78.1	46%	0.463	44%	0.436	S	S	.	.	H	α-helix	trans	-61.4	-43.2	177.3	-76.5	164.9	-31.9	0	0	111.6	P8 T9 L14 L15 E16	P8-Q12 HydrophobicContact CB-CB 3.97Å; T9-Q12 WeakPolarHBondContact O-CA 3.37Å; T9-Q12 WeakPolarHBondContact O-CB 3.3Å; T9-Q12 PolarHBondContact O-N 3.33Å; T9-Q12 WeakPolarHBondContact OG1-CB 3.41Å; T9-Q12 VanDerWaalsContact OG1-CG 3.27Å; T9-Q12 WeakPolarHBondContact OG1-CG 3.48Å; T9-Q12 PolarHBondContact OG1-N 3.05Å; T9-Q12 PolarHBondContact OG1-OE1 2.97Å; T9-Q12 VanDerWaalsContact OG1-OE1 3.08Å; Q12-L14 VanDerWaalsContact C-N 3.33Å; Q12-L14 PolarHBondContact O-N 3.32Å; Q12-L15 PolarHBondContact O-N 3.14Å; Q12-E16 WeakPolarHBondContact O-CG 3.22Å; Q12-E16 PolarHBondContact O-N 2.97Å
13	Q	84	Confident	71.5	Confident	94 Å²	94	74.5 Å²	74.5	44%	0.439	42%	0.416	S	S	.	.	H	α-helix	trans	-61.3	-39.8	176.2	-68.9	-178	-18	0	0	112.3	P8 T9 Q11 E16 Q17	P8-Q13 HydrophobicContact CB-CG 4.05Å; P8-Q13 HydrophobicContact CG-CG 4Å; T9-Q13 PolarHBondContact O-N 3.36Å; Q11-Q13 PolarHBondContact O-N 3.14Å; Q13-E16 WeakPolarHBondContact O-CB 3.11Å; Q13-E16 PolarHBondContact O-N 2.73Å; Q13-Q17 WeakPolarHBondContact O-CG 3.4Å; Q13-Q17 PolarHBondContact O-N 3.48Å
14	L	87.5	Confident	73.1	Confident	16 Å²	16	69.1 Å²	69.1	8%	0.084	39%	0.394	C	S	.	.	H	α-helix	trans	-70.6	-37.8	176.5	-72.4	167.8	0	0	0	112.1	A10 Q11 Q12 E16 Q17 V18 R36 L37 I40	A10-L14 VanDerWaalsContact O-CG 3.29Å; A10-L14 WeakPolarHBondContact O-CG 3.47Å; A10-L14 PolarHBondContact O-N 2.89Å; A10-L14 VanDerWaalsContact O-N 3.11Å; Q11-L14 PolarHBondContact O-N 3.31Å; Q12-L14 VanDerWaalsContact C-N 3.33Å; Q12-L14 PolarHBondContact O-N 3.32Å; L14-E16 VanDerWaalsContact C-N 3.32Å; L14-Q17 WeakPolarHBondContact O-CB 3.13Å; L14-Q17 PolarHBondContact O-N 3.3Å; L14-V18 WeakPolarHBondContact O-CG2 3.38Å; L14-V18 PolarHBondContact O-N 2.83Å; L14-R36 HydrophobicContact CD1-CB 3.83Å; L14-R36 HydrophobicContact CD2-CB 4.18Å; L14-L37 HydrophobicContact CB-CD1 3.98Å; L14-L37 HydrophobicContact CB-CD2 3.65Å; L14-L37 HydrophobicContact CB-CG 3.63Å; L14-L37 HydrophobicContact CD1-CD2 4.18Å; L14-L37 HydrophobicContact CD1-CG 4.21Å; L14-I40 HydrophobicContact CD1-CD1 3.49Å; L14-I40 VanDerWaalsContact CD1-CD1 3.49Å
15	L	86.9	Confident	75	Confident	16 Å²	16	70.3 Å²	70.3	8%	0.084	39%	0.391	C	S	.	.	H	α-helix	trans	-64.3	-37.8	173.1	-77.1	169.2	0	0	0	111.5	Q11 Q12 V18 R19 L37 D46 V47	Q11-L15 WeakPolarHBondContact O-CG 3.37Å; Q11-L15 PolarHBondContact O-N 3.46Å; Q12-L15 PolarHBondContact O-N 3.14Å; L15-V18 WeakPolarHBondContact O-CB 3.35Å; L15-V18 PolarHBondContact O-N 3.23Å; L15-R19 WeakPolarHBondContact O-CG 3.4Å; L15-R19 PolarHBondContact O-N 3.24Å; L15-L37 HydrophobicContact CD2-CD1 3.73Å; L15-L37 HydrophobicContact CG-CD1 3.96Å; L15-L37 HydrophobicContact CG-CD2 4.08Å; L15-D46 HydrophobicContact CD1-CB 3.96Å; L15-D46 HydrophobicContact CD2-CB 3.91Å; L15-V47 HydrophobicContact CD2-CG2 4.35Å
16	E	82.6	Confident	77	Confident	98 Å²	98	68 Å²	68	46%	0.458	37%	0.374	S	S	.	.	H	α-helix	trans	-62.4	-41.9	171.1	-76.1	170.6	-171.2	0	0	111.8	Q12 Q13 L14 V18 R19 L20	Q12-E16 WeakPolarHBondContact O-CG 3.22Å; Q12-E16 PolarHBondContact O-N 2.97Å; Q13-E16 WeakPolarHBondContact O-CB 3.11Å; Q13-E16 PolarHBondContact O-N 2.73Å; L14-E16 VanDerWaalsContact C-N 3.32Å; E16-V18 VanDerWaalsContact C-N 3.32Å; E16-V18 PolarHBondContact O-N 3.07Å; E16-R19 PolarHBondContact O-N 3.34Å; E16-L20 WeakPolarHBondContact O-CB 3.48Å; E16-L20 PolarHBondContact O-N 3.33Å
17	Q	84.9	Confident	78.9	Confident	72 Å²	72	66.5 Å²	66.5	34%	0.336	35%	0.352	S	S	.	.	H	α-helix	trans	-62.8	-38.4	173.9	-73.7	176.6	16	0	0	112.2	Q13 L14 G21 L29 S33	Q13-Q17 WeakPolarHBondContact O-CG 3.4Å; Q13-Q17 PolarHBondContact O-N 3.48Å; L14-Q17 WeakPolarHBondContact O-CB 3.13Å; L14-Q17 PolarHBondContact O-N 3.3Å; Q17-G21 PolarHBondContact O-N 3.13Å; Q17-L29 HydrophobicContact CB-CD1 4.47Å; Q17-S33 WeakPolarHBondContact CB-OG 3.05Å; Q17-S33 PolarHBondContact OE1-OG 3.44Å
18	V	86.1	Confident	80.5	Confident	1 Å²	1	66 Å²	66	1%	0.006	34%	0.338	C	S	.	.	H	α-helix	trans	-60.6	-52.9	171.4	171.3	0	0	0	0	110.2	L14 L15 E16 L20 G21 E22 V30 L34 L37 A50	L14-V18 WeakPolarHBondContact O-CG2 3.38Å; L14-V18 PolarHBondContact O-N 2.83Å; L15-V18 WeakPolarHBondContact O-CB 3.35Å; L15-V18 PolarHBondContact O-N 3.23Å; E16-V18 VanDerWaalsContact C-N 3.32Å; E16-V18 PolarHBondContact O-N 3.07Å; V18-L20 VanDerWaalsContact C-N 3.31Å; V18-L20 PolarHBondContact O-N 3.49Å; V18-G21 CarbonylContact O-C 3.54Å; V18-G21 PolarHBondContact O-N 2.86Å; V18-G21 VanDerWaalsContact O-N 3.1Å; V18-E22 HydrophobicContact CG1-CG 4.22Å; V18-E22 VanDerWaalsContact O-CG 3.31Å; V18-E22 WeakPolarHBondContact O-CG 3.05Å; V18-E22 PolarHBondContact O-N 3.35Å; V18-V30 HydrophobicContact CG1-CG1 4.33Å; V18-L34 HydrophobicContact CG2-CD2 4.33Å; V18-L34 HydrophobicContact CG2-CG 4.07Å; V18-L37 HydrophobicContact CG2-CD1 3.87Å; V18-A50 HydrophobicContact CG1-CB 3.93Å
19	R	81.2	Confident	81.6	Confident	83 Å²	83	65.4 Å²	65.4	31%	0.313	33%	0.331	S	S	.	.	H	α-helix	trans	-58.6	-42.4	179.9	-71.1	178.8	-169.9	139.5	4	112.1	L15 E16 E22 A23	L15-R19 WeakPolarHBondContact O-CG 3.4Å; L15-R19 PolarHBondContact O-N 3.24Å; E16-R19 PolarHBondContact O-N 3.34Å; R19-E22 PolarHBondContact O-N 3.3Å; R19-A23 VanDerWaalsContact O-CB 3.3Å; R19-A23 WeakPolarHBondContact O-CB 3.35Å; R19-A23 PolarHBondContact O-N 2.89Å
20	L	76.5	Confident	81.9	Confident	92 Å²	92	62 Å²	62	48%	0.482	31%	0.311	S	S	.	.	H	α-helix	trans	-63.5	-44.4	175.5	-177.8	66.1	0	0	0	111	E16 V18 E22 A23 T24	E16-L20 WeakPolarHBondContact O-CB 3.48Å; E16-L20 PolarHBondContact O-N 3.33Å; V18-L20 VanDerWaalsContact C-N 3.31Å; V18-L20 PolarHBondContact O-N 3.49Å; L20-E22 VanDerWaalsContact C-N 3.34Å; L20-E22 PolarHBondContact O-N 2.98Å; L20-A23 PolarHBondContact O-N 2.97Å; L20-T24 HydrophobicContact CD1-CG2 3.98Å; L20-T24 HydrophobicContact CG-CG2 4.44Å; L20-T24 WeakPolarHBondContact O-CB 3.35Å; L20-T24 WeakPolarHBondContact O-CG2 3.03Å; L20-T24 PolarHBondContact O-N 3.15Å; L20-T24 PolarHBondContact O-OG1 3.18Å
21	G	79.7	Confident	82.3	Confident	0 Å²	0	61.7 Å²	61.7	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-61	-41.8	175.3	0	0	0	0	0	112.4	Q17 V18 T24 H25 R26	Q17-G21 PolarHBondContact O-N 3.13Å; V18-G21 CarbonylContact O-C 3.54Å; V18-G21 PolarHBondContact O-N 2.86Å; V18-G21 VanDerWaalsContact O-N 3.1Å; G21-T24 PolarHBondContact O-N 2.04Å; G21-H25 CarbonylContact O-C 3.59Å; G21-H25 WeakPolarHBondContact O-CA 2.88Å; G21-H25 PolarHBondContact O-N 3.3Å; G21-R26 PolarHBondContact O-N 3.4Å
22	E	80.9	Confident	82.6	Confident	34 Å²	34	64.6 Å²	64.6	16%	0.159	31%	0.312	C	S	.	.	H	α-helix	trans	-63.7	-47.1	175.3	-68.9	-173.1	135.2	0	0	111.5	V18 R19 L20 T24 H25 V30 R53 R57	V18-E22 HydrophobicContact CG1-CG 4.22Å; V18-E22 VanDerWaalsContact O-CG 3.31Å; V18-E22 WeakPolarHBondContact O-CG 3.05Å; V18-E22 PolarHBondContact O-N 3.35Å; R19-E22 PolarHBondContact O-N 3.3Å; L20-E22 VanDerWaalsContact C-N 3.34Å; L20-E22 PolarHBondContact O-N 2.98Å; E22-T24 VanDerWaalsContact C-N 3.31Å; E22-T24 PolarHBondContact O-N 2.89Å; E22-H25 PolarHBondContact O-N 3.19Å; E22-V30 HydrophobicContact CG-CG2 3.9Å; E22-R53 IonicContact OE1-CZ 3.64Å; E22-R53 IonicContact OE1-NE 2.76Å; E22-R53 PolarHBondContact OE1-NE 3.34Å; E22-R53 IonicContact OE1-NH2 3.91Å; E22-R53 IonicContact OE2-CZ 3.1Å; E22-R53 IonicContact OE2-NE 3.03Å; E22-R53 PolarHBondContact OE2-NE 2.79Å; E22-R53 VanDerWaalsContact OE2-NE 3.08Å; E22-R53 IonicContact OE2-NH2 2.65Å; E22-R53 PolarHBondContact OE2-NH2 2.77Å; E22-R57 IonicContact OE1-CZ 2.79Å; E22-R57 IonicContact OE1-NH1 3.04Å; E22-R57 PolarHBondContact OE1-NH1 2.78Å; E22-R57 IonicContact OE1-NH2 2.66Å; E22-R57 PolarHBondContact OE1-NH2 2.98Å
23	A	69.9	Low	83	Confident	44 Å²	44	60 Å²	60	36%	0.364	29%	0.29	S	S	.	.	H	α-helix	trans	-69.9	-24.5	180	0	0	0	0	0	113.7	R19 L20 T160	R19-A23 VanDerWaalsContact O-CB 3.3Å; R19-A23 WeakPolarHBondContact O-CB 3.35Å; R19-A23 PolarHBondContact O-N 2.89Å; L20-A23 PolarHBondContact O-N 2.97Å; A23-T160 HydrophobicContact CB-CG2 4.35Å
24	T	71.8	Confident	83.3	Confident	74 Å²	74	55.5 Å²	55.5	45%	0.454	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.8	6.5	178.9	60.3	0	0	0	0	113.4	L20 G21 E22 R26	L20-T24 HydrophobicContact CD1-CG2 3.98Å; L20-T24 HydrophobicContact CG-CG2 4.44Å; L20-T24 WeakPolarHBondContact O-CB 3.35Å; L20-T24 WeakPolarHBondContact O-CG2 3.03Å; L20-T24 PolarHBondContact O-N 3.15Å; L20-T24 PolarHBondContact O-OG1 3.18Å; G21-T24 PolarHBondContact O-N 2.04Å; E22-T24 VanDerWaalsContact C-N 3.31Å; E22-T24 PolarHBondContact O-N 2.89Å; T24-R26 PolarHBondContact O-N 3.46Å
25	H	75.5	Confident	83.3	Confident	156 Å²	156	61.8 Å²	61.8	72%	0.722	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	55	32.3	-176.7	-51.5	-55	0	0	0	114.5	G21 E22 E27	G21-H25 CarbonylContact O-C 3.59Å; G21-H25 WeakPolarHBondContact O-CA 2.88Å; G21-H25 PolarHBondContact O-N 3.3Å; E22-H25 PolarHBondContact O-N 3.19Å; H25-E27 PolarHBondContact O-N 2.84Å
26	R	82.3	Confident	83.5	Confident	134 Å²	134	67.2 Å²	67.2	51%	0.506	31%	0.312	S	S	.	.			trans	-95.4	79.7	176.6	-73.5	-70.9	-61.6	-93.8	-0.4	110.7	G21 T24 D28 L29 V30	G21-R26 PolarHBondContact O-N 3.4Å; T24-R26 PolarHBondContact O-N 3.46Å; R26-D28 WeakPolarHBondContact CB-OD1 3.18Å; R26-D28 IonicContact CZ-OD1 2.69Å; R26-D28 IonicContact CZ-OD2 3.33Å; R26-D28 IonicContact NE-OD1 3.16Å; R26-D28 PolarHBondContact NE-OD1 3.11Å; R26-D28 IonicContact NE-OD2 2.86Å; R26-D28 PolarHBondContact NE-OD2 3.43Å; R26-D28 IonicContact NH2-OD1 3.9Å; R26-D28 IonicContact NH2-OD2 2.94Å; R26-D28 PolarHBondContact NH2-OD2 3.26Å; R26-D28 PolarHBondContact O-N 2.89Å; R26-L29 HydrophobicContact CB-CB 4.04Å; R26-L29 WeakPolarHBondContact O-CB 3.35Å; R26-L29 PolarHBondContact O-N 3.17Å; R26-L29 VanDerWaalsContact O-N 3.13Å; R26-V30 PolarHBondContact O-N 3.31Å
27	E	83.6	Confident	84	Confident	56 Å²	56	62.6 Å²	62.6	26%	0.262	29%	0.291	S	S	.	.	H	α-helix	trans	-65.4	-25.1	-176.6	-163	62.4	-151.7	0	0	112.5	H25 V30 Q31 S54 R57	H25-E27 PolarHBondContact O-N 2.84Å; E27-V30 PolarHBondContact O-N 3.28Å; E27-Q31 WeakPolarHBondContact O-CG 3.37Å; E27-Q31 PolarHBondContact O-N 3.42Å; E27-Q31 PolarHBondContact OE1-NE2 2.86Å; E27-Q31 VanDerWaalsContact OE1-NE2 3.08Å; E27-S54 PolarHBondContact OE1-OG 3.48Å; E27-R57 IonicContact OE1-NE 3.9Å; E27-R57 IonicContact OE1-NH2 3.57Å; E27-R57 IonicContact OE2-CZ 3.54Å; E27-R57 IonicContact OE2-NE 2.7Å; E27-R57 PolarHBondContact OE2-NE 3.25Å; E27-R57 IonicContact OE2-NH2 3.87Å; E27-R57 PolarHBondContact OE2-NH2 2.91Å
28	D	84.5	Confident	84.2	Confident	73 Å²	73	61.9 Å²	61.9	39%	0.39	29%	0.288	S	S	.	.	H	α-helix	trans	-59.3	-46.4	170.9	62.7	-41.3	0	0	0	112.1	R26 V30 Q31 Q32	R26-D28 WeakPolarHBondContact CB-OD1 3.18Å; R26-D28 IonicContact CZ-OD1 2.69Å; R26-D28 IonicContact CZ-OD2 3.33Å; R26-D28 IonicContact NE-OD1 3.16Å; R26-D28 PolarHBondContact NE-OD1 3.11Å; R26-D28 IonicContact NE-OD2 2.86Å; R26-D28 PolarHBondContact NE-OD2 3.43Å; R26-D28 IonicContact NH2-OD1 3.9Å; R26-D28 IonicContact NH2-OD2 2.94Å; R26-D28 PolarHBondContact NH2-OD2 3.26Å; R26-D28 PolarHBondContact O-N 2.89Å; D28-V30 VanDerWaalsContact C-N 3.35Å; D28-Q31 PolarHBondContact O-N 3Å; D28-Q32 WeakPolarHBondContact O-CG 3.33Å; D28-Q32 PolarHBondContact O-N 3.22Å; D28-Q32 VanDerWaalsContact O-N 3.15Å
29	L	87.3	Confident	84.2	Confident	41 Å²	41	67.6 Å²	67.6	22%	0.215	32%	0.317	C	S	.	.	H	α-helix	trans	-66.3	-40.1	177.6	-178.3	63.4	0	0	0	111	Q17 R26 S33	Q17-L29 HydrophobicContact CB-CD1 4.47Å; R26-L29 HydrophobicContact CB-CB 4.04Å; R26-L29 WeakPolarHBondContact O-CB 3.35Å; R26-L29 PolarHBondContact O-N 3.17Å; R26-L29 VanDerWaalsContact O-N 3.13Å; L29-S33 VanDerWaalsContact O-CB 3.29Å; L29-S33 WeakPolarHBondContact O-CB 3.34Å; L29-S33 PolarHBondContact O-N 3.18Å; L29-S33 PolarHBondContact O-OG 2.83Å
30	V	88.3	Confident	84.5	Confident	0 Å²	0	67.9 Å²	67.9	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-61	-50.7	176.6	174.8	0	0	0	0	110.8	V18 E22 R26 E27 D28 Q32 S33 L34	V18-V30 HydrophobicContact CG1-CG1 4.33Å; E22-V30 HydrophobicContact CG-CG2 3.9Å; R26-V30 PolarHBondContact O-N 3.31Å; E27-V30 PolarHBondContact O-N 3.28Å; D28-V30 VanDerWaalsContact C-N 3.35Å; V30-Q32 PolarHBondContact O-N 3.26Å; V30-S33 PolarHBondContact O-N 3.27Å; V30-L34 HydrophobicContact CG1-CD1 3.64Å; V30-L34 HydrophobicContact CG1-CG 4.21Å; V30-L34 VanDerWaalsContact O-CB 3.26Å; V30-L34 WeakPolarHBondContact O-CB 2.74Å; V30-L34 WeakPolarHBondContact O-CG 3.26Å; V30-L34 PolarHBondContact O-N 3.12Å
31	Q	88.5	Confident	85.1	Confident	58 Å²	58	66.2 Å²	66.2	27%	0.271	32%	0.316	S	S	.	.	H	α-helix	trans	-61.3	-45.8	-179	-70.3	-50	-55.6	0	0	112.4	E27 D28 S33 L34 Y35 S54	E27-Q31 WeakPolarHBondContact O-CG 3.37Å; E27-Q31 PolarHBondContact O-N 3.42Å; E27-Q31 PolarHBondContact OE1-NE2 2.86Å; E27-Q31 VanDerWaalsContact OE1-NE2 3.08Å; D28-Q31 PolarHBondContact O-N 3Å; Q31-S33 VanDerWaalsContact C-N 3.33Å; Q31-S33 PolarHBondContact O-N 3.43Å; Q31-L34 PolarHBondContact O-N 3.38Å; Q31-Y35 WeakPolarHBondContact O-CB 3.47Å; Q31-Y35 PolarHBondContact O-N 2.83Å; Q31-S54 PolarHBondContact NE2-OG 2.95Å
32	Q	88.2	Confident	85.5	Confident	116 Å²	116	68.9 Å²	68.9	54%	0.542	33%	0.333	S	S	.	.	H	α-helix	trans	-63.8	-40.3	-179.4	-71.4	-179.1	10.1	0	0	112.2	D28 V30 R36	D28-Q32 WeakPolarHBondContact O-CG 3.33Å; D28-Q32 PolarHBondContact O-N 3.22Å; D28-Q32 VanDerWaalsContact O-N 3.15Å; V30-Q32 PolarHBondContact O-N 3.26Å; Q32-R36 WeakPolarHBondContact O-CG 3.33Å; Q32-R36 PolarHBondContact O-N 3.17Å
33	S	92.1	Very high	86	Confident	1 Å²	1	71.4 Å²	71.4	1%	0.007	35%	0.348	C	S	.	.	H	α-helix	trans	-72.7	-41.5	-179.7	-53.9	0	0	0	0	111.4	Q17 L29 V30 Q31 R36 L37	Q17-S33 WeakPolarHBondContact CB-OG 3.05Å; Q17-S33 PolarHBondContact OE1-OG 3.44Å; L29-S33 VanDerWaalsContact O-CB 3.29Å; L29-S33 WeakPolarHBondContact O-CB 3.34Å; L29-S33 PolarHBondContact O-N 3.18Å; L29-S33 PolarHBondContact O-OG 2.83Å; V30-S33 PolarHBondContact O-N 3.27Å; Q31-S33 VanDerWaalsContact C-N 3.33Å; Q31-S33 PolarHBondContact O-N 3.43Å; S33-R36 PolarHBondContact O-N 2.8Å; S33-L37 WeakPolarHBondContact O-CB 3.49Å; S33-L37 WeakPolarHBondContact O-CG 3.37Å; S33-L37 PolarHBondContact O-N 2.95Å
34	L	90.7	Very high	87	Confident	0 Å²	0	70.6 Å²	70.6	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-60.6	-45.7	174.4	-84.7	176.6	0	0	0	112.3	V18 V30 Q31 R36 L37 E38 A50	V18-L34 HydrophobicContact CG2-CD2 4.33Å; V18-L34 HydrophobicContact CG2-CG 4.07Å; V30-L34 HydrophobicContact CG1-CD1 3.64Å; V30-L34 HydrophobicContact CG1-CG 4.21Å; V30-L34 VanDerWaalsContact O-CB 3.26Å; V30-L34 WeakPolarHBondContact O-CB 2.74Å; V30-L34 WeakPolarHBondContact O-CG 3.26Å; V30-L34 PolarHBondContact O-N 3.12Å; Q31-L34 PolarHBondContact O-N 3.38Å; L34-R36 VanDerWaalsContact C-N 3.28Å; L34-R36 PolarHBondContact O-N 3.13Å; L34-L37 WeakPolarHBondContact O-CB 3.43Å; L34-L37 PolarHBondContact O-N 3.04Å; L34-L37 VanDerWaalsContact O-N 3.12Å; L34-E38 WeakPolarHBondContact O-CG 3.04Å; L34-E38 PolarHBondContact O-N 2.86Å; L34-A50 HydrophobicContact CD2-CB 3.52Å
35	Y	88.1	Confident	87.9	Confident	149 Å²	149	68.8 Å²	68.8	58%	0.584	33%	0.327	S	S	*	.	H	α-helix	trans	-57.4	-42.9	177.9	176.9	-102.6	0	0	0	112	Q31 L39	Q31-Y35 WeakPolarHBondContact O-CB 3.47Å; Q31-Y35 PolarHBondContact O-N 2.83Å; Y35-L39 HydrophobicContact CD1-CD1 4.21Å; Y35-L39 HydrophobicContact CE1-CD1 3.65Å; Y35-L39 WeakPolarHBondContact O-CG 3.19Å; Y35-L39 PolarHBondContact O-N 2.77Å
36	R	91.5	Very high	88.6	Confident	130 Å²	130	64.2 Å²	64.2	49%	0.491	31%	0.308	S	S	.	.	H	α-helix	trans	-66.6	-41.7	176.1	-67.8	173.6	-176.2	176	2.7	111.7	L14 Q32 S33 L34 L39 I40	L14-R36 HydrophobicContact CD1-CB 3.83Å; L14-R36 HydrophobicContact CD2-CB 4.18Å; Q32-R36 WeakPolarHBondContact O-CG 3.33Å; Q32-R36 PolarHBondContact O-N 3.17Å; S33-R36 PolarHBondContact O-N 2.8Å; L34-R36 VanDerWaalsContact C-N 3.28Å; L34-R36 PolarHBondContact O-N 3.13Å; R36-L39 PolarHBondContact O-N 3.24Å; R36-I40 WeakPolarHBondContact O-CD1 3.28Å; R36-I40 WeakPolarHBondContact O-CG1 3.29Å; R36-I40 PolarHBondContact O-N 3.12Å; R36-I40 VanDerWaalsContact O-N 3.15Å
37	L	92.3	Very high	89.1	Confident	0 Å²	0	57.9 Å²	57.9	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-63.5	-41.7	177.7	-78.8	166.8	0	0	0	112.7	Q11 L14 L15 V18 S33 L34 L39 I40 D41 V47	Q11-L37 HydrophobicContact CB-CD2 4.36Å; Q11-L37 HydrophobicContact CG-CD2 4.48Å; L14-L37 HydrophobicContact CB-CD1 3.98Å; L14-L37 HydrophobicContact CB-CD2 3.65Å; L14-L37 HydrophobicContact CB-CG 3.63Å; L14-L37 HydrophobicContact CD1-CD2 4.18Å; L14-L37 HydrophobicContact CD1-CG 4.21Å; L15-L37 HydrophobicContact CD2-CD1 3.73Å; L15-L37 HydrophobicContact CG-CD1 3.96Å; L15-L37 HydrophobicContact CG-CD2 4.08Å; V18-L37 HydrophobicContact CG2-CD1 3.87Å; S33-L37 WeakPolarHBondContact O-CB 3.49Å; S33-L37 WeakPolarHBondContact O-CG 3.37Å; S33-L37 PolarHBondContact O-N 2.95Å; L34-L37 WeakPolarHBondContact O-CB 3.43Å; L34-L37 PolarHBondContact O-N 3.04Å; L34-L37 VanDerWaalsContact O-N 3.12Å; L37-L39 VanDerWaalsContact C-N 3.27Å; L37-L39 PolarHBondContact O-N 3.12Å; L37-I40 PolarHBondContact O-N 3.13Å; L37-I40 VanDerWaalsContact O-N 3.11Å; L37-D41 CarbonylContact O-C 3.58Å; L37-D41 PolarHBondContact O-N 3.03Å; L37-V47 HydrophobicContact CB-CB 4.45Å; L37-V47 HydrophobicContact CB-CG1 3.82Å; L37-V47 HydrophobicContact CB-CG2 3.76Å; L37-V47 HydrophobicContact CD1-CG2 4.33Å; L37-V47 HydrophobicContact CD2-CG2 4.04Å; L37-V47 HydrophobicContact CG-CG2 4.26Å
38	E	89.9	Confident	89.5	Confident	58 Å²	58	55.3 Å²	55.3	27%	0.271	27%	0.272	S	S	.	.	H	α-helix	trans	-64.8	-29.8	177.1	-73.1	177.8	167.2	0	0	112.3	L34 P42 V47 R51	L34-E38 WeakPolarHBondContact O-CG 3.04Å; L34-E38 PolarHBondContact O-N 2.86Å; E38-P42 VanDerWaalsContact O-CB 3.29Å; E38-P42 WeakPolarHBondContact O-CB 3.31Å; E38-P42 VanDerWaalsContact O-CD 3.28Å; E38-P42 WeakPolarHBondContact O-CD 3.41Å; E38-V47 HydrophobicContact CG-CG1 3.78Å; E38-R51 WeakPolarHBondContact OE1-CD 3.33Å; E38-R51 WeakPolarHBondContact OE1-CG 3.39Å; E38-R51 IonicContact OE1-NE 3.98Å
39	L	85.5	Confident	89.8	Confident	121 Å²	121	51.9 Å²	51.9	63%	0.634	25%	0.254	S	S	*	.	H	α-helix	trans	-74.1	-31.7	171.7	-71	174.4	0	0	0	113.1	Y35 R36 L37	Y35-L39 HydrophobicContact CD1-CD1 4.21Å; Y35-L39 HydrophobicContact CE1-CD1 3.65Å; Y35-L39 WeakPolarHBondContact O-CG 3.19Å; Y35-L39 PolarHBondContact O-N 2.77Å; R36-L39 PolarHBondContact O-N 3.24Å; L37-L39 VanDerWaalsContact C-N 3.27Å; L37-L39 PolarHBondContact O-N 3.12Å
40	I	87	Confident	90	Very high	89 Å²	89	50 Å²	50	46%	0.456	24%	0.244	S	C	.	.	H	α-helix	trans	-82.9	-46.9	-175.9	-62.8	161.6	0	0	0	111.1	Q11 L14 R36 L37	Q11-I40 HydrophobicContact CG-CB 4.38Å; Q11-I40 HydrophobicContact CG-CG2 3.55Å; L14-I40 HydrophobicContact CD1-CD1 3.49Å; L14-I40 VanDerWaalsContact CD1-CD1 3.49Å; R36-I40 WeakPolarHBondContact O-CD1 3.28Å; R36-I40 WeakPolarHBondContact O-CG1 3.29Å; R36-I40 PolarHBondContact O-N 3.12Å; R36-I40 VanDerWaalsContact O-N 3.15Å; L37-I40 PolarHBondContact O-N 3.13Å; L37-I40 VanDerWaalsContact O-N 3.11Å
41	D	89.4	Confident	90.2	Very high	56 Å²	56	53 Å²	53	30%	0.299	26%	0.255	S	S	.	.			trans	-153.2	90.2	174.5	-175.9	-0.9	0	0	0	110.6	L37 N43 N44	L37-D41 CarbonylContact O-C 3.58Å; L37-D41 PolarHBondContact O-N 3.03Å; D41-N43 PolarHBondContact O-N 3.22Å; D41-N43 VanDerWaalsContact O-N 3.17Å; D41-N43 PolarHBondContact OD1-N 2.99Å; D41-N43 VanDerWaalsContact OD1-N 3.12Å; D41-N44 HydrophobicContact CB-CB 4.09Å; D41-N44 PolarHBondContact O-N 2.77Å; D41-N44 PolarHBondContact OD1-N 2.73Å; D41-N44 WeakPolarHBondContact OD2-CB 3.38Å
42	P	88.4	Confident	90.4	Very high	57 Å²	57	50.3 Å²	50.3	37%	0.37	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-16.5	-177.8	24.4	-31.4	0	0	0	113.2	E38 R70	E38-P42 VanDerWaalsContact O-CB 3.29Å; E38-P42 WeakPolarHBondContact O-CB 3.31Å; E38-P42 VanDerWaalsContact O-CD 3.28Å; E38-P42 WeakPolarHBondContact O-CD 3.41Å; P42-R70 PolarHBondContact O-NH1 2.74Å; P42-R70 PolarHBondContact O-NH2 2.63Å
43	N	90.3	Very high	90.5	Very high	86 Å²	86	46.5 Å²	46.5	46%	0.46	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.7	-1.5	-177.4	-70.9	-28.5	0	0	0	112.9	D41 P45 R70 L74	D41-N43 PolarHBondContact O-N 3.22Å; D41-N43 VanDerWaalsContact O-N 3.17Å; D41-N43 PolarHBondContact OD1-N 2.99Å; D41-N43 VanDerWaalsContact OD1-N 3.12Å; N43-P45 WeakPolarHBondContact O-CD 3.48Å; N43-R70 PolarHBondContact OD1-NH2 2.79Å; N43-L74 HydrophobicContact CB-CD1 4.47Å; N43-L74 HydrophobicContact CB-CD2 4.2Å
44	N	91.5	Very high	90.4	Very high	27 Å²	27	46.5 Å²	46.5	14%	0.144	22%	0.223	C	C	.	.			trans	-59.5	123.1	173.7	-174.4	-38.5	0	0	0	110	D41 D46 V47 V48	D41-N44 HydrophobicContact CB-CB 4.09Å; D41-N44 PolarHBondContact O-N 2.77Å; D41-N44 PolarHBondContact OD1-N 2.73Å; D41-N44 WeakPolarHBondContact OD2-CB 3.38Å; N44-D46 PolarHBondContact O-N 3.44Å; N44-D46 VanDerWaalsContact O-N 3.14Å; N44-D46 PolarHBondContact OD1-N 3.39Å; N44-V47 HydrophobicContact CB-CB 4.12Å; N44-V47 HydrophobicContact CB-CG2 3.72Å; N44-V47 PolarHBondContact O-N 3.47Å; N44-V48 WeakPolarHBondContact O-CG2 3.14Å; N44-V48 PolarHBondContact O-N 2.89Å
45	P	91.5	Very high	90.5	Very high	37 Å²	37	47.1 Å²	47.1	24%	0.24	23%	0.226	C	C	.	.	H	α-helix	trans	-53.2	-35.1	-179.5	-29.1	36.8	0	0	0	114.5	N43 A49 L71 A75 A80	N43-P45 WeakPolarHBondContact O-CD 3.48Å; P45-A49 VanDerWaalsContact O-CB 3.25Å; P45-A49 WeakPolarHBondContact O-CB 3.09Å; P45-A49 PolarHBondContact O-N 3.19Å; P45-L71 HydrophobicContact CB-CD1 3.81Å; P45-L71 WeakPolarHBondContact O-CD1 3.29Å; P45-A75 HydrophobicContact CB-CB 4.02Å; P45-A75 HydrophobicContact CG-CB 3.56Å; P45-A80 HydrophobicContact CB-CB 4.07Å
46	D	90.3	Very high	90.5	Very high	60 Å²	60	41.4 Å²	41.4	32%	0.321	21%	0.206	S	C	.	.	H	α-helix	trans	-72.1	-34.6	179.7	-67	-36.2	0	0	0	112.2	L15 N44 A49 A50	L15-D46 HydrophobicContact CD1-CB 3.96Å; L15-D46 HydrophobicContact CD2-CB 3.91Å; N44-D46 PolarHBondContact O-N 3.44Å; N44-D46 VanDerWaalsContact O-N 3.14Å; N44-D46 PolarHBondContact OD1-N 3.39Å; D46-A49 PolarHBondContact O-N 2.9Å; D46-A50 VanDerWaalsContact O-CB 3.26Å; D46-A50 WeakPolarHBondContact O-CB 3.12Å; D46-A50 PolarHBondContact O-N 2.78Å
47	V	91.5	Very high	90.3	Very high	1 Å²	1	40.2 Å²	40.2	1%	0.006	20%	0.201	C	C	.	.	H	α-helix	trans	-69.4	-45	176.4	179.1	0	0	0	0	110	L15 L37 E38 N44 A49 A50 R51	L15-V47 HydrophobicContact CD2-CG2 4.35Å; L37-V47 HydrophobicContact CB-CB 4.45Å; L37-V47 HydrophobicContact CB-CG1 3.82Å; L37-V47 HydrophobicContact CB-CG2 3.76Å; L37-V47 HydrophobicContact CD1-CG2 4.33Å; L37-V47 HydrophobicContact CD2-CG2 4.04Å; L37-V47 HydrophobicContact CG-CG2 4.26Å; E38-V47 HydrophobicContact CG-CG1 3.78Å; N44-V47 HydrophobicContact CB-CB 4.12Å; N44-V47 HydrophobicContact CB-CG2 3.72Å; N44-V47 PolarHBondContact O-N 3.47Å; V47-A49 VanDerWaalsContact C-N 3.35Å; V47-A49 PolarHBondContact O-N 2.84Å; V47-A50 PolarHBondContact O-N 2.86Å; V47-R51 PolarHBondContact O-N 2.79Å
48	V	93	Very high	90.1	Very high	2 Å²	2	45.1 Å²	45.1	1%	0.012	22%	0.224	C	C	.	.	H	α-helix	trans	-62.9	-41.7	175.3	179.5	0	0	0	0	111	N44 R51 F52 Q67 L71 L74	N44-V48 WeakPolarHBondContact O-CG2 3.14Å; N44-V48 PolarHBondContact O-N 2.89Å; V48-R51 PolarHBondContact O-N 2.87Å; V48-F52 WeakPolarHBondContact O-CB 3.04Å; V48-F52 PolarHBondContact O-N 2.81Å; V48-Q67 HydrophobicContact CG1-CB 4.39Å; V48-L71 HydrophobicContact CB-CD1 4.18Å; V48-L71 HydrophobicContact CG1-CB 3.99Å; V48-L71 HydrophobicContact CG1-CD1 4.21Å; V48-L74 HydrophobicContact CG2-CD1 3.93Å
49	A	91.5	Very high	89.9	Confident	1 Å²	1	45 Å²	45	1%	0.008	24%	0.238	C	C	.	.	H	α-helix	trans	-65.8	-39.4	175.9	0	0	0	0	0	112.9	P45 D46 V47 F52 R53 L71 A80	P45-A49 VanDerWaalsContact O-CB 3.25Å; P45-A49 WeakPolarHBondContact O-CB 3.09Å; P45-A49 PolarHBondContact O-N 3.19Å; D46-A49 PolarHBondContact O-N 2.9Å; V47-A49 VanDerWaalsContact C-N 3.35Å; V47-A49 PolarHBondContact O-N 2.84Å; A49-F52 WeakPolarHBondContact O-CB 3.42Å; A49-F52 PolarHBondContact O-N 2.77Å; A49-R53 WeakPolarHBondContact O-CG 3.28Å; A49-R53 PolarHBondContact O-N 2.87Å; A49-L71 HydrophobicContact CB-CD2 3.95Å; A49-A80 HydrophobicContact CB-CB 3.93Å
50	A	90.3	Very high	90.1	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-67.3	-39.3	175.5	0	0	0	0	0	112.2	V18 L34 D46 V47 R53 S54	V18-A50 HydrophobicContact CG1-CB 3.93Å; L34-A50 HydrophobicContact CD2-CB 3.52Å; D46-A50 VanDerWaalsContact O-CB 3.26Å; D46-A50 WeakPolarHBondContact O-CB 3.12Å; D46-A50 PolarHBondContact O-N 2.78Å; V47-A50 PolarHBondContact O-N 2.86Å; A50-R53 PolarHBondContact O-N 2.96Å; A50-S54 PolarHBondContact O-N 2.91Å
51	R	92.4	Very high	90.2	Very high	65 Å²	65	42 Å²	42	25%	0.245	22%	0.223	C	C	.	.	H	α-helix	trans	-62.5	-43.9	172.4	-173.9	61.6	171.6	176	3.2	111.5	E38 V47 V48 R53 S54 L55 Q67	E38-R51 WeakPolarHBondContact OE1-CD 3.33Å; E38-R51 WeakPolarHBondContact OE1-CG 3.39Å; E38-R51 IonicContact OE1-NE 3.98Å; V47-R51 PolarHBondContact O-N 2.79Å; V48-R51 PolarHBondContact O-N 2.87Å; R51-R53 PolarHBondContact O-N 2.85Å; R51-S54 PolarHBondContact O-N 2.98Å; R51-L55 HydrophobicContact CG-CD1 4.25Å; R51-L55 WeakPolarHBondContact O-CG 3.47Å; R51-L55 PolarHBondContact O-N 2.79Å; R51-Q67 HydrophobicContact CG-CG 4.27Å
52	F	93.4	Very high	90.2	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-53.4	-49	172	158	-93.1	0	0	0	112.1	V48 A49 S54 L55 L56 A64 Q67 L68 S84 T87 M88	V48-F52 WeakPolarHBondContact O-CB 3.04Å; V48-F52 PolarHBondContact O-N 2.81Å; A49-F52 WeakPolarHBondContact O-CB 3.42Å; A49-F52 PolarHBondContact O-N 2.77Å; F52-S54 PolarHBondContact O-N 2.7Å; F52-L55 PolarHBondContact O-N 2.87Å; F52-L56 HydrophobicContact CE1-CD1 3.7Å; F52-L56 HydrophobicContact CE2-CD1 3.76Å; F52-L56 HydrophobicContact CE2-CG 4.16Å; F52-L56 HydrophobicContact CZ-CD1 3.26Å; F52-L56 HydrophobicContact CZ-CG 4.13Å; F52-L56 PolarHBondContact O-N 2.86Å; F52-A64 HydrophobicContact CD2-CB 3.88Å; F52-A64 WeakPolarHBondContact CD2-O 3.46Å; F52-A64 HydrophobicContact CE2-CB 4.04Å; F52-Q67 HydrophobicContact CB-CB 3.84Å; F52-L68 HydrophobicContact CD2-CB 4.19Å; F52-L68 HydrophobicContact CE2-CB 4.19Å; F52-S84 VanDerWaalsContact CD1-OG 3.28Å; F52-S84 WeakPolarHBondContact CD1-OG 3.1Å; F52-S84 VanDerWaalsContact CE1-CB 3.49Å; F52-S84 WeakPolarHBondContact CE1-O 3.14Å; F52-S84 WeakPolarHBondContact CZ-O 3.33Å; F52-T87 HydrophobicContact CE1-CG2 3.96Å; F52-T87 HydrophobicContact CZ-CG2 4.32Å; F52-M88 HydrophobicContact CE2-CB 4.1Å; F52-M88 HydrophobicContact CE2-CE 3.79Å; F52-M88 HydrophobicContact CE2-SD 4.22Å; F52-M88 HydrophobicContact CZ-CB 3.9Å
53	R	90.9	Very high	90.3	Very high	37 Å²	37	43 Å²	43	14%	0.14	23%	0.228	C	C	.	.	H	α-helix	trans	-64.9	-38.9	179.2	-70.7	-169	-58.4	-95.2	11.1	112.4	E22 A49 A50 R51 L56 R57	E22-R53 IonicContact OE1-CZ 3.64Å; E22-R53 IonicContact OE1-NE 2.76Å; E22-R53 PolarHBondContact OE1-NE 3.34Å; E22-R53 IonicContact OE1-NH2 3.91Å; E22-R53 IonicContact OE2-CZ 3.1Å; E22-R53 IonicContact OE2-NE 3.03Å; E22-R53 PolarHBondContact OE2-NE 2.79Å; E22-R53 VanDerWaalsContact OE2-NE 3.08Å; E22-R53 IonicContact OE2-NH2 2.65Å; E22-R53 PolarHBondContact OE2-NH2 2.77Å; A49-R53 WeakPolarHBondContact O-CG 3.28Å; A49-R53 PolarHBondContact O-N 2.87Å; A50-R53 PolarHBondContact O-N 2.96Å; R51-R53 PolarHBondContact O-N 2.85Å; R53-L56 PolarHBondContact O-N 2.79Å; R53-R57 PolarHBondContact O-N 2.8Å
54	S	89.7	Confident	90.4	Very high	0 Å²	0	39 Å²	39	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-64.4	-43.3	176.4	-178.3	0	0	0	0	112.3	E27 Q31 A50 R51 F52 L56 R57 Q58	E27-S54 PolarHBondContact OE1-OG 3.48Å; Q31-S54 PolarHBondContact NE2-OG 2.95Å; A50-S54 PolarHBondContact O-N 2.91Å; R51-S54 PolarHBondContact O-N 2.98Å; F52-S54 PolarHBondContact O-N 2.7Å; S54-L56 PolarHBondContact O-N 2.79Å; S54-R57 PolarHBondContact O-N 2.94Å; S54-Q58 WeakPolarHBondContact O-CG 3.23Å; S54-Q58 PolarHBondContact O-N 3.48Å; S54-Q58 PolarHBondContact OG-NE2 2.82Å
55	L	91.1	Very high	90.4	Very high	13 Å²	13	41.1 Å²	41.1	7%	0.068	22%	0.215	C	C	.	.	H	α-helix	trans	-61.6	-41.9	175.3	-69.9	168.7	0	0	0	112	R51 F52 R57 Q58 G59 D60 A64 Q67	R51-L55 HydrophobicContact CG-CD1 4.25Å; R51-L55 WeakPolarHBondContact O-CG 3.47Å; R51-L55 PolarHBondContact O-N 2.79Å; F52-L55 PolarHBondContact O-N 2.87Å; L55-R57 PolarHBondContact O-N 2.76Å; L55-Q58 CarbonylContact O-C 3.49Å; L55-Q58 PolarHBondContact O-N 2.8Å; L55-Q58 VanDerWaalsContact O-N 3.17Å; L55-G59 PolarHBondContact O-N 2.77Å; L55-G59 VanDerWaalsContact O-N 3.12Å; L55-D60 HydrophobicContact CB-CB 4.44Å; L55-D60 HydrophobicContact CD2-CB 4.19Å; L55-D60 PolarHBondContact O-N 2.85Å; L55-A64 HydrophobicContact CB-CB 4.08Å; L55-Q67 HydrophobicContact CD1-CG 3.64Å
56	L	89	Confident	90.5	Very high	29 Å²	29	46.3 Å²	46.3	15%	0.152	23%	0.234	C	C	.	.	H	α-helix	trans	-60.5	-42.1	173.5	-77.5	-176.8	0	0	0	112.7	F52 R53 S54 Q58 G59 I61 A64 T87 M88	F52-L56 HydrophobicContact CE1-CD1 3.7Å; F52-L56 HydrophobicContact CE2-CD1 3.76Å; F52-L56 HydrophobicContact CE2-CG 4.16Å; F52-L56 HydrophobicContact CZ-CD1 3.26Å; F52-L56 HydrophobicContact CZ-CG 4.13Å; F52-L56 PolarHBondContact O-N 2.86Å; R53-L56 PolarHBondContact O-N 2.79Å; S54-L56 PolarHBondContact O-N 2.79Å; L56-Q58 VanDerWaalsContact C-N 3.27Å; L56-Q58 PolarHBondContact O-N 2.8Å; L56-G59 PolarHBondContact O-N 3.02Å; L56-G59 VanDerWaalsContact O-N 3.13Å; L56-I61 HydrophobicContact CD2-CD1 3.54Å; L56-A64 HydrophobicContact CD2-CB 3.54Å; L56-A64 HydrophobicContact CG-CB 3.65Å; L56-T87 HydrophobicContact CD1-CG2 3.72Å; L56-M88 HydrophobicContact CD2-SD 4.08Å
57	R	87.6	Confident	90.7	Very high	105 Å²	105	45.2 Å²	45.2	40%	0.396	23%	0.227	S	C	.	.	H	α-helix	trans	-65.6	-30.1	176	-74.3	-167	-60.9	-82.5	-3.5	112.9	E22 E27 R53 S54 L55 G59	E22-R57 IonicContact OE1-CZ 2.79Å; E22-R57 IonicContact OE1-NH1 3.04Å; E22-R57 PolarHBondContact OE1-NH1 2.78Å; E22-R57 IonicContact OE1-NH2 2.66Å; E22-R57 PolarHBondContact OE1-NH2 2.98Å; E27-R57 IonicContact OE1-NE 3.9Å; E27-R57 IonicContact OE1-NH2 3.57Å; E27-R57 IonicContact OE2-CZ 3.54Å; E27-R57 IonicContact OE2-NE 2.7Å; E27-R57 PolarHBondContact OE2-NE 3.25Å; E27-R57 IonicContact OE2-NH2 3.87Å; E27-R57 PolarHBondContact OE2-NH2 2.91Å; R53-R57 PolarHBondContact O-N 2.8Å; S54-R57 PolarHBondContact O-N 2.94Å; L55-R57 PolarHBondContact O-N 2.76Å; R57-G59 VanDerWaalsContact C-N 3.27Å
58	Q	87.9	Confident	90.8	Very high	104 Å²	104	45.7 Å²	45.7	49%	0.486	23%	0.229	S	C	.	.	H	α-helix	trans	-79.4	-7.9	174.9	-67.5	172.7	21.2	0	0	113.3	S54 L55 L56 D60	S54-Q58 WeakPolarHBondContact O-CG 3.23Å; S54-Q58 PolarHBondContact O-N 3.48Å; S54-Q58 PolarHBondContact OG-NE2 2.82Å; L55-Q58 CarbonylContact O-C 3.49Å; L55-Q58 PolarHBondContact O-N 2.8Å; L55-Q58 VanDerWaalsContact O-N 3.17Å; L56-Q58 VanDerWaalsContact C-N 3.27Å; L56-Q58 PolarHBondContact O-N 2.8Å; Q58-D60 VanDerWaalsContact C-N 3.34Å
59	G	84.8	Confident	90.8	Very high	54 Å²	54	49.2 Å²	49.2	56%	0.557	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	82.5	5.9	-177.3	0	0	0	0	0	114.7	L55 L56 R57 I61	L55-G59 PolarHBondContact O-N 2.77Å; L55-G59 VanDerWaalsContact O-N 3.12Å; L56-G59 PolarHBondContact O-N 3.02Å; L56-G59 VanDerWaalsContact O-N 3.13Å; R57-G59 VanDerWaalsContact C-N 3.27Å; G59-I61 VanDerWaalsContact C-N 3.35Å; G59-I61 PolarHBondContact O-N 3.4Å; G59-I61 VanDerWaalsContact O-N 3.07Å
60	D	90.5	Very high	90.9	Very high	72 Å²	72	52.7 Å²	52.7	39%	0.385	26%	0.261	S	S	.	.			trans	-82.8	78.3	175.5	-175.5	7.6	0	0	0	110.5	L55 Q58 G63 A64	L55-D60 HydrophobicContact CB-CB 4.44Å; L55-D60 HydrophobicContact CD2-CB 4.19Å; L55-D60 PolarHBondContact O-N 2.85Å; Q58-D60 VanDerWaalsContact C-N 3.34Å; D60-G63 PolarHBondContact O-N 3.41Å; D60-G63 WeakPolarHBondContact OD1-CA 3.46Å; D60-G63 PolarHBondContact OD1-N 3.48Å; D60-A64 WeakPolarHBondContact O-CB 3.46Å; D60-A64 PolarHBondContact O-N 3.49Å
61	I	89.5	Confident	91.1	Very high	77 Å²	77	52.7 Å²	52.7	40%	0.395	26%	0.261	S	S	.	.	H	α-helix	trans	-65	-39.3	-179.2	-54.5	-56.8	0	0	0	111.4	L56 G59 A64 Q65	L56-I61 HydrophobicContact CD2-CD1 3.54Å; G59-I61 VanDerWaalsContact C-N 3.35Å; G59-I61 PolarHBondContact O-N 3.4Å; G59-I61 VanDerWaalsContact O-N 3.07Å; I61-A64 PolarHBondContact O-N 2.97Å; I61-Q65 PolarHBondContact O-N 2.82Å
62	D	88.7	Confident	91.1	Very high	124 Å²	124	51.3 Å²	51.3	66%	0.663	26%	0.261	S	S	*	.	H	α-helix	trans	-66.7	-42.7	179.4	-70.4	-20.7	0	0	0	111.1	Q65 K66	D62-Q65 PolarHBondContact O-N 2.88Å; D62-K66 WeakPolarHBondContact O-CG 3.32Å; D62-K66 PolarHBondContact O-N 2.77Å; D62-K66 VanDerWaalsContact O-N 3.08Å
63	G	91.3	Very high	91.1	Very high	10 Å²	10	59 Å²	59	10%	0.103	30%	0.297	C	S	.	.	H	α-helix	trans	-62.7	-42.4	173	0	0	0	0	0	112.1	D60 K66 Q67	D60-G63 PolarHBondContact O-N 3.41Å; D60-G63 WeakPolarHBondContact OD1-CA 3.46Å; D60-G63 PolarHBondContact OD1-N 3.48Å; G63-K66 PolarHBondContact O-N 2.78Å; G63-Q67 PolarHBondContact O-N 2.82Å; G63-Q67 VanDerWaalsContact O-N 3.13Å
64	A	92.3	Very high	91.1	Very high	0 Å²	0	60.5 Å²	60.5	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-61.9	-42.6	174	0	0	0	0	0	111.5	F52 L55 L56 D60 I61 K66 Q67 L68 M88	F52-A64 HydrophobicContact CD2-CB 3.88Å; F52-A64 WeakPolarHBondContact CD2-O 3.46Å; F52-A64 HydrophobicContact CE2-CB 4.04Å; L55-A64 HydrophobicContact CB-CB 4.08Å; L56-A64 HydrophobicContact CD2-CB 3.54Å; L56-A64 HydrophobicContact CG-CB 3.65Å; D60-A64 WeakPolarHBondContact O-CB 3.46Å; D60-A64 PolarHBondContact O-N 3.49Å; I61-A64 PolarHBondContact O-N 2.97Å; A64-K66 VanDerWaalsContact C-N 3.31Å; A64-K66 PolarHBondContact O-N 3.31Å; A64-Q67 PolarHBondContact O-N 2.83Å; A64-Q67 VanDerWaalsContact O-N 3.11Å; A64-L68 PolarHBondContact O-N 3.15Å; A64-M88 HydrophobicContact CB-CE 3.94Å
65	Q	92.3	Very high	91.1	Very high	72 Å²	72	61.2 Å²	61.2	34%	0.336	31%	0.313	S	S	.	.	H	α-helix	trans	-60.7	-41.8	177.7	-173.1	58.9	53.1	0	0	111.2	I61 D62 Q67 L68 D69 M88	I61-Q65 PolarHBondContact O-N 2.82Å; D62-Q65 PolarHBondContact O-N 2.88Å; Q65-Q67 VanDerWaalsContact C-N 3.33Å; Q65-Q67 PolarHBondContact O-N 2.8Å; Q65-L68 WeakPolarHBondContact O-CB 3.45Å; Q65-L68 PolarHBondContact O-N 2.78Å; Q65-L68 VanDerWaalsContact O-N 3.14Å; Q65-D69 PolarHBondContact NE2-OD1 3.04Å; Q65-D69 VanDerWaalsContact O-CG 3.24Å; Q65-D69 PolarHBondContact O-N 2.8Å; Q65-M88 HydrophobicContact CB-CE 3.75Å; Q65-M88 HydrophobicContact CG-CE 4.47Å; Q65-M88 VanDerWaalsContact N-CE 3.25Å; Q65-M88 VanDerWaalsContact OE1-CE 3.28Å
66	K	93.3	Very high	91	Very high	147 Å²	147	64.4 Å²	64.4	64%	0.639	34%	0.335	S	S	*	.	H	α-helix	trans	-59.6	-40.8	174.1	-70.4	173	-175.8	172.1	0	112.7	D62 G63 A64 R70	D62-K66 WeakPolarHBondContact O-CG 3.32Å; D62-K66 PolarHBondContact O-N 2.77Å; D62-K66 VanDerWaalsContact O-N 3.08Å; G63-K66 PolarHBondContact O-N 2.78Å; A64-K66 VanDerWaalsContact C-N 3.31Å; A64-K66 PolarHBondContact O-N 3.31Å; K66-R70 WeakPolarHBondContact O-CB 3.09Å; K66-R70 PolarHBondContact O-N 3.01Å
67	Q	94.6	Very high	90.8	Very high	37 Å²	37	67.5 Å²	67.5	17%	0.173	36%	0.359	C	S	.	.	H	α-helix	trans	-69.9	-34.7	176.1	-64.6	-52.9	-42.3	0	0	112.1	V48 R51 F52 L55 G63 A64 Q65 R70 L71	V48-Q67 HydrophobicContact CG1-CB 4.39Å; R51-Q67 HydrophobicContact CG-CG 4.27Å; F52-Q67 HydrophobicContact CB-CB 3.84Å; L55-Q67 HydrophobicContact CD1-CG 3.64Å; G63-Q67 PolarHBondContact O-N 2.82Å; G63-Q67 VanDerWaalsContact O-N 3.13Å; A64-Q67 PolarHBondContact O-N 2.83Å; A64-Q67 VanDerWaalsContact O-N 3.11Å; Q65-Q67 VanDerWaalsContact C-N 3.33Å; Q65-Q67 PolarHBondContact O-N 2.8Å; Q67-R70 PolarHBondContact O-N 2.84Å; Q67-L71 VanDerWaalsContact O-CB 3.29Å; Q67-L71 WeakPolarHBondContact O-CB 3.47Å; Q67-L71 PolarHBondContact O-N 2.86Å
68	L	92.8	Very high	90.8	Very high	11 Å²	11	63.7 Å²	63.7	6%	0.058	35%	0.349	C	S	.	.	H	α-helix	trans	-66	-43.1	174.5	-177.4	63.1	0	0	0	111.7	F52 A64 Q65 R70 L71 S72 Y81 R85 M88	F52-L68 HydrophobicContact CD2-CB 4.19Å; F52-L68 HydrophobicContact CE2-CB 4.19Å; A64-L68 PolarHBondContact O-N 3.15Å; Q65-L68 WeakPolarHBondContact O-CB 3.45Å; Q65-L68 PolarHBondContact O-N 2.78Å; Q65-L68 VanDerWaalsContact O-N 3.14Å; L68-R70 VanDerWaalsContact C-N 3.33Å; L68-L71 PolarHBondContact O-N 3.23Å; L68-S72 PolarHBondContact O-N 3.16Å; L68-Y81 HydrophobicContact CD1-CD2 3.92Å; L68-Y81 HydrophobicContact CD1-CE2 3.74Å; L68-Y81 HydrophobicContact CG-CE2 4.31Å; L68-R85 HydrophobicContact CD1-CB 4.23Å; L68-M88 HydrophobicContact CD2-CB 3.7Å; L68-M88 HydrophobicContact CD2-CE 4.32Å; L68-M88 HydrophobicContact CD2-CG 3.78Å
69	D	93.7	Very high	90.6	Very high	75 Å²	75	62.8 Å²	62.8	40%	0.401	35%	0.347	S	S	.	.	H	α-helix	trans	-61.6	-44.1	174.9	-65.5	-17.6	0	0	0	110.4	Q65 L71 S72 Q73	Q65-D69 PolarHBondContact NE2-OD1 3.04Å; Q65-D69 VanDerWaalsContact O-CG 3.24Å; Q65-D69 PolarHBondContact O-N 2.8Å; D69-L71 VanDerWaalsContact C-N 3.34Å; D69-L71 PolarHBondContact O-N 2.71Å; D69-S72 WeakPolarHBondContact O-CB 3.33Å; D69-S72 PolarHBondContact O-N 2.77Å; D69-S72 PolarHBondContact O-OG 2.9Å; D69-Q73 PolarHBondContact O-N 2.9Å
70	R	93.9	Very high	90.6	Very high	74 Å²	74	60.5 Å²	60.5	28%	0.279	32%	0.323	S	S	.	.	H	α-helix	trans	-59.8	-43.7	174.4	-174.3	178.5	178.6	-139.5	-3.9	111.9	P42 N43 K66 Q67 L68 S72 Q73 L74	P42-R70 PolarHBondContact O-NH1 2.74Å; P42-R70 PolarHBondContact O-NH2 2.63Å; N43-R70 PolarHBondContact OD1-NH2 2.79Å; K66-R70 WeakPolarHBondContact O-CB 3.09Å; K66-R70 PolarHBondContact O-N 3.01Å; Q67-R70 PolarHBondContact O-N 2.84Å; L68-R70 VanDerWaalsContact C-N 3.33Å; R70-S72 VanDerWaalsContact C-N 3.3Å; R70-S72 PolarHBondContact O-N 2.84Å; R70-Q73 PolarHBondContact O-N 2.89Å; R70-L74 HydrophobicContact CG-CD1 3.81Å; R70-L74 HydrophobicContact CG-CG 4.35Å; R70-L74 WeakPolarHBondContact O-CB 3.28Å; R70-L74 WeakPolarHBondContact O-CG 3.43Å; R70-L74 PolarHBondContact O-N 2.8Å
71	L	92.6	Very high	90.5	Very high	0 Å²	0	59.2 Å²	59.2	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-66.5	-32.8	178.6	-168.5	58.3	0	0	0	112.1	P45 V48 A49 Q67 L68 D69 Q73 L74 A75 A80 Y81	P45-L71 HydrophobicContact CB-CD1 3.81Å; P45-L71 WeakPolarHBondContact O-CD1 3.29Å; V48-L71 HydrophobicContact CB-CD1 4.18Å; V48-L71 HydrophobicContact CG1-CB 3.99Å; V48-L71 HydrophobicContact CG1-CD1 4.21Å; A49-L71 HydrophobicContact CB-CD2 3.95Å; Q67-L71 VanDerWaalsContact O-CB 3.29Å; Q67-L71 WeakPolarHBondContact O-CB 3.47Å; Q67-L71 PolarHBondContact O-N 2.86Å; L68-L71 PolarHBondContact O-N 3.23Å; D69-L71 VanDerWaalsContact C-N 3.34Å; D69-L71 PolarHBondContact O-N 2.71Å; L71-Q73 VanDerWaalsContact C-N 3.29Å; L71-Q73 PolarHBondContact O-N 2.89Å; L71-L74 PolarHBondContact O-N 2.8Å; L71-A75 CarbonylContact O-C 3.47Å; L71-A75 PolarHBondContact O-N 2.85Å; L71-A80 HydrophobicContact CD1-CB 4.45Å; L71-A80 HydrophobicContact CD2-CB 4.44Å; L71-Y81 HydrophobicContact CB-CD2 4.14Å; L71-Y81 HydrophobicContact CD2-CD2 4.42Å; L71-Y81 HydrophobicContact CG-CD2 4.05Å; L71-Y81 HydrophobicContact CG-CG 4.47Å
72	S	93	Very high	90.4	Very high	36 Å²	36	60.1 Å²	60.1	25%	0.252	31%	0.314	S	S	.	.	H	α-helix	trans	-64.2	-33	173.5	84.5	0	0	0	0	112.7	L68 D69 R70 P76	L68-S72 PolarHBondContact O-N 3.16Å; D69-S72 WeakPolarHBondContact O-CB 3.33Å; D69-S72 PolarHBondContact O-N 2.77Å; D69-S72 PolarHBondContact O-OG 2.9Å; R70-S72 VanDerWaalsContact C-N 3.3Å; R70-S72 PolarHBondContact O-N 2.84Å; S72-P76 VanDerWaalsContact O-CB 3.29Å; S72-P76 WeakPolarHBondContact O-CB 3.09Å; S72-P76 WeakPolarHBondContact O-CD 3.47Å
73	Q	92.6	Very high	90.2	Very high	162 Å²	162	54.6 Å²	54.6	76%	0.757	29%	0.285	S	S	*	.	H	α-helix	trans	-81.1	-42	177.1	-66.7	176.7	1.3	0	0	111.7	D69 R70 L71	D69-Q73 PolarHBondContact O-N 2.9Å; R70-Q73 PolarHBondContact O-N 2.89Å; L71-Q73 VanDerWaalsContact C-N 3.29Å; L71-Q73 PolarHBondContact O-N 2.89Å
74	L	91.7	Very high	90	Very high	68 Å²	68	54.1 Å²	54.1	36%	0.356	28%	0.28	S	S	.	.	H	α-helix	trans	-71.5	-43.9	-176.6	-73.2	172.9	0	0	0	112.6	N43 V48 R70 L71	N43-L74 HydrophobicContact CB-CD1 4.47Å; N43-L74 HydrophobicContact CB-CD2 4.2Å; V48-L74 HydrophobicContact CG2-CD1 3.93Å; R70-L74 HydrophobicContact CG-CD1 3.81Å; R70-L74 HydrophobicContact CG-CG 4.35Å; R70-L74 WeakPolarHBondContact O-CB 3.28Å; R70-L74 WeakPolarHBondContact O-CG 3.43Å; R70-L74 PolarHBondContact O-N 2.8Å; L71-L74 PolarHBondContact O-N 2.8Å
75	A	90.2	Very high	89.8	Confident	15 Å²	15	59.1 Å²	59.1	12%	0.124	30%	0.299	C	S	.	.			trans	-153.6	69.9	-173.9	0	0	0	0	0	112.5	P45 L71 S77 S78 Y81	P45-A75 HydrophobicContact CB-CB 4.02Å; P45-A75 HydrophobicContact CG-CB 3.56Å; L71-A75 CarbonylContact O-C 3.47Å; L71-A75 PolarHBondContact O-N 2.85Å; A75-S77 PolarHBondContact O-N 2.84Å; A75-S77 VanDerWaalsContact O-N 3.1Å; A75-S78 WeakPolarHBondContact CB-OG 3.35Å; A75-S78 WeakPolarHBondContact O-CB 3.41Å; A75-S78 PolarHBondContact O-N 2.82Å; A75-S78 PolarHBondContact O-OG 3.1Å; A75-Y81 WeakPolarHBondContact O-CB 3.13Å
76	P	87.6	Confident	89.6	Confident	80 Å²	80	56 Å²	56	52%	0.519	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-22.1	-174.5	20.8	-31	0	0	0	114.6	S72 Y81	S72-P76 VanDerWaalsContact O-CB 3.29Å; S72-P76 WeakPolarHBondContact O-CB 3.09Å; S72-P76 WeakPolarHBondContact O-CD 3.47Å; P76-Y81 WeakPolarHBondContact O-CD1 3.38Å
77	S	86.4	Confident	89.3	Confident	95 Å²	95	50.6 Å²	50.6	66%	0.664	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.2	-8.6	178.6	57.4	0	0	0	0	113.9	A75 K82	A75-S77 PolarHBondContact O-N 2.84Å; A75-S77 VanDerWaalsContact O-N 3.1Å; S77-K82 WeakPolarHBondContact O-CE 3.17Å; S77-K82 PolarHBondContact O-NZ 2.76Å
78	S	87.4	Confident	89	Confident	25 Å²	25	49.5 Å²	49.5	18%	0.175	26%	0.259	C	S	.	.	S	Bend	trans	-66.9	151.4	-173.9	65.5	0	0	0	0	113.1	A75 A80 Y81 K82	A75-S78 WeakPolarHBondContact CB-OG 3.35Å; A75-S78 WeakPolarHBondContact O-CB 3.41Å; A75-S78 PolarHBondContact O-N 2.82Å; A75-S78 PolarHBondContact O-OG 3.1Å; S78-A80 PolarHBondContact O-N 2.83Å; S78-Y81 PolarHBondContact O-N 3.49Å; S78-Y81 WeakPolarHBondContact OG-CB 3.29Å; S78-Y81 PolarHBondContact OG-N 2.9Å; S78-K82 WeakPolarHBondContact O-CG 3.32Å; S78-K82 PolarHBondContact O-N 2.93Å; S78-K82 VanDerWaalsContact O-N 3.13Å
79	N	82.6	Confident	88.8	Confident	85 Å²	85	52.7 Å²	52.7	46%	0.455	28%	0.276	S	S	.	.	H	α-helix	trans	-62.6	-36.8	171.7	-164.7	57.3	0	0	0	111.2	Y81 K82 S83	N79-Y81 PolarHBondContact O-N 2.84Å; N79-K82 PolarHBondContact O-N 2.93Å; N79-S83 VanDerWaalsContact O-CB 3.27Å; N79-S83 WeakPolarHBondContact O-CB 3.35Å; N79-S83 PolarHBondContact O-N 2.83Å
80	A	85.4	Confident	88.5	Confident	6 Å²	6	50 Å²	50	5%	0.05	26%	0.261	C	S	.	.	H	α-helix	trans	-52.8	-51.3	172.6	0	0	0	0	0	111.9	P45 A49 L71 S78 S84	P45-A80 HydrophobicContact CB-CB 4.07Å; A49-A80 HydrophobicContact CB-CB 3.93Å; L71-A80 HydrophobicContact CD1-CB 4.45Å; L71-A80 HydrophobicContact CD2-CB 4.44Å; S78-A80 PolarHBondContact O-N 2.83Å; A80-S84 VanDerWaalsContact O-CB 3.31Å; A80-S84 WeakPolarHBondContact O-CB 3.4Å; A80-S84 PolarHBondContact O-N 2.82Å; A80-S84 PolarHBondContact O-OG 2.83Å; A80-S84 VanDerWaalsContact O-OG 3.06Å
81	Y	88.6	Confident	88	Confident	44 Å²	44	48 Å²	48	17%	0.173	26%	0.259	C	S	.	.	H	α-helix	trans	-63.1	-47.3	177.4	178.9	-116.1	0	0	0	112.7	L68 L71 A75 P76 S78 N79 S83 S84 R85	L68-Y81 HydrophobicContact CD1-CD2 3.92Å; L68-Y81 HydrophobicContact CD1-CE2 3.74Å; L68-Y81 HydrophobicContact CG-CE2 4.31Å; L71-Y81 HydrophobicContact CB-CD2 4.14Å; L71-Y81 HydrophobicContact CD2-CD2 4.42Å; L71-Y81 HydrophobicContact CG-CD2 4.05Å; L71-Y81 HydrophobicContact CG-CG 4.47Å; A75-Y81 WeakPolarHBondContact O-CB 3.13Å; P76-Y81 WeakPolarHBondContact O-CD1 3.38Å; S78-Y81 PolarHBondContact O-N 3.49Å; S78-Y81 WeakPolarHBondContact OG-CB 3.29Å; S78-Y81 PolarHBondContact OG-N 2.9Å; N79-Y81 PolarHBondContact O-N 2.84Å; Y81-S83 PolarHBondContact O-N 2.58Å; Y81-S84 PolarHBondContact O-N 2.71Å; Y81-R85 WeakPolarHBondContact O-CB 3.3Å; Y81-R85 PolarHBondContact O-N 2.88Å
82	K	86.5	Confident	87.6	Confident	97 Å²	97	50.3 Å²	50.3	42%	0.422	27%	0.273	S	S	.	.	H	α-helix	trans	-60.5	-46.4	-179.7	-69.7	171.2	-177.5	168.1	0	111.5	S77 S78 N79 R85 T86	S77-K82 WeakPolarHBondContact O-CE 3.17Å; S77-K82 PolarHBondContact O-NZ 2.76Å; S78-K82 WeakPolarHBondContact O-CG 3.32Å; S78-K82 PolarHBondContact O-N 2.93Å; S78-K82 VanDerWaalsContact O-N 3.13Å; N79-K82 PolarHBondContact O-N 2.93Å; K82-R85 PolarHBondContact O-N 2.62Å; K82-T86 PolarHBondContact O-N 2.85Å; K82-T86 VanDerWaalsContact O-N 3.13Å; K82-T86 PolarHBondContact O-OG1 2.92Å
83	S	84.9	Confident	87.1	Confident	7 Å²	7	52.9 Å²	52.9	5%	0.049	29%	0.289	C	S	.	.	H	α-helix	trans	-62.8	-48.8	176.7	-175.2	0	0	0	0	110.9	N79 Y81 R85 T86 T87 P127	N79-S83 VanDerWaalsContact O-CB 3.27Å; N79-S83 WeakPolarHBondContact O-CB 3.35Å; N79-S83 PolarHBondContact O-N 2.83Å; Y81-S83 PolarHBondContact O-N 2.58Å; S83-R85 VanDerWaalsContact C-N 3.33Å; S83-R85 PolarHBondContact O-N 2.86Å; S83-T86 WeakPolarHBondContact O-CB 3.47Å; S83-T86 PolarHBondContact O-N 2.92Å; S83-T86 VanDerWaalsContact O-N 3.15Å; S83-T87 PolarHBondContact O-N 2.91Å; S83-T87 PolarHBondContact O-OG1 3.02Å; S83-P127 WeakPolarHBondContact OG-CA 3.09Å
84	S	87.6	Confident	86.7	Confident	1 Å²	1	50.9 Å²	50.9	1%	0.007	28%	0.284	C	S	.	.	H	α-helix	trans	-62.3	-38.3	179.3	-67.9	0	0	0	0	112.6	F52 A80 Y81 T86 T87 M88	F52-S84 VanDerWaalsContact CD1-OG 3.28Å; F52-S84 WeakPolarHBondContact CD1-OG 3.1Å; F52-S84 VanDerWaalsContact CE1-CB 3.49Å; F52-S84 WeakPolarHBondContact CE1-O 3.14Å; F52-S84 WeakPolarHBondContact CZ-O 3.33Å; A80-S84 VanDerWaalsContact O-CB 3.31Å; A80-S84 WeakPolarHBondContact O-CB 3.4Å; A80-S84 PolarHBondContact O-N 2.82Å; A80-S84 PolarHBondContact O-OG 2.83Å; A80-S84 VanDerWaalsContact O-OG 3.06Å; Y81-S84 PolarHBondContact O-N 2.71Å; S84-T86 VanDerWaalsContact C-N 3.34Å; S84-T86 PolarHBondContact O-N 2.76Å; S84-T87 PolarHBondContact O-N 2.84Å; S84-M88 WeakPolarHBondContact O-CB 3.45Å; S84-M88 PolarHBondContact O-N 2.75Å
85	R	89.1	Confident	86.5	Confident	104 Å²	104	47.7 Å²	47.7	39%	0.392	27%	0.267	S	S	.	.	H	α-helix	trans	-61.4	-43.3	174.1	-173.4	-176.4	66.4	-174.1	-1.1	111.6	L68 Y81 K82 S83 M88 L89	L68-R85 HydrophobicContact CD1-CB 4.23Å; Y81-R85 WeakPolarHBondContact O-CB 3.3Å; Y81-R85 PolarHBondContact O-N 2.88Å; K82-R85 PolarHBondContact O-N 2.62Å; S83-R85 VanDerWaalsContact C-N 3.33Å; S83-R85 PolarHBondContact O-N 2.86Å; R85-M88 PolarHBondContact O-N 3.48Å; R85-L89 PolarHBondContact O-N 2.89Å
86	T	87.3	Confident	86.3	Confident	6 Å²	6	53.9 Å²	53.9	4%	0.037	29%	0.287	C	S	.	.	H	α-helix	trans	-65.2	-45.6	175.4	-59.8	0	0	0	0	111.1	K82 S83 S84 M88 L89 L90 F122 P127	K82-T86 PolarHBondContact O-N 2.85Å; K82-T86 VanDerWaalsContact O-N 3.13Å; K82-T86 PolarHBondContact O-OG1 2.92Å; S83-T86 WeakPolarHBondContact O-CB 3.47Å; S83-T86 PolarHBondContact O-N 2.92Å; S83-T86 VanDerWaalsContact O-N 3.15Å; S84-T86 VanDerWaalsContact C-N 3.34Å; S84-T86 PolarHBondContact O-N 2.76Å; T86-M88 VanDerWaalsContact C-N 3.26Å; T86-M88 PolarHBondContact O-N 2.91Å; T86-L89 WeakPolarHBondContact O-CB 3.46Å; T86-L89 PolarHBondContact O-N 2.77Å; T86-L89 VanDerWaalsContact O-N 3.16Å; T86-L90 HydrophobicContact CG2-CD1 4.35Å; T86-L90 HydrophobicContact CG2-CG 4.5Å; T86-L90 VanDerWaalsContact O-CG 3.29Å; T86-L90 WeakPolarHBondContact O-CG 3.5Å; T86-L90 PolarHBondContact O-N 2.88Å; T86-F122 HydrophobicContact CG2-CB 4.43Å; T86-F122 HydrophobicContact CG2-CD1 3.59Å; T86-F122 HydrophobicContact CG2-CE1 4.33Å; T86-F122 HydrophobicContact CG2-CG 4.39Å; T86-P127 HydrophobicContact CG2-CG 4.16Å
87	T	86.6	Confident	86.3	Confident	34 Å²	34	56.8 Å²	56.8	21%	0.209	29%	0.294	C	S	.	.	H	α-helix	trans	-59.7	-37.3	175.3	-54.9	0	0	0	0	111.9	F52 L56 S83 S84 L90 S91	F52-T87 HydrophobicContact CE1-CG2 3.96Å; F52-T87 HydrophobicContact CZ-CG2 4.32Å; L56-T87 HydrophobicContact CD1-CG2 3.72Å; S83-T87 PolarHBondContact O-N 2.91Å; S83-T87 PolarHBondContact O-OG1 3.02Å; S84-T87 PolarHBondContact O-N 2.84Å; T87-L90 PolarHBondContact O-N 2.79Å; T87-S91 PolarHBondContact O-N 3.16Å; T87-S91 VanDerWaalsContact O-N 3.17Å
88	M	88.3	Confident	86.4	Confident	14 Å²	14	53.8 Å²	53.8	7%	0.069	28%	0.275	C	S	.	.	H	α-helix	trans	-64.4	-46.6	174.7	-174.1	60.1	105.4	0	0	111.1	F52 L56 A64 Q65 L68 S84 R85 T86 L90 S91	F52-M88 HydrophobicContact CE2-CB 4.1Å; F52-M88 HydrophobicContact CE2-CE 3.79Å; F52-M88 HydrophobicContact CE2-SD 4.22Å; F52-M88 HydrophobicContact CZ-CB 3.9Å; L56-M88 HydrophobicContact CD2-SD 4.08Å; A64-M88 HydrophobicContact CB-CE 3.94Å; Q65-M88 HydrophobicContact CB-CE 3.75Å; Q65-M88 HydrophobicContact CG-CE 4.47Å; Q65-M88 VanDerWaalsContact N-CE 3.25Å; Q65-M88 VanDerWaalsContact OE1-CE 3.28Å; L68-M88 HydrophobicContact CD2-CB 3.7Å; L68-M88 HydrophobicContact CD2-CE 4.32Å; L68-M88 HydrophobicContact CD2-CG 3.78Å; S84-M88 WeakPolarHBondContact O-CB 3.45Å; S84-M88 PolarHBondContact O-N 2.75Å; R85-M88 PolarHBondContact O-N 3.48Å; T86-M88 VanDerWaalsContact C-N 3.26Å; T86-M88 PolarHBondContact O-N 2.91Å; M88-L90 VanDerWaalsContact C-N 3.26Å; M88-L90 PolarHBondContact O-N 2.86Å; M88-S91 WeakPolarHBondContact O-CB 3.36Å; M88-S91 PolarHBondContact O-N 2.69Å; M88-S91 PolarHBondContact O-OG 2.77Å
89	L	88.4	Confident	86.5	Confident	78 Å²	78	53.2 Å²	53.2	41%	0.408	27%	0.27	S	S	.	.	H	α-helix	trans	-56.1	-43.5	173.6	179.7	65.6	0	0	0	111	R85 T86 S91 T92 G95 L121	R85-L89 PolarHBondContact O-N 2.89Å; T86-L89 WeakPolarHBondContact O-CB 3.46Å; T86-L89 PolarHBondContact O-N 2.77Å; T86-L89 VanDerWaalsContact O-N 3.16Å; L89-S91 PolarHBondContact O-N 3.12Å; L89-T92 PolarHBondContact O-N 3.35Å; L89-T92 VanDerWaalsContact O-N 3.11Å; L89-T92 PolarHBondContact O-OG1 2.82Å; L89-G95 WeakPolarHBondContact O-CA 3.13Å; L89-L121 HydrophobicContact CD2-CD1 4.04Å
90	L	86.9	Confident	86.8	Confident	18 Å²	18	54.5 Å²	54.5	9%	0.094	27%	0.273	C	S	.	.	H	α-helix	trans	-66.1	-15.5	178	-66.6	176.9	0	0	0	114.4	T86 T87 M88 R96 L99 L121 F122 P127 I131	T86-L90 HydrophobicContact CG2-CD1 4.35Å; T86-L90 HydrophobicContact CG2-CG 4.5Å; T86-L90 VanDerWaalsContact O-CG 3.29Å; T86-L90 WeakPolarHBondContact O-CG 3.5Å; T86-L90 PolarHBondContact O-N 2.88Å; T87-L90 PolarHBondContact O-N 2.79Å; M88-L90 VanDerWaalsContact C-N 3.26Å; M88-L90 PolarHBondContact O-N 2.86Å; L90-R96 WeakPolarHBondContact O-CG 3.39Å; L90-L99 HydrophobicContact CD2-CB 3.98Å; L90-L99 HydrophobicContact CD2-CD1 4.48Å; L90-L99 HydrophobicContact CD2-CD2 4.16Å; L90-L99 HydrophobicContact CD2-CG 4.43Å; L90-L121 HydrophobicContact CD2-CD1 4.06Å; L90-L121 HydrophobicContact CD2-CD2 3.53Å; L90-L121 HydrophobicContact CD2-CG 3.84Å; L90-F122 HydrophobicContact CD1-CE1 4.32Å; L90-P127 HydrophobicContact CD1-CG 4.07Å; L90-I131 HydrophobicContact CD1-CD1 3.61Å
91	S	84.3	Confident	87	Confident	33 Å²	33	59.7 Å²	59.7	23%	0.231	30%	0.296	C	S	.	.	H	α-helix	trans	-81.2	-23.1	173.9	77.5	0	0	0	0	112.7	T87 M88 L89 R96	T87-S91 PolarHBondContact O-N 3.16Å; T87-S91 VanDerWaalsContact O-N 3.17Å; M88-S91 WeakPolarHBondContact O-CB 3.36Å; M88-S91 PolarHBondContact O-N 2.69Å; M88-S91 PolarHBondContact O-OG 2.77Å; L89-S91 PolarHBondContact O-N 3.12Å; S91-R96 PolarHBondContact O-NE 2.77Å
92	T	85.1	Confident	87.1	Confident	49 Å²	49	57.6 Å²	57.6	30%	0.301	29%	0.288	S	S	.	.	S	Bend	trans	-72	156	177.9	77.2	0	0	0	0	111.1	L89 D94 G95 R96	L89-T92 PolarHBondContact O-N 3.35Å; L89-T92 VanDerWaalsContact O-N 3.11Å; L89-T92 PolarHBondContact O-OG1 2.82Å; T92-D94 VanDerWaalsContact C-N 3.27Å; T92-D94 PolarHBondContact O-N 2.85Å; T92-G95 PolarHBondContact O-N 2.82Å; T92-G95 PolarHBondContact OG1-N 2.81Å; T92-G95 VanDerWaalsContact OG1-N 3.17Å; T92-R96 WeakPolarHBondContact O-CG 3.18Å; T92-R96 PolarHBondContact O-N 3.11Å
93	P	80.7	Confident	87.4	Confident	89 Å²	89	56.7 Å²	56.7	58%	0.578	28%	0.282	S	S	*	.	H	α-helix	trans	-53.7	-43.8	174.6	-26.4	35.6	0	0	0	112.9	R96 Q97	P93-R96 PolarHBondContact O-N 3.47Å; P93-Q97 PolarHBondContact O-N 2.85Å
94	D	85	Confident	87.6	Confident	121 Å²	121	61.7 Å²	61.7	65%	0.647	31%	0.308	S	S	*	.	H	α-helix	trans	-65.4	-44.2	-179.3	-65.7	-10.4	0	0	0	112.2	T92 Q97 A98	T92-D94 VanDerWaalsContact C-N 3.27Å; T92-D94 PolarHBondContact O-N 2.85Å; D94-Q97 PolarHBondContact O-N 3.14Å; D94-A98 WeakPolarHBondContact O-CB 3.35Å; D94-A98 PolarHBondContact O-N 3.49Å
95	G	86.6	Confident	87.8	Confident	1 Å²	1	63.7 Å²	63.7	1%	0.01	32%	0.317	C	S	.	.	H	α-helix	trans	-66.4	-37.3	177.1	0	0	0	0	0	112.5	L89 T92 A98 L99	L89-G95 WeakPolarHBondContact O-CA 3.13Å; T92-G95 PolarHBondContact O-N 2.82Å; T92-G95 PolarHBondContact OG1-N 2.81Å; T92-G95 VanDerWaalsContact OG1-N 3.17Å; G95-A98 PolarHBondContact O-N 3.22Å; G95-L99 WeakPolarHBondContact O-CB 3.48Å; G95-L99 PolarHBondContact O-N 3.17Å
96	R	86	Confident	87.8	Confident	145 Å²	145	59.1 Å²	59.1	55%	0.547	30%	0.302	S	S	.	.	H	α-helix	trans	-62	-44.9	172	-75.6	-173.3	-86.2	165.7	-6.9	111.5	L90 S91 T92 P93 L99 Q100	L90-R96 WeakPolarHBondContact O-CG 3.39Å; S91-R96 PolarHBondContact O-NE 2.77Å; T92-R96 WeakPolarHBondContact O-CG 3.18Å; T92-R96 PolarHBondContact O-N 3.11Å; P93-R96 PolarHBondContact O-N 3.47Å; R96-L99 PolarHBondContact O-N 2.85Å; R96-Q100 VanDerWaalsContact O-CG 3.26Å; R96-Q100 WeakPolarHBondContact O-CG 3.43Å; R96-Q100 PolarHBondContact O-N 3.18Å
97	Q	87.6	Confident	87.7	Confident	140 Å²	140	64.5 Å²	64.5	65%	0.654	33%	0.334	S	S	*	.	H	α-helix	trans	-63.2	-44.7	177.6	-174.4	175.5	-6.1	0	0	111.6	P93 D94 L99 Q100 Q101	P93-Q97 PolarHBondContact O-N 2.85Å; D94-Q97 PolarHBondContact O-N 3.14Å; Q97-L99 PolarHBondContact O-N 3.27Å; Q97-Q100 PolarHBondContact O-N 2.79Å; Q97-Q101 PolarHBondContact O-N 3.36Å
98	A	89.3	Confident	87.7	Confident	33 Å²	33	66.5 Å²	66.5	27%	0.273	35%	0.347	S	S	.	.	H	α-helix	trans	-63	-39.9	177.3	0	0	0	0	0	112.5	D94 G95 Q101 A102 L121	D94-A98 WeakPolarHBondContact O-CB 3.35Å; D94-A98 PolarHBondContact O-N 3.49Å; G95-A98 PolarHBondContact O-N 3.22Å; A98-Q101 PolarHBondContact O-N 3.25Å; A98-A102 PolarHBondContact O-N 3.36Å; A98-L121 HydrophobicContact CB-CD1 3.73Å; A98-L121 HydrophobicContact CB-CD2 4.31Å
99	L	90.5	Very high	87.5	Confident	13 Å²	13	68.6 Å²	68.6	7%	0.068	37%	0.372	C	S	.	.	H	α-helix	trans	-65.1	-42.8	174.8	-175.4	62.7	0	0	0	111.8	L90 G95 R96 Q97 Q101 A102 R103 Y118 L121 F122 I131	L90-L99 HydrophobicContact CD2-CB 3.98Å; L90-L99 HydrophobicContact CD2-CD1 4.48Å; L90-L99 HydrophobicContact CD2-CD2 4.16Å; L90-L99 HydrophobicContact CD2-CG 4.43Å; G95-L99 WeakPolarHBondContact O-CB 3.48Å; G95-L99 PolarHBondContact O-N 3.17Å; R96-L99 PolarHBondContact O-N 2.85Å; Q97-L99 PolarHBondContact O-N 3.27Å; L99-Q101 VanDerWaalsContact C-N 3.28Å; L99-Q101 PolarHBondContact O-N 2.85Å; L99-A102 PolarHBondContact O-N 3.37Å; L99-R103 WeakPolarHBondContact O-CB 3.32Å; L99-R103 WeakPolarHBondContact O-CG 3.34Å; L99-R103 PolarHBondContact O-N 2.9Å; L99-Y118 HydrophobicContact CD1-CD1 4.37Å; L99-Y118 HydrophobicContact CD1-CE1 3.84Å; L99-L121 HydrophobicContact CB-CD2 3.86Å; L99-L121 HydrophobicContact CD1-CD2 4.02Å; L99-F122 HydrophobicContact CD1-CZ 4.48Å; L99-I131 HydrophobicContact CD2-CD1 4.42Å
100	Q	89	Confident	87.6	Confident	112 Å²	112	69.1 Å²	69.1	52%	0.523	37%	0.372	S	S	.	.	H	α-helix	trans	-64.1	-34.7	176.5	-69.4	-61.7	-20.5	0	0	112	R96 Q97 R103 L104	R96-Q100 VanDerWaalsContact O-CG 3.26Å; R96-Q100 WeakPolarHBondContact O-CG 3.43Å; R96-Q100 PolarHBondContact O-N 3.18Å; Q97-Q100 PolarHBondContact O-N 2.79Å; Q100-R103 PolarHBondContact O-N 2.67Å; Q100-L104 WeakPolarHBondContact O-CB 3.45Å; Q100-L104 PolarHBondContact O-N 3.38Å
101	Q	89.3	Confident	87.7	Confident	114 Å²	114	68.9 Å²	68.9	53%	0.533	37%	0.373	S	S	.	.	H	α-helix	trans	-65.5	-45.6	173.7	-171.9	174.7	11.9	0	0	112	Q97 A98 L99 R103 L104 Q105	Q97-Q101 PolarHBondContact O-N 3.36Å; A98-Q101 PolarHBondContact O-N 3.25Å; L99-Q101 VanDerWaalsContact C-N 3.28Å; L99-Q101 PolarHBondContact O-N 2.85Å; Q101-R103 VanDerWaalsContact C-N 3.32Å; Q101-R103 PolarHBondContact O-N 3.39Å; Q101-L104 PolarHBondContact O-N 2.94Å; Q101-Q105 WeakPolarHBondContact O-CG 3.4Å; Q101-Q105 PolarHBondContact O-N 3.36Å; Q101-Q105 VanDerWaalsContact O-N 3.11Å
102	A	90.6	Very high	88	Confident	0 Å²	0	74 Å²	74	0%	0	39%	0.393	C	S	.	.	H	α-helix	trans	-61.6	-41.4	175.6	0	0	0	0	0	111.7	A98 L99 Q105 A106 Y118	A98-A102 PolarHBondContact O-N 3.36Å; L99-A102 PolarHBondContact O-N 3.37Å; A102-Q105 PolarHBondContact O-N 3.04Å; A102-A106 PolarHBondContact O-N 2.98Å; A102-Y118 HydrophobicContact CB-CD1 3.82Å; A102-Y118 HydrophobicContact CB-CD2 4.41Å; A102-Y118 HydrophobicContact CB-CE1 3.73Å; A102-Y118 HydrophobicContact CB-CE2 4.29Å; A102-Y118 HydrophobicContact CB-CG 4.16Å
103	R	92.5	Very high	88.3	Confident	79 Å²	79	76.3 Å²	76.3	30%	0.298	40%	0.4	S	S	.	.	H	α-helix	trans	-59.1	-50	173.9	-78.1	170.4	173.2	177	-6.7	111.7	L99 Q100 Q101 Q105 A106 T107 E134	L99-R103 WeakPolarHBondContact O-CB 3.32Å; L99-R103 WeakPolarHBondContact O-CG 3.34Å; L99-R103 PolarHBondContact O-N 2.9Å; Q100-R103 PolarHBondContact O-N 2.67Å; Q101-R103 VanDerWaalsContact C-N 3.32Å; Q101-R103 PolarHBondContact O-N 3.39Å; R103-Q105 VanDerWaalsContact C-N 3.27Å; R103-Q105 PolarHBondContact O-N 3.16Å; R103-A106 WeakPolarHBondContact O-CA 3.48Å; R103-A106 WeakPolarHBondContact O-CB 3.45Å; R103-A106 PolarHBondContact O-N 2.95Å; R103-T107 PolarHBondContact O-N 2.91Å; R103-T107 PolarHBondContact O-OG1 2.69Å; R103-E134 WeakPolarHBondContact CG-OE1 3.35Å; R103-E134 IonicContact CZ-OE1 2.67Å; R103-E134 IonicContact CZ-OE2 3.5Å; R103-E134 VanDerWaalsContact CZ-OE2 3.27Å; R103-E134 VanDerWaalsContact NE-CD 3.32Å; R103-E134 IonicContact NE-OE1 3.3Å; R103-E134 PolarHBondContact NE-OE1 2.67Å; R103-E134 IonicContact NE-OE2 2.65Å; R103-E134 PolarHBondContact NE-OE2 2.79Å; R103-E134 IonicContact NH2-OE1 3.55Å; R103-E134 IonicContact NH2-OE2 2.93Å; R103-E134 PolarHBondContact NH2-OE2 2.86Å
104	L	89.3	Confident	88.8	Confident	112 Å²	112	72 Å²	72	59%	0.586	37%	0.373	S	S	*	.	H	α-helix	trans	-57	-41.1	178.6	-177.6	63.5	0	0	0	112	Q100 Q101 T107 T108	Q100-L104 WeakPolarHBondContact O-CB 3.45Å; Q100-L104 PolarHBondContact O-N 3.38Å; Q101-L104 PolarHBondContact O-N 2.94Å; L104-T107 PolarHBondContact O-N 3.03Å; L104-T108 HydrophobicContact CD1-CG2 4.11Å; L104-T108 HydrophobicContact CG-CG2 4.5Å; L104-T108 WeakPolarHBondContact O-CB 3.33Å; L104-T108 VanDerWaalsContact O-CG2 3.22Å; L104-T108 WeakPolarHBondContact O-CG2 3.35Å; L104-T108 PolarHBondContact O-N 3Å; L104-T108 PolarHBondContact O-OG1 2.96Å
105	Q	91.6	Very high	89.2	Confident	43 Å²	43	66.6 Å²	66.6	20%	0.201	34%	0.344	C	S	.	.	H	α-helix	trans	-63.1	-44.7	173.7	-69.4	169.6	-31.7	0	0	111.4	Q101 A102 R103 T107 T108 G109 H110 E113 A114 S117	Q101-Q105 WeakPolarHBondContact O-CG 3.4Å; Q101-Q105 PolarHBondContact O-N 3.36Å; Q101-Q105 VanDerWaalsContact O-N 3.11Å; A102-Q105 PolarHBondContact O-N 3.04Å; R103-Q105 VanDerWaalsContact C-N 3.27Å; R103-Q105 PolarHBondContact O-N 3.16Å; Q105-T107 VanDerWaalsContact C-N 3.35Å; Q105-T107 PolarHBondContact O-N 2.87Å; Q105-T108 WeakPolarHBondContact CA-OG1 3.08Å; Q105-T108 PolarHBondContact O-N 3.28Å; Q105-T108 PolarHBondContact O-OG1 3Å; Q105-G109 PolarHBondContact O-N 2.88Å; Q105-H110 HydrophobicContact CB-CB 4.17Å; Q105-H110 WeakPolarHBondContact O-CB 3.29Å; Q105-H110 PolarHBondContact O-N 2.7Å; Q105-E113 PolarHBondContact OE1-O 3.3Å; Q105-A114 HydrophobicContact CB-CB 3.74Å; Q105-S117 PolarHBondContact OE1-OG 3.19Å
106	A	88.3	Confident	89.4	Confident	8 Å²	8	69.3 Å²	69.3	7%	0.066	37%	0.366	C	S	.	.	H	α-helix	trans	-63.4	-37.6	179.4	0	0	0	0	0	112.8	A102 R103 A114 Y118 T138 K141	A102-A106 PolarHBondContact O-N 2.98Å; R103-A106 WeakPolarHBondContact O-CA 3.48Å; R103-A106 WeakPolarHBondContact O-CB 3.45Å; R103-A106 PolarHBondContact O-N 2.95Å; A106-A114 HydrophobicContact CB-CB 3.85Å; A106-Y118 HydrophobicContact CB-CE2 4.44Å; A106-T138 HydrophobicContact CB-CG2 3.85Å; A106-K141 PolarHBondContact O-NZ 3.37Å
107	T	86.7	Confident	89.6	Confident	118 Å²	118	63.9 Å²	63.9	72%	0.724	35%	0.35	S	S	*	.	H	α-helix	trans	-76.3	-31.5	178.1	-12.9	0	0	0	0	112.8	R103 L104 Q105 G109	R103-T107 PolarHBondContact O-N 2.91Å; R103-T107 PolarHBondContact O-OG1 2.69Å; L104-T107 PolarHBondContact O-N 3.03Å; Q105-T107 VanDerWaalsContact C-N 3.35Å; Q105-T107 PolarHBondContact O-N 2.87Å; T107-G109 VanDerWaalsContact C-N 3.28Å; T107-G109 PolarHBondContact O-N 3.45Å
108	T	86.5	Confident	89.8	Confident	77 Å²	77	57.2 Å²	57.2	47%	0.472	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.1	2.4	-179.5	54.5	0	0	0	0	114.2	L104 Q105 H110	L104-T108 HydrophobicContact CD1-CG2 4.11Å; L104-T108 HydrophobicContact CG-CG2 4.5Å; L104-T108 WeakPolarHBondContact O-CB 3.33Å; L104-T108 VanDerWaalsContact O-CG2 3.22Å; L104-T108 WeakPolarHBondContact O-CG2 3.35Å; L104-T108 PolarHBondContact O-N 3Å; L104-T108 PolarHBondContact O-OG1 2.96Å; Q105-T108 WeakPolarHBondContact CA-OG1 3.08Å; Q105-T108 PolarHBondContact O-N 3.28Å; Q105-T108 PolarHBondContact O-OG1 3Å; T108-H110 PolarHBondContact OG1-ND1 2.83Å
109	G	83.9	Confident	89.9	Confident	57 Å²	57	58.4 Å²	58.4	59%	0.588	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	93.2	-0.9	175.7	0	0	0	0	0	115.2	Q105 T107 A111	Q105-G109 PolarHBondContact O-N 2.88Å; T107-G109 VanDerWaalsContact C-N 3.28Å; T107-G109 PolarHBondContact O-N 3.45Å; G109-A111 VanDerWaalsContact C-N 3.25Å; G109-A111 PolarHBondContact O-N 3.01Å
110	H	89.5	Confident	89.7	Confident	89 Å²	89	66.7 Å²	66.7	41%	0.412	36%	0.356	S	S	.	.			trans	-81	66.2	179	-65.5	97.3	0	0	0	110.6	Q105 T108 E113 A114	Q105-H110 HydrophobicContact CB-CB 4.17Å; Q105-H110 WeakPolarHBondContact O-CB 3.29Å; Q105-H110 PolarHBondContact O-N 2.7Å; T108-H110 PolarHBondContact OG1-ND1 2.83Å; H110-E113 VanDerWaalsContact CA-OE2 3.25Å; H110-E113 WeakPolarHBondContact CA-OE2 3.15Å; H110-E113 HydrophobicContact CB-CB 4.28Å; H110-E113 WeakPolarHBondContact CB-OE2 3.44Å; H110-E113 IonicContact CD2-OE1 3.59Å; H110-E113 PolarHBondContact CD2-OE1 2.88Å; H110-E113 IonicContact CD2-OE2 3.13Å; H110-E113 IonicContact CG-OE2 3.62Å; H110-A114 WeakPolarHBondContact O-CB 3.3Å; H110-A114 PolarHBondContact O-N 2.91Å
111	A	89	Confident	89.6	Confident	14 Å²	14	62 Å²	62	12%	0.116	34%	0.335	C	S	.	.	H	α-helix	trans	-66	-40.4	-169.8	0	0	0	0	0	113.1	G109 V115 K141 I142	G109-A111 VanDerWaalsContact C-N 3.25Å; G109-A111 PolarHBondContact O-N 3.01Å; A111-V115 WeakPolarHBondContact O-CB 3.34Å; A111-V115 VanDerWaalsContact O-CG2 3.26Å; A111-V115 WeakPolarHBondContact O-CG2 3.28Å; A111-V115 PolarHBondContact O-N 2.71Å; A111-K141 HydrophobicContact CB-CB 3.75Å; A111-K141 HydrophobicContact CB-CD 4.48Å; A111-I142 HydrophobicContact CB-CG1 4.06Å
112	E	91.6	Very high	89.5	Confident	141 Å²	141	56.9 Å²	56.9	66%	0.659	31%	0.311	S	S	*	.	H	α-helix	trans	-69.4	-44.1	178.1	-67.9	-171.8	177.8	0	0	111.3	A114 V115 A116 I142	E112-A114 VanDerWaalsContact C-N 3.34Å; E112-A114 PolarHBondContact O-N 2.84Å; E112-V115 PolarHBondContact O-N 2.93Å; E112-A116 WeakPolarHBondContact O-CB 3.26Å; E112-A116 PolarHBondContact O-N 3.12Å; E112-I142 HydrophobicContact CG-CD1 4.05Å; E112-I142 HydrophobicContact CG-CG1 4.21Å
113	E	91.3	Very high	88.8	Confident	96 Å²	96	62.9 Å²	62.9	45%	0.449	34%	0.343	S	S	.	.	H	α-helix	trans	-65.2	-39.2	176.5	-59.4	99.7	147.9	0	0	111.9	Q105 H110 A116 S117	Q105-E113 PolarHBondContact OE1-O 3.3Å; H110-E113 VanDerWaalsContact CA-OE2 3.25Å; H110-E113 WeakPolarHBondContact CA-OE2 3.15Å; H110-E113 HydrophobicContact CB-CB 4.28Å; H110-E113 WeakPolarHBondContact CB-OE2 3.44Å; H110-E113 IonicContact CD2-OE1 3.59Å; H110-E113 PolarHBondContact CD2-OE1 2.88Å; H110-E113 IonicContact CD2-OE2 3.13Å; H110-E113 IonicContact CG-OE2 3.62Å; E113-A116 PolarHBondContact O-N 2.82Å; E113-S117 WeakPolarHBondContact O-CB 3.38Å; E113-S117 PolarHBondContact O-N 2.91Å; E113-S117 PolarHBondContact O-OG 2.8Å
114	A	92	Very high	87.6	Confident	0 Å²	0	62.1 Å²	62.1	0%	0	36%	0.359	C	S	.	.	H	α-helix	trans	-61.7	-47.2	175.4	0	0	0	0	0	111.3	Q105 A106 H110 E112 A116 S117 Y118 T138	Q105-A114 HydrophobicContact CB-CB 3.74Å; A106-A114 HydrophobicContact CB-CB 3.85Å; H110-A114 WeakPolarHBondContact O-CB 3.3Å; H110-A114 PolarHBondContact O-N 2.91Å; E112-A114 VanDerWaalsContact C-N 3.34Å; E112-A114 PolarHBondContact O-N 2.84Å; A114-A116 VanDerWaalsContact C-N 3.29Å; A114-A116 PolarHBondContact O-N 3.29Å; A114-S117 PolarHBondContact O-N 3.31Å; A114-Y118 HydrophobicContact CB-CE2 4.33Å; A114-Y118 WeakPolarHBondContact O-CD2 3.38Å; A114-Y118 PolarHBondContact O-N 3.05Å; A114-T138 HydrophobicContact CB-CG2 3.72Å
115	V	91.9	Very high	86.7	Confident	6 Å²	6	58.5 Å²	58.5	4%	0.036	35%	0.346	C	S	.	.	H	α-helix	trans	-62.3	-38.3	176.6	170.4	0	0	0	0	111.1	A111 E112 Y118 N119 Y135 T138 V139 I142	A111-V115 WeakPolarHBondContact O-CB 3.34Å; A111-V115 VanDerWaalsContact O-CG2 3.26Å; A111-V115 WeakPolarHBondContact O-CG2 3.28Å; A111-V115 PolarHBondContact O-N 2.71Å; E112-V115 PolarHBondContact O-N 2.93Å; V115-Y118 PolarHBondContact O-N 3.3Å; V115-N119 VanDerWaalsContact O-CB 3.29Å; V115-N119 WeakPolarHBondContact O-CB 3.27Å; V115-N119 PolarHBondContact O-N 2.5Å; V115-N119 PolarHBondContact O-ND2 3.48Å; V115-N119 PolarHBondContact O-OD1 3.21Å; V115-Y135 HydrophobicContact CG1-CE2 4.37Å; V115-T138 HydrophobicContact CG2-CG2 4.01Å; V115-V139 HydrophobicContact CG1-CG2 4.26Å; V115-V139 HydrophobicContact CG2-CB 4.44Å; V115-V139 HydrophobicContact CG2-CG2 3.71Å; V115-I142 HydrophobicContact CB-CD1 4.25Å; V115-I142 HydrophobicContact CG2-CD1 3.86Å
116	A	91.1	Very high	86	Confident	58 Å²	58	57.6 Å²	57.6	48%	0.479	34%	0.344	S	S	.	.	H	α-helix	trans	-63.5	-44.3	173.8	0	0	0	0	0	112.1	E112 E113 A114 N119 K120	E112-A116 WeakPolarHBondContact O-CB 3.26Å; E112-A116 PolarHBondContact O-N 3.12Å; E113-A116 PolarHBondContact O-N 2.82Å; A114-A116 VanDerWaalsContact C-N 3.29Å; A114-A116 PolarHBondContact O-N 3.29Å; A116-N119 PolarHBondContact O-N 2.77Å; A116-K120 WeakPolarHBondContact O-CB 3.25Å; A116-K120 PolarHBondContact O-N 2.81Å
117	S	90.5	Very high	85.4	Confident	31 Å²	31	57.3 Å²	57.3	22%	0.217	34%	0.341	C	S	.	.	H	α-helix	trans	-63.5	-42.8	176.2	-67.3	0	0	0	0	112.2	Q105 E113 A114 K120 L121	Q105-S117 PolarHBondContact OE1-OG 3.19Å; E113-S117 WeakPolarHBondContact O-CB 3.38Å; E113-S117 PolarHBondContact O-N 2.91Å; E113-S117 PolarHBondContact O-OG 2.8Å; A114-S117 PolarHBondContact O-N 3.31Å; S117-K120 PolarHBondContact O-N 3.03Å; S117-L121 WeakPolarHBondContact O-CB 3.38Å; S117-L121 PolarHBondContact O-N 2.87Å
118	Y	91.9	Very high	84.8	Confident	1 Å²	1	55.6 Å²	55.6	0%	0.004	33%	0.325	C	S	.	.	H	α-helix	trans	-61.5	-46.9	172	-74.9	-57.2	0	0	0	111.7	L99 A102 A106 A114 V115 K120 L121 F122 E134 Y135 T138	L99-Y118 HydrophobicContact CD1-CD1 4.37Å; L99-Y118 HydrophobicContact CD1-CE1 3.84Å; A102-Y118 HydrophobicContact CB-CD1 3.82Å; A102-Y118 HydrophobicContact CB-CD2 4.41Å; A102-Y118 HydrophobicContact CB-CE1 3.73Å; A102-Y118 HydrophobicContact CB-CE2 4.29Å; A102-Y118 HydrophobicContact CB-CG 4.16Å; A106-Y118 HydrophobicContact CB-CE2 4.44Å; A114-Y118 HydrophobicContact CB-CE2 4.33Å; A114-Y118 WeakPolarHBondContact O-CD2 3.38Å; A114-Y118 PolarHBondContact O-N 3.05Å; V115-Y118 PolarHBondContact O-N 3.3Å; Y118-K120 VanDerWaalsContact C-N 3.28Å; Y118-K120 PolarHBondContact O-N 2.98Å; Y118-L121 PolarHBondContact O-N 3.46Å; Y118-L121 VanDerWaalsContact O-N 3.1Å; Y118-F122 HydrophobicContact CD1-CD2 4.49Å; Y118-F122 HydrophobicContact CD1-CE1 4.37Å; Y118-F122 AromaticContact CD1-CE2 3.49Å; Y118-F122 HydrophobicContact CD1-CE2 3.49Å; Y118-F122 VanDerWaalsContact CD1-CE2 3.49Å; Y118-F122 AromaticContact CD1-CZ 3.41Å; Y118-F122 HydrophobicContact CD1-CZ 3.41Å; Y118-F122 VanDerWaalsContact CD1-CZ 3.41Å; Y118-F122 HydrophobicContact CE1-CE2 4.42Å; Y118-F122 HydrophobicContact CE1-CZ 4.11Å; Y118-F122 AromaticContact CG-CE2 3.88Å; Y118-F122 HydrophobicContact CG-CE2 3.88Å; Y118-F122 HydrophobicContact CG-CZ 4.27Å; Y118-F122 VanDerWaalsContact O-CB 3.27Å; Y118-F122 WeakPolarHBondContact O-CB 3.42Å; Y118-F122 VanDerWaalsContact O-CD2 3.27Å; Y118-F122 WeakPolarHBondContact O-CD2 3.26Å; Y118-F122 WeakPolarHBondContact O-CG 3.4Å; Y118-F122 PolarHBondContact O-N 3.4Å; Y118-E134 WeakPolarHBondContact CE1-OE1 3.15Å; Y118-E134 WeakPolarHBondContact OH-CG 3.3Å; Y118-E134 PolarHBondContact OH-OE1 3.29Å; Y118-Y135 VanDerWaalsContact CB-CD2 3.46Å; Y118-Y135 AromaticContact CD2-CD2 3.9Å; Y118-Y135 HydrophobicContact CD2-CD2 3.9Å; Y118-Y135 AromaticContact CG-CD2 3.75Å; Y118-Y135 HydrophobicContact CG-CD2 3.75Å; Y118-Y135 HydrophobicContact CG-CE2 4.38Å; Y118-T138 HydrophobicContact CE2-CG2 4.17Å
119	N	90.4	Very high	84.3	Confident	57 Å²	57	54 Å²	54	31%	0.305	32%	0.323	S	S	.	.	H	α-helix	trans	-60.4	-39.4	179.3	-73.4	-14.8	0	0	0	111.7	V115 A116 N123 Y135	V115-N119 VanDerWaalsContact O-CB 3.29Å; V115-N119 WeakPolarHBondContact O-CB 3.27Å; V115-N119 PolarHBondContact O-N 2.5Å; V115-N119 PolarHBondContact O-ND2 3.48Å; V115-N119 PolarHBondContact O-OD1 3.21Å; A116-N119 PolarHBondContact O-N 2.77Å; N119-N123 WeakPolarHBondContact O-CA 3.25Å; N119-N123 PolarHBondContact O-N 2.82Å; N119-Y135 WeakPolarHBondContact OD1-CE2 3.22Å; N119-Y135 PolarHBondContact OD1-OH 3.27Å
120	K	87.9	Confident	84	Confident	187 Å²	187	55.6 Å²	55.6	81%	0.813	32%	0.318	S	S	*	.	H	α-helix	trans	-63.6	-42.3	174.1	-175.5	179.6	179.1	-177.7	0	111.6	A116 S117 Y118	A116-K120 WeakPolarHBondContact O-CB 3.25Å; A116-K120 PolarHBondContact O-N 2.81Å; S117-K120 PolarHBondContact O-N 3.03Å; Y118-K120 VanDerWaalsContact C-N 3.28Å; Y118-K120 PolarHBondContact O-N 2.98Å
121	L	86.4	Confident	83.8	Confident	15 Å²	15	53.1 Å²	53.1	8%	0.079	31%	0.308	C	S	.	.	H	α-helix	trans	-71.1	-37.4	-179.5	-171.4	57.1	0	0	0	112.6	L89 L90 A98 L99 S117 Y118	L89-L121 HydrophobicContact CD2-CD1 4.04Å; L90-L121 HydrophobicContact CD2-CD1 4.06Å; L90-L121 HydrophobicContact CD2-CD2 3.53Å; L90-L121 HydrophobicContact CD2-CG 3.84Å; A98-L121 HydrophobicContact CB-CD1 3.73Å; A98-L121 HydrophobicContact CB-CD2 4.31Å; L99-L121 HydrophobicContact CB-CD2 3.86Å; L99-L121 HydrophobicContact CD1-CD2 4.02Å; S117-L121 WeakPolarHBondContact O-CB 3.38Å; S117-L121 PolarHBondContact O-N 2.87Å; Y118-L121 PolarHBondContact O-N 3.46Å; Y118-L121 VanDerWaalsContact O-N 3.1Å
122	F	86.6	Confident	83.8	Confident	5 Å²	5	52.9 Å²	52.9	2%	0.022	31%	0.306	C	S	.	.	H	α-helix	trans	-93.9	-12.1	-173.6	-58.5	-22	0	0	0	113.7	T86 L90 L99 Y118 G124 A125 P126 P127 I131 Y135	T86-F122 HydrophobicContact CG2-CB 4.43Å; T86-F122 HydrophobicContact CG2-CD1 3.59Å; T86-F122 HydrophobicContact CG2-CE1 4.33Å; T86-F122 HydrophobicContact CG2-CG 4.39Å; L90-F122 HydrophobicContact CD1-CE1 4.32Å; L99-F122 HydrophobicContact CD1-CZ 4.48Å; Y118-F122 HydrophobicContact CD1-CD2 4.49Å; Y118-F122 HydrophobicContact CD1-CE1 4.37Å; Y118-F122 AromaticContact CD1-CE2 3.49Å; Y118-F122 HydrophobicContact CD1-CE2 3.49Å; Y118-F122 VanDerWaalsContact CD1-CE2 3.49Å; Y118-F122 AromaticContact CD1-CZ 3.41Å; Y118-F122 HydrophobicContact CD1-CZ 3.41Å; Y118-F122 VanDerWaalsContact CD1-CZ 3.41Å; Y118-F122 HydrophobicContact CE1-CE2 4.42Å; Y118-F122 HydrophobicContact CE1-CZ 4.11Å; Y118-F122 AromaticContact CG-CE2 3.88Å; Y118-F122 HydrophobicContact CG-CE2 3.88Å; Y118-F122 HydrophobicContact CG-CZ 4.27Å; Y118-F122 VanDerWaalsContact O-CB 3.27Å; Y118-F122 WeakPolarHBondContact O-CB 3.42Å; Y118-F122 VanDerWaalsContact O-CD2 3.27Å; Y118-F122 WeakPolarHBondContact O-CD2 3.26Å; Y118-F122 WeakPolarHBondContact O-CG 3.4Å; Y118-F122 PolarHBondContact O-N 3.4Å; F122-G124 VanDerWaalsContact C-N 3.25Å; F122-G124 PolarHBondContact O-N 3.16Å; F122-A125 WeakPolarHBondContact CB-O 3.48Å; F122-P126 HydrophobicContact CD2-CB 3.8Å; F122-P126 HydrophobicContact CE2-CB 3.92Å; F122-P127 HydrophobicContact CE1-CG 4.29Å; F122-I131 HydrophobicContact CE1-CG2 4.01Å; F122-I131 HydrophobicContact CE2-CG2 4.2Å; F122-I131 HydrophobicContact CZ-CG2 3.41Å; F122-I131 VanDerWaalsContact CZ-CG2 3.41Å; F122-Y135 HydrophobicContact CD2-CD2 4.15Å; F122-Y135 HydrophobicContact CD2-CE2 4.49Å; F122-Y135 AromaticContact CE2-CD2 3.86Å; F122-Y135 HydrophobicContact CE2-CD2 3.86Å; F122-Y135 HydrophobicContact CE2-CG 4.22Å
123	N	77.1	Confident	83.6	Confident	127 Å²	127	47 Å²	47	68%	0.679	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.6	45.1	-174.7	-162.8	20.6	0	0	0	112.7	N119	N119-N123 WeakPolarHBondContact O-CA 3.25Å; N119-N123 PolarHBondContact O-N 2.82Å
124	G	66	Low	83.6	Confident	62 Å²	62	44.4 Å²	44.4	64%	0.639	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	100.9	-15	170.9	0	0	0	0	0	117.5	F122	F122-G124 VanDerWaalsContact C-N 3.25Å; F122-G124 PolarHBondContact O-N 3.16Å
125	A	70.7	Confident	83.6	Confident	36 Å²	36	44.9 Å²	44.9	30%	0.298	27%	0.269	S	S	.	.	S	Bend	trans	-139.3	120.7	177.4	0	0	0	0	0	112.1	F122	F122-A125 WeakPolarHBondContact CB-O 3.48Å
126	P	78.1	Confident	83.7	Confident	25 Å²	25	45.6 Å²	45.6	16%	0.162	27%	0.271	C	S	.	.	P	Polyproline II helix	trans	-65	144.6	178.8	29.3	-35.2	0	0	0	110.8	F122 Y135	F122-P126 HydrophobicContact CD2-CB 3.8Å; F122-P126 HydrophobicContact CE2-CB 3.92Å; P126-Y135 HydrophobicContact CB-CD1 4.02Å; P126-Y135 HydrophobicContact CB-CG 4.03Å; P126-Y135 HydrophobicContact CG-CD1 3.74Å; P126-Y135 HydrophobicContact CG-CE1 4.18Å; P126-Y135 HydrophobicContact CG-CG 4.28Å
127	P	75.2	Confident	83.8	Confident	2 Å²	2	44 Å²	44	1%	0.013	26%	0.257	C	S	.	.	P	Polyproline II helix	trans	-66.3	149.2	172.9	26.4	-30.4	0	0	0	111	S83 T86 L90 F122 I131 A132	S83-P127 WeakPolarHBondContact OG-CA 3.09Å; T86-P127 HydrophobicContact CG2-CG 4.16Å; L90-P127 HydrophobicContact CD1-CG 4.07Å; F122-P127 HydrophobicContact CE1-CG 4.29Å; P127-I131 HydrophobicContact CG-CB 4.08Å; P127-I131 HydrophobicContact CG-CD1 4.24Å; P127-I131 HydrophobicContact CG-CG2 3.76Å; P127-A132 WeakPolarHBondContact O-CB 3.48Å; P127-A132 PolarHBondContact O-N 3.05Å
128	E	74.4	Confident	83.9	Confident	82 Å²	82	42.9 Å²	42.9	38%	0.383	25%	0.248	S	C	.	.	S	Bend	trans	-58.6	159.5	179.8	-65	178.8	-175.9	0	0	112.9
129	G	74.1	Confident	83.9	Confident	42 Å²	42	42.8 Å²	42.8	43%	0.433	25%	0.248	S	C	.	.	S	Bend	trans	88.3	-150.8	177.7	0	0	0	0	0	114.4	I131 A132 V133	G129-I131 PolarHBondContact O-N 3.41Å; G129-A132 WeakPolarHBondContact O-CB 3.05Å; G129-A132 PolarHBondContact O-N 2.98Å; G129-V133 PolarHBondContact O-N 2.73Å
130	D	78.3	Confident	84.1	Confident	91 Å²	91	40.2 Å²	40.2	49%	0.487	23%	0.234	S	C	.	.	H	α-helix	trans	-60.7	-29.2	-171.7	-67.4	-30	0	0	0	113.9	A132 V133 E134	D130-A132 VanDerWaalsContact C-N 3.33Å; D130-A132 PolarHBondContact O-N 3.02Å; D130-V133 WeakPolarHBondContact O-CB 3.35Å; D130-V133 PolarHBondContact O-N 2.76Å; D130-E134 WeakPolarHBondContact O-CB 3.29Å; D130-E134 PolarHBondContact O-N 3.24Å
131	I	85.9	Confident	84.2	Confident	38 Å²	38	36.5 Å²	36.5	20%	0.195	22%	0.218	C	C	.	.	H	α-helix	trans	-67.9	-34.9	176.7	-60.4	179.7	0	0	0	110.9	L90 L99 F122 P127 G129 E134 Y135	L90-I131 HydrophobicContact CD1-CD1 3.61Å; L99-I131 HydrophobicContact CD2-CD1 4.42Å; F122-I131 HydrophobicContact CE1-CG2 4.01Å; F122-I131 HydrophobicContact CE2-CG2 4.2Å; F122-I131 HydrophobicContact CZ-CG2 3.41Å; F122-I131 VanDerWaalsContact CZ-CG2 3.41Å; P127-I131 HydrophobicContact CG-CB 4.08Å; P127-I131 HydrophobicContact CG-CD1 4.24Å; P127-I131 HydrophobicContact CG-CG2 3.76Å; G129-I131 PolarHBondContact O-N 3.41Å; I131-E134 PolarHBondContact O-N 3.03Å; I131-Y135 WeakPolarHBondContact O-CB 3.48Å; I131-Y135 PolarHBondContact O-N 2.93Å
132	A	87.9	Confident	84.5	Confident	8 Å²	8	36.6 Å²	36.6	7%	0.066	22%	0.219	C	C	.	.	H	α-helix	trans	-65.4	-40.8	172.1	0	0	0	0	0	111.1	P127 G129 D130 Y135 W136 I156	P127-A132 WeakPolarHBondContact O-CB 3.48Å; P127-A132 PolarHBondContact O-N 3.05Å; G129-A132 WeakPolarHBondContact O-CB 3.05Å; G129-A132 PolarHBondContact O-N 2.98Å; D130-A132 VanDerWaalsContact C-N 3.33Å; D130-A132 PolarHBondContact O-N 3.02Å; A132-Y135 PolarHBondContact O-N 3.27Å; A132-W136 WeakPolarHBondContact O-CB 3.46Å; A132-W136 PolarHBondContact O-N 3.44Å; A132-I156 HydrophobicContact CB-CD1 3.84Å
133	V	89	Confident	84.5	Confident	17 Å²	17	41.3 Å²	41.3	10%	0.103	25%	0.25	C	C	.	.	H	α-helix	trans	-60.8	-46.2	175	176.4	0	0	0	0	110.7	G129 D130 S137 L153 I156 L166	G129-V133 PolarHBondContact O-N 2.73Å; D130-V133 WeakPolarHBondContact O-CB 3.35Å; D130-V133 PolarHBondContact O-N 2.76Å; V133-S137 WeakPolarHBondContact O-CB 3.38Å; V133-S137 PolarHBondContact O-N 3.33Å; V133-S137 PolarHBondContact O-OG 3.11Å; V133-L153 HydrophobicContact CG1-CD2 4.35Å; V133-I156 HydrophobicContact CG2-CD1 4.48Å; V133-I156 HydrophobicContact CG2-CG2 3.66Å; V133-L166 HydrophobicContact CG1-CB 4.36Å; V133-L166 HydrophobicContact CG1-CD1 3.9Å; V133-L166 HydrophobicContact CG2-CD1 4.28Å; V133-L166 HydrophobicContact CG2-CD2 4.14Å
134	E	90	Very high	85.1	Confident	43 Å²	43	40 Å²	40	20%	0.201	26%	0.257	C	S	.	.	H	α-helix	trans	-59.6	-48.5	176.9	-175.9	-174	131.8	0	0	111.9	R103 Y118 D130 I131 T138	R103-E134 WeakPolarHBondContact CG-OE1 3.35Å; R103-E134 IonicContact CZ-OE1 2.67Å; R103-E134 IonicContact CZ-OE2 3.5Å; R103-E134 VanDerWaalsContact CZ-OE2 3.27Å; R103-E134 VanDerWaalsContact NE-CD 3.32Å; R103-E134 IonicContact NE-OE1 3.3Å; R103-E134 PolarHBondContact NE-OE1 2.67Å; R103-E134 IonicContact NE-OE2 2.65Å; R103-E134 PolarHBondContact NE-OE2 2.79Å; R103-E134 IonicContact NH2-OE1 3.55Å; R103-E134 IonicContact NH2-OE2 2.93Å; R103-E134 PolarHBondContact NH2-OE2 2.86Å; Y118-E134 WeakPolarHBondContact CE1-OE1 3.15Å; Y118-E134 WeakPolarHBondContact OH-CG 3.3Å; Y118-E134 PolarHBondContact OH-OE1 3.29Å; D130-E134 WeakPolarHBondContact O-CB 3.29Å; D130-E134 PolarHBondContact O-N 3.24Å; I131-E134 PolarHBondContact O-N 3.03Å; E134-T138 PolarHBondContact O-N 3.12Å; E134-T138 PolarHBondContact O-OG1 3.36Å
135	Y	92.9	Very high	86.4	Confident	9 Å²	9	40.2 Å²	40.2	4%	0.035	24%	0.238	C	C	.	.	H	α-helix	trans	-59.3	-55.1	177.4	175.4	-100.9	0	0	0	111.6	V115 Y118 N119 F122 P126 I131 A132 S137 T138 V139	V115-Y135 HydrophobicContact CG1-CE2 4.37Å; Y118-Y135 VanDerWaalsContact CB-CD2 3.46Å; Y118-Y135 AromaticContact CD2-CD2 3.9Å; Y118-Y135 HydrophobicContact CD2-CD2 3.9Å; Y118-Y135 AromaticContact CG-CD2 3.75Å; Y118-Y135 HydrophobicContact CG-CD2 3.75Å; Y118-Y135 HydrophobicContact CG-CE2 4.38Å; N119-Y135 WeakPolarHBondContact OD1-CE2 3.22Å; N119-Y135 PolarHBondContact OD1-OH 3.27Å; F122-Y135 HydrophobicContact CD2-CD2 4.15Å; F122-Y135 HydrophobicContact CD2-CE2 4.49Å; F122-Y135 AromaticContact CE2-CD2 3.86Å; F122-Y135 HydrophobicContact CE2-CD2 3.86Å; F122-Y135 HydrophobicContact CE2-CG 4.22Å; P126-Y135 HydrophobicContact CB-CD1 4.02Å; P126-Y135 HydrophobicContact CB-CG 4.03Å; P126-Y135 HydrophobicContact CG-CD1 3.74Å; P126-Y135 HydrophobicContact CG-CE1 4.18Å; P126-Y135 HydrophobicContact CG-CG 4.28Å; I131-Y135 WeakPolarHBondContact O-CB 3.48Å; I131-Y135 PolarHBondContact O-N 2.93Å; A132-Y135 PolarHBondContact O-N 3.27Å; Y135-S137 VanDerWaalsContact C-N 3.32Å; Y135-S137 PolarHBondContact O-N 2.85Å; Y135-T138 WeakPolarHBondContact O-CA 3.38Å; Y135-T138 WeakPolarHBondContact O-CB 3.3Å; Y135-T138 PolarHBondContact O-N 3.26Å; Y135-V139 HydrophobicContact CD1-CG2 4.18Å; Y135-V139 HydrophobicContact CE1-CG2 3.75Å; Y135-V139 HydrophobicContact CE2-CG2 4.25Å; Y135-V139 WeakPolarHBondContact O-CG2 3.15Å; Y135-V139 PolarHBondContact O-N 2.91Å
136	W	93.7	Very high	87.4	Confident	22 Å²	22	42 Å²	42	8%	0.083	24%	0.237	C	C	.	.	H	α-helix	trans	-69.1	-31	-176.6	-70.4	116.5	0	0	0	112.5	A132 T138 V139 A140 E148 A149 Q152 L153	A132-W136 WeakPolarHBondContact O-CB 3.46Å; A132-W136 PolarHBondContact O-N 3.44Å; W136-T138 VanDerWaalsContact C-N 3.26Å; W136-T138 PolarHBondContact O-N 2.95Å; W136-V139 HydrophobicContact CE3-CB 4.03Å; W136-V139 HydrophobicContact CE3-CG1 4.21Å; W136-V139 HydrophobicContact CE3-CG2 4.02Å; W136-V139 HydrophobicContact CZ3-CB 4.47Å; W136-V139 HydrophobicContact CZ3-CG1 4.23Å; W136-V139 HydrophobicContact CZ3-CG2 4.29Å; W136-V139 PolarHBondContact O-N 3.38Å; W136-A140 WeakPolarHBondContact O-CB 3.09Å; W136-A140 PolarHBondContact O-N 2.92Å; W136-E148 WeakPolarHBondContact CH2-OE1 3.48Å; W136-E148 HydrophobicContact CZ3-CG 4.11Å; W136-E148 WeakPolarHBondContact CZ3-OE1 3.24Å; W136-A149 HydrophobicContact CE3-CB 4.31Å; W136-A149 WeakPolarHBondContact O-CB 3.32Å; W136-Q152 HydrophobicContact CD2-CB 3.51Å; W136-Q152 HydrophobicContact CD2-CG 3.79Å; W136-Q152 HydrophobicContact CE3-CB 4.02Å; W136-Q152 HydrophobicContact CE3-CG 3.95Å; W136-Q152 HydrophobicContact CG-CB 3.74Å; W136-Q152 HydrophobicContact CH2-CG 3.73Å; W136-Q152 HydrophobicContact CZ2-CB 4.11Å; W136-Q152 HydrophobicContact CZ2-CG 3.55Å; W136-Q152 HydrophobicContact CZ3-CB 4.49Å; W136-Q152 HydrophobicContact CZ3-CG 3.92Å; W136-L153 HydrophobicContact CB-CD2 3.74Å; W136-L153 HydrophobicContact CB-CG 3.83Å
137	S	92.3	Very high	88	Confident	25 Å²	25	42.7 Å²	42.7	18%	0.175	25%	0.249	C	C	.	.	H	α-helix	trans	-64.2	-33	170.3	-61.1	0	0	0	0	111.9	V133 Y135	V133-S137 WeakPolarHBondContact O-CB 3.38Å; V133-S137 PolarHBondContact O-N 3.33Å; V133-S137 PolarHBondContact O-OG 3.11Å; Y135-S137 VanDerWaalsContact C-N 3.32Å; Y135-S137 PolarHBondContact O-N 2.85Å
138	T	92.2	Very high	88.9	Confident	6 Å²	6	46.3 Å²	46.3	4%	0.037	27%	0.266	C	S	.	.	H	α-helix	trans	-72.5	-43.1	173.9	-54.1	0	0	0	0	111.3	A106 A114 V115 Y118 E134 Y135 W136 A140 K141	A106-T138 HydrophobicContact CB-CG2 3.85Å; A114-T138 HydrophobicContact CB-CG2 3.72Å; V115-T138 HydrophobicContact CG2-CG2 4.01Å; Y118-T138 HydrophobicContact CE2-CG2 4.17Å; E134-T138 PolarHBondContact O-N 3.12Å; E134-T138 PolarHBondContact O-OG1 3.36Å; Y135-T138 WeakPolarHBondContact O-CA 3.38Å; Y135-T138 WeakPolarHBondContact O-CB 3.3Å; Y135-T138 PolarHBondContact O-N 3.26Å; W136-T138 VanDerWaalsContact C-N 3.26Å; W136-T138 PolarHBondContact O-N 2.95Å; T138-A140 PolarHBondContact O-N 3.4Å; T138-K141 WeakPolarHBondContact O-CB 3.31Å; T138-K141 PolarHBondContact O-N 2.93Å; T138-K141 VanDerWaalsContact O-N 3.1Å
139	V	93.6	Very high	89.7	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-59.8	-35.8	174.1	180	0	0	0	0	111.3	V115 Y135 W136 K141 I142 R145 A149	V115-V139 HydrophobicContact CG1-CG2 4.26Å; V115-V139 HydrophobicContact CG2-CB 4.44Å; V115-V139 HydrophobicContact CG2-CG2 3.71Å; Y135-V139 HydrophobicContact CD1-CG2 4.18Å; Y135-V139 HydrophobicContact CE1-CG2 3.75Å; Y135-V139 HydrophobicContact CE2-CG2 4.25Å; Y135-V139 WeakPolarHBondContact O-CG2 3.15Å; Y135-V139 PolarHBondContact O-N 2.91Å; W136-V139 HydrophobicContact CE3-CB 4.03Å; W136-V139 HydrophobicContact CE3-CG1 4.21Å; W136-V139 HydrophobicContact CE3-CG2 4.02Å; W136-V139 HydrophobicContact CZ3-CB 4.47Å; W136-V139 HydrophobicContact CZ3-CG1 4.23Å; W136-V139 HydrophobicContact CZ3-CG2 4.29Å; W136-V139 PolarHBondContact O-N 3.38Å; V139-K141 PolarHBondContact O-N 3.3Å; V139-K141 VanDerWaalsContact O-N 3.15Å; V139-I142 WeakPolarHBondContact O-CB 3.4Å; V139-I142 PolarHBondContact O-N 2.94Å; V139-R145 HydrophobicContact CG1-CB 3.66Å; V139-A149 HydrophobicContact CB-CB 4.09Å; V139-A149 HydrophobicContact CG1-CB 4Å
140	A	93.1	Very high	90.7	Very high	2 Å²	2	40.5 Å²	40.5	2%	0.017	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-20.2	178.2	0	0	0	0	0	114	W136 T138 I142 R146 A149 L173	W136-A140 WeakPolarHBondContact O-CB 3.09Å; W136-A140 PolarHBondContact O-N 2.92Å; T138-A140 PolarHBondContact O-N 3.4Å; A140-I142 PolarHBondContact O-N 2.81Å; A140-R146 PolarHBondContact O-NE 2.97Å; A140-A149 HydrophobicContact CB-CB 3.72Å; A140-L173 HydrophobicContact CB-CD1 3.73Å; A140-L173 HydrophobicContact CB-CD2 3.78Å; A140-L173 HydrophobicContact CB-CG 4.44Å
141	K	91.2	Very high	91.4	Very high	109 Å²	109	39.7 Å²	39.7	47%	0.474	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-16.7	173.7	-60.7	-179.9	-178.4	-177.8	0	112.7	A106 A111 T138 V139 P143	A106-K141 PolarHBondContact O-NZ 3.37Å; A111-K141 HydrophobicContact CB-CB 3.75Å; A111-K141 HydrophobicContact CB-CD 4.48Å; T138-K141 WeakPolarHBondContact O-CB 3.31Å; T138-K141 PolarHBondContact O-N 2.93Å; T138-K141 VanDerWaalsContact O-N 3.1Å; V139-K141 PolarHBondContact O-N 3.3Å; V139-K141 VanDerWaalsContact O-N 3.15Å; K141-P143 WeakPolarHBondContact O-CD 3.38Å
142	I	91.6	Very high	91.7	Very high	17 Å²	17	40.3 Å²	40.3	9%	0.087	23%	0.225	C	C	.	.	S	Bend	trans	-89.6	111.1	176.1	-55.5	172.2	0	0	0	108.6	A111 E112 V115 V139 A140 A144 R145 R146	A111-I142 HydrophobicContact CB-CG1 4.06Å; E112-I142 HydrophobicContact CG-CD1 4.05Å; E112-I142 HydrophobicContact CG-CG1 4.21Å; V115-I142 HydrophobicContact CB-CD1 4.25Å; V115-I142 HydrophobicContact CG2-CD1 3.86Å; V139-I142 WeakPolarHBondContact O-CB 3.4Å; V139-I142 PolarHBondContact O-N 2.94Å; A140-I142 PolarHBondContact O-N 2.81Å; I142-A144 VanDerWaalsContact C-N 3.31Å; I142-A144 PolarHBondContact O-N 2.96Å; I142-R145 HydrophobicContact CB-CB 4.35Å; I142-R145 HydrophobicContact CG2-CB 4.36Å; I142-R145 HydrophobicContact CG2-CG 4.29Å; I142-R145 CarbonylContact O-C 3.33Å; I142-R145 PolarHBondContact O-N 3.13Å; I142-R146 PolarHBondContact O-N 3.49Å
143	P	87.6	Confident	92	Very high	104 Å²	104	39.9 Å²	39.9	68%	0.675	22%	0.222	S	C	*	.	G	3₁₀ helix	trans	-54.8	-41.9	-172.9	-28	35.7	0	0	0	114	K141 R145 R146	K141-P143 WeakPolarHBondContact O-CD 3.38Å; P143-R145 PolarHBondContact O-N 3.14Å; P143-R146 WeakPolarHBondContact O-CB 3.5Å; P143-R146 PolarHBondContact O-N 3.04Å
144	A	89.2	Confident	92.2	Very high	100 Å²	100	43 Å²	43	83%	0.826	23%	0.234	S	C	*	.	G	3₁₀ helix	trans	-64.7	-26.3	179.7	0	0	0	0	0	113.6	I142	I142-A144 VanDerWaalsContact C-N 3.31Å; I142-A144 PolarHBondContact O-N 2.96Å
145	R	92.9	Very high	92.1	Very high	67 Å²	67	47.7 Å²	47.7	25%	0.253	25%	0.25	S	C	.	.	G	3₁₀ helix	trans	-107.5	4.4	-178.4	-61.4	-171.5	65.7	-162.4	-2.2	113.3	V139 I142 P143 G147 E148 A149	V139-R145 HydrophobicContact CG1-CB 3.66Å; I142-R145 HydrophobicContact CB-CB 4.35Å; I142-R145 HydrophobicContact CG2-CB 4.36Å; I142-R145 HydrophobicContact CG2-CG 4.29Å; I142-R145 CarbonylContact O-C 3.33Å; I142-R145 PolarHBondContact O-N 3.13Å; P143-R145 PolarHBondContact O-N 3.14Å; R145-G147 VanDerWaalsContact C-N 3.34Å; R145-G147 PolarHBondContact O-N 3.43Å; R145-E148 IonicContact CZ-OE2 2.77Å; R145-E148 IonicContact NE-OE2 3.37Å; R145-E148 PolarHBondContact NE-OE2 2.93Å; R145-E148 VanDerWaalsContact NH2-CD 3.35Å; R145-E148 IonicContact NH2-OE1 3.55Å; R145-E148 PolarHBondContact NH2-OE1 3.18Å; R145-E148 IonicContact NH2-OE2 2.75Å; R145-E148 PolarHBondContact NH2-OE2 3.41Å; R145-E148 WeakPolarHBondContact O-CB 3.3Å; R145-E148 PolarHBondContact O-N 3.27Å; R145-A149 PolarHBondContact O-N 2.85Å
146	R	92.4	Very high	91.9	Very high	73 Å²	73	48.4 Å²	48.4	28%	0.275	25%	0.254	S	S	.	.	H	α-helix	trans	-59.7	-41.8	-176.4	-173.6	177.3	-70.6	177.3	-0.4	112.7	A140 I142 P143 E148 A149 I150 S177	A140-R146 PolarHBondContact O-NE 2.97Å; I142-R146 PolarHBondContact O-N 3.49Å; P143-R146 WeakPolarHBondContact O-CB 3.5Å; P143-R146 PolarHBondContact O-N 3.04Å; R146-E148 PolarHBondContact O-N 3.13Å; R146-A149 PolarHBondContact O-N 3.49Å; R146-I150 HydrophobicContact CG-CD1 3.95Å; R146-I150 HydrophobicContact CG-CG1 4.44Å; R146-I150 WeakPolarHBondContact O-CG1 3.42Å; R146-I150 PolarHBondContact O-N 3.45Å; R146-S177 VanDerWaalsContact CD-OG 3.29Å; R146-S177 WeakPolarHBondContact CD-OG 3.48Å
147	G	91.2	Very high	91.8	Very high	39 Å²	39	47.8 Å²	47.8	40%	0.402	25%	0.252	S	S	.	.	H	α-helix	trans	-61.8	-41.6	177.9	0	0	0	0	0	113.1	R145 N151	R145-G147 VanDerWaalsContact C-N 3.34Å; R145-G147 PolarHBondContact O-N 3.43Å; G147-N151 PolarHBondContact O-N 3.08Å; G147-N151 PolarHBondContact O-ND2 3.17Å
148	E	92.8	Very high	91.5	Very high	79 Å²	79	49.7 Å²	49.7	37%	0.369	27%	0.269	S	S	.	.	H	α-helix	trans	-60.9	-49.7	174.8	-175.6	-164	170.3	0	0	110.7	W136 R145 R146 I150 N151 Q152	W136-E148 WeakPolarHBondContact CH2-OE1 3.48Å; W136-E148 HydrophobicContact CZ3-CG 4.11Å; W136-E148 WeakPolarHBondContact CZ3-OE1 3.24Å; R145-E148 IonicContact CZ-OE2 2.77Å; R145-E148 IonicContact NE-OE2 3.37Å; R145-E148 PolarHBondContact NE-OE2 2.93Å; R145-E148 VanDerWaalsContact NH2-CD 3.35Å; R145-E148 IonicContact NH2-OE1 3.55Å; R145-E148 PolarHBondContact NH2-OE1 3.18Å; R145-E148 IonicContact NH2-OE2 2.75Å; R145-E148 PolarHBondContact NH2-OE2 3.41Å; R145-E148 WeakPolarHBondContact O-CB 3.3Å; R145-E148 PolarHBondContact O-N 3.27Å; R146-E148 PolarHBondContact O-N 3.13Å; E148-I150 PolarHBondContact O-N 2.93Å; E148-N151 PolarHBondContact O-N 2.84Å; E148-Q152 WeakPolarHBondContact O-CG 3.28Å; E148-Q152 PolarHBondContact O-N 3.25Å; E148-Q152 VanDerWaalsContact O-N 3.16Å
149	A	92.6	Very high	90.9	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-60.9	-44.1	-179.7	0	0	0	0	0	113	W136 V139 A140 R145 R146 N151 Q152 L153	W136-A149 HydrophobicContact CE3-CB 4.31Å; W136-A149 WeakPolarHBondContact O-CB 3.32Å; V139-A149 HydrophobicContact CB-CB 4.09Å; V139-A149 HydrophobicContact CG1-CB 4Å; A140-A149 HydrophobicContact CB-CB 3.72Å; R145-A149 PolarHBondContact O-N 2.85Å; R146-A149 PolarHBondContact O-N 3.49Å; A149-N151 VanDerWaalsContact C-N 3.29Å; A149-N151 PolarHBondContact O-N 3.36Å; A149-Q152 PolarHBondContact O-N 2.92Å; A149-L153 WeakPolarHBondContact O-CG 3.29Å; A149-L153 PolarHBondContact O-N 3.49Å
150	I	94.7	Very high	90	Very high	1 Å²	1	55.8 Å²	55.8	1%	0.005	30%	0.303	C	S	.	.	H	α-helix	trans	-58.8	-43.8	176.8	-70.7	167.9	0	0	0	110.6	R146 E148 Q152 L153 K154 L170 L173 L174 S177 R179	R146-I150 HydrophobicContact CG-CD1 3.95Å; R146-I150 HydrophobicContact CG-CG1 4.44Å; R146-I150 WeakPolarHBondContact O-CG1 3.42Å; R146-I150 PolarHBondContact O-N 3.45Å; E148-I150 PolarHBondContact O-N 2.93Å; I150-Q152 VanDerWaalsContact C-N 3.3Å; I150-Q152 PolarHBondContact O-N 3.4Å; I150-L153 PolarHBondContact O-N 3.11Å; I150-K154 HydrophobicContact CG2-CD 4.21Å; I150-K154 HydrophobicContact CG2-CG 4.4Å; I150-K154 WeakPolarHBondContact O-CB 3.32Å; I150-K154 WeakPolarHBondContact O-CG 3.5Å; I150-K154 PolarHBondContact O-N 3.47Å; I150-L170 HydrophobicContact CG2-CD1 4.26Å; I150-L173 HydrophobicContact CG1-CB 4.34Å; I150-L174 HydrophobicContact CG2-CD2 3.59Å; I150-L174 HydrophobicContact CG2-CG 4.38Å; I150-S177 WeakPolarHBondContact CD1-OG 3.42Å; I150-R179 VanDerWaalsContact CG2-NH1 3.3Å
151	N	93.4	Very high	89	Confident	74 Å²	74	59.1 Å²	59.1	40%	0.396	32%	0.324	S	S	.	.	H	α-helix	trans	-64.1	-36.5	-179.7	-71	-19.9	0	0	0	112.2	G147 E148 A149 R155	G147-N151 PolarHBondContact O-N 3.08Å; G147-N151 PolarHBondContact O-ND2 3.17Å; E148-N151 PolarHBondContact O-N 2.84Å; A149-N151 VanDerWaalsContact C-N 3.29Å; A149-N151 PolarHBondContact O-N 3.36Å; N151-R155 PolarHBondContact O-N 3.23Å
152	Q	91.7	Very high	88.2	Confident	51 Å²	51	56.4 Å²	56.4	24%	0.238	33%	0.327	C	S	.	.	H	α-helix	trans	-72.4	-43.5	177	-63.9	-73.1	8.5	0	0	112.1	W136 E148 A149 I150 K154 R155 I156	W136-Q152 HydrophobicContact CD2-CB 3.51Å; W136-Q152 HydrophobicContact CD2-CG 3.79Å; W136-Q152 HydrophobicContact CE3-CB 4.02Å; W136-Q152 HydrophobicContact CE3-CG 3.95Å; W136-Q152 HydrophobicContact CG-CB 3.74Å; W136-Q152 HydrophobicContact CH2-CG 3.73Å; W136-Q152 HydrophobicContact CZ2-CB 4.11Å; W136-Q152 HydrophobicContact CZ2-CG 3.55Å; W136-Q152 HydrophobicContact CZ3-CB 4.49Å; W136-Q152 HydrophobicContact CZ3-CG 3.92Å; E148-Q152 WeakPolarHBondContact O-CG 3.28Å; E148-Q152 PolarHBondContact O-N 3.25Å; E148-Q152 VanDerWaalsContact O-N 3.16Å; A149-Q152 PolarHBondContact O-N 2.92Å; I150-Q152 VanDerWaalsContact C-N 3.3Å; I150-Q152 PolarHBondContact O-N 3.4Å; Q152-K154 VanDerWaalsContact C-N 3.28Å; Q152-K154 PolarHBondContact O-N 3.39Å; Q152-R155 WeakPolarHBondContact O-CB 3.46Å; Q152-R155 PolarHBondContact O-N 3.33Å; Q152-R155 VanDerWaalsContact O-N 3.1Å; Q152-I156 WeakPolarHBondContact O-CG1 3.4Å; Q152-I156 PolarHBondContact O-N 3.06Å
153	L	93.2	Very high	87.8	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-61.9	-35.8	174.9	-69.3	169.5	0	0	0	112.1	V133 W136 A149 I150 I156 N157 L166 L170 L173	V133-L153 HydrophobicContact CG1-CD2 4.35Å; W136-L153 HydrophobicContact CB-CD2 3.74Å; W136-L153 HydrophobicContact CB-CG 3.83Å; A149-L153 WeakPolarHBondContact O-CG 3.29Å; A149-L153 PolarHBondContact O-N 3.49Å; I150-L153 PolarHBondContact O-N 3.11Å; L153-I156 PolarHBondContact O-N 3.03Å; L153-N157 WeakPolarHBondContact O-CB 3.23Å; L153-N157 PolarHBondContact O-N 3.41Å; L153-L166 HydrophobicContact CB-CD1 4.2Å; L153-L166 HydrophobicContact CD2-CD1 3.63Å; L153-L166 HydrophobicContact CG-CD1 4.45Å; L153-L170 HydrophobicContact CB-CD1 3.93Å; L153-L173 HydrophobicContact CD1-CD1 3.7Å
154	K	93.3	Very high	87.8	Confident	83 Å²	83	54.8 Å²	54.8	36%	0.361	32%	0.315	S	S	.	.	H	α-helix	trans	-61.2	-42.1	172.1	-78.1	-178.4	68.6	177.7	0	112.3	I150 Q152 N157 A158 L170 E182	I150-K154 HydrophobicContact CG2-CD 4.21Å; I150-K154 HydrophobicContact CG2-CG 4.4Å; I150-K154 WeakPolarHBondContact O-CB 3.32Å; I150-K154 WeakPolarHBondContact O-CG 3.5Å; I150-K154 PolarHBondContact O-N 3.47Å; Q152-K154 VanDerWaalsContact C-N 3.28Å; Q152-K154 PolarHBondContact O-N 3.39Å; K154-N157 PolarHBondContact O-N 3.12Å; K154-A158 PolarHBondContact O-N 3.14Å; K154-L170 HydrophobicContact CG-CD1 4.23Å; K154-L170 HydrophobicContact CG-CD2 4.08Å; K154-E182 IonicContact NZ-OE2 3.56Å; K154-E182 PolarHBondContact NZ-OE2 3.21Å
155	R	89.5	Confident	87.6	Confident	141 Å²	141	51.8 Å²	51.8	53%	0.532	29%	0.294	S	S	.	.	H	α-helix	trans	-63	-48.4	175.2	-69.5	-179.7	-164.8	138.7	0.2	110.8	N151 Q152 N157 A158 D159	N151-R155 PolarHBondContact O-N 3.23Å; Q152-R155 WeakPolarHBondContact O-CB 3.46Å; Q152-R155 PolarHBondContact O-N 3.33Å; Q152-R155 VanDerWaalsContact O-N 3.1Å; R155-N157 VanDerWaalsContact C-N 3.28Å; R155-N157 PolarHBondContact O-N 2.86Å; R155-A158 WeakPolarHBondContact O-CB 3.36Å; R155-A158 PolarHBondContact O-N 3.36Å; R155-D159 PolarHBondContact O-N 2.92Å
156	I	88.5	Confident	87.4	Confident	23 Å²	23	48.7 Å²	48.7	12%	0.118	28%	0.282	C	S	.	.	H	α-helix	trans	-60.2	-39.5	178.7	-60.7	164.5	0	0	0	111.2	A132 V133 Q152 L153 D159 T160 L166	A132-I156 HydrophobicContact CB-CD1 3.84Å; V133-I156 HydrophobicContact CG2-CD1 4.48Å; V133-I156 HydrophobicContact CG2-CG2 3.66Å; Q152-I156 WeakPolarHBondContact O-CG1 3.4Å; Q152-I156 PolarHBondContact O-N 3.06Å; L153-I156 PolarHBondContact O-N 3.03Å; I156-D159 PolarHBondContact O-N 2.91Å; I156-T160 PolarHBondContact O-N 2.81Å; I156-T160 PolarHBondContact O-OG1 2.66Å; I156-L166 HydrophobicContact CB-CD2 4.23Å; I156-L166 HydrophobicContact CG2-CD2 3.8Å
157	N	89.9	Confident	87.5	Confident	9 Å²	9	45.3 Å²	45.3	5%	0.048	27%	0.269	C	S	.	.	H	α-helix	trans	-67.1	-35	176.1	176.4	66.8	0	0	0	112.6	L153 K154 R155 D159 T160 P161 L166 Q167 L170 Q189	L153-N157 WeakPolarHBondContact O-CB 3.23Å; L153-N157 PolarHBondContact O-N 3.41Å; K154-N157 PolarHBondContact O-N 3.12Å; R155-N157 VanDerWaalsContact C-N 3.28Å; R155-N157 PolarHBondContact O-N 2.86Å; N157-D159 VanDerWaalsContact C-N 3.3Å; N157-T160 CarbonylContact O-C 3.54Å; N157-T160 VanDerWaalsContact O-C 3.31Å; N157-T160 PolarHBondContact O-N 2.92Å; N157-P161 WeakPolarHBondContact O-CA 3.39Å; N157-L166 HydrophobicContact CB-CD2 3.8Å; N157-L166 HydrophobicContact CB-CG 4.26Å; N157-Q167 WeakPolarHBondContact OD1-CG 3.36Å; N157-Q167 PolarHBondContact OD1-NE2 2.93Å; N157-Q167 VanDerWaalsContact OD1-NE2 3.15Å; N157-L170 HydrophobicContact CB-CD2 4.07Å; N157-Q189 PolarHBondContact ND2-OE1 3.31Å
158	A	86.4	Confident	87.5	Confident	66 Å²	66	45.7 Å²	45.7	55%	0.545	26%	0.262	S	S	.	.	H	α-helix	trans	-64	-38.6	172.8	0	0	0	0	0	111.3	K154 R155 T160	K154-A158 PolarHBondContact O-N 3.14Å; R155-A158 WeakPolarHBondContact O-CB 3.36Å; R155-A158 PolarHBondContact O-N 3.36Å; A158-T160 VanDerWaalsContact C-N 3.34Å
159	D	79.3	Confident	87.4	Confident	106 Å²	106	45.4 Å²	45.4	57%	0.567	26%	0.263	S	S	*	.	H	α-helix	trans	-74.7	-23.4	177.6	-60.2	-27.6	0	0	0	112.9	R155 I156 N157	R155-D159 PolarHBondContact O-N 2.92Å; I156-D159 PolarHBondContact O-N 2.91Å; N157-D159 VanDerWaalsContact C-N 3.3Å
160	T	76.5	Confident	87.5	Confident	28 Å²	28	45.5 Å²	45.5	17%	0.172	26%	0.264	C	S	.	.			trans	-131.6	63.5	-176.8	58.2	0	0	0	0	112.9	A23 I156 N157 A158 G162 N163	A23-T160 HydrophobicContact CB-CG2 4.35Å; I156-T160 PolarHBondContact O-N 2.81Å; I156-T160 PolarHBondContact O-OG1 2.66Å; N157-T160 CarbonylContact O-C 3.54Å; N157-T160 VanDerWaalsContact O-C 3.31Å; N157-T160 PolarHBondContact O-N 2.92Å; A158-T160 VanDerWaalsContact C-N 3.34Å; T160-G162 PolarHBondContact O-N 3.47Å; T160-N163 PolarHBondContact O-N 3.45Å; T160-N163 VanDerWaalsContact O-N 3.13Å
161	P	71.5	Confident	87.5	Confident	72 Å²	72	45.4 Å²	45.4	47%	0.468	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	5.7	-167.3	24.7	-34.2	0	0	0	116.9	N157 Q167	N157-P161 WeakPolarHBondContact O-CA 3.39Å; P161-Q167 PolarHBondContact O-NE2 2.79Å
162	G	73.8	Confident	87.5	Confident	52 Å²	52	45.8 Å²	45.8	54%	0.536	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118	2.6	176.7	0	0	0	0	0	115.4	T160 T164	T160-G162 PolarHBondContact O-N 3.47Å; G162-T164 PolarHBondContact O-N 3.39Å
163	N	84.1	Confident	87.6	Confident	43 Å²	43	44.7 Å²	44.7	23%	0.23	26%	0.261	C	S	.	.			trans	-76.3	91.2	178.8	-170.9	-31.7	0	0	0	110.6	T160 G165 L166 Q167	T160-N163 PolarHBondContact O-N 3.45Å; T160-N163 VanDerWaalsContact O-N 3.13Å; N163-G165 VanDerWaalsContact C-N 3.27Å; N163-G165 PolarHBondContact O-N 3Å; N163-G165 PolarHBondContact OD1-N 3.09Å; N163-L166 HydrophobicContact CB-CB 3.99Å; N163-L166 PolarHBondContact O-N 3.22Å; N163-L166 PolarHBondContact OD1-N 3.3Å; N163-Q167 WeakPolarHBondContact O-CG 3.23Å; N163-Q167 PolarHBondContact O-N 3Å
164	T	86.2	Confident	87.6	Confident	44 Å²	44	44.7 Å²	44.7	27%	0.27	26%	0.261	S	S	.	.	H	α-helix	trans	-62.8	-31.7	-176.7	56.3	0	0	0	0	112.9	G162 N168 S193 A195	G162-T164 PolarHBondContact O-N 3.39Å; T164-N168 VanDerWaalsContact O-CB 3.26Å; T164-N168 WeakPolarHBondContact O-CB 3.31Å; T164-N168 PolarHBondContact O-N 3.46Å; T164-S193 WeakPolarHBondContact CG2-OG 3.44Å; T164-A195 HydrophobicContact CG2-CB 4.43Å
165	G	85.9	Confident	87.5	Confident	37 Å²	37	41.8 Å²	41.8	38%	0.381	25%	0.248	S	C	.	.	H	α-helix	trans	-67.2	-44.6	176.3	0	0	0	0	0	112.7	N163 N169	N163-G165 VanDerWaalsContact C-N 3.27Å; N163-G165 PolarHBondContact O-N 3Å; N163-G165 PolarHBondContact OD1-N 3.09Å; G165-N169 PolarHBondContact O-N 3.05Å
166	L	89.6	Confident	87.5	Confident	2 Å²	2	38.5 Å²	38.5	1%	0.01	25%	0.246	C	C	.	.	H	α-helix	trans	-61.8	-47.7	172.8	169.4	59.8	0	0	0	111.2	V133 L153 I156 N157 N163 N168 N169 L170	V133-L166 HydrophobicContact CG1-CB 4.36Å; V133-L166 HydrophobicContact CG1-CD1 3.9Å; V133-L166 HydrophobicContact CG2-CD1 4.28Å; V133-L166 HydrophobicContact CG2-CD2 4.14Å; L153-L166 HydrophobicContact CB-CD1 4.2Å; L153-L166 HydrophobicContact CD2-CD1 3.63Å; L153-L166 HydrophobicContact CG-CD1 4.45Å; I156-L166 HydrophobicContact CB-CD2 4.23Å; I156-L166 HydrophobicContact CG2-CD2 3.8Å; N157-L166 HydrophobicContact CB-CD2 3.8Å; N157-L166 HydrophobicContact CB-CG 4.26Å; N163-L166 HydrophobicContact CB-CB 3.99Å; N163-L166 PolarHBondContact O-N 3.22Å; N163-L166 PolarHBondContact OD1-N 3.3Å; L166-N168 PolarHBondContact O-N 2.86Å; L166-N169 PolarHBondContact O-N 2.78Å; L166-L170 VanDerWaalsContact O-CB 3.23Å; L166-L170 WeakPolarHBondContact O-CB 3.42Å; L166-L170 PolarHBondContact O-N 3.02Å
167	Q	92.7	Very high	87.6	Confident	1 Å²	1	39.2 Å²	39.2	1%	0.005	25%	0.254	C	S	.	.	H	α-helix	trans	-61	-43.5	-179	-73.3	169.1	-15.8	0	0	112.1	N157 P161 N163 L170 A171 V186 M190	N157-Q167 WeakPolarHBondContact OD1-CG 3.36Å; N157-Q167 PolarHBondContact OD1-NE2 2.93Å; N157-Q167 VanDerWaalsContact OD1-NE2 3.15Å; P161-Q167 PolarHBondContact O-NE2 2.79Å; N163-Q167 WeakPolarHBondContact O-CG 3.23Å; N163-Q167 PolarHBondContact O-N 3Å; Q167-L170 PolarHBondContact O-N 2.77Å; Q167-A171 WeakPolarHBondContact O-CB 3.46Å; Q167-A171 PolarHBondContact O-N 3.32Å; Q167-V186 HydrophobicContact CB-CG1 3.93Å; Q167-V186 HydrophobicContact CG-CG1 4.19Å; Q167-V186 VanDerWaalsContact O-CG1 3.31Å; Q167-V186 WeakPolarHBondContact O-CG1 3.32Å; Q167-M190 HydrophobicContact CB-CB 4.03Å; Q167-M190 HydrophobicContact CB-CG 4.12Å; Q167-M190 HydrophobicContact CB-SD 4.18Å; Q167-M190 VanDerWaalsContact OE1-CA 3.22Å
168	N	92.7	Very high	87.3	Confident	47 Å²	47	44.5 Å²	44.5	25%	0.251	28%	0.282	S	S	.	.	H	α-helix	trans	-56.2	-52.5	174.6	-177.8	97.3	0	0	0	111.6	T164 L166 A171 L172 M190 I203	T164-N168 VanDerWaalsContact O-CB 3.26Å; T164-N168 WeakPolarHBondContact O-CB 3.31Å; T164-N168 PolarHBondContact O-N 3.46Å; L166-N168 PolarHBondContact O-N 2.86Å; N168-A171 PolarHBondContact O-N 3.16Å; N168-L172 WeakPolarHBondContact O-CG 3.43Å; N168-L172 PolarHBondContact O-N 3.19Å; N168-M190 HydrophobicContact CB-CE 4.11Å; N168-M190 HydrophobicContact CB-SD 4.41Å; N168-I203 WeakPolarHBondContact OD1-CD1 3.4Å
169	N	90.7	Very high	87.4	Confident	74 Å²	74	44.3 Å²	44.3	40%	0.396	27%	0.267	S	S	.	.	H	α-helix	trans	-66.8	-40	-178.4	-70.2	-12	0	0	0	112.2	G165 L166 L172 L173	G165-N169 PolarHBondContact O-N 3.05Å; L166-N169 PolarHBondContact O-N 2.78Å; N169-L172 PolarHBondContact O-N 2.96Å; N169-L173 WeakPolarHBondContact O-CB 3.48Å; N169-L173 WeakPolarHBondContact O-CG 3.05Å; N169-L173 PolarHBondContact O-N 2.88Å
170	L	94.3	Very high	87.8	Confident	1 Å²	1	45.4 Å²	45.4	1%	0.005	26%	0.263	C	S	.	.	H	α-helix	trans	-64.8	-42.4	178.3	179.7	58	0	0	0	111.6	I150 L153 K154 N157 L166 Q167 L173 L174 V186	I150-L170 HydrophobicContact CG2-CD1 4.26Å; L153-L170 HydrophobicContact CB-CD1 3.93Å; K154-L170 HydrophobicContact CG-CD1 4.23Å; K154-L170 HydrophobicContact CG-CD2 4.08Å; N157-L170 HydrophobicContact CB-CD2 4.07Å; L166-L170 VanDerWaalsContact O-CB 3.23Å; L166-L170 WeakPolarHBondContact O-CB 3.42Å; L166-L170 PolarHBondContact O-N 3.02Å; Q167-L170 PolarHBondContact O-N 2.77Å; L170-L173 PolarHBondContact O-N 3.02Å; L170-L174 HydrophobicContact CD1-CD1 4.11Å; L170-L174 HydrophobicContact CD1-CG 4.26Å; L170-L174 HydrophobicContact CG-CD1 3.96Å; L170-L174 VanDerWaalsContact O-CG 3.27Å; L170-L174 WeakPolarHBondContact O-CG 3.41Å; L170-L174 PolarHBondContact O-N 3.27Å; L170-V186 HydrophobicContact CB-CG1 4.38Å; L170-V186 HydrophobicContact CD2-CG1 4.33Å; L170-V186 HydrophobicContact CD2-CG2 3.92Å; L170-V186 HydrophobicContact CG-CG1 4.41Å; L170-V186 HydrophobicContact CG-CG2 4.15Å
171	A	93.9	Very high	88.3	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-60.5	-47.5	176.3	0	0	0	0	0	111.5	Q167 N168 L173 L174 F175 V186 L187	Q167-A171 WeakPolarHBondContact O-CB 3.46Å; Q167-A171 PolarHBondContact O-N 3.32Å; N168-A171 PolarHBondContact O-N 3.16Å; A171-L173 VanDerWaalsContact C-N 3.33Å; A171-L173 PolarHBondContact O-N 2.94Å; A171-L174 PolarHBondContact O-N 3.32Å; A171-F175 HydrophobicContact CB-CE2 4.19Å; A171-F175 WeakPolarHBondContact O-CD2 3.41Å; A171-F175 PolarHBondContact O-N 2.77Å; A171-V186 HydrophobicContact CB-CB 4.43Å; A171-V186 HydrophobicContact CB-CG1 4.2Å; A171-L187 HydrophobicContact CB-CD2 3.49Å; A171-L187 VanDerWaalsContact CB-CD2 3.49Å; A171-L187 HydrophobicContact CB-CG 3.89Å
172	L	93.8	Very high	89.3	Confident	81 Å²	81	50 Å²	50	42%	0.424	28%	0.281	S	S	.	.	H	α-helix	trans	-61.4	-39	176.8	-67.9	173.7	0	0	0	112.6	N168 N169 S176 I203	N168-L172 WeakPolarHBondContact O-CG 3.43Å; N168-L172 PolarHBondContact O-N 3.19Å; N169-L172 PolarHBondContact O-N 2.96Å; L172-S176 WeakPolarHBondContact O-CB 3.4Å; L172-S176 PolarHBondContact O-N 2.81Å; L172-S176 PolarHBondContact O-OG 2.87Å; L172-I203 HydrophobicContact CD2-CD1 4.4Å; L172-I203 HydrophobicContact CD2-CG2 4.16Å; L172-I203 HydrophobicContact CG-CD1 4.36Å
173	L	93.1	Very high	90.2	Very high	29 Å²	29	47.6 Å²	47.6	15%	0.152	26%	0.256	C	S	.	.	H	α-helix	trans	-64.4	-38.5	174.6	-78.2	170.2	0	0	0	112.6	A140 I150 L153 N169 L170 A171 S176 S177	A140-L173 HydrophobicContact CB-CD1 3.73Å; A140-L173 HydrophobicContact CB-CD2 3.78Å; A140-L173 HydrophobicContact CB-CG 4.44Å; I150-L173 HydrophobicContact CG1-CB 4.34Å; L153-L173 HydrophobicContact CD1-CD1 3.7Å; N169-L173 WeakPolarHBondContact O-CB 3.48Å; N169-L173 WeakPolarHBondContact O-CG 3.05Å; N169-L173 PolarHBondContact O-N 2.88Å; L170-L173 PolarHBondContact O-N 3.02Å; A171-L173 VanDerWaalsContact C-N 3.33Å; A171-L173 PolarHBondContact O-N 2.94Å; L173-S176 WeakPolarHBondContact CA-OG 3.36Å; L173-S176 PolarHBondContact O-OG 3.38Å; L173-S176 VanDerWaalsContact O-OG 3.07Å; L173-S177 WeakPolarHBondContact O-CB 3.3Å; L173-S177 PolarHBondContact O-N 3.13Å; L173-S177 PolarHBondContact O-OG 3.47Å
174	L	94	Very high	90.7	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-68.7	-44	177.7	-72.6	164.5	0	0	0	111.5	I150 L170 A171 S177 D178 R179 E182 V186	I150-L174 HydrophobicContact CG2-CD2 3.59Å; I150-L174 HydrophobicContact CG2-CG 4.38Å; L170-L174 HydrophobicContact CD1-CD1 4.11Å; L170-L174 HydrophobicContact CD1-CG 4.26Å; L170-L174 HydrophobicContact CG-CD1 3.96Å; L170-L174 VanDerWaalsContact O-CG 3.27Å; L170-L174 WeakPolarHBondContact O-CG 3.41Å; L170-L174 PolarHBondContact O-N 3.27Å; A171-L174 PolarHBondContact O-N 3.32Å; L174-S177 CarbonylContact O-C 3.56Å; L174-S177 PolarHBondContact O-N 3.28Å; L174-S177 VanDerWaalsContact O-N 3.14Å; L174-D178 PolarHBondContact O-N 3.02Å; L174-R179 HydrophobicContact CB-CB 4.37Å; L174-R179 HydrophobicContact CD2-CB 3.87Å; L174-R179 PolarHBondContact O-N 3.17Å; L174-E182 HydrophobicContact CD1-CB 4Å; L174-E182 HydrophobicContact CD2-CB 3.92Å; L174-E182 HydrophobicContact CG-CB 4.46Å; L174-V186 HydrophobicContact CD1-CG2 3.77Å
175	F	91.9	Very high	91	Very high	21 Å²	21	47.7 Å²	47.7	9%	0.092	26%	0.261	C	S	.	.	H	α-helix	trans	-63.1	-44.4	175.9	-67.6	-54.8	0	0	0	112.3	A171 S177 D178 R180 F184 L187 I203 Q207	A171-F175 HydrophobicContact CB-CE2 4.19Å; A171-F175 WeakPolarHBondContact O-CD2 3.41Å; A171-F175 PolarHBondContact O-N 2.77Å; F175-S177 PolarHBondContact O-N 3.22Å; F175-S177 VanDerWaalsContact O-N 3.14Å; F175-D178 PolarHBondContact O-N 3.46Å; F175-D178 VanDerWaalsContact O-N 3.14Å; F175-R180 HydrophobicContact CD1-CB 4.4Å; F175-R180 HydrophobicContact CD1-CG 4.12Å; F175-R180 HydrophobicContact CE1-CB 4.41Å; F175-F184 HydrophobicContact CE1-CD1 4.31Å; F175-F184 HydrophobicContact CE1-CD2 4.08Å; F175-F184 HydrophobicContact CE1-CE1 4.2Å; F175-F184 AromaticContact CE1-CE2 3.97Å; F175-F184 HydrophobicContact CE1-CE2 3.97Å; F175-F184 HydrophobicContact CE1-CG 4.24Å; F175-F184 HydrophobicContact CE1-CZ 4.04Å; F175-F184 AromaticContact CZ-CD1 3.94Å; F175-F184 HydrophobicContact CZ-CD1 3.94Å; F175-F184 HydrophobicContact CZ-CD2 4.47Å; F175-F184 HydrophobicContact CZ-CE1 4.02Å; F175-F184 HydrophobicContact CZ-CG 4.18Å; F175-F184 HydrophobicContact CZ-CZ 4.32Å; F175-L187 HydrophobicContact CE2-CD1 3.82Å; F175-L187 HydrophobicContact CE2-CG 4.37Å; F175-L187 HydrophobicContact CZ-CD1 3.93Å; F175-I203 HydrophobicContact CD2-CG2 4.26Å; F175-I203 HydrophobicContact CE2-CG2 3.89Å; F175-Q207 HydrophobicContact CD1-CG 3.93Å; F175-Q207 HydrophobicContact CD2-CG 3.91Å; F175-Q207 HydrophobicContact CE1-CG 3.82Å; F175-Q207 HydrophobicContact CE2-CG 3.8Å; F175-Q207 HydrophobicContact CG-CG 4Å; F175-Q207 HydrophobicContact CZ-CG 3.76Å
176	S	89.9	Confident	91.3	Very high	72 Å²	72	46.4 Å²	46.4	50%	0.503	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-6.8	176.3	61.4	0	0	0	0	114.5	L172 L173	L172-S176 WeakPolarHBondContact O-CB 3.4Å; L172-S176 PolarHBondContact O-N 2.81Å; L172-S176 PolarHBondContact O-OG 2.87Å; L173-S176 WeakPolarHBondContact CA-OG 3.36Å; L173-S176 PolarHBondContact O-OG 3.38Å; L173-S176 VanDerWaalsContact O-OG 3.07Å
177	S	89.1	Confident	91.5	Very high	39 Å²	39	46.3 Å²	46.3	27%	0.273	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-110.3	15.2	175.3	-51.9	0	0	0	0	112.7	R146 I150 L173 L174 F175 R179	R146-S177 VanDerWaalsContact CD-OG 3.29Å; R146-S177 WeakPolarHBondContact CD-OG 3.48Å; I150-S177 WeakPolarHBondContact CD1-OG 3.42Å; L173-S177 WeakPolarHBondContact O-CB 3.3Å; L173-S177 PolarHBondContact O-N 3.13Å; L173-S177 PolarHBondContact O-OG 3.47Å; L174-S177 CarbonylContact O-C 3.56Å; L174-S177 PolarHBondContact O-N 3.28Å; L174-S177 VanDerWaalsContact O-N 3.14Å; F175-S177 PolarHBondContact O-N 3.22Å; F175-S177 VanDerWaalsContact O-N 3.14Å; S177-R179 PolarHBondContact O-N 3.47Å
178	D	83.4	Confident	91.5	Very high	119 Å²	119	50 Å²	50	64%	0.636	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.1	26.1	-176.6	-158	30.9	0	0	0	114.5	L174 F175 R180	L174-D178 PolarHBondContact O-N 3.02Å; F175-D178 PolarHBondContact O-N 3.46Å; F175-D178 VanDerWaalsContact O-N 3.14Å; D178-R180 PolarHBondContact O-N 3.3Å; D178-R180 IonicContact OD1-NE 3.67Å; D178-R180 IonicContact OD1-NH2 3.62Å
179	R	88.8	Confident	91.4	Very high	63 Å²	63	50.8 Å²	50.8	24%	0.238	26%	0.264	C	S	.	.			trans	-100.1	57.2	176.8	-66.3	170.8	68.2	172.6	2.7	110.2	I150 L174 S177 D181 E182 G183	I150-R179 VanDerWaalsContact CG2-NH1 3.3Å; L174-R179 HydrophobicContact CB-CB 4.37Å; L174-R179 HydrophobicContact CD2-CB 3.87Å; L174-R179 PolarHBondContact O-N 3.17Å; S177-R179 PolarHBondContact O-N 3.47Å; R179-D181 PolarHBondContact O-N 3.42Å; R179-E182 HydrophobicContact CB-CB 4.49Å; R179-E182 IonicContact CZ-OE1 2.68Å; R179-E182 IonicContact CZ-OE2 3.27Å; R179-E182 IonicContact NE-OE1 3.73Å; R179-E182 PolarHBondContact NE-OE1 3.41Å; R179-E182 IonicContact NE-OE2 2.94Å; R179-E182 IonicContact NH2-OE1 3.22Å; R179-E182 PolarHBondContact NH2-OE1 2.9Å; R179-E182 IonicContact NH2-OE2 3.93Å; R179-E182 PolarHBondContact NH2-OE2 3.48Å; R179-E182 PolarHBondContact O-N 3.26Å; R179-G183 PolarHBondContact O-N 2.94Å
180	R	87.2	Confident	91.4	Very high	129 Å²	129	47.6 Å²	47.6	49%	0.487	25%	0.247	S	C	.	.	H	α-helix	trans	-60.7	-45.7	-168.3	-69.3	-166.3	-112.4	-160.5	-3.5	114.3	F175 D178 E182 G183 F184	F175-R180 HydrophobicContact CD1-CB 4.4Å; F175-R180 HydrophobicContact CD1-CG 4.12Å; F175-R180 HydrophobicContact CE1-CB 4.41Å; D178-R180 PolarHBondContact O-N 3.3Å; D178-R180 IonicContact OD1-NE 3.67Å; D178-R180 IonicContact OD1-NH2 3.62Å; R180-E182 PolarHBondContact O-N 3.46Å; R180-G183 WeakPolarHBondContact O-CA 3.37Å; R180-G183 PolarHBondContact O-N 3.49Å; R180-F184 HydrophobicContact CB-CE2 4.32Å; R180-F184 WeakPolarHBondContact O-CD2 3.41Å; R180-F184 PolarHBondContact O-N 2.97Å
181	D	88.4	Confident	91.2	Very high	140 Å²	140	47.8 Å²	47.8	75%	0.749	25%	0.249	S	C	*	.	H	α-helix	trans	-59.8	-40	-178.3	-67.4	-26	0	0	0	111.6	R179 F184 A185	R179-D181 PolarHBondContact O-N 3.42Å; D181-F184 PolarHBondContact O-N 2.89Å; D181-A185 PolarHBondContact O-N 2.92Å
182	E	92.6	Very high	91	Very high	57 Å²	57	56 Å²	56	27%	0.266	29%	0.285	S	S	.	.	H	α-helix	trans	-68.2	-39.8	175	-62.3	-174.6	-109.8	0	0	111.7	K154 L174 R179 R180 F184 A185 V186	K154-E182 IonicContact NZ-OE2 3.56Å; K154-E182 PolarHBondContact NZ-OE2 3.21Å; L174-E182 HydrophobicContact CD1-CB 4Å; L174-E182 HydrophobicContact CD2-CB 3.92Å; L174-E182 HydrophobicContact CG-CB 4.46Å; R179-E182 HydrophobicContact CB-CB 4.49Å; R179-E182 IonicContact CZ-OE1 2.68Å; R179-E182 IonicContact CZ-OE2 3.27Å; R179-E182 IonicContact NE-OE1 3.73Å; R179-E182 PolarHBondContact NE-OE1 3.41Å; R179-E182 IonicContact NE-OE2 2.94Å; R179-E182 IonicContact NH2-OE1 3.22Å; R179-E182 PolarHBondContact NH2-OE1 2.9Å; R179-E182 IonicContact NH2-OE2 3.93Å; R179-E182 PolarHBondContact NH2-OE2 3.48Å; R179-E182 PolarHBondContact O-N 3.26Å; R180-E182 PolarHBondContact O-N 3.46Å; E182-F184 PolarHBondContact O-N 3.23Å; E182-A185 PolarHBondContact O-N 3.45Å; E182-V186 WeakPolarHBondContact O-CG2 3.49Å; E182-V186 PolarHBondContact O-N 3.06Å; E182-V186 VanDerWaalsContact O-N 3.09Å
183	G	92.7	Very high	90.5	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-58.1	-46.9	174.9	0	0	0	0	0	111.9	R179 R180 A185 V186 L187	R179-G183 PolarHBondContact O-N 2.94Å; R180-G183 WeakPolarHBondContact O-CA 3.37Å; R180-G183 PolarHBondContact O-N 3.49Å; G183-A185 PolarHBondContact O-N 3Å; G183-V186 PolarHBondContact O-N 3.33Å; G183-L187 WeakPolarHBondContact O-CG 3.32Å; G183-L187 PolarHBondContact O-N 3.43Å; G183-L187 VanDerWaalsContact O-N 3.12Å
184	F	93.6	Very high	89.9	Confident	33 Å²	33	59.6 Å²	59.6	15%	0.145	31%	0.307	C	S	.	.	H	α-helix	trans	-64.5	-37.2	176	-72	-60.1	0	0	0	112.9	F175 R180 D181 E182 V186 L187 E188 W204 Q207	F175-F184 HydrophobicContact CE1-CD1 4.31Å; F175-F184 HydrophobicContact CE1-CD2 4.08Å; F175-F184 HydrophobicContact CE1-CE1 4.2Å; F175-F184 AromaticContact CE1-CE2 3.97Å; F175-F184 HydrophobicContact CE1-CE2 3.97Å; F175-F184 HydrophobicContact CE1-CG 4.24Å; F175-F184 HydrophobicContact CE1-CZ 4.04Å; F175-F184 AromaticContact CZ-CD1 3.94Å; F175-F184 HydrophobicContact CZ-CD1 3.94Å; F175-F184 HydrophobicContact CZ-CD2 4.47Å; F175-F184 HydrophobicContact CZ-CE1 4.02Å; F175-F184 HydrophobicContact CZ-CG 4.18Å; F175-F184 HydrophobicContact CZ-CZ 4.32Å; R180-F184 HydrophobicContact CB-CE2 4.32Å; R180-F184 WeakPolarHBondContact O-CD2 3.41Å; R180-F184 PolarHBondContact O-N 2.97Å; D181-F184 PolarHBondContact O-N 2.89Å; E182-F184 PolarHBondContact O-N 3.23Å; F184-V186 VanDerWaalsContact C-N 3.32Å; F184-V186 PolarHBondContact O-N 3.16Å; F184-L187 HydrophobicContact CD1-CD1 4.42Å; F184-L187 PolarHBondContact O-N 3.01Å; F184-E188 WeakPolarHBondContact O-CB 3.43Å; F184-E188 PolarHBondContact O-N 3.37Å; F184-W204 HydrophobicContact CB-CH2 4.05Å; F184-W204 HydrophobicContact CB-CZ2 4.13Å; F184-W204 HydrophobicContact CB-CZ3 4.49Å; F184-W204 AromaticContact CD1-CD1 3.92Å; F184-W204 AromaticContact CD1-CD2 3.61Å; F184-W204 HydrophobicContact CD1-CD2 3.61Å; F184-W204 AromaticContact CD1-CE2 3.36Å; F184-W204 HydrophobicContact CD1-CE3 4.16Å; F184-W204 AromaticContact CD1-CG 3.95Å; F184-W204 HydrophobicContact CD1-CG 3.95Å; F184-W204 HydrophobicContact CD1-CH2 4.21Å; F184-W204 AromaticContact CD1-CZ2 3.69Å; F184-W204 HydrophobicContact CD1-CZ2 3.69Å; F184-W204 HydrophobicContact CD1-CZ3 4.43Å; F184-W204 AromaticContact CD1-NE1 3.58Å; F184-W204 AromaticContact CE1-CD1 3.54Å; F184-W204 HydrophobicContact CE1-CD2 4.04Å; F184-W204 AromaticContact CE1-CE2 3.78Å; F184-W204 AromaticContact CE1-CG 3.89Å; F184-W204 HydrophobicContact CE1-CG 3.89Å; F184-W204 HydrophobicContact CE1-CZ2 4.45Å; F184-W204 AromaticContact CE1-NE1 3.46Å; F184-W204 HydrophobicContact CG-CZ2 4.15Å; F184-W204 WeakPolarHBondContact O-CZ3 3.44Å; F184-Q207 HydrophobicContact CE1-CB 4.06Å; F184-Q207 HydrophobicContact CZ-CB 3.8Å
185	A	92.7	Very high	89.4	Confident	56 Å²	56	63.8 Å²	63.8	46%	0.463	34%	0.342	S	S	.	.	H	α-helix	trans	-62.6	-38.2	175.9	0	0	0	0	0	112.5	D181 E182 G183 E188 Q189	D181-A185 PolarHBondContact O-N 2.92Å; E182-A185 PolarHBondContact O-N 3.45Å; G183-A185 PolarHBondContact O-N 3Å; A185-E188 PolarHBondContact O-N 2.9Å; A185-Q189 PolarHBondContact O-N 2.91Å; A185-Q189 VanDerWaalsContact O-N 3.09Å
186	V	92.8	Very high	89.1	Confident	10 Å²	10	62.8 Å²	62.8	6%	0.061	34%	0.337	C	S	.	.	H	α-helix	trans	-66.9	-42.7	175.1	174.7	0	0	0	0	111.1	Q167 L170 A171 L174 E182 G183 F184 E188 Q189 M190	Q167-V186 HydrophobicContact CB-CG1 3.93Å; Q167-V186 HydrophobicContact CG-CG1 4.19Å; Q167-V186 VanDerWaalsContact O-CG1 3.31Å; Q167-V186 WeakPolarHBondContact O-CG1 3.32Å; L170-V186 HydrophobicContact CB-CG1 4.38Å; L170-V186 HydrophobicContact CD2-CG1 4.33Å; L170-V186 HydrophobicContact CD2-CG2 3.92Å; L170-V186 HydrophobicContact CG-CG1 4.41Å; L170-V186 HydrophobicContact CG-CG2 4.15Å; A171-V186 HydrophobicContact CB-CB 4.43Å; A171-V186 HydrophobicContact CB-CG1 4.2Å; L174-V186 HydrophobicContact CD1-CG2 3.77Å; E182-V186 WeakPolarHBondContact O-CG2 3.49Å; E182-V186 PolarHBondContact O-N 3.06Å; E182-V186 VanDerWaalsContact O-N 3.09Å; G183-V186 PolarHBondContact O-N 3.33Å; F184-V186 VanDerWaalsContact C-N 3.32Å; F184-V186 PolarHBondContact O-N 3.16Å; V186-E188 VanDerWaalsContact C-N 3.3Å; V186-E188 PolarHBondContact O-N 2.83Å; V186-Q189 WeakPolarHBondContact O-CB 3.36Å; V186-Q189 PolarHBondContact O-N 3.42Å; V186-M190 PolarHBondContact O-N 3.14Å
187	L	93.8	Very high	89	Confident	0 Å²	0	63 Å²	63	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-63.9	-35.9	175.6	-64.7	-177	0	0	0	112.4	A171 F175 G183 F184 Q189 M190 A191 A200 I203 W204	A171-L187 HydrophobicContact CB-CD2 3.49Å; A171-L187 VanDerWaalsContact CB-CD2 3.49Å; A171-L187 HydrophobicContact CB-CG 3.89Å; F175-L187 HydrophobicContact CE2-CD1 3.82Å; F175-L187 HydrophobicContact CE2-CG 4.37Å; F175-L187 HydrophobicContact CZ-CD1 3.93Å; G183-L187 WeakPolarHBondContact O-CG 3.32Å; G183-L187 PolarHBondContact O-N 3.43Å; G183-L187 VanDerWaalsContact O-N 3.12Å; F184-L187 HydrophobicContact CD1-CD1 4.42Å; F184-L187 PolarHBondContact O-N 3.01Å; L187-Q189 VanDerWaalsContact C-N 3.31Å; L187-M190 HydrophobicContact CD2-SD 4.39Å; L187-M190 WeakPolarHBondContact O-CB 3.44Å; L187-M190 PolarHBondContact O-N 3.2Å; L187-A191 WeakPolarHBondContact O-CB 3.37Å; L187-A191 PolarHBondContact O-N 2.76Å; L187-A200 HydrophobicContact CB-CB 4.44Å; L187-A200 HydrophobicContact CD2-CB 4.45Å; L187-I203 HydrophobicContact CD1-CB 4.09Å; L187-I203 HydrophobicContact CD1-CG2 3.83Å; L187-I203 HydrophobicContact CD2-CB 4.06Å; L187-I203 HydrophobicContact CD2-CD1 4.25Å; L187-I203 HydrophobicContact CD2-CG2 4.09Å; L187-W204 HydrophobicContact CB-CE3 3.6Å; L187-W204 HydrophobicContact CB-CZ3 3.96Å; L187-W204 HydrophobicContact CD1-CB 3.85Å; L187-W204 HydrophobicContact CD1-CD2 4.4Å; L187-W204 HydrophobicContact CD1-CE3 4.12Å; L187-W204 HydrophobicContact CD1-CG 4.35Å
188	E	92.7	Very high	89	Confident	78 Å²	78	67.2 Å²	67.2	36%	0.364	34%	0.342	S	S	.	.	H	α-helix	trans	-64.8	-38.3	175.3	-169.7	172	174	0	0	111.1	F184 A185 V186 A191 W204 I227	F184-E188 WeakPolarHBondContact O-CB 3.43Å; F184-E188 PolarHBondContact O-N 3.37Å; A185-E188 PolarHBondContact O-N 2.9Å; V186-E188 VanDerWaalsContact C-N 3.3Å; V186-E188 PolarHBondContact O-N 2.83Å; E188-A191 PolarHBondContact O-N 3.29Å; E188-W204 HydrophobicContact CB-CH2 4.27Å; E188-W204 HydrophobicContact CB-CZ3 3.93Å; E188-I227 HydrophobicContact CG-CD1 4.33Å
189	Q	90.6	Very high	89.3	Confident	64 Å²	64	62.7 Å²	62.7	30%	0.299	32%	0.324	S	S	.	.	H	α-helix	trans	-63.7	-46.2	171.8	-130	-176.8	-4.5	0	0	111.4	N157 A185 V186 L187 A191 K192	N157-Q189 PolarHBondContact ND2-OE1 3.31Å; A185-Q189 PolarHBondContact O-N 2.91Å; A185-Q189 VanDerWaalsContact O-N 3.09Å; V186-Q189 WeakPolarHBondContact O-CB 3.36Å; V186-Q189 PolarHBondContact O-N 3.42Å; L187-Q189 VanDerWaalsContact C-N 3.31Å; Q189-A191 VanDerWaalsContact C-N 3.28Å; Q189-A191 PolarHBondContact O-N 3.29Å; Q189-K192 WeakPolarHBondContact O-CB 3.09Å; Q189-K192 PolarHBondContact O-N 2.86Å
190	M	90.9	Very high	89.4	Confident	8 Å²	8	59.7 Å²	59.7	4%	0.039	31%	0.313	C	S	.	.	H	α-helix	trans	-60.8	-36.6	178	-171.6	-178.4	173.7	0	0	112.4	Q167 N168 V186 L187 K192 S193 G196 A200	Q167-M190 HydrophobicContact CB-CB 4.03Å; Q167-M190 HydrophobicContact CB-CG 4.12Å; Q167-M190 HydrophobicContact CB-SD 4.18Å; Q167-M190 VanDerWaalsContact OE1-CA 3.22Å; N168-M190 HydrophobicContact CB-CE 4.11Å; N168-M190 HydrophobicContact CB-SD 4.41Å; V186-M190 PolarHBondContact O-N 3.14Å; L187-M190 HydrophobicContact CD2-SD 4.39Å; L187-M190 WeakPolarHBondContact O-CB 3.44Å; L187-M190 PolarHBondContact O-N 3.2Å; M190-K192 PolarHBondContact O-N 3.19Å; M190-S193 PolarHBondContact O-N 2.92Å; M190-S193 VanDerWaalsContact O-N 3.16Å; M190-S193 PolarHBondContact O-OG 3.5Å; M190-G196 WeakPolarHBondContact CE-O 3.45Å; M190-G196 CarbonylContact O-C 3.16Å; M190-A200 HydrophobicContact CB-CB 4.07Å; M190-A200 HydrophobicContact CG-CB 4.04Å; M190-A200 HydrophobicContact SD-CB 4.01Å
191	A	90.3	Very high	89.7	Confident	5 Å²	5	53.8 Å²	53.8	4%	0.041	29%	0.291	C	S	.	.	H	α-helix	trans	-68.2	-17.3	179.3	0	0	0	0	0	114.5	L187 E188 Q189 S193 A200 I227 F228	L187-A191 WeakPolarHBondContact O-CB 3.37Å; L187-A191 PolarHBondContact O-N 2.76Å; E188-A191 PolarHBondContact O-N 3.29Å; Q189-A191 VanDerWaalsContact C-N 3.28Å; Q189-A191 PolarHBondContact O-N 3.29Å; A191-S193 VanDerWaalsContact C-N 3.26Å; A191-S193 PolarHBondContact O-N 2.98Å; A191-A200 HydrophobicContact CB-CB 4.2Å; A191-I227 HydrophobicContact CB-CG2 4.11Å; A191-F228 HydrophobicContact CB-CE1 3.74Å; A191-F228 HydrophobicContact CB-CZ 3.86Å
192	K	87.8	Confident	89.9	Confident	171 Å²	171	52.5 Å²	52.5	74%	0.743	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.1	-23	173	-64	175.9	-178.8	179	0	112.4	Q189 M190	Q189-K192 WeakPolarHBondContact O-CB 3.09Å; Q189-K192 PolarHBondContact O-N 2.86Å; M190-K192 PolarHBondContact O-N 3.19Å
193	S	84	Confident	89.9	Confident	31 Å²	31	51 Å²	51	22%	0.217	27%	0.273	C	S	.	.	S	Bend	trans	-90.8	135.9	176	76.4	0	0	0	0	110.6	T164 M190 A191 A195 G196 R197	T164-S193 WeakPolarHBondContact CG2-OG 3.44Å; M190-S193 PolarHBondContact O-N 2.92Å; M190-S193 VanDerWaalsContact O-N 3.16Å; M190-S193 PolarHBondContact O-OG 3.5Å; A191-S193 VanDerWaalsContact C-N 3.26Å; A191-S193 PolarHBondContact O-N 2.98Å; S193-A195 PolarHBondContact O-N 2.85Å; S193-G196 PolarHBondContact O-N 2.91Å; S193-G196 WeakPolarHBondContact OG-CA 3.25Å; S193-G196 PolarHBondContact OG-N 3.3Å; S193-R197 PolarHBondContact O-N 2.89Å
194	N	81.5	Confident	90	Very high	156 Å²	156	51.2 Å²	51.2	83%	0.834	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-34.3	178.8	-143.9	41.3	0	0	0	111.6
195	A	82	Confident	89.9	Confident	88 Å²	88	51.1 Å²	51.1	73%	0.727	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.7	-29.3	177.4	0	0	0	0	0	113.7	T164 S193	T164-A195 HydrophobicContact CG2-CB 4.43Å; S193-A195 PolarHBondContact O-N 2.85Å
196	G	85.3	Confident	89.9	Confident	0 Å²	0	50 Å²	50	0%	0	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.3	-17.7	-178.8	0	0	0	0	0	114.4	M190 S193 E198 G199 A200	M190-G196 WeakPolarHBondContact CE-O 3.45Å; M190-G196 CarbonylContact O-C 3.16Å; S193-G196 PolarHBondContact O-N 2.91Å; S193-G196 WeakPolarHBondContact OG-CA 3.25Å; S193-G196 PolarHBondContact OG-N 3.3Å; G196-E198 PolarHBondContact O-N 3.35Å; G196-G199 PolarHBondContact O-N 3.33Å; G196-A200 WeakPolarHBondContact O-CB 3.43Å; G196-A200 PolarHBondContact O-N 3.06Å
197	R	89.5	Confident	89.8	Confident	77 Å²	77	52.7 Å²	52.7	29%	0.291	28%	0.278	S	S	.	.	H	α-helix	trans	-56.5	-44.9	-172.7	-166.7	-179.4	-178.7	102.9	-5.2	113.6	S193 S201 I227 F228 S229 D230	S193-R197 PolarHBondContact O-N 2.89Å; R197-S201 WeakPolarHBondContact O-CB 3.42Å; R197-S201 PolarHBondContact O-N 2.93Å; R197-I227 PolarHBondContact NH2-O 2.83Å; R197-F228 HydrophobicContact CG-CD1 4.21Å; R197-F228 HydrophobicContact CG-CE1 4.21Å; R197-F228 WeakPolarHBondContact O-CE1 3.41Å; R197-S229 PolarHBondContact NH2-OG 2.86Å; R197-S229 VanDerWaalsContact NH2-OG 3.12Å; R197-D230 IonicContact NE-OD1 3.88Å
198	E	88.2	Confident	89.6	Confident	126 Å²	126	52.7 Å²	52.7	59%	0.589	28%	0.278	S	S	*	.	H	α-helix	trans	-67.1	-45.8	-179.4	-166.1	-166.2	149.5	0	0	112.2	G196 S201 K202	G196-E198 PolarHBondContact O-N 3.35Å; E198-S201 WeakPolarHBondContact O-CB 3.38Å; E198-S201 PolarHBondContact O-N 3.46Å; E198-K202 PolarHBondContact O-N 3.14Å; E198-K202 VanDerWaalsContact O-N 3.12Å; E198-K202 WeakPolarHBondContact OE1-CE 3.19Å; E198-K202 IonicContact OE1-NZ 2.88Å; E198-K202 PolarHBondContact OE1-NZ 3.11Å
199	G	89	Confident	89.3	Confident	25 Å²	25	55.1 Å²	55.1	26%	0.258	29%	0.287	S	S	.	.	H	α-helix	trans	-62.9	-42.5	176.9	0	0	0	0	0	112.2	G196 S201 K202 I203	G196-G199 PolarHBondContact O-N 3.33Å; G199-S201 VanDerWaalsContact C-N 3.34Å; G199-S201 PolarHBondContact O-N 2.79Å; G199-K202 PolarHBondContact O-N 3.14Å; G199-I203 WeakPolarHBondContact O-CG1 3.36Å; G199-I203 PolarHBondContact O-N 3.06Å; G199-I203 VanDerWaalsContact O-N 3.15Å
200	A	92.3	Very high	88.8	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-60.8	-43.7	175.6	0	0	0	0	0	111.8	L187 M190 A191 G196 K202 I203 W204 F228	L187-A200 HydrophobicContact CB-CB 4.44Å; L187-A200 HydrophobicContact CD2-CB 4.45Å; M190-A200 HydrophobicContact CB-CB 4.07Å; M190-A200 HydrophobicContact CG-CB 4.04Å; M190-A200 HydrophobicContact SD-CB 4.01Å; A191-A200 HydrophobicContact CB-CB 4.2Å; G196-A200 WeakPolarHBondContact O-CB 3.43Å; G196-A200 PolarHBondContact O-N 3.06Å; A200-K202 PolarHBondContact O-N 3.35Å; A200-I203 PolarHBondContact O-N 2.95Å; A200-W204 WeakPolarHBondContact O-CB 3.49Å; A200-W204 PolarHBondContact O-N 2.96Å; A200-F228 HydrophobicContact CB-CE1 4.18Å; A200-F228 HydrophobicContact CB-CZ 3.96Å
201	S	93.7	Very high	88.5	Confident	5 Å²	5	60.4 Å²	60.4	4%	0.035	32%	0.317	C	S	.	.	H	α-helix	trans	-59.9	-45.8	178.9	-170	0	0	0	0	112.2	R197 E198 G199 W204 Y205 Y224 S233	R197-S201 WeakPolarHBondContact O-CB 3.42Å; R197-S201 PolarHBondContact O-N 2.93Å; E198-S201 WeakPolarHBondContact O-CB 3.38Å; E198-S201 PolarHBondContact O-N 3.46Å; G199-S201 VanDerWaalsContact C-N 3.34Å; G199-S201 PolarHBondContact O-N 2.79Å; S201-W204 PolarHBondContact O-N 3.37Å; S201-Y205 WeakPolarHBondContact O-CB 3.36Å; S201-Y205 PolarHBondContact O-N 3.22Å; S201-Y224 WeakPolarHBondContact O-CE2 3.5Å; S201-Y224 PolarHBondContact OG-OH 3.49Å; S201-S233 PolarHBondContact OG-OG 3.43Å; S201-S233 VanDerWaalsContact OG-OG 3.09Å
202	K	91.6	Very high	88.1	Confident	113 Å²	113	63.8 Å²	63.8	49%	0.491	34%	0.339	S	S	.	.	H	α-helix	trans	-63.3	-47.4	178.8	-75.5	172	174.5	167.4	0	112.5	E198 G199 A200 G206	E198-K202 PolarHBondContact O-N 3.14Å; E198-K202 VanDerWaalsContact O-N 3.12Å; E198-K202 WeakPolarHBondContact OE1-CE 3.19Å; E198-K202 IonicContact OE1-NZ 2.88Å; E198-K202 PolarHBondContact OE1-NZ 3.11Å; G199-K202 PolarHBondContact O-N 3.14Å; A200-K202 PolarHBondContact O-N 3.35Å; K202-G206 PolarHBondContact O-N 3.48Å
203	I	92.4	Very high	88	Confident	25 Å²	25	57.3 Å²	57.3	13%	0.128	31%	0.313	C	S	.	.	H	α-helix	trans	-66.1	-45.1	178.7	-61.7	172.7	0	0	0	110.2	N168 L172 F175 L187 G199 A200 Y205 G206 Q207	N168-I203 WeakPolarHBondContact OD1-CD1 3.4Å; L172-I203 HydrophobicContact CD2-CD1 4.4Å; L172-I203 HydrophobicContact CD2-CG2 4.16Å; L172-I203 HydrophobicContact CG-CD1 4.36Å; F175-I203 HydrophobicContact CD2-CG2 4.26Å; F175-I203 HydrophobicContact CE2-CG2 3.89Å; L187-I203 HydrophobicContact CD1-CB 4.09Å; L187-I203 HydrophobicContact CD1-CG2 3.83Å; L187-I203 HydrophobicContact CD2-CB 4.06Å; L187-I203 HydrophobicContact CD2-CD1 4.25Å; L187-I203 HydrophobicContact CD2-CG2 4.09Å; G199-I203 WeakPolarHBondContact O-CG1 3.36Å; G199-I203 PolarHBondContact O-N 3.06Å; G199-I203 VanDerWaalsContact O-N 3.15Å; A200-I203 PolarHBondContact O-N 2.95Å; I203-Y205 PolarHBondContact O-N 3.35Å; I203-G206 PolarHBondContact O-N 2.7Å; I203-Q207 WeakPolarHBondContact O-CG 3.49Å; I203-Q207 PolarHBondContact O-N 3.43Å; I203-Q207 VanDerWaalsContact O-N 3.13Å
204	W	94.4	Very high	88.1	Confident	4 Å²	4	56.3 Å²	56.3	2%	0.015	31%	0.306	C	S	.	.	H	α-helix	trans	-58.8	-51	-179.1	-163.3	-50.8	0	0	0	110.9	F184 L187 E188 A200 S201 G206 Q207 I208 K223 Y224 I227 F228	F184-W204 HydrophobicContact CB-CH2 4.05Å; F184-W204 HydrophobicContact CB-CZ2 4.13Å; F184-W204 HydrophobicContact CB-CZ3 4.49Å; F184-W204 AromaticContact CD1-CD1 3.92Å; F184-W204 AromaticContact CD1-CD2 3.61Å; F184-W204 HydrophobicContact CD1-CD2 3.61Å; F184-W204 AromaticContact CD1-CE2 3.36Å; F184-W204 HydrophobicContact CD1-CE3 4.16Å; F184-W204 AromaticContact CD1-CG 3.95Å; F184-W204 HydrophobicContact CD1-CG 3.95Å; F184-W204 HydrophobicContact CD1-CH2 4.21Å; F184-W204 AromaticContact CD1-CZ2 3.69Å; F184-W204 HydrophobicContact CD1-CZ2 3.69Å; F184-W204 HydrophobicContact CD1-CZ3 4.43Å; F184-W204 AromaticContact CD1-NE1 3.58Å; F184-W204 AromaticContact CE1-CD1 3.54Å; F184-W204 HydrophobicContact CE1-CD2 4.04Å; F184-W204 AromaticContact CE1-CE2 3.78Å; F184-W204 AromaticContact CE1-CG 3.89Å; F184-W204 HydrophobicContact CE1-CG 3.89Å; F184-W204 HydrophobicContact CE1-CZ2 4.45Å; F184-W204 AromaticContact CE1-NE1 3.46Å; F184-W204 HydrophobicContact CG-CZ2 4.15Å; F184-W204 WeakPolarHBondContact O-CZ3 3.44Å; L187-W204 HydrophobicContact CB-CE3 3.6Å; L187-W204 HydrophobicContact CB-CZ3 3.96Å; L187-W204 HydrophobicContact CD1-CB 3.85Å; L187-W204 HydrophobicContact CD1-CD2 4.4Å; L187-W204 HydrophobicContact CD1-CE3 4.12Å; L187-W204 HydrophobicContact CD1-CG 4.35Å; E188-W204 HydrophobicContact CB-CH2 4.27Å; E188-W204 HydrophobicContact CB-CZ3 3.93Å; A200-W204 WeakPolarHBondContact O-CB 3.49Å; A200-W204 PolarHBondContact O-N 2.96Å; S201-W204 PolarHBondContact O-N 3.37Å; W204-G206 VanDerWaalsContact C-N 3.32Å; W204-G206 PolarHBondContact O-N 3.37Å; W204-Q207 PolarHBondContact O-N 2.94Å; W204-I208 VanDerWaalsContact CD1-CD1 3.45Å; W204-I208 PolarHBondContact O-N 2.98Å; W204-K223 HydrophobicContact CZ2-CD 4.18Å; W204-K223 HydrophobicContact CZ2-CG 4.2Å; W204-Y224 HydrophobicContact CB-CD2 3.97Å; W204-Y224 HydrophobicContact CB-CE2 4.2Å; W204-Y224 AromaticContact CD1-CD2 3.58Å; W204-Y224 AromaticContact CG-CD2 3.76Å; W204-Y224 HydrophobicContact CG-CD2 3.76Å; W204-Y224 HydrophobicContact CG-CE2 4.46Å; W204-I227 HydrophobicContact CH2-CD1 3.3Å; W204-I227 HydrophobicContact CZ2-CD1 3.79Å; W204-I227 HydrophobicContact CZ3-CD1 3.76Å; W204-F228 HydrophobicContact CB-CE2 4.11Å; W204-F228 AromaticContact CD2-CE2 3.97Å; W204-F228 HydrophobicContact CD2-CE2 3.97Å; W204-F228 AromaticContact CE3-CE2 3.78Å; W204-F228 HydrophobicContact CE3-CE2 3.78Å; W204-F228 HydrophobicContact CE3-CZ 4.18Å; W204-F228 HydrophobicContact CG-CE2 4.13Å
205	Y	93.4	Very high	88.3	Confident	31 Å²	31	51.8 Å²	51.8	12%	0.122	28%	0.282	C	S	.	.	H	α-helix	trans	-64.4	-37.8	179.5	-176.6	-115.1	0	0	0	112.2	S201 I203 Q207 I208 K209 L221 Y224 A236 A237 Q240	S201-Y205 WeakPolarHBondContact O-CB 3.36Å; S201-Y205 PolarHBondContact O-N 3.22Å; I203-Y205 PolarHBondContact O-N 3.35Å; Y205-Q207 PolarHBondContact O-N 3.48Å; Y205-I208 PolarHBondContact O-N 3.23Å; Y205-K209 PolarHBondContact O-N 3.47Å; Y205-L221 HydrophobicContact CE2-CD2 4.19Å; Y205-Y224 HydrophobicContact CD2-CE1 4.39Å; Y205-A236 HydrophobicContact CE1-CB 3.95Å; Y205-A236 WeakPolarHBondContact OH-CB 3.44Å; Y205-A237 HydrophobicContact CD2-CB 3.84Å; Y205-A237 HydrophobicContact CE2-CB 3.6Å; Y205-Q240 PolarHBondContact OH-OE1 2.65Å; Y205-Q240 VanDerWaalsContact OH-OE1 3.07Å
206	G	91.3	Very high	88.4	Confident	32 Å²	32	50.4 Å²	50.4	33%	0.33	27%	0.27	S	S	.	.	H	α-helix	trans	-55.4	-38.4	173.8	0	0	0	0	0	113.2	K202 I203 W204 I208	K202-G206 PolarHBondContact O-N 3.48Å; I203-G206 PolarHBondContact O-N 2.7Å; W204-G206 VanDerWaalsContact C-N 3.32Å; W204-G206 PolarHBondContact O-N 3.37Å; G206-I208 VanDerWaalsContact C-N 3.31Å; G206-I208 PolarHBondContact O-N 3.27Å
207	Q	90.2	Very high	88.5	Confident	67 Å²	67	50.4 Å²	50.4	31%	0.313	27%	0.27	S	S	.	.	H	α-helix	trans	-71.8	-22.6	176.1	-62.8	-57.6	-53.9	0	0	113.8	F175 F184 I203 W204 Y205	F175-Q207 HydrophobicContact CD1-CG 3.93Å; F175-Q207 HydrophobicContact CD2-CG 3.91Å; F175-Q207 HydrophobicContact CE1-CG 3.82Å; F175-Q207 HydrophobicContact CE2-CG 3.8Å; F175-Q207 HydrophobicContact CG-CG 4Å; F175-Q207 HydrophobicContact CZ-CG 3.76Å; F184-Q207 HydrophobicContact CE1-CB 4.06Å; F184-Q207 HydrophobicContact CZ-CB 3.8Å; I203-Q207 WeakPolarHBondContact O-CG 3.49Å; I203-Q207 PolarHBondContact O-N 3.43Å; I203-Q207 VanDerWaalsContact O-N 3.13Å; W204-Q207 PolarHBondContact O-N 2.94Å; Y205-Q207 PolarHBondContact O-N 3.48Å
208	I	90.6	Very high	88.5	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-89.5	-35.4	179.9	-59	174.2	0	0	0	111.4	W204 Y205 G206 D210 M211 A220 L221 Y224	W204-I208 VanDerWaalsContact CD1-CD1 3.45Å; W204-I208 PolarHBondContact O-N 2.98Å; Y205-I208 PolarHBondContact O-N 3.23Å; G206-I208 VanDerWaalsContact C-N 3.31Å; G206-I208 PolarHBondContact O-N 3.27Å; I208-D210 PolarHBondContact O-N 3.46Å; I208-M211 HydrophobicContact CB-SD 4.45Å; I208-M211 HydrophobicContact CG2-SD 4.21Å; I208-M211 VanDerWaalsContact O-CB 3.3Å; I208-M211 WeakPolarHBondContact O-CB 3.49Å; I208-M211 WeakPolarHBondContact O-CG 3.19Å; I208-M211 PolarHBondContact O-N 3.26Å; I208-A220 HydrophobicContact CD1-CB 3.99Å; I208-A220 WeakPolarHBondContact CD1-O 3.3Å; I208-A220 HydrophobicContact CG1-CB 3.99Å; I208-A220 HydrophobicContact CG2-CB 4.12Å; I208-L221 HydrophobicContact CG2-CD2 3.65Å; I208-L221 HydrophobicContact CG2-CG 3.73Å; I208-Y224 HydrophobicContact CD1-CG 4.2Å
209	K	86	Confident	88.6	Confident	129 Å²	129	44.8 Å²	44.8	56%	0.561	26%	0.257	S	S	*	.	H	α-helix	trans	-54.2	-39.4	-173.3	-177.1	-176.6	171.9	-174.4	0	113	Y205 M211	Y205-K209 PolarHBondContact O-N 3.47Å; K209-M211 VanDerWaalsContact C-N 3.32Å
210	D	80.2	Confident	88.7	Confident	137 Å²	137	44.6 Å²	44.6	73%	0.733	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.8	3.4	-176.4	-59.6	-26.4	0	0	0	113.2	I208	I208-D210 PolarHBondContact O-N 3.46Å
211	M	83.9	Confident	88.7	Confident	47 Å²	47	44.6 Å²	44.6	23%	0.232	25%	0.253	C	S	.	.	S	Bend	trans	-72.4	135.7	176.3	-65.4	179.1	67.8	0	0	111	I208 K209 A216 A220	I208-M211 HydrophobicContact CB-SD 4.45Å; I208-M211 HydrophobicContact CG2-SD 4.21Å; I208-M211 VanDerWaalsContact O-CB 3.3Å; I208-M211 WeakPolarHBondContact O-CB 3.49Å; I208-M211 WeakPolarHBondContact O-CG 3.19Å; I208-M211 PolarHBondContact O-N 3.26Å; K209-M211 VanDerWaalsContact C-N 3.32Å; M211-A216 HydrophobicContact CE-CB 4.28Å; M211-A220 HydrophobicContact CE-CB 4.37Å; M211-A220 HydrophobicContact SD-CB 3.97Å
212	P	83.3	Confident	88.7	Confident	76 Å²	76	49.6 Å²	49.6	49%	0.494	27%	0.274	S	S	.	.			trans	-63.5	146.4	172.3	27.6	-34.2	0	0	0	110.8	S214 S217 A261	P212-S214 PolarHBondContact O-N 2.98Å; P212-S214 VanDerWaalsContact O-N 3.09Å; P212-S214 PolarHBondContact O-OG 3.43Å; P212-S217 PolarHBondContact O-OG 2.84Å; P212-A261 HydrophobicContact CB-CB 4.32Å; P212-A261 HydrophobicContact CG-CB 3.84Å
213	V	85.6	Confident	88.8	Confident	34 Å²	34	49.1 Å²	49.1	21%	0.206	27%	0.271	C	S	.	.	S	Bend	trans	-58.1	114.7	-179.3	-178.9	0	0	0	0	109.9	Q244 L248 F253 A257	V213-Q244 HydrophobicContact CB-CG 4.46Å; V213-Q244 HydrophobicContact CG1-CB 4.11Å; V213-Q244 HydrophobicContact CG1-CG 3.96Å; V213-Q244 HydrophobicContact CG2-CG 4.03Å; V213-L248 HydrophobicContact CG1-CD1 4.19Å; V213-L248 HydrophobicContact CG1-CD2 4.08Å; V213-L248 HydrophobicContact CG1-CG 3.9Å; V213-F253 HydrophobicContact CG1-CE1 4.18Å; V213-A257 WeakPolarHBondContact O-CB 3.42Å
214	S	85.2	Confident	88.9	Confident	11 Å²	11	47.9 Å²	47.9	8%	0.077	27%	0.265	C	S	.	.	S	Bend	trans	-161.6	169.5	-175.1	58.5	0	0	0	0	110.8	P212 A216 S217 V218	P212-S214 PolarHBondContact O-N 2.98Å; P212-S214 VanDerWaalsContact O-N 3.09Å; P212-S214 PolarHBondContact O-OG 3.43Å; S214-A216 PolarHBondContact O-N 3.27Å; S214-S217 PolarHBondContact N-OG 3.1Å; S214-S217 PolarHBondContact O-N 3.08Å; S214-S217 PolarHBondContact O-OG 2.95Å; S214-S217 PolarHBondContact OG-N 3.13Å; S214-V218 WeakPolarHBondContact O-CG2 3.4Å; S214-V218 PolarHBondContact O-N 3.42Å
215	D	85.5	Confident	88.8	Confident	61 Å²	61	49.7 Å²	49.7	33%	0.326	28%	0.275	S	S	.	.	H	α-helix	trans	-61.5	-27	172.1	-71.5	-0.8	0	0	0	111.7	S219 R254 Q258	D215-S219 WeakPolarHBondContact O-CB 3.36Å; D215-S219 PolarHBondContact O-N 3.01Å; D215-S219 PolarHBondContact O-OG 3.29Å; D215-R254 IonicContact OD1-NE 3.24Å; D215-R254 PolarHBondContact OD1-NE 3.43Å; D215-R254 IonicContact OD1-NH2 2.8Å; D215-R254 IonicContact OD2-CZ 3.16Å; D215-R254 IonicContact OD2-NE 2.79Å; D215-R254 IonicContact OD2-NH2 2.68Å; D215-R254 PolarHBondContact OD2-NH2 3.35Å; D215-Q258 PolarHBondContact OD1-NE2 3.39Å; D215-Q258 PolarHBondContact OD2-NE2 2.95Å
216	A	84.1	Confident	88.8	Confident	58 Å²	58	52.7 Å²	52.7	48%	0.479	30%	0.301	S	S	.	.	H	α-helix	trans	-70	-44.4	176.5	0	0	0	0	0	111.8	M211 S214 S219 A220	M211-A216 HydrophobicContact CE-CB 4.28Å; S214-A216 PolarHBondContact O-N 3.27Å; A216-S219 PolarHBondContact O-N 3.44Å; A216-A220 WeakPolarHBondContact O-CB 3.41Å; A216-A220 PolarHBondContact O-N 3.4Å
217	S	88.1	Confident	88.8	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-66.3	-38.7	175.6	63.1	0	0	0	0	111.5	P212 S214 S219 A220 L221 Q244	P212-S217 PolarHBondContact O-OG 2.84Å; S214-S217 PolarHBondContact N-OG 3.1Å; S214-S217 PolarHBondContact O-N 3.08Å; S214-S217 PolarHBondContact O-OG 2.95Å; S214-S217 PolarHBondContact OG-N 3.13Å; S217-S219 PolarHBondContact O-N 2.93Å; S217-A220 PolarHBondContact O-N 3.45Å; S217-L221 WeakPolarHBondContact O-CG 3.47Å; S217-L221 PolarHBondContact O-N 2.55Å; S217-Q244 VanDerWaalsContact CB-OE1 3.31Å; S217-Q244 PolarHBondContact OG-OE1 3.45Å
218	V	90.2	Very high	89	Confident	13 Å²	13	49.6 Å²	49.6	8%	0.079	28%	0.278	C	S	.	.	H	α-helix	trans	-60.4	-44.4	172.5	167.8	0	0	0	0	111.5	S214 L221 K222 L241 Q244 Q245 L248	S214-V218 WeakPolarHBondContact O-CG2 3.4Å; S214-V218 PolarHBondContact O-N 3.42Å; V218-L221 PolarHBondContact O-N 3.4Å; V218-K222 HydrophobicContact CG1-CD 4.29Å; V218-K222 WeakPolarHBondContact O-CG 3.43Å; V218-K222 PolarHBondContact O-N 3.02Å; V218-L241 HydrophobicContact CB-CD1 4.37Å; V218-L241 HydrophobicContact CG1-CD1 3.8Å; V218-L241 HydrophobicContact CG2-CD1 4.45Å; V218-Q244 HydrophobicContact CG2-CB 3.97Å; V218-Q245 HydrophobicContact CG1-CG 4.37Å; V218-Q245 HydrophobicContact CG2-CG 4.45Å; V218-L248 HydrophobicContact CG2-CD1 3.59Å
219	S	90.6	Very high	88.8	Confident	73 Å²	73	53.8 Å²	53.8	51%	0.51	31%	0.307	S	S	.	.	H	α-helix	trans	-66.1	-39.2	178.1	-60.5	0	0	0	0	111.8	D215 A216 S217 K222 K223	D215-S219 WeakPolarHBondContact O-CB 3.36Å; D215-S219 PolarHBondContact O-N 3.01Å; D215-S219 PolarHBondContact O-OG 3.29Å; A216-S219 PolarHBondContact O-N 3.44Å; S217-S219 PolarHBondContact O-N 2.93Å; S219-K222 PolarHBondContact O-N 3.14Å; S219-K223 WeakPolarHBondContact O-CB 3.36Å; S219-K223 PolarHBondContact O-N 3.27Å
220	A	90	Very high	88.7	Confident	21 Å²	21	52.6 Å²	52.6	17%	0.174	31%	0.307	C	S	.	.	H	α-helix	trans	-63.4	-44.4	175.1	0	0	0	0	0	111.7	I208 M211 A216 S217 K223 Y224	I208-A220 HydrophobicContact CD1-CB 3.99Å; I208-A220 WeakPolarHBondContact CD1-O 3.3Å; I208-A220 HydrophobicContact CG1-CB 3.99Å; I208-A220 HydrophobicContact CG2-CB 4.12Å; M211-A220 HydrophobicContact CE-CB 4.37Å; M211-A220 HydrophobicContact SD-CB 3.97Å; A216-A220 WeakPolarHBondContact O-CB 3.41Å; A216-A220 PolarHBondContact O-N 3.4Å; S217-A220 PolarHBondContact O-N 3.45Å; A220-K223 PolarHBondContact O-N 3.37Å; A220-Y224 WeakPolarHBondContact O-CB 3.48Å; A220-Y224 PolarHBondContact O-N 3.16Å
221	L	93.2	Very high	88.8	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-61.2	-44.2	174.7	-72.7	167.1	0	0	0	111.6	Y205 I208 S217 V218 Y224 L225 A237 Q240 L241	Y205-L221 HydrophobicContact CE2-CD2 4.19Å; I208-L221 HydrophobicContact CG2-CD2 3.65Å; I208-L221 HydrophobicContact CG2-CG 3.73Å; S217-L221 WeakPolarHBondContact O-CG 3.47Å; S217-L221 PolarHBondContact O-N 2.55Å; V218-L221 PolarHBondContact O-N 3.4Å; L221-Y224 PolarHBondContact O-N 2.85Å; L221-L225 WeakPolarHBondContact O-CB 3.39Å; L221-L225 VanDerWaalsContact O-CG 3.26Å; L221-L225 WeakPolarHBondContact O-CG 3.41Å; L221-L225 PolarHBondContact O-N 2.95Å; L221-A237 HydrophobicContact CD2-CB 3.99Å; L221-Q240 HydrophobicContact CD1-CB 4.3Å; L221-Q240 HydrophobicContact CD1-CG 3.98Å; L221-Q240 HydrophobicContact CD2-CB 4.45Å; L221-L241 HydrophobicContact CB-CB 4.19Å; L221-L241 HydrophobicContact CB-CD1 4.11Å; L221-L241 HydrophobicContact CD1-CB 4.05Å; L221-L241 HydrophobicContact CD1-CD1 4.41Å
222	K	94	Very high	88.6	Confident	110 Å²	110	53 Å²	53	48%	0.478	32%	0.322	S	S	.	.	H	α-helix	trans	-61.4	-43.7	175	-74.2	176.6	178.6	-179.4	0	112.2	V218 S219 L225 S226 L241	V218-K222 HydrophobicContact CG1-CD 4.29Å; V218-K222 WeakPolarHBondContact O-CG 3.43Å; V218-K222 PolarHBondContact O-N 3.02Å; S219-K222 PolarHBondContact O-N 3.14Å; K222-L225 PolarHBondContact O-N 2.99Å; K222-S226 PolarHBondContact O-N 2.95Å; K222-L241 HydrophobicContact CG-CD1 4.23Å; K222-L241 HydrophobicContact CG-CD2 4.1Å
223	K	92.8	Very high	88.8	Confident	102 Å²	102	50.1 Å²	50.1	44%	0.443	30%	0.303	S	S	.	.	H	α-helix	trans	-63.1	-45.4	176.9	-175.2	172	-179.7	-179.7	0	111	W204 S219 A220 L225 S226 I227	W204-K223 HydrophobicContact CZ2-CD 4.18Å; W204-K223 HydrophobicContact CZ2-CG 4.2Å; S219-K223 WeakPolarHBondContact O-CB 3.36Å; S219-K223 PolarHBondContact O-N 3.27Å; A220-K223 PolarHBondContact O-N 3.37Å; K223-L225 PolarHBondContact O-N 3.24Å; K223-S226 PolarHBondContact O-N 3.04Å; K223-S226 VanDerWaalsContact O-N 3.14Å; K223-S226 PolarHBondContact O-OG 3.16Å; K223-I227 HydrophobicContact CG-CD1 4.25Å; K223-I227 PolarHBondContact O-N 3.05Å
224	Y	94.1	Very high	89	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-55.8	-50.3	174.9	171.2	-97.2	0	0	0	112	S201 W204 Y205 I208 A220 L221 S226 I227 F228 S233 V234 A237	S201-Y224 WeakPolarHBondContact O-CE2 3.5Å; S201-Y224 PolarHBondContact OG-OH 3.49Å; W204-Y224 HydrophobicContact CB-CD2 3.97Å; W204-Y224 HydrophobicContact CB-CE2 4.2Å; W204-Y224 AromaticContact CD1-CD2 3.58Å; W204-Y224 AromaticContact CG-CD2 3.76Å; W204-Y224 HydrophobicContact CG-CD2 3.76Å; W204-Y224 HydrophobicContact CG-CE2 4.46Å; Y205-Y224 HydrophobicContact CD2-CE1 4.39Å; I208-Y224 HydrophobicContact CD1-CG 4.2Å; A220-Y224 WeakPolarHBondContact O-CB 3.48Å; A220-Y224 PolarHBondContact O-N 3.16Å; L221-Y224 PolarHBondContact O-N 2.85Å; Y224-S226 PolarHBondContact O-N 2.76Å; Y224-I227 PolarHBondContact O-N 3.45Å; Y224-I227 VanDerWaalsContact O-N 3.09Å; Y224-F228 AromaticContact CD2-CD2 3.4Å; Y224-F228 HydrophobicContact CD2-CD2 3.4Å; Y224-F228 VanDerWaalsContact CD2-CD2 3.4Å; Y224-F228 AromaticContact CD2-CE2 3.83Å; Y224-F228 HydrophobicContact CD2-CE2 3.83Å; Y224-F228 HydrophobicContact CD2-CG 4.42Å; Y224-F228 HydrophobicContact CE2-CB 4.24Å; Y224-F228 AromaticContact CE2-CD2 3.28Å; Y224-F228 HydrophobicContact CE2-CD2 3.28Å; Y224-F228 AromaticContact CE2-CE2 3.81Å; Y224-F228 HydrophobicContact CE2-CE2 3.81Å; Y224-F228 AromaticContact CE2-CG 3.94Å; Y224-F228 HydrophobicContact CE2-CG 3.94Å; Y224-F228 HydrophobicContact CG-CD2 4.23Å; Y224-F228 WeakPolarHBondContact O-CD2 3.49Å; Y224-F228 PolarHBondContact O-N 3.48Å; Y224-S233 VanDerWaalsContact OH-CB 3.32Å; Y224-S233 WeakPolarHBondContact OH-CB 3.46Å; Y224-S233 PolarHBondContact OH-OG 3.36Å; Y224-V234 HydrophobicContact CE1-CG2 4.16Å; Y224-A237 HydrophobicContact CD1-CB 3.54Å; Y224-A237 HydrophobicContact CE1-CB 3.44Å; Y224-A237 VanDerWaalsContact CE1-CB 3.44Å
225	L	93.3	Very high	89.2	Confident	41 Å²	41	51 Å²	51	22%	0.215	32%	0.315	C	S	.	.	H	α-helix	trans	-66.6	-19.1	178.8	-67.2	172.9	0	0	0	113.8	L221 K222 K223 V234 A237 Q238 L241	L221-L225 WeakPolarHBondContact O-CB 3.39Å; L221-L225 VanDerWaalsContact O-CG 3.26Å; L221-L225 WeakPolarHBondContact O-CG 3.41Å; L221-L225 PolarHBondContact O-N 2.95Å; K222-L225 PolarHBondContact O-N 2.99Å; K223-L225 PolarHBondContact O-N 3.24Å; L225-V234 HydrophobicContact CD2-CG1 3.78Å; L225-A237 HydrophobicContact CD2-CB 3.98Å; L225-A237 HydrophobicContact CG-CB 4.41Å; L225-Q238 HydrophobicContact CD1-CG 4.03Å; L225-Q238 HydrophobicContact CD2-CG 3.73Å; L225-L241 HydrophobicContact CD1-CD2 3.66Å
226	S	93.3	Very high	89.4	Confident	95 Å²	95	50 Å²	50	66%	0.664	31%	0.314	S	S	*	.	H	α-helix	trans	-78.2	-23.7	173.6	75.6	0	0	0	0	113.4	K222 K223 Y224	K222-S226 PolarHBondContact O-N 2.95Å; K223-S226 PolarHBondContact O-N 3.04Å; K223-S226 VanDerWaalsContact O-N 3.14Å; K223-S226 PolarHBondContact O-OG 3.16Å; Y224-S226 PolarHBondContact O-N 2.76Å
227	I	91.5	Very high	89.8	Confident	33 Å²	33	47.2 Å²	47.2	17%	0.169	29%	0.292	C	S	.	.	H	α-helix	trans	-97.9	-39.5	-177.7	-63.3	169.1	0	0	0	110.5	E188 A191 R197 W204 K223 Y224	E188-I227 HydrophobicContact CG-CD1 4.33Å; A191-I227 HydrophobicContact CB-CG2 4.11Å; R197-I227 PolarHBondContact NH2-O 2.83Å; W204-I227 HydrophobicContact CH2-CD1 3.3Å; W204-I227 HydrophobicContact CZ2-CD1 3.79Å; W204-I227 HydrophobicContact CZ3-CD1 3.76Å; K223-I227 HydrophobicContact CG-CD1 4.25Å; K223-I227 PolarHBondContact O-N 3.05Å; Y224-I227 PolarHBondContact O-N 3.45Å; Y224-I227 VanDerWaalsContact O-N 3.09Å
228	F	92.7	Very high	89.9	Confident	1 Å²	1	52.5 Å²	52.5	0%	0.004	32%	0.316	C	S	.	.			trans	-110.9	109.4	-177.5	-56.4	-77	0	0	0	110.7	A191 R197 A200 W204 Y224 V234	A191-F228 HydrophobicContact CB-CE1 3.74Å; A191-F228 HydrophobicContact CB-CZ 3.86Å; R197-F228 HydrophobicContact CG-CD1 4.21Å; R197-F228 HydrophobicContact CG-CE1 4.21Å; R197-F228 WeakPolarHBondContact O-CE1 3.41Å; A200-F228 HydrophobicContact CB-CE1 4.18Å; A200-F228 HydrophobicContact CB-CZ 3.96Å; W204-F228 HydrophobicContact CB-CE2 4.11Å; W204-F228 AromaticContact CD2-CE2 3.97Å; W204-F228 HydrophobicContact CD2-CE2 3.97Å; W204-F228 AromaticContact CE3-CE2 3.78Å; W204-F228 HydrophobicContact CE3-CE2 3.78Å; W204-F228 HydrophobicContact CE3-CZ 4.18Å; W204-F228 HydrophobicContact CG-CE2 4.13Å; Y224-F228 AromaticContact CD2-CD2 3.4Å; Y224-F228 HydrophobicContact CD2-CD2 3.4Å; Y224-F228 VanDerWaalsContact CD2-CD2 3.4Å; Y224-F228 AromaticContact CD2-CE2 3.83Å; Y224-F228 HydrophobicContact CD2-CE2 3.83Å; Y224-F228 HydrophobicContact CD2-CG 4.42Å; Y224-F228 HydrophobicContact CE2-CB 4.24Å; Y224-F228 AromaticContact CE2-CD2 3.28Å; Y224-F228 HydrophobicContact CE2-CD2 3.28Å; Y224-F228 AromaticContact CE2-CE2 3.81Å; Y224-F228 HydrophobicContact CE2-CE2 3.81Å; Y224-F228 AromaticContact CE2-CG 3.94Å; Y224-F228 HydrophobicContact CE2-CG 3.94Å; Y224-F228 HydrophobicContact CG-CD2 4.23Å; Y224-F228 WeakPolarHBondContact O-CD2 3.49Å; Y224-F228 PolarHBondContact O-N 3.48Å; F228-V234 HydrophobicContact CB-CG2 3.92Å
229	S	86.6	Confident	90	Very high	87 Å²	87	55.8 Å²	55.8	61%	0.608	34%	0.34	S	S	*	.			trans	-83.5	-22.2	-179.1	42.6	0	0	0	0	114.3	R197	R197-S229 PolarHBondContact NH2-OG 2.86Å; R197-S229 VanDerWaalsContact NH2-OG 3.12Å
230	D	84.3	Confident	90	Very high	104 Å²	104	54.1 Å²	54.1	56%	0.556	32%	0.324	S	S	*	.	S	Bend	trans	-153.3	158.5	-166.1	57.1	-32	0	0	0	111.6	R197 V234	R197-D230 IonicContact NE-OD1 3.88Å; D230-V234 VanDerWaalsContact O-CG2 3.29Å; D230-V234 WeakPolarHBondContact O-CG2 3.38Å
231	G	82.5	Confident	90.1	Very high	48 Å²	48	54.1 Å²	54.1	50%	0.495	32%	0.321	S	S	.	.	S	Bend	trans	116.5	162.6	-179.3	0	0	0	0	0	114.3	S233 V234	G231-S233 VanDerWaalsContact C-N 3.28Å; G231-S233 PolarHBondContact O-N 2.78Å; G231-V234 WeakPolarHBondContact O-CB 3.23Å; G231-V234 PolarHBondContact O-N 3.1Å
232	D	80.4	Confident	90	Very high	145 Å²	145	56.8 Å²	56.8	78%	0.775	34%	0.343	S	S	*	.	H	α-helix	trans	-56.5	-38.7	-172.6	-63.5	-22.4	0	0	0	113.6	V234	D232-V234 VanDerWaalsContact C-N 3.32Å; D232-V234 PolarHBondContact O-N 3.27Å
233	S	87.1	Confident	89.8	Confident	16 Å²	16	55.8 Å²	55.8	11%	0.112	34%	0.34	C	S	.	.	H	α-helix	trans	-75.2	-18	179.5	48	0	0	0	0	113.6	S201 Y224 G231 A237	S201-S233 PolarHBondContact OG-OG 3.43Å; S201-S233 VanDerWaalsContact OG-OG 3.09Å; Y224-S233 VanDerWaalsContact OH-CB 3.32Å; Y224-S233 WeakPolarHBondContact OH-CB 3.46Å; Y224-S233 PolarHBondContact OH-OG 3.36Å; G231-S233 VanDerWaalsContact C-N 3.28Å; G231-S233 PolarHBondContact O-N 2.78Å; S233-A237 VanDerWaalsContact O-CB 3.29Å; S233-A237 WeakPolarHBondContact O-CB 3.46Å; S233-A237 PolarHBondContact O-N 3.43Å
234	V	90.4	Very high	89.7	Confident	6 Å²	6	51.3 Å²	51.3	4%	0.036	32%	0.321	C	S	.	.	H	α-helix	trans	-69.5	-44	178.5	175.8	0	0	0	0	111.1	Y224 L225 F228 D230 G231 D232 A236 A237 Q238	Y224-V234 HydrophobicContact CE1-CG2 4.16Å; L225-V234 HydrophobicContact CD2-CG1 3.78Å; F228-V234 HydrophobicContact CB-CG2 3.92Å; D230-V234 VanDerWaalsContact O-CG2 3.29Å; D230-V234 WeakPolarHBondContact O-CG2 3.38Å; G231-V234 WeakPolarHBondContact O-CB 3.23Å; G231-V234 PolarHBondContact O-N 3.1Å; D232-V234 VanDerWaalsContact C-N 3.32Å; D232-V234 PolarHBondContact O-N 3.27Å; V234-A236 VanDerWaalsContact C-N 3.33Å; V234-A236 PolarHBondContact O-N 3.49Å; V234-A237 PolarHBondContact O-N 2.94Å; V234-Q238 WeakPolarHBondContact O-CG 3.41Å; V234-Q238 PolarHBondContact O-N 3.35Å
235	A	88.6	Confident	89.6	Confident	58 Å²	58	55.7 Å²	55.7	48%	0.479	34%	0.341	S	S	.	.	H	α-helix	trans	-63.2	-39.9	176.1	0	0	0	0	0	112.1	S239	A235-S239 PolarHBondContact O-N 3.49Å; A235-S239 VanDerWaalsContact O-N 3.12Å; A235-S239 PolarHBondContact O-OG 2.99Å
236	A	90.5	Very high	89.4	Confident	39 Å²	39	61 Å²	61	32%	0.322	36%	0.362	S	S	.	.	H	α-helix	trans	-64.9	-43.9	174.9	0	0	0	0	0	111.6	Y205 V234 S239 Q240	Y205-A236 HydrophobicContact CE1-CB 3.95Å; Y205-A236 WeakPolarHBondContact OH-CB 3.44Å; V234-A236 VanDerWaalsContact C-N 3.33Å; V234-A236 PolarHBondContact O-N 3.49Å; A236-S239 PolarHBondContact O-N 3.35Å; A236-Q240 WeakPolarHBondContact O-CB 3.45Å; A236-Q240 PolarHBondContact O-N 3.11Å
237	A	91.1	Very high	89.1	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-64.5	-38.9	177.3	0	0	0	0	0	113.1	Y205 L221 Y224 L225 S233 V234 Q240 L241	Y205-A237 HydrophobicContact CD2-CB 3.84Å; Y205-A237 HydrophobicContact CE2-CB 3.6Å; L221-A237 HydrophobicContact CD2-CB 3.99Å; Y224-A237 HydrophobicContact CD1-CB 3.54Å; Y224-A237 HydrophobicContact CE1-CB 3.44Å; Y224-A237 VanDerWaalsContact CE1-CB 3.44Å; L225-A237 HydrophobicContact CD2-CB 3.98Å; L225-A237 HydrophobicContact CG-CB 4.41Å; S233-A237 VanDerWaalsContact O-CB 3.29Å; S233-A237 WeakPolarHBondContact O-CB 3.46Å; S233-A237 PolarHBondContact O-N 3.43Å; V234-A237 PolarHBondContact O-N 2.94Å; A237-Q240 PolarHBondContact O-N 3.29Å; A237-L241 VanDerWaalsContact O-CB 3.28Å; A237-L241 WeakPolarHBondContact O-CB 3.47Å; A237-L241 PolarHBondContact O-N 3.26Å
238	Q	91.9	Very high	88.9	Confident	111 Å²	111	58.8 Å²	58.8	52%	0.519	34%	0.341	S	S	.	.	H	α-helix	trans	-62.1	-44.4	173.9	-74.1	174.3	-10.7	0	0	111.6	L225 V234 L241 A242	L225-Q238 HydrophobicContact CD1-CG 4.03Å; L225-Q238 HydrophobicContact CD2-CG 3.73Å; V234-Q238 WeakPolarHBondContact O-CG 3.41Å; V234-Q238 PolarHBondContact O-N 3.35Å; Q238-L241 PolarHBondContact O-N 2.8Å; Q238-A242 PolarHBondContact O-N 2.91Å
239	S	91.1	Very high	88.6	Confident	82 Å²	82	62.3 Å²	62.3	57%	0.573	37%	0.371	S	S	*	.	H	α-helix	trans	-64.8	-44.6	178	-57.6	0	0	0	0	111.6	A235 A236 L241 A242 E243	A235-S239 PolarHBondContact O-N 3.49Å; A235-S239 VanDerWaalsContact O-N 3.12Å; A235-S239 PolarHBondContact O-OG 2.99Å; A236-S239 PolarHBondContact O-N 3.35Å; S239-L241 VanDerWaalsContact C-N 3.34Å; S239-L241 PolarHBondContact O-N 3.43Å; S239-A242 PolarHBondContact O-N 3.01Å; S239-E243 PolarHBondContact O-N 3.49Å
240	Q	91.4	Very high	88.7	Confident	37 Å²	37	62.1 Å²	62.1	17%	0.173	36%	0.363	C	S	.	.	H	α-helix	trans	-64	-39.4	176.6	-171.8	174.6	-34.8	0	0	111.6	Y205 L221 A236 A237 E243 Q244	Y205-Q240 PolarHBondContact OH-OE1 2.65Å; Y205-Q240 VanDerWaalsContact OH-OE1 3.07Å; L221-Q240 HydrophobicContact CD1-CB 4.3Å; L221-Q240 HydrophobicContact CD1-CG 3.98Å; L221-Q240 HydrophobicContact CD2-CB 4.45Å; A236-Q240 WeakPolarHBondContact O-CB 3.45Å; A236-Q240 PolarHBondContact O-N 3.11Å; A237-Q240 PolarHBondContact O-N 3.29Å; Q240-E243 PolarHBondContact O-N 3.49Å; Q240-Q244 HydrophobicContact CG-CG 4.35Å; Q240-Q244 VanDerWaalsContact NE2-NE2 3.18Å; Q240-Q244 WeakPolarHBondContact O-CB 3.42Å; Q240-Q244 VanDerWaalsContact O-CG 3.28Å; Q240-Q244 WeakPolarHBondContact O-CG 3.22Å; Q240-Q244 PolarHBondContact O-N 2.75Å
241	L	92.2	Very high	88.8	Confident	21 Å²	21	61.1 Å²	61.1	11%	0.11	36%	0.362	C	S	.	.	H	α-helix	trans	-62.2	-46.8	176.8	176.3	60.8	0	0	0	111.3	V218 L221 K222 L225 A237 Q238 S239 E243 Q244 Q245	V218-L241 HydrophobicContact CB-CD1 4.37Å; V218-L241 HydrophobicContact CG1-CD1 3.8Å; V218-L241 HydrophobicContact CG2-CD1 4.45Å; L221-L241 HydrophobicContact CB-CB 4.19Å; L221-L241 HydrophobicContact CB-CD1 4.11Å; L221-L241 HydrophobicContact CD1-CB 4.05Å; L221-L241 HydrophobicContact CD1-CD1 4.41Å; K222-L241 HydrophobicContact CG-CD1 4.23Å; K222-L241 HydrophobicContact CG-CD2 4.1Å; L225-L241 HydrophobicContact CD1-CD2 3.66Å; A237-L241 VanDerWaalsContact O-CB 3.28Å; A237-L241 WeakPolarHBondContact O-CB 3.47Å; A237-L241 PolarHBondContact O-N 3.26Å; Q238-L241 PolarHBondContact O-N 2.8Å; S239-L241 VanDerWaalsContact C-N 3.34Å; S239-L241 PolarHBondContact O-N 3.43Å; L241-E243 PolarHBondContact O-N 3.17Å; L241-Q244 PolarHBondContact O-N 3.41Å; L241-Q245 HydrophobicContact CD1-CG 4.02Å; L241-Q245 WeakPolarHBondContact O-CB 3.21Å; L241-Q245 VanDerWaalsContact O-CG 3.24Å; L241-Q245 WeakPolarHBondContact O-CG 3.49Å; L241-Q245 PolarHBondContact O-N 3.45Å
242	A	90.9	Very high	88.9	Confident	57 Å²	57	60.6 Å²	60.6	47%	0.471	35%	0.353	S	S	.	.	H	α-helix	trans	-61.5	-43.4	178.6	0	0	0	0	0	112.1	Q238 S239 Q245 K246	Q238-A242 PolarHBondContact O-N 2.91Å; S239-A242 PolarHBondContact O-N 3.01Å; A242-Q245 PolarHBondContact O-N 3.45Å; A242-K246 WeakPolarHBondContact O-CB 3.43Å; A242-K246 PolarHBondContact O-N 2.81Å
243	E	89.8	Confident	89.2	Confident	89 Å²	89	57.1 Å²	57.1	42%	0.416	33%	0.331	S	S	.	.	H	α-helix	trans	-66.6	-45.2	178.2	-177.2	56.1	-153.8	0	0	111.9	S239 Q240 L241 Q245 K246 Q247	S239-E243 PolarHBondContact O-N 3.49Å; Q240-E243 PolarHBondContact O-N 3.49Å; L241-E243 PolarHBondContact O-N 3.17Å; E243-Q245 VanDerWaalsContact C-N 3.34Å; E243-Q245 PolarHBondContact O-N 2.94Å; E243-K246 WeakPolarHBondContact O-CB 3.23Å; E243-K246 PolarHBondContact O-N 3.35Å; E243-Q247 WeakPolarHBondContact O-CG 3.24Å; E243-Q247 PolarHBondContact O-N 2.92Å; E243-Q247 PolarHBondContact OE1-NE2 3.43Å
244	Q	91.1	Very high	89.3	Confident	8 Å²	8	60.9 Å²	60.9	4%	0.037	34%	0.343	C	S	.	.	H	α-helix	trans	-62.1	-41.1	176.7	-72.4	-168.7	5.3	0	0	112	V213 S217 V218 Q240 L241 K246 Q247 L248	V213-Q244 HydrophobicContact CB-CG 4.46Å; V213-Q244 HydrophobicContact CG1-CB 4.11Å; V213-Q244 HydrophobicContact CG1-CG 3.96Å; V213-Q244 HydrophobicContact CG2-CG 4.03Å; S217-Q244 VanDerWaalsContact CB-OE1 3.31Å; S217-Q244 PolarHBondContact OG-OE1 3.45Å; V218-Q244 HydrophobicContact CG2-CB 3.97Å; Q240-Q244 HydrophobicContact CG-CG 4.35Å; Q240-Q244 VanDerWaalsContact NE2-NE2 3.18Å; Q240-Q244 WeakPolarHBondContact O-CB 3.42Å; Q240-Q244 VanDerWaalsContact O-CG 3.28Å; Q240-Q244 WeakPolarHBondContact O-CG 3.22Å; Q240-Q244 PolarHBondContact O-N 2.75Å; L241-Q244 PolarHBondContact O-N 3.41Å; Q244-K246 VanDerWaalsContact C-N 3.31Å; Q244-K246 PolarHBondContact O-N 3.19Å; Q244-Q247 PolarHBondContact O-N 3.4Å; Q244-L248 WeakPolarHBondContact O-CB 3.4Å; Q244-L248 VanDerWaalsContact O-CG 3.25Å; Q244-L248 WeakPolarHBondContact O-CG 3.34Å; Q244-L248 PolarHBondContact O-N 2.94Å
245	Q	90.5	Very high	89.4	Confident	91 Å²	91	60.7 Å²	60.7	43%	0.425	34%	0.342	S	S	.	.	H	α-helix	trans	-64.6	-36.1	176.6	-74.4	179.6	-54.1	0	0	112.5	V218 L241 A242 E243 A249	V218-Q245 HydrophobicContact CG1-CG 4.37Å; V218-Q245 HydrophobicContact CG2-CG 4.45Å; L241-Q245 HydrophobicContact CD1-CG 4.02Å; L241-Q245 WeakPolarHBondContact O-CB 3.21Å; L241-Q245 VanDerWaalsContact O-CG 3.24Å; L241-Q245 WeakPolarHBondContact O-CG 3.49Å; L241-Q245 PolarHBondContact O-N 3.45Å; A242-Q245 PolarHBondContact O-N 3.45Å; E243-Q245 VanDerWaalsContact C-N 3.34Å; E243-Q245 PolarHBondContact O-N 2.94Å; Q245-A249 PolarHBondContact O-N 2.87Å
246	K	89.5	Confident	89.5	Confident	153 Å²	153	61.4 Å²	61.4	67%	0.665	33%	0.332	S	S	*	.	H	α-helix	trans	-66.4	-44.3	175.6	-177	-176.5	174.5	-170.3	0	111.7	A242 E243 Q244 A249	A242-K246 WeakPolarHBondContact O-CB 3.43Å; A242-K246 PolarHBondContact O-N 2.81Å; E243-K246 WeakPolarHBondContact O-CB 3.23Å; E243-K246 PolarHBondContact O-N 3.35Å; Q244-K246 VanDerWaalsContact C-N 3.31Å; Q244-K246 PolarHBondContact O-N 3.19Å; K246-A249 WeakPolarHBondContact O-CB 3.5Å; K246-A249 PolarHBondContact O-N 3.07Å
247	Q	87	Confident	89.4	Confident	65 Å²	65	60.3 Å²	60.3	30%	0.304	32%	0.323	S	S	.	.	H	α-helix	trans	-67	-43	178.5	-67.3	178.3	6.4	0	0	111.9	E243 Q244 A249 D250 F253	E243-Q247 WeakPolarHBondContact O-CG 3.24Å; E243-Q247 PolarHBondContact O-N 2.92Å; E243-Q247 PolarHBondContact OE1-NE2 3.43Å; Q244-Q247 PolarHBondContact O-N 3.4Å; Q247-A249 PolarHBondContact O-N 3.3Å; Q247-D250 PolarHBondContact O-N 3.32Å; Q247-F253 HydrophobicContact CB-CD1 3.97Å; Q247-F253 HydrophobicContact CB-CE1 3.56Å; Q247-F253 HydrophobicContact CB-CZ 4.09Å; Q247-F253 HydrophobicContact CG-CE1 4.49Å; Q247-F253 VanDerWaalsContact O-CD1 3.25Å; Q247-F253 WeakPolarHBondContact O-CD1 3.45Å
248	L	87.6	Confident	89.2	Confident	16 Å²	16	61.7 Å²	61.7	8%	0.084	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-4.8	178.4	-66.7	170.7	0	0	0	113.8	V213 V218 Q244 D250 R254	V213-L248 HydrophobicContact CG1-CD1 4.19Å; V213-L248 HydrophobicContact CG1-CD2 4.08Å; V213-L248 HydrophobicContact CG1-CG 3.9Å; V218-L248 HydrophobicContact CG2-CD1 3.59Å; Q244-L248 WeakPolarHBondContact O-CB 3.4Å; Q244-L248 VanDerWaalsContact O-CG 3.25Å; Q244-L248 WeakPolarHBondContact O-CG 3.34Å; Q244-L248 PolarHBondContact O-N 2.94Å; L248-D250 VanDerWaalsContact C-N 3.32Å; L248-R254 HydrophobicContact CD2-CB 4.12Å; L248-R254 HydrophobicContact CD2-CG 4.02Å; L248-R254 WeakPolarHBondContact O-CD 3.33Å
249	A	87.3	Confident	89.2	Confident	76 Å²	76	56.4 Å²	56.4	63%	0.628	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.1	-25.3	173.7	0	0	0	0	0	112.7	Q245 K246 Q247 P251	Q245-A249 PolarHBondContact O-N 2.87Å; K246-A249 WeakPolarHBondContact O-CB 3.5Å; K246-A249 PolarHBondContact O-N 3.07Å; Q247-A249 PolarHBondContact O-N 3.3Å; A249-P251 VanDerWaalsContact O-CD 3.32Å; A249-P251 WeakPolarHBondContact O-CD 3.24Å
250	D	87	Confident	89.2	Confident	83 Å²	83	53.9 Å²	53.9	44%	0.444	29%	0.285	S	S	.	.	S	Bend	trans	-77.5	116.6	169.9	172.5	11.7	0	0	0	109.5	Q247 L248 A252 F253 R254	Q247-D250 PolarHBondContact O-N 3.32Å; L248-D250 VanDerWaalsContact C-N 3.32Å; D250-A252 PolarHBondContact O-N 2.92Å; D250-A252 PolarHBondContact OD1-N 3.48Å; D250-F253 HydrophobicContact CB-CB 3.9Å; D250-F253 PolarHBondContact O-N 3.49Å; D250-F253 PolarHBondContact OD2-N 3.23Å; D250-R254 VanDerWaalsContact O-CB 3.3Å; D250-R254 WeakPolarHBondContact O-CB 3.43Å; D250-R254 PolarHBondContact O-N 2.92Å
251	P	86.2	Confident	88.8	Confident	83 Å²	83	53 Å²	53	54%	0.539	28%	0.283	S	S	.	.	H	α-helix	trans	-58.4	-32.6	178.9	-23.5	34.5	0	0	0	113.9	A249 A255	A249-P251 VanDerWaalsContact O-CD 3.32Å; A249-P251 WeakPolarHBondContact O-CD 3.24Å; P251-A255 WeakPolarHBondContact O-CB 3.33Å; P251-A255 PolarHBondContact O-N 3.21Å
252	A	85.3	Confident	88.6	Confident	36 Å²	36	52.5 Å²	52.5	30%	0.298	28%	0.282	S	S	.	.	H	α-helix	trans	-74.1	-46.7	-179.5	0	0	0	0	0	111.1	D250 A255 R256 A281	D250-A252 PolarHBondContact O-N 2.92Å; D250-A252 PolarHBondContact OD1-N 3.48Å; A252-A255 PolarHBondContact O-N 3.37Å; A252-R256 WeakPolarHBondContact O-CB 3.15Å; A252-R256 PolarHBondContact O-N 2.87Å; A252-A281 HydrophobicContact CB-CB 3.94Å
253	F	87.7	Confident	88.5	Confident	72 Å²	72	49.9 Å²	49.9	32%	0.316	26%	0.26	S	S	.	.	H	α-helix	trans	-59.7	-45.2	172.1	-176.7	-88.6	0	0	0	111.7	V213 Q247 D250 A255 R256 A257	V213-F253 HydrophobicContact CG1-CE1 4.18Å; Q247-F253 HydrophobicContact CB-CD1 3.97Å; Q247-F253 HydrophobicContact CB-CE1 3.56Å; Q247-F253 HydrophobicContact CB-CZ 4.09Å; Q247-F253 HydrophobicContact CG-CE1 4.49Å; Q247-F253 VanDerWaalsContact O-CD1 3.25Å; Q247-F253 WeakPolarHBondContact O-CD1 3.45Å; D250-F253 HydrophobicContact CB-CB 3.9Å; D250-F253 PolarHBondContact O-N 3.49Å; D250-F253 PolarHBondContact OD2-N 3.23Å; F253-A255 PolarHBondContact O-N 2.99Å; F253-R256 PolarHBondContact O-N 2.83Å; F253-A257 HydrophobicContact CD1-CB 4.34Å; F253-A257 HydrophobicContact CE1-CB 4.03Å; F253-A257 VanDerWaalsContact O-CB 3.28Å; F253-A257 WeakPolarHBondContact O-CB 3.4Å; F253-A257 PolarHBondContact O-N 3.47Å
254	R	89.3	Confident	88.2	Confident	96 Å²	96	51.4 Å²	51.4	36%	0.362	27%	0.271	S	S	.	.	H	α-helix	trans	-57.9	-50.2	178	178.3	166	178.9	-105.6	-0.9	111.5	D215 L248 D250 R256 A257 Q258	D215-R254 IonicContact OD1-NE 3.24Å; D215-R254 PolarHBondContact OD1-NE 3.43Å; D215-R254 IonicContact OD1-NH2 2.8Å; D215-R254 IonicContact OD2-CZ 3.16Å; D215-R254 IonicContact OD2-NE 2.79Å; D215-R254 IonicContact OD2-NH2 2.68Å; D215-R254 PolarHBondContact OD2-NH2 3.35Å; L248-R254 HydrophobicContact CD2-CB 4.12Å; L248-R254 HydrophobicContact CD2-CG 4.02Å; L248-R254 WeakPolarHBondContact O-CD 3.33Å; D250-R254 VanDerWaalsContact O-CB 3.3Å; D250-R254 WeakPolarHBondContact O-CB 3.43Å; D250-R254 PolarHBondContact O-N 2.92Å; R254-R256 VanDerWaalsContact C-N 3.34Å; R254-R256 PolarHBondContact O-N 3.03Å; R254-A257 PolarHBondContact O-N 3Å; R254-Q258 HydrophobicContact CG-CG 4.22Å; R254-Q258 VanDerWaalsContact O-CB 3.27Å; R254-Q258 WeakPolarHBondContact O-CB 3.14Å; R254-Q258 WeakPolarHBondContact O-CG 3.12Å; R254-Q258 PolarHBondContact O-N 3Å
255	A	90.6	Very high	87.7	Confident	1 Å²	1	54.2 Å²	54.2	1%	0.008	29%	0.292	C	S	.	.	H	α-helix	trans	-60.7	-42.9	178.7	0	0	0	0	0	111.9	P251 A252 F253 G259 E274 Q277 A278	P251-A255 WeakPolarHBondContact O-CB 3.33Å; P251-A255 PolarHBondContact O-N 3.21Å; A252-A255 PolarHBondContact O-N 3.37Å; F253-A255 PolarHBondContact O-N 2.99Å; A255-G259 PolarHBondContact O-N 2.88Å; A255-E274 WeakPolarHBondContact CA-OE2 3.39Å; A255-Q277 HydrophobicContact CB-CB 4.03Å; A255-Q277 HydrophobicContact CB-CG 3.86Å; A255-A278 HydrophobicContact CB-CB 4.48Å
256	R	92	Very high	87.2	Confident	74 Å²	74	52.1 Å²	52.1	28%	0.279	30%	0.295	S	S	.	.	H	α-helix	trans	-62.2	-51.2	176.2	-173	-172.8	-169.1	-86.4	-4.1	112	A252 F253 R254 G259 L260 A278 D285 E287	A252-R256 WeakPolarHBondContact O-CB 3.15Å; A252-R256 PolarHBondContact O-N 2.87Å; F253-R256 PolarHBondContact O-N 2.83Å; R254-R256 VanDerWaalsContact C-N 3.34Å; R254-R256 PolarHBondContact O-N 3.03Å; R256-G259 PolarHBondContact O-N 3.41Å; R256-L260 HydrophobicContact CG-CD1 4.1Å; R256-L260 WeakPolarHBondContact O-CG 3.43Å; R256-L260 PolarHBondContact O-N 3.2Å; R256-A278 HydrophobicContact CB-CB 3.98Å; R256-D285 WeakPolarHBondContact CD-OD2 2.99Å; R256-D285 IonicContact CZ-OD2 3.4Å; R256-D285 IonicContact NE-OD1 2.82Å; R256-D285 IonicContact NE-OD2 3.89Å; R256-D285 PolarHBondContact NE-OD2 2.96Å; R256-D285 IonicContact NH2-OD1 3.38Å; R256-D285 PolarHBondContact NH2-OD1 2.93Å; R256-D285 IonicContact NH2-OD2 3.66Å; R256-E287 IonicContact CZ-OE2 3.63Å; R256-E287 IonicContact NH1-OE2 3.71Å; R256-E287 IonicContact NH2-OE2 3.4Å; R256-E287 PolarHBondContact NH2-OE2 3.32Å
257	A	87.6	Confident	86.9	Confident	15 Å²	15	49.3 Å²	49.3	12%	0.124	29%	0.285	C	S	.	.	H	α-helix	trans	-65.8	-42.8	-176.3	0	0	0	0	0	111.7	V213 F253 R254 A261	V213-A257 WeakPolarHBondContact O-CB 3.42Å; F253-A257 HydrophobicContact CD1-CB 4.34Å; F253-A257 HydrophobicContact CE1-CB 4.03Å; F253-A257 VanDerWaalsContact O-CB 3.28Å; F253-A257 WeakPolarHBondContact O-CB 3.4Å; F253-A257 PolarHBondContact O-N 3.47Å; R254-A257 PolarHBondContact O-N 3Å; A257-A261 VanDerWaalsContact O-CB 3.26Å; A257-A261 WeakPolarHBondContact O-CB 3.21Å; A257-A261 PolarHBondContact O-N 3.48Å
258	Q	88.2	Confident	86.8	Confident	30 Å²	30	46.7 Å²	46.7	14%	0.14	28%	0.275	C	S	.	.	H	α-helix	trans	-65.3	-41.9	174.5	-70.4	-171.3	1.5	0	0	112.2	D215 R254 A262 E274	D215-Q258 PolarHBondContact OD1-NE2 3.39Å; D215-Q258 PolarHBondContact OD2-NE2 2.95Å; R254-Q258 HydrophobicContact CG-CG 4.22Å; R254-Q258 VanDerWaalsContact O-CB 3.27Å; R254-Q258 WeakPolarHBondContact O-CB 3.14Å; R254-Q258 WeakPolarHBondContact O-CG 3.12Å; R254-Q258 PolarHBondContact O-N 3Å; Q258-A262 WeakPolarHBondContact O-CB 3.33Å; Q258-A262 PolarHBondContact O-N 2.7Å; Q258-E274 HydrophobicContact CB-CG 4.19Å
259	G	90.8	Very high	86.7	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-59.9	-50.2	177.4	0	0	0	0	0	112.9	A255 R256 A262 V263	A255-G259 PolarHBondContact O-N 2.88Å; R256-G259 PolarHBondContact O-N 3.41Å; G259-A262 PolarHBondContact O-N 3.41Å; G259-V263 WeakPolarHBondContact O-CG2 3.32Å; G259-V263 PolarHBondContact O-N 3.08Å; G259-V263 VanDerWaalsContact O-N 3.12Å
260	L	90.3	Very high	86.7	Confident	29 Å²	29	51.8 Å²	51.8	15%	0.152	30%	0.298	C	S	.	.	H	α-helix	trans	-64.3	-48	178.6	-67.2	173.7	0	0	0	111.7	R256 A262 V263 D264 L275 E287 A291	R256-L260 HydrophobicContact CG-CD1 4.1Å; R256-L260 WeakPolarHBondContact O-CG 3.43Å; R256-L260 PolarHBondContact O-N 3.2Å; L260-A262 PolarHBondContact O-N 3.16Å; L260-V263 PolarHBondContact O-N 3.36Å; L260-D264 PolarHBondContact O-N 2.9Å; L260-L275 HydrophobicContact CD2-CD2 4.45Å; L260-E287 HydrophobicContact CD1-CG 4.42Å; L260-E287 HydrophobicContact CD2-CG 4.05Å; L260-A291 HydrophobicContact CD2-CB 3.41Å; L260-A291 VanDerWaalsContact CD2-CB 3.41Å
261	A	84.7	Confident	86.8	Confident	17 Å²	17	47.9 Å²	47.9	14%	0.14	28%	0.277	C	S	.	.	H	α-helix	trans	-60.2	-35.7	177.2	0	0	0	0	0	112.4	P212 A257 S265	P212-A261 HydrophobicContact CB-CB 4.32Å; P212-A261 HydrophobicContact CG-CB 3.84Å; A257-A261 VanDerWaalsContact O-CB 3.26Å; A257-A261 WeakPolarHBondContact O-CB 3.21Å; A257-A261 PolarHBondContact O-N 3.48Å; A261-S265 WeakPolarHBondContact O-CB 3.35Å; A261-S265 PolarHBondContact O-N 3.3Å; A261-S265 VanDerWaalsContact O-N 3.09Å; A261-S265 PolarHBondContact O-OG 3.23Å
262	A	87.3	Confident	87.3	Confident	11 Å²	11	44.5 Å²	44.5	9%	0.091	25%	0.254	C	S	.	.	H	α-helix	trans	-68.4	-35.1	175.9	0	0	0	0	0	112.6	Q258 G259 L260 S265 G266 M267 K270 A271	Q258-A262 WeakPolarHBondContact O-CB 3.33Å; Q258-A262 PolarHBondContact O-N 2.7Å; G259-A262 PolarHBondContact O-N 3.41Å; L260-A262 PolarHBondContact O-N 3.16Å; A262-S265 WeakPolarHBondContact CA-OG 3.28Å; A262-S265 PolarHBondContact O-OG 2.85Å; A262-S265 VanDerWaalsContact O-OG 3.09Å; A262-G266 PolarHBondContact O-N 3.48Å; A262-M267 HydrophobicContact CB-CB 4.38Å; A262-M267 WeakPolarHBondContact O-CA 3.49Å; A262-M267 PolarHBondContact O-N 3.37Å; A262-K270 HydrophobicContact CB-CB 4.45Å; A262-A271 HydrophobicContact CB-CB 3.68Å
263	V	89.4	Confident	87.7	Confident	2 Å²	2	45.9 Å²	45.9	1%	0.012	26%	0.26	C	S	.	.	H	α-helix	trans	-69.4	-44.7	175.8	171.7	0	0	0	0	111.7	G259 L260 S265 G266 A271 L275 A291 Q294 A295 Q298	G259-V263 WeakPolarHBondContact O-CG2 3.32Å; G259-V263 PolarHBondContact O-N 3.08Å; G259-V263 VanDerWaalsContact O-N 3.12Å; L260-V263 PolarHBondContact O-N 3.36Å; V263-S265 PolarHBondContact O-N 3.14Å; V263-G266 PolarHBondContact O-N 3.48Å; V263-A271 HydrophobicContact CG2-CB 3.56Å; V263-L275 HydrophobicContact CG2-CD1 3.59Å; V263-A291 HydrophobicContact CG2-CB 4.27Å; V263-Q294 HydrophobicContact CG1-CB 4.03Å; V263-Q294 HydrophobicContact CG1-CG 3.63Å; V263-A295 HydrophobicContact CG2-CB 3.91Å; V263-Q298 PolarHBondContact O-NE2 2.94Å
264	D	82.3	Confident	87.9	Confident	121 Å²	121	44.8 Å²	44.8	65%	0.647	26%	0.256	S	S	*	.	H	α-helix	trans	-65.1	-30.4	178.9	-69.4	-22.3	0	0	0	112	L260 G266	L260-D264 PolarHBondContact O-N 2.9Å; D264-G266 VanDerWaalsContact C-N 3.29Å; D264-G266 PolarHBondContact O-N 3.35Å
265	S	80.6	Confident	88.1	Confident	68 Å²	68	40.2 Å²	40.2	48%	0.476	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.2	4.7	172.4	56	0	0	0	0	114.4	A261 A262 V263 M267	A261-S265 WeakPolarHBondContact O-CB 3.35Å; A261-S265 PolarHBondContact O-N 3.3Å; A261-S265 VanDerWaalsContact O-N 3.09Å; A261-S265 PolarHBondContact O-OG 3.23Å; A262-S265 WeakPolarHBondContact CA-OG 3.28Å; A262-S265 PolarHBondContact O-OG 2.85Å; A262-S265 VanDerWaalsContact O-OG 3.09Å; V263-S265 PolarHBondContact O-N 3.14Å; S265-M267 PolarHBondContact O-N 3.23Å
266	G	81	Confident	88.3	Confident	47 Å²	47	43 Å²	43	49%	0.485	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.1	10.2	179.8	0	0	0	0	0	114.7	A262 V263 D264 A268	A262-G266 PolarHBondContact O-N 3.48Å; V263-G266 PolarHBondContact O-N 3.48Å; D264-G266 VanDerWaalsContact C-N 3.29Å; D264-G266 PolarHBondContact O-N 3.35Å; G266-A268 VanDerWaalsContact C-N 3.27Å; G266-A268 PolarHBondContact O-N 3.36Å
267	M	83.2	Confident	88.4	Confident	94 Å²	94	43.7 Å²	43.7	46%	0.463	26%	0.258	S	S	.	.			trans	-85.7	58.7	-179.5	-59.5	-168.9	-168.4	0	0	112	A262 S265 G269 K270 A271	A262-M267 HydrophobicContact CB-CB 4.38Å; A262-M267 WeakPolarHBondContact O-CA 3.49Å; A262-M267 PolarHBondContact O-N 3.37Å; S265-M267 PolarHBondContact O-N 3.23Å; M267-G269 PolarHBondContact O-N 2.93Å; M267-G269 VanDerWaalsContact O-N 3.07Å; M267-K270 HydrophobicContact CB-CB 4.45Å; M267-K270 PolarHBondContact O-N 3.43Å; M267-K270 HydrophobicContact SD-CD 4.15Å; M267-A271 PolarHBondContact O-N 2.91Å
268	A	84.2	Confident	88.6	Confident	10 Å²	10	43.2 Å²	43.2	8%	0.083	25%	0.254	C	S	.	.	H	α-helix	trans	-49	-40	-176.6	0	0	0	0	0	114.4	G266 K270 A271 I272 A295 Q298 K299	G266-A268 VanDerWaalsContact C-N 3.27Å; G266-A268 PolarHBondContact O-N 3.36Å; A268-K270 PolarHBondContact O-N 2.69Å; A268-A271 PolarHBondContact O-N 3.18Å; A268-I272 WeakPolarHBondContact O-CG1 3.41Å; A268-I272 PolarHBondContact O-N 3.14Å; A268-A295 WeakPolarHBondContact CB-O 3.44Å; A268-Q298 HydrophobicContact CB-CB 3.66Å; A268-K299 HydrophobicContact CB-CB 4.35Å
269	G	85.9	Confident	88.8	Confident	55 Å²	55	42.9 Å²	42.9	57%	0.567	25%	0.254	S	S	*	.	H	α-helix	trans	-63.5	-37.2	-179.3	0	0	0	0	0	113.9	M267 P273	M267-G269 PolarHBondContact O-N 2.93Å; M267-G269 VanDerWaalsContact O-N 3.07Å; G269-P273 WeakPolarHBondContact O-CD 3.33Å
270	K	86.3	Confident	88.9	Confident	144 Å²	144	51.9 Å²	51.9	63%	0.626	29%	0.288	S	S	*	.	H	α-helix	trans	-80.2	-32.7	176.1	-67.9	-175.8	-179.1	176.9	0	111.8	A262 M267 A268 P273	A262-K270 HydrophobicContact CB-CB 4.45Å; M267-K270 HydrophobicContact CB-CB 4.45Å; M267-K270 PolarHBondContact O-N 3.43Å; M267-K270 HydrophobicContact SD-CD 4.15Å; A268-K270 PolarHBondContact O-N 2.69Å; K270-P273 WeakPolarHBondContact O-CD 3.36Å; K270-P273 WeakPolarHBondContact O-CG 3.49Å
271	A	90.8	Very high	89	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-64.4	-42.9	-179.1	0	0	0	0	0	113.3	A262 V263 M267 A268 E274 L275 A295	A262-A271 HydrophobicContact CB-CB 3.68Å; V263-A271 HydrophobicContact CG2-CB 3.56Å; M267-A271 PolarHBondContact O-N 2.91Å; A268-A271 PolarHBondContact O-N 3.18Å; A271-E274 PolarHBondContact O-N 2.79Å; A271-L275 HydrophobicContact CB-CD1 3.96Å; A271-L275 VanDerWaalsContact O-CB 3.28Å; A271-L275 WeakPolarHBondContact O-CB 3.28Å; A271-L275 VanDerWaalsContact O-CG 3.27Å; A271-L275 WeakPolarHBondContact O-CG 3.39Å; A271-L275 PolarHBondContact O-N 3.49Å; A271-A295 HydrophobicContact CB-CB 3.99Å
272	I	95.3	Very high	89.2	Confident	12 Å²	12	56.3 Å²	56.3	6%	0.062	32%	0.318	C	S	.	.	H	α-helix	trans	-54.8	-54.2	-173.3	-70.3	163.2	0	0	0	113.7	A268 E274 L275 Q276 L292 A295 Y296 K299	A268-I272 WeakPolarHBondContact O-CG1 3.41Å; A268-I272 PolarHBondContact O-N 3.14Å; I272-E274 PolarHBondContact O-N 3.14Å; I272-L275 PolarHBondContact O-N 3.45Å; I272-Q276 HydrophobicContact CG2-CG 4.27Å; I272-Q276 WeakPolarHBondContact O-CB 3.41Å; I272-Q276 WeakPolarHBondContact O-CG 3.33Å; I272-Q276 PolarHBondContact O-N 3.3Å; I272-L292 HydrophobicContact CG1-CD1 4.45Å; I272-L292 HydrophobicContact CG2-CD1 4.36Å; I272-A295 HydrophobicContact CG1-CB 3.89Å; I272-Y296 HydrophobicContact CD1-CD1 3.8Å; I272-Y296 HydrophobicContact CD1-CE1 3.88Å; I272-Y296 HydrophobicContact CG1-CD1 4.21Å; I272-Y296 HydrophobicContact CG1-CE1 4.12Å; I272-Y296 HydrophobicContact CG2-CE1 3.93Å; I272-K299 HydrophobicContact CD1-CB 4.38Å; I272-K299 HydrophobicContact CD1-CD 3.48Å; I272-K299 VanDerWaalsContact CD1-CD 3.48Å
273	P	93.7	Very high	89.5	Confident	66 Å²	66	60 Å²	60	43%	0.429	34%	0.341	S	S	.	.	H	α-helix	trans	-63.1	-42.2	-178.3	22.3	-32.7	0	0	0	112.7	G269 K270 Q276 Q277	G269-P273 WeakPolarHBondContact O-CD 3.33Å; K270-P273 WeakPolarHBondContact O-CD 3.36Å; K270-P273 WeakPolarHBondContact O-CG 3.49Å; P273-Q276 PolarHBondContact O-N 2.95Å; P273-Q277 PolarHBondContact O-N 3.41Å
274	E	92	Very high	89.5	Confident	49 Å²	49	67.7 Å²	67.7	23%	0.229	37%	0.374	C	S	.	.	H	α-helix	trans	-64.8	-44.4	178.5	-62.9	-57.6	151	0	0	111.4	A255 Q258 A271 I272 Q277 A278	A255-E274 WeakPolarHBondContact CA-OE2 3.39Å; Q258-E274 HydrophobicContact CB-CG 4.19Å; A271-E274 PolarHBondContact O-N 2.79Å; I272-E274 PolarHBondContact O-N 3.14Å; E274-Q277 WeakPolarHBondContact O-CB 3.31Å; E274-Q277 PolarHBondContact O-N 3.4Å; E274-A278 PolarHBondContact O-N 2.79Å
275	L	94.3	Very high	90	Very high	0 Å²	0	62.9 Å²	62.9	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-68.8	-35	176.3	-71.2	169.6	0	0	0	112.4	L260 V263 A271 I272 Q277 A278 V279 A288 A291 L292 A295	L260-L275 HydrophobicContact CD2-CD2 4.45Å; V263-L275 HydrophobicContact CG2-CD1 3.59Å; A271-L275 HydrophobicContact CB-CD1 3.96Å; A271-L275 VanDerWaalsContact O-CB 3.28Å; A271-L275 WeakPolarHBondContact O-CB 3.28Å; A271-L275 VanDerWaalsContact O-CG 3.27Å; A271-L275 WeakPolarHBondContact O-CG 3.39Å; A271-L275 PolarHBondContact O-N 3.49Å; I272-L275 PolarHBondContact O-N 3.45Å; L275-Q277 VanDerWaalsContact C-N 3.29Å; L275-Q277 PolarHBondContact O-N 2.89Å; L275-A278 PolarHBondContact O-N 3.27Å; L275-V279 WeakPolarHBondContact O-CB 3.41Å; L275-V279 WeakPolarHBondContact O-CG2 3.3Å; L275-V279 PolarHBondContact O-N 2.89Å; L275-A288 HydrophobicContact CD2-CB 4.43Å; L275-A291 HydrophobicContact CD1-CB 3.93Å; L275-A291 HydrophobicContact CD2-CB 3.98Å; L275-L292 HydrophobicContact CB-CB 4.06Å; L275-L292 HydrophobicContact CB-CD1 3.87Å; L275-L292 HydrophobicContact CB-CG 4.45Å; L275-L292 HydrophobicContact CD1-CB 4.35Å; L275-A295 HydrophobicContact CD1-CB 4.32Å
276	Q	95.2	Very high	90.6	Very high	60 Å²	60	60.5 Å²	60.5	28%	0.28	33%	0.332	S	S	.	.	H	α-helix	trans	-61.7	-40	171.3	-78	177.4	-2.4	0	0	111.1	I272 P273 R280 L292 Y296	I272-Q276 HydrophobicContact CG2-CG 4.27Å; I272-Q276 WeakPolarHBondContact O-CB 3.41Å; I272-Q276 WeakPolarHBondContact O-CG 3.33Å; I272-Q276 PolarHBondContact O-N 3.3Å; P273-Q276 PolarHBondContact O-N 2.95Å; Q276-R280 WeakPolarHBondContact O-CB 3.4Å; Q276-R280 WeakPolarHBondContact O-CG 3.37Å; Q276-R280 PolarHBondContact O-N 3.5Å; Q276-L292 HydrophobicContact CG-CD1 4.19Å; Q276-L292 HydrophobicContact CG-CD2 4.33Å; Q276-Y296 PolarHBondContact NE2-OH 3.19Å
277	Q	93.2	Very high	91.1	Very high	88 Å²	88	61.8 Å²	61.8	41%	0.411	33%	0.325	S	S	.	.	H	α-helix	trans	-66.9	-43.3	174.6	179.4	172.1	-17.2	0	0	111.6	A255 P273 E274 L275 R280 A281	A255-Q277 HydrophobicContact CB-CB 4.03Å; A255-Q277 HydrophobicContact CB-CG 3.86Å; P273-Q277 PolarHBondContact O-N 3.41Å; E274-Q277 WeakPolarHBondContact O-CB 3.31Å; E274-Q277 PolarHBondContact O-N 3.4Å; L275-Q277 VanDerWaalsContact C-N 3.29Å; L275-Q277 PolarHBondContact O-N 2.89Å; Q277-R280 PolarHBondContact O-N 2.93Å; Q277-A281 WeakPolarHBondContact O-CB 3.36Å; Q277-A281 PolarHBondContact O-N 3.41Å
278	A	91.2	Very high	91.6	Very high	4 Å²	4	57.3 Å²	57.3	3%	0.033	30%	0.303	C	S	.	.	H	α-helix	trans	-60.5	-45.8	175.9	0	0	0	0	0	112	A255 R256 E274 L275 R280 A281 N282 A288	A255-A278 HydrophobicContact CB-CB 4.48Å; R256-A278 HydrophobicContact CB-CB 3.98Å; E274-A278 PolarHBondContact O-N 2.79Å; L275-A278 PolarHBondContact O-N 3.27Å; A278-R280 VanDerWaalsContact C-N 3.35Å; A278-R280 PolarHBondContact O-N 3.44Å; A278-A281 PolarHBondContact O-N 3Å; A278-N282 PolarHBondContact O-N 3.12Å; A278-A288 HydrophobicContact CB-CB 4.32Å
279	V	93.6	Very high	92.1	Very high	23 Å²	23	57.1 Å²	57.1	14%	0.139	30%	0.3	C	S	.	.	H	α-helix	trans	-67.8	-32.7	177.2	171.5	0	0	0	0	111.8	L275 N282 P283 A288 L289 L292	L275-V279 WeakPolarHBondContact O-CB 3.41Å; L275-V279 WeakPolarHBondContact O-CG2 3.3Å; L275-V279 PolarHBondContact O-N 2.89Å; V279-N282 CarbonylContact O-C 3.45Å; V279-P283 WeakPolarHBondContact O-CA 3.39Å; V279-P283 WeakPolarHBondContact O-CD 3.42Å; V279-P283 WeakPolarHBondContact O-CG 3.35Å; V279-A288 HydrophobicContact CG2-CB 3.92Å; V279-L289 HydrophobicContact CB-CD2 4.45Å; V279-L289 HydrophobicContact CG1-CD2 3.55Å; V279-L289 HydrophobicContact CG1-CG 4.11Å; V279-L289 HydrophobicContact CG2-CD2 3.95Å; V279-L289 HydrophobicContact CG2-CG 3.97Å; V279-L292 HydrophobicContact CG2-CD2 4.17Å
280	R	93.2	Very high	92.5	Very high	189 Å²	189	54.5 Å²	54.5	71%	0.713	27%	0.273	S	S	*	.	H	α-helix	trans	-66.6	-39.8	171.3	-76.1	174.4	-159.4	166.1	8.3	111.9	Q276 Q277 A278	Q276-R280 WeakPolarHBondContact O-CB 3.4Å; Q276-R280 WeakPolarHBondContact O-CG 3.37Å; Q276-R280 PolarHBondContact O-N 3.5Å; Q277-R280 PolarHBondContact O-N 2.93Å; A278-R280 VanDerWaalsContact C-N 3.35Å; A278-R280 PolarHBondContact O-N 3.44Å
281	A	91.1	Very high	92.9	Very high	63 Å²	63	47.9 Å²	47.9	52%	0.521	25%	0.246	S	C	.	.	H	α-helix	trans	-70.9	-37.2	178.7	0	0	0	0	0	112.1	A252 Q277 A278	A252-A281 HydrophobicContact CB-CB 3.94Å; Q277-A281 WeakPolarHBondContact O-CB 3.36Å; Q277-A281 PolarHBondContact O-N 3.41Å; A278-A281 PolarHBondContact O-N 3Å
282	N	90.3	Very high	93.1	Very high	77 Å²	77	48.1 Å²	48.1	41%	0.412	25%	0.247	S	C	.	.			trans	-137	91.9	172.7	-176	6	0	0	0	111.6	A278 V279 K284 D285	A278-N282 PolarHBondContact O-N 3.12Å; V279-N282 CarbonylContact O-C 3.45Å; N282-K284 PolarHBondContact O-N 3.17Å; N282-K284 PolarHBondContact OD1-N 3.33Å; N282-K284 VanDerWaalsContact OD1-N 3.14Å; N282-D285 HydrophobicContact CB-CB 4.14Å; N282-D285 WeakPolarHBondContact O-CB 3.18Å; N282-D285 PolarHBondContact O-N 3.27Å; N282-D285 VanDerWaalsContact O-N 3.12Å
283	P	92.4	Very high	93.1	Very high	87 Å²	87	47.6 Å²	47.6	57%	0.565	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-8.3	179.3	-23.8	34.3	0	0	0	115.3	V279	V279-P283 WeakPolarHBondContact O-CA 3.39Å; V279-P283 WeakPolarHBondContact O-CD 3.42Å; V279-P283 WeakPolarHBondContact O-CG 3.35Å
284	K	90.7	Very high	93.2	Very high	165 Å²	165	45.7 Å²	45.7	72%	0.717	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-103.4	4.7	177.8	-64.4	-174	179.1	-176.7	0	113.1	N282 S286	N282-K284 PolarHBondContact O-N 3.17Å; N282-K284 PolarHBondContact OD1-N 3.33Å; N282-K284 VanDerWaalsContact OD1-N 3.14Å; K284-S286 PolarHBondContact O-N 3.06Å
285	D	91.8	Very high	93.4	Very high	20 Å²	20	43.3 Å²	43.3	11%	0.107	22%	0.219	C	C	.	.			trans	-72.7	92.9	174.8	-167.7	-24.8	0	0	0	109.6	R256 N282 E287 A288 L289	R256-D285 WeakPolarHBondContact CD-OD2 2.99Å; R256-D285 IonicContact CZ-OD2 3.4Å; R256-D285 IonicContact NE-OD1 2.82Å; R256-D285 IonicContact NE-OD2 3.89Å; R256-D285 PolarHBondContact NE-OD2 2.96Å; R256-D285 IonicContact NH2-OD1 3.38Å; R256-D285 PolarHBondContact NH2-OD1 2.93Å; R256-D285 IonicContact NH2-OD2 3.66Å; N282-D285 HydrophobicContact CB-CB 4.14Å; N282-D285 WeakPolarHBondContact O-CB 3.18Å; N282-D285 PolarHBondContact O-N 3.27Å; N282-D285 VanDerWaalsContact O-N 3.12Å; D285-E287 PolarHBondContact O-N 3.06Å; D285-E287 PolarHBondContact OD1-N 3.44Å; D285-A288 HydrophobicContact CB-CB 3.84Å; D285-A288 VanDerWaalsContact CG-CB 3.47Å; D285-A288 PolarHBondContact O-N 2.66Å; D285-A288 PolarHBondContact OD1-N 2.96Å; D285-L289 WeakPolarHBondContact O-CB 3.44Å; D285-L289 PolarHBondContact O-N 2.85Å
286	S	92.7	Very high	93.5	Very high	18 Å²	18	44.2 Å²	44.2	13%	0.126	22%	0.222	C	C	.	.	H	α-helix	trans	-57.7	-36.6	-179.8	66	0	0	0	0	111.4	K284 G290 A312 D316 W325	K284-S286 PolarHBondContact O-N 3.06Å; S286-G290 PolarHBondContact O-N 3.04Å; S286-A312 WeakPolarHBondContact O-CB 3.46Å; S286-D316 VanDerWaalsContact OG-CB 3.3Å; S286-D316 WeakPolarHBondContact OG-CB 3.45Å; S286-W325 VanDerWaalsContact O-CH2 3.27Å; S286-W325 WeakPolarHBondContact O-CH2 3.32Å
287	E	92.2	Very high	93.5	Very high	73 Å²	73	42.1 Å²	42.1	34%	0.341	21%	0.214	S	C	.	.	H	α-helix	trans	-69.6	-46.1	-179.8	-171.7	172.7	-150.6	0	0	111.4	R256 L260 D285 L289 G290 A291	R256-E287 IonicContact CZ-OE2 3.63Å; R256-E287 IonicContact NH1-OE2 3.71Å; R256-E287 IonicContact NH2-OE2 3.4Å; R256-E287 PolarHBondContact NH2-OE2 3.32Å; L260-E287 HydrophobicContact CD1-CG 4.42Å; L260-E287 HydrophobicContact CD2-CG 4.05Å; D285-E287 PolarHBondContact O-N 3.06Å; D285-E287 PolarHBondContact OD1-N 3.44Å; E287-L289 PolarHBondContact O-N 2.87Å; E287-G290 PolarHBondContact O-N 3.31Å; E287-A291 VanDerWaalsContact O-CB 3.25Å; E287-A291 WeakPolarHBondContact O-CB 3.16Å; E287-A291 PolarHBondContact O-N 3.04Å
288	A	92.6	Very high	93.4	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-64.1	-38.9	175.3	0	0	0	0	0	112.2	L275 A278 V279 D285 L292	L275-A288 HydrophobicContact CD2-CB 4.43Å; A278-A288 HydrophobicContact CB-CB 4.32Å; V279-A288 HydrophobicContact CG2-CB 3.92Å; D285-A288 HydrophobicContact CB-CB 3.84Å; D285-A288 VanDerWaalsContact CG-CB 3.47Å; D285-A288 PolarHBondContact O-N 2.66Å; D285-A288 PolarHBondContact OD1-N 2.96Å; A288-L292 VanDerWaalsContact O-CB 3.27Å; A288-L292 WeakPolarHBondContact O-CB 3.04Å; A288-L292 PolarHBondContact O-N 2.75Å
289	L	95.4	Very high	93.4	Very high	6 Å²	6	48.2 Å²	48.2	3%	0.031	24%	0.24	C	C	.	.	H	α-helix	trans	-64.8	-44	174.2	-80.3	165.7	0	0	0	112.1	V279 D285 E287 L292 G293 K311 A312 L315	V279-L289 HydrophobicContact CB-CD2 4.45Å; V279-L289 HydrophobicContact CG1-CD2 3.55Å; V279-L289 HydrophobicContact CG1-CG 4.11Å; V279-L289 HydrophobicContact CG2-CD2 3.95Å; V279-L289 HydrophobicContact CG2-CG 3.97Å; D285-L289 WeakPolarHBondContact O-CB 3.44Å; D285-L289 PolarHBondContact O-N 2.85Å; E287-L289 PolarHBondContact O-N 2.87Å; L289-L292 WeakPolarHBondContact O-CB 3.44Å; L289-L292 PolarHBondContact O-N 2.91Å; L289-G293 PolarHBondContact O-N 3.16Å; L289-K311 HydrophobicContact CD1-CB 4.39Å; L289-A312 HydrophobicContact CB-CB 3.97Å; L289-L315 HydrophobicContact CD1-CD1 3.26Å
290	G	95	Very high	93.3	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-68	-39.2	179.1	0	0	0	0	0	112.4	S286 E287 L292 G293 Q294	S286-G290 PolarHBondContact O-N 3.04Å; E287-G290 PolarHBondContact O-N 3.31Å; G290-L292 VanDerWaalsContact C-N 3.35Å; G290-G293 PolarHBondContact O-N 3.43Å; G290-Q294 PolarHBondContact O-N 3.45Å
291	A	93.6	Very high	93.3	Very high	6 Å²	6	42.2 Å²	42.2	5%	0.05	23%	0.23	C	C	.	.	H	α-helix	trans	-64.3	-38.8	171.2	0	0	0	0	0	111.9	L260 V263 L275 E287 G293 Q294 A295	L260-A291 HydrophobicContact CD2-CB 3.41Å; L260-A291 VanDerWaalsContact CD2-CB 3.41Å; V263-A291 HydrophobicContact CG2-CB 4.27Å; L275-A291 HydrophobicContact CD1-CB 3.93Å; L275-A291 HydrophobicContact CD2-CB 3.98Å; E287-A291 VanDerWaalsContact O-CB 3.25Å; E287-A291 WeakPolarHBondContact O-CB 3.16Å; E287-A291 PolarHBondContact O-N 3.04Å; A291-G293 VanDerWaalsContact C-N 3.32Å; A291-G293 PolarHBondContact O-N 2.89Å; A291-Q294 PolarHBondContact O-N 3.29Å; A291-A295 WeakPolarHBondContact O-CB 3.38Å; A291-A295 PolarHBondContact O-N 3.39Å
292	L	95.9	Very high	93.4	Very high	5 Å²	5	41.8 Å²	41.8	3%	0.026	22%	0.215	C	C	.	.	H	α-helix	trans	-63.6	-41.9	175.1	-177.9	59	0	0	0	110.5	I272 L275 Q276 V279 A288 L289 G290 A295 Y296	I272-L292 HydrophobicContact CG1-CD1 4.45Å; I272-L292 HydrophobicContact CG2-CD1 4.36Å; L275-L292 HydrophobicContact CB-CB 4.06Å; L275-L292 HydrophobicContact CB-CD1 3.87Å; L275-L292 HydrophobicContact CB-CG 4.45Å; L275-L292 HydrophobicContact CD1-CB 4.35Å; Q276-L292 HydrophobicContact CG-CD1 4.19Å; Q276-L292 HydrophobicContact CG-CD2 4.33Å; V279-L292 HydrophobicContact CG2-CD2 4.17Å; A288-L292 VanDerWaalsContact O-CB 3.27Å; A288-L292 WeakPolarHBondContact O-CB 3.04Å; A288-L292 PolarHBondContact O-N 2.75Å; L289-L292 WeakPolarHBondContact O-CB 3.44Å; L289-L292 PolarHBondContact O-N 2.91Å; G290-L292 VanDerWaalsContact C-N 3.35Å; L292-A295 PolarHBondContact O-N 3.43Å; L292-Y296 HydrophobicContact CD1-CD2 3.99Å; L292-Y296 HydrophobicContact CD1-CE2 3.48Å; L292-Y296 VanDerWaalsContact CD1-CE2 3.48Å; L292-Y296 HydrophobicContact CD2-CE2 4.08Å; L292-Y296 HydrophobicContact CG-CD2 3.9Å; L292-Y296 HydrophobicContact CG-CE2 3.51Å; L292-Y296 WeakPolarHBondContact O-CD2 3.28Å; L292-Y296 PolarHBondContact O-N 3Å
293	G	95.9	Very high	93.7	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-59.9	-43	171.5	0	0	0	0	0	113.4	L289 G290 A291 Y296 S297 A305	L289-G293 PolarHBondContact O-N 3.16Å; G290-G293 PolarHBondContact O-N 3.43Å; A291-G293 VanDerWaalsContact C-N 3.32Å; A291-G293 PolarHBondContact O-N 2.89Å; G293-Y296 PolarHBondContact O-N 2.92Å; G293-S297 PolarHBondContact O-N 3.16Å; G293-A305 WeakPolarHBondContact O-CB 3.47Å
294	Q	94.8	Very high	93.8	Very high	26 Å²	26	39.6 Å²	39.6	12%	0.121	21%	0.206	C	C	.	.	H	α-helix	trans	-63.9	-42.7	174.7	-178.4	177.2	-24.9	0	0	112	V263 G290 A291 S297 Q298 K324 L328	V263-Q294 HydrophobicContact CG1-CB 4.03Å; V263-Q294 HydrophobicContact CG1-CG 3.63Å; G290-Q294 PolarHBondContact O-N 3.45Å; A291-Q294 PolarHBondContact O-N 3.29Å; Q294-S297 WeakPolarHBondContact O-CB 3.24Å; Q294-S297 PolarHBondContact O-N 3.42Å; Q294-Q298 WeakPolarHBondContact O-CG 3.17Å; Q294-Q298 PolarHBondContact O-N 3.38Å; Q294-K324 VanDerWaalsContact OE1-CE 3.28Å; Q294-L328 HydrophobicContact CB-CD1 3.96Å; Q294-L328 HydrophobicContact CG-CD1 3.91Å
295	A	95.4	Very high	94.1	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-61.9	-45.1	176.5	0	0	0	0	0	111.5	V263 A268 A271 I272 L275 A291 L292 S297 Q298 K299	V263-A295 HydrophobicContact CG2-CB 3.91Å; A268-A295 WeakPolarHBondContact CB-O 3.44Å; A271-A295 HydrophobicContact CB-CB 3.99Å; I272-A295 HydrophobicContact CG1-CB 3.89Å; L275-A295 HydrophobicContact CD1-CB 4.32Å; A291-A295 WeakPolarHBondContact O-CB 3.38Å; A291-A295 PolarHBondContact O-N 3.39Å; L292-A295 PolarHBondContact O-N 3.43Å; A295-S297 VanDerWaalsContact C-N 3.32Å; A295-S297 PolarHBondContact O-N 2.87Å; A295-Q298 PolarHBondContact O-N 3.02Å; A295-K299 PolarHBondContact O-N 3.36Å
296	Y	97.1	Very high	94.3	Very high	18 Å²	18	31.4 Å²	31.4	7%	0.071	17%	0.17	C	C	.	.	H	α-helix	trans	-62.5	-39.4	174.6	-76.3	-55.4	0	0	0	112.1	I272 Q276 L292 G293 K299 G300 D301 N304	I272-Y296 HydrophobicContact CD1-CD1 3.8Å; I272-Y296 HydrophobicContact CD1-CE1 3.88Å; I272-Y296 HydrophobicContact CG1-CD1 4.21Å; I272-Y296 HydrophobicContact CG1-CE1 4.12Å; I272-Y296 HydrophobicContact CG2-CE1 3.93Å; Q276-Y296 PolarHBondContact NE2-OH 3.19Å; L292-Y296 HydrophobicContact CD1-CD2 3.99Å; L292-Y296 HydrophobicContact CD1-CE2 3.48Å; L292-Y296 VanDerWaalsContact CD1-CE2 3.48Å; L292-Y296 HydrophobicContact CD2-CE2 4.08Å; L292-Y296 HydrophobicContact CG-CD2 3.9Å; L292-Y296 HydrophobicContact CG-CE2 3.51Å; L292-Y296 WeakPolarHBondContact O-CD2 3.28Å; L292-Y296 PolarHBondContact O-N 3Å; G293-Y296 PolarHBondContact O-N 2.92Å; Y296-K299 PolarHBondContact O-N 3.42Å; Y296-G300 PolarHBondContact O-N 3.09Å; Y296-D301 HydrophobicContact CD1-CB 3.84Å; Y296-D301 HydrophobicContact CG-CB 4.43Å; Y296-D301 PolarHBondContact O-N 2.8Å; Y296-N304 HydrophobicContact CD1-CB 3.76Å; Y296-N304 HydrophobicContact CD2-CB 3.51Å; Y296-N304 HydrophobicContact CE1-CB 3.9Å; Y296-N304 HydrophobicContact CE2-CB 3.63Å; Y296-N304 HydrophobicContact CG-CB 3.57Å
297	S	94.5	Very high	94.4	Very high	17 Å²	17	32.4 Å²	32.4	12%	0.119	18%	0.18	C	C	.	.	H	α-helix	trans	-60.6	-46.1	173.9	-178	0	0	0	0	112	G293 Q294 A295 K299 G300 N332	G293-S297 PolarHBondContact O-N 3.16Å; Q294-S297 WeakPolarHBondContact O-CB 3.24Å; Q294-S297 PolarHBondContact O-N 3.42Å; A295-S297 VanDerWaalsContact C-N 3.32Å; A295-S297 PolarHBondContact O-N 2.87Å; S297-K299 VanDerWaalsContact C-N 3.28Å; S297-K299 PolarHBondContact O-N 3.07Å; S297-G300 PolarHBondContact O-N 3.2Å; S297-G300 VanDerWaalsContact O-N 3.1Å; S297-N332 VanDerWaalsContact CB-ND2 3.35Å; S297-N332 WeakPolarHBondContact CB-ND2 3.46Å; S297-N332 PolarHBondContact OG-ND2 3.07Å; S297-N332 PolarHBondContact OG-OD1 3.45Å
298	Q	91.2	Very high	94.6	Very high	83 Å²	83	29.8 Å²	29.8	39%	0.388	17%	0.168	S	C	.	.	H	α-helix	trans	-63.4	-32.9	177.6	-74.4	172.8	-9.7	0	0	112.1	V263 A268 Q294 A295 G300	V263-Q298 PolarHBondContact O-NE2 2.94Å; A268-Q298 HydrophobicContact CB-CB 3.66Å; Q294-Q298 WeakPolarHBondContact O-CG 3.17Å; Q294-Q298 PolarHBondContact O-N 3.38Å; A295-Q298 PolarHBondContact O-N 3.02Å; Q298-G300 VanDerWaalsContact C-N 3.31Å
299	K	92.3	Very high	94.7	Very high	136 Å²	136	29.8 Å²	29.8	59%	0.591	17%	0.168	S	C	*	.	H	α-helix	trans	-78.2	-12.4	174.8	-168.7	176	175.5	-173.7	0	113.5	A268 I272 A295 Y296 S297 D301	A268-K299 HydrophobicContact CB-CB 4.35Å; I272-K299 HydrophobicContact CD1-CB 4.38Å; I272-K299 HydrophobicContact CD1-CD 3.48Å; I272-K299 VanDerWaalsContact CD1-CD 3.48Å; A295-K299 PolarHBondContact O-N 3.36Å; Y296-K299 PolarHBondContact O-N 3.42Å; S297-K299 VanDerWaalsContact C-N 3.28Å; S297-K299 PolarHBondContact O-N 3.07Å; K299-D301 VanDerWaalsContact C-N 3.34Å
300	G	90.5	Very high	94.7	Very high	37 Å²	37	33 Å²	33	38%	0.381	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	81.2	8.3	-173.8	0	0	0	0	0	114.7	Y296 S297 Q298 R302	Y296-G300 PolarHBondContact O-N 3.09Å; S297-G300 PolarHBondContact O-N 3.2Å; S297-G300 VanDerWaalsContact O-N 3.1Å; Q298-G300 VanDerWaalsContact C-N 3.31Å; G300-R302 VanDerWaalsContact C-N 3.3Å; G300-R302 WeakPolarHBondContact O-CG 3.39Å; G300-R302 PolarHBondContact O-N 3.04Å
301	D	93.8	Very high	94.7	Very high	50 Å²	50	38.8 Å²	38.8	27%	0.267	21%	0.208	S	C	.	.			trans	-80.2	79.3	173.6	-173.2	-16.7	0	0	0	110	Y296 K299 A303 N304 A305	Y296-D301 HydrophobicContact CD1-CB 3.84Å; Y296-D301 HydrophobicContact CG-CB 4.43Å; Y296-D301 PolarHBondContact O-N 2.8Å; K299-D301 VanDerWaalsContact C-N 3.34Å; D301-A303 VanDerWaalsContact C-N 3.33Å; D301-A303 PolarHBondContact O-N 2.96Å; D301-N304 VanDerWaalsContact CG-ND2 3.33Å; D301-N304 PolarHBondContact OD1-N 2.68Å; D301-N304 PolarHBondContact OD1-ND2 3.01Å; D301-N304 PolarHBondContact OD2-ND2 3.27Å; D301-A305 WeakPolarHBondContact O-CB 3.43Å; D301-A305 PolarHBondContact O-N 3.4Å
302	R	94.4	Very high	94.7	Very high	54 Å²	54	38.5 Å²	38.5	20%	0.204	21%	0.206	C	C	.	.	H	α-helix	trans	-62.9	-37.4	-171.1	-52.1	-56.5	-173.9	143	7.5	112.7	G300 A305 V306 N332 W335 L336	G300-R302 VanDerWaalsContact C-N 3.3Å; G300-R302 WeakPolarHBondContact O-CG 3.39Å; G300-R302 PolarHBondContact O-N 3.04Å; R302-A305 PolarHBondContact O-N 3.46Å; R302-V306 VanDerWaalsContact O-CG2 3.27Å; R302-V306 WeakPolarHBondContact O-CG2 3.46Å; R302-V306 PolarHBondContact O-N 3.4Å; R302-N332 WeakPolarHBondContact CD-OD1 3.3Å; R302-N332 PolarHBondContact NH1-OD1 2.79Å; R302-W335 HydrophobicContact CG-CB 4.49Å; R302-L336 HydrophobicContact CB-CB 3.95Å; R302-L336 HydrophobicContact CB-CD1 4.18Å
303	A	95	Very high	94.6	Very high	51 Å²	51	39.3 Å²	39.3	42%	0.421	21%	0.21	S	C	.	.	H	α-helix	trans	-66.5	-48.2	-177.3	0	0	0	0	0	111.6	D301 A305 V306 A307 L336	D301-A303 VanDerWaalsContact C-N 3.33Å; D301-A303 PolarHBondContact O-N 2.96Å; A303-A305 VanDerWaalsContact C-N 3.34Å; A303-V306 PolarHBondContact O-N 2.89Å; A303-A307 PolarHBondContact O-N 2.84Å; A303-A307 VanDerWaalsContact O-N 3.12Å; A303-L336 HydrophobicContact CB-CD1 4.07Å; A303-L336 HydrophobicContact CB-CD2 4.49Å
304	N	95.4	Very high	94.5	Very high	66 Å²	66	43 Å²	43	35%	0.353	24%	0.241	S	C	.	.	H	α-helix	trans	-70.2	-32.3	176.4	-75.2	-58.3	0	0	0	112.1	Y296 D301 N308	Y296-N304 HydrophobicContact CD1-CB 3.76Å; Y296-N304 HydrophobicContact CD2-CB 3.51Å; Y296-N304 HydrophobicContact CE1-CB 3.9Å; Y296-N304 HydrophobicContact CE2-CB 3.63Å; Y296-N304 HydrophobicContact CG-CB 3.57Å; D301-N304 VanDerWaalsContact CG-ND2 3.33Å; D301-N304 PolarHBondContact OD1-N 2.68Å; D301-N304 PolarHBondContact OD1-ND2 3.01Å; D301-N304 PolarHBondContact OD2-ND2 3.27Å; N304-N308 WeakPolarHBondContact O-CB 3.43Å; N304-N308 PolarHBondContact O-N 2.91Å; N304-N308 VanDerWaalsContact O-N 3.1Å; N304-N308 PolarHBondContact O-ND2 3.14Å
305	A	96.3	Very high	94.4	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-58.9	-53.4	173.3	0	0	0	0	0	111.2	G293 D301 R302 A303 A307 N308 L309 N332	G293-A305 WeakPolarHBondContact O-CB 3.47Å; D301-A305 WeakPolarHBondContact O-CB 3.43Å; D301-A305 PolarHBondContact O-N 3.4Å; R302-A305 PolarHBondContact O-N 3.46Å; A303-A305 VanDerWaalsContact C-N 3.34Å; A305-A307 PolarHBondContact O-N 3.32Å; A305-N308 PolarHBondContact O-N 2.83Å; A305-L309 WeakPolarHBondContact O-CB 3.18Å; A305-L309 WeakPolarHBondContact O-CD1 3.41Å; A305-L309 WeakPolarHBondContact O-CG 3.5Å; A305-L309 PolarHBondContact O-N 2.82Å; A305-N332 HydrophobicContact CB-CB 4.31Å
306	V	96.2	Very high	94.1	Very high	14 Å²	14	48.1 Å²	48.1	9%	0.085	27%	0.268	C	S	.	.	H	α-helix	trans	-56.5	-51.3	178.7	170.3	0	0	0	0	111	R302 A303 N308 L309 E310 L329 N332 R333 L336	R302-V306 VanDerWaalsContact O-CG2 3.27Å; R302-V306 WeakPolarHBondContact O-CG2 3.46Å; R302-V306 PolarHBondContact O-N 3.4Å; A303-V306 PolarHBondContact O-N 2.89Å; V306-N308 PolarHBondContact O-N 3.43Å; V306-L309 PolarHBondContact O-N 3.37Å; V306-E310 HydrophobicContact CG1-CG 4.38Å; V306-E310 VanDerWaalsContact CG1-OE1 3.3Å; V306-E310 WeakPolarHBondContact CG1-OE1 3.4Å; V306-E310 WeakPolarHBondContact O-CB 3.39Å; V306-E310 VanDerWaalsContact O-CG 3.27Å; V306-E310 WeakPolarHBondContact O-CG 3.31Å; V306-E310 PolarHBondContact O-N 2.91Å; V306-L329 HydrophobicContact CB-CD1 4.18Å; V306-L329 HydrophobicContact CG1-CD1 3.87Å; V306-L329 HydrophobicContact CG2-CD1 4.17Å; V306-N332 HydrophobicContact CG2-CB 3.77Å; V306-R333 HydrophobicContact CG1-CG 4.05Å; V306-R333 HydrophobicContact CG2-CG 3.86Å; V306-L336 HydrophobicContact CB-CD2 4.5Å; V306-L336 HydrophobicContact CG2-CD2 4.16Å
307	A	95.8	Very high	93.7	Very high	39 Å²	39	50.4 Å²	50.4	32%	0.322	29%	0.285	S	S	.	.	H	α-helix	trans	-62.9	-36.8	-176.1	0	0	0	0	0	113.8	A303 A305 K311	A303-A307 PolarHBondContact O-N 2.84Å; A303-A307 VanDerWaalsContact O-N 3.12Å; A305-A307 PolarHBondContact O-N 3.32Å; A307-K311 VanDerWaalsContact O-CG 3.3Å; A307-K311 WeakPolarHBondContact O-CG 3.44Å; A307-K311 PolarHBondContact O-N 3.41Å
308	N	95.5	Very high	93.3	Very high	17 Å²	17	58 Å²	58	9%	0.091	32%	0.318	C	S	.	.	H	α-helix	trans	-81	-36.6	179.6	-72.5	-76	0	0	0	112.4	N304 A305 V306 K311 A312	N304-N308 WeakPolarHBondContact O-CB 3.43Å; N304-N308 PolarHBondContact O-N 2.91Å; N304-N308 VanDerWaalsContact O-N 3.1Å; N304-N308 PolarHBondContact O-ND2 3.14Å; A305-N308 PolarHBondContact O-N 2.83Å; V306-N308 PolarHBondContact O-N 3.43Å; N308-K311 PolarHBondContact O-N 3.39Å; N308-A312 WeakPolarHBondContact O-CB 3.48Å; N308-A312 PolarHBondContact O-N 3.41Å
309	L	95.5	Very high	93	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-64.4	-42.3	174.5	-69.5	169.8	0	0	0	111.4	A305 V306 K311 A312 L313 W325 L328 L329	A305-L309 WeakPolarHBondContact O-CB 3.18Å; A305-L309 WeakPolarHBondContact O-CD1 3.41Å; A305-L309 WeakPolarHBondContact O-CG 3.5Å; A305-L309 PolarHBondContact O-N 2.82Å; V306-L309 PolarHBondContact O-N 3.37Å; L309-K311 VanDerWaalsContact C-N 3.31Å; L309-K311 PolarHBondContact O-N 2.9Å; L309-A312 PolarHBondContact O-N 2.86Å; L309-L313 WeakPolarHBondContact O-CB 3.31Å; L309-L313 WeakPolarHBondContact O-CD1 3.36Å; L309-L313 VanDerWaalsContact O-CG 3.26Å; L309-L313 WeakPolarHBondContact O-CG 3.2Å; L309-L313 PolarHBondContact O-N 3.18Å; L309-W325 HydrophobicContact CD2-CB 3.89Å; L309-W325 HydrophobicContact CD2-CG 3.84Å; L309-L328 HydrophobicContact CD1-CB 3.71Å; L309-L329 HydrophobicContact CB-CB 4.41Å; L309-L329 HydrophobicContact CB-CD1 4.28Å; L309-L329 HydrophobicContact CD1-CB 4.28Å
310	E	95.5	Very high	92.7	Very high	74 Å²	74	54 Å²	54	35%	0.346	32%	0.317	S	S	.	.	H	α-helix	trans	-59.8	-41.9	175.3	-75	173.1	173.7	0	0	111.9	V306 A314 L329 R333	V306-E310 HydrophobicContact CG1-CG 4.38Å; V306-E310 VanDerWaalsContact CG1-OE1 3.3Å; V306-E310 WeakPolarHBondContact CG1-OE1 3.4Å; V306-E310 WeakPolarHBondContact O-CB 3.39Å; V306-E310 VanDerWaalsContact O-CG 3.27Å; V306-E310 WeakPolarHBondContact O-CG 3.31Å; V306-E310 PolarHBondContact O-N 2.91Å; E310-A314 VanDerWaalsContact O-CB 3.32Å; E310-A314 WeakPolarHBondContact O-CB 3.44Å; E310-A314 PolarHBondContact O-N 3.34Å; E310-L329 HydrophobicContact CG-CD1 3.83Å; E310-L329 HydrophobicContact CG-CD2 4Å; E310-R333 IonicContact OE1-CZ 2.73Å; E310-R333 VanDerWaalsContact OE1-CZ 3.3Å; E310-R333 IonicContact OE1-NE 2.66Å; E310-R333 PolarHBondContact OE1-NE 3.07Å; E310-R333 VanDerWaalsContact OE1-NE 3.13Å; E310-R333 IonicContact OE1-NH2 3.56Å; E310-R333 PolarHBondContact OE1-NH2 3.48Å
311	K	95	Very high	92.5	Very high	122 Å²	122	53.8 Å²	53.8	53%	0.53	31%	0.307	S	S	.	.	H	α-helix	trans	-66	-43.4	175.4	-73.2	174.8	-176.4	-179.7	0	112.3	L289 A307 N308 L309 A314 L315	L289-K311 HydrophobicContact CD1-CB 4.39Å; A307-K311 VanDerWaalsContact O-CG 3.3Å; A307-K311 WeakPolarHBondContact O-CG 3.44Å; A307-K311 PolarHBondContact O-N 3.41Å; N308-K311 PolarHBondContact O-N 3.39Å; L309-K311 VanDerWaalsContact C-N 3.31Å; L309-K311 PolarHBondContact O-N 2.9Å; K311-A314 PolarHBondContact O-N 2.89Å; K311-L315 WeakPolarHBondContact O-CG 3.34Å; K311-L315 PolarHBondContact O-N 3.32Å
312	A	93.4	Very high	92.2	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-60.4	-47.7	178.5	0	0	0	0	0	111.4	S286 L289 N308 L309 A314 L315 D316 W325	S286-A312 WeakPolarHBondContact O-CB 3.46Å; L289-A312 HydrophobicContact CB-CB 3.97Å; N308-A312 WeakPolarHBondContact O-CB 3.48Å; N308-A312 PolarHBondContact O-N 3.41Å; L309-A312 PolarHBondContact O-N 2.86Å; A312-A314 VanDerWaalsContact C-N 3.32Å; A312-A314 PolarHBondContact O-N 3.48Å; A312-L315 PolarHBondContact O-N 3.31Å; A312-D316 PolarHBondContact O-N 2.84Å; A312-W325 HydrophobicContact CB-CD2 4.39Å; A312-W325 HydrophobicContact CB-CE3 3.92Å; A312-W325 HydrophobicContact CB-CH2 4.22Å; A312-W325 HydrophobicContact CB-CZ3 3.83Å
313	L	93.3	Very high	92	Very high	22 Å²	22	57 Å²	57	12%	0.115	33%	0.328	C	S	.	.	H	α-helix	trans	-64.6	-33.3	177.5	-71.8	166.2	0	0	0	112.9	L309 N322 W325 N326 L329	L309-L313 WeakPolarHBondContact O-CB 3.31Å; L309-L313 WeakPolarHBondContact O-CD1 3.36Å; L309-L313 VanDerWaalsContact O-CG 3.26Å; L309-L313 WeakPolarHBondContact O-CG 3.2Å; L309-L313 PolarHBondContact O-N 3.18Å; L313-N322 WeakPolarHBondContact CD2-OD1 3.41Å; L313-W325 HydrophobicContact CD1-CB 4.26Å; L313-W325 HydrophobicContact CD2-CB 3.94Å; L313-W325 HydrophobicContact CD2-CE3 4.03Å; L313-W325 HydrophobicContact CG-CB 4.09Å; L313-W325 HydrophobicContact CG-CE3 4.25Å; L313-N326 WeakPolarHBondContact CD1-OD1 3.34Å; L313-L329 HydrophobicContact CD1-CD2 3.69Å
314	A	93.5	Very high	91.8	Very high	78 Å²	78	58.2 Å²	58.2	65%	0.645	32%	0.324	S	S	*	.	H	α-helix	trans	-73.1	-31.5	175.7	0	0	0	0	0	113.1	E310 K311 A312	E310-A314 VanDerWaalsContact O-CB 3.32Å; E310-A314 WeakPolarHBondContact O-CB 3.44Å; E310-A314 PolarHBondContact O-N 3.34Å; K311-A314 PolarHBondContact O-N 2.89Å; A312-A314 VanDerWaalsContact C-N 3.32Å; A312-A314 PolarHBondContact O-N 3.48Å
315	L	92.9	Very high	91.7	Very high	80 Å²	80	55.2 Å²	55.2	42%	0.419	31%	0.308	S	S	.	.	H	α-helix	trans	-80.6	-37.4	-179.9	-74.7	169.1	0	0	0	113	L289 K311 A312	L289-L315 HydrophobicContact CD1-CD1 3.26Å; K311-L315 WeakPolarHBondContact O-CG 3.34Å; K311-L315 PolarHBondContact O-N 3.32Å; A312-L315 PolarHBondContact O-N 3.31Å
316	D	89.8	Confident	91.5	Very high	52 Å²	52	58.6 Å²	58.6	28%	0.278	33%	0.326	S	S	.	.			trans	-137.1	83.7	177.5	-176	8.7	0	0	0	111.5	S286 A312 H318 S319	S286-D316 VanDerWaalsContact OG-CB 3.3Å; S286-D316 WeakPolarHBondContact OG-CB 3.45Å; A312-D316 PolarHBondContact O-N 2.84Å; D316-H318 PolarHBondContact O-N 2.96Å; D316-H318 VanDerWaalsContact O-N 3.16Å; D316-H318 PolarHBondContact OD1-N 2.91Å; D316-H318 VanDerWaalsContact OD1-N 3.17Å; D316-S319 PolarHBondContact O-N 3.36Å; D316-S319 PolarHBondContact OD1-N 3.32Å; D316-S319 WeakPolarHBondContact OD2-CA 3.4Å; D316-S319 VanDerWaalsContact OD2-CB 3.24Å; D316-S319 WeakPolarHBondContact OD2-CB 3.26Å
317	P	87.5	Confident	91.3	Very high	67 Å²	67	61.5 Å²	61.5	44%	0.435	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-12.3	177.1	-21.4	33.3	0	0	0	114.4	N322	P317-N322 PolarHBondContact O-ND2 3.12Å
318	H	86.2	Confident	91.2	Very high	176 Å²	176	61.5 Å²	61.5	82%	0.815	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.5	15.1	-176.8	-60.6	-56.2	0	0	0	112.8	D316	D316-H318 PolarHBondContact O-N 2.96Å; D316-H318 VanDerWaalsContact O-N 3.16Å; D316-H318 PolarHBondContact OD1-N 2.91Å; D316-H318 VanDerWaalsContact OD1-N 3.17Å
319	S	84.6	Confident	91.1	Very high	15 Å²	15	61 Å²	61	11%	0.105	34%	0.339	C	S	.	.			trans	-57.3	143.5	175.5	-168.7	0	0	0	0	111.3	D316 N321 N322	D316-S319 PolarHBondContact O-N 3.36Å; D316-S319 PolarHBondContact OD1-N 3.32Å; D316-S319 WeakPolarHBondContact OD2-CA 3.4Å; D316-S319 VanDerWaalsContact OD2-CB 3.24Å; D316-S319 WeakPolarHBondContact OD2-CB 3.26Å; S319-N321 PolarHBondContact O-N 3.42Å; S319-N321 VanDerWaalsContact O-N 3.1Å; S319-N321 PolarHBondContact OG-N 3Å; S319-N322 WeakPolarHBondContact O-CB 3.35Å; S319-N322 PolarHBondContact O-N 3Å
320	S	85.9	Confident	91.1	Very high	121 Å²	121	65.8 Å²	65.8	85%	0.846	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-19.9	168.4	55.5	0	0	0	0	112.9
321	N	87.4	Confident	91	Very high	31 Å²	31	65.3 Å²	65.3	17%	0.166	36%	0.361	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.2	-0	176.7	-72.6	-61.3	0	0	0	114.2	S319 D323 K324 W325	S319-N321 PolarHBondContact O-N 3.42Å; S319-N321 VanDerWaalsContact O-N 3.1Å; S319-N321 PolarHBondContact OG-N 3Å; N321-D323 PolarHBondContact O-N 3.49Å; N321-K324 WeakPolarHBondContact O-CB 3.4Å; N321-K324 PolarHBondContact O-N 3.19Å; N321-K324 WeakPolarHBondContact OD1-CE 3.5Å; N321-K324 PolarHBondContact OD1-NZ 3.37Å; N321-W325 HydrophobicContact CB-CD2 3.88Å; N321-W325 HydrophobicContact CB-CE3 4.36Å; N321-W325 HydrophobicContact CB-CG 4.44Å; N321-W325 HydrophobicContact CB-CH2 4Å; N321-W325 HydrophobicContact CB-CZ2 3.47Å; N321-W325 VanDerWaalsContact CB-CZ2 3.47Å; N321-W325 HydrophobicContact CB-CZ3 4.42Å; N321-W325 PolarHBondContact O-N 3.07Å
322	N	87.8	Confident	91	Very high	39 Å²	39	59.5 Å²	59.5	21%	0.209	34%	0.336	C	S	.	.	H	α-helix	trans	-56	-48.8	-172	-173.8	13.2	0	0	0	113	L313 P317 S319 K324 W325 N326	L313-N322 WeakPolarHBondContact CD2-OD1 3.41Å; P317-N322 PolarHBondContact O-ND2 3.12Å; S319-N322 WeakPolarHBondContact O-CB 3.35Å; S319-N322 PolarHBondContact O-N 3Å; N322-K324 VanDerWaalsContact C-N 3.34Å; N322-K324 PolarHBondContact O-N 2.65Å; N322-W325 PolarHBondContact O-N 3.38Å; N322-N326 WeakPolarHBondContact O-CB 3.33Å; N322-N326 PolarHBondContact O-N 2.59Å; N322-N326 PolarHBondContact O-ND2 3.48Å; N322-N326 PolarHBondContact OD1-ND2 3.08Å
323	D	89.2	Confident	91.1	Very high	133 Å²	133	64.4 Å²	64.4	71%	0.711	35%	0.354	S	S	*	.	H	α-helix	trans	-61.8	-41.6	179.2	-68.3	-26	0	0	0	112.4	N321 N326 S327	N321-D323 PolarHBondContact O-N 3.49Å; D323-N326 PolarHBondContact O-N 2.87Å; D323-S327 WeakPolarHBondContact O-CB 3.12Å; D323-S327 PolarHBondContact O-N 2.88Å
324	K	90.4	Very high	91.2	Very high	77 Å²	77	63.6 Å²	63.6	34%	0.335	35%	0.35	S	S	.	.	H	α-helix	trans	-60.7	-47.4	175.4	-178.3	-179	65.9	176.3	0	110.6	Q294 N321 N322 S327 L328	Q294-K324 VanDerWaalsContact OE1-CE 3.28Å; N321-K324 WeakPolarHBondContact O-CB 3.4Å; N321-K324 PolarHBondContact O-N 3.19Å; N321-K324 WeakPolarHBondContact OD1-CE 3.5Å; N321-K324 PolarHBondContact OD1-NZ 3.37Å; N322-K324 VanDerWaalsContact C-N 3.34Å; N322-K324 PolarHBondContact O-N 2.65Å; K324-S327 PolarHBondContact O-N 2.94Å; K324-L328 HydrophobicContact CG-CD1 4.22Å; K324-L328 WeakPolarHBondContact O-CG 3.35Å; K324-L328 PolarHBondContact O-N 3.04Å
325	W	93.3	Very high	91.2	Very high	2 Å²	2	63.4 Å²	63.4	1%	0.008	33%	0.333	C	S	.	.	H	α-helix	trans	-68.1	-38.7	-179.6	-65	-19.3	0	0	0	112.8	S286 L309 A312 L313 N321 N322 L328 L329	S286-W325 VanDerWaalsContact O-CH2 3.27Å; S286-W325 WeakPolarHBondContact O-CH2 3.32Å; L309-W325 HydrophobicContact CD2-CB 3.89Å; L309-W325 HydrophobicContact CD2-CG 3.84Å; A312-W325 HydrophobicContact CB-CD2 4.39Å; A312-W325 HydrophobicContact CB-CE3 3.92Å; A312-W325 HydrophobicContact CB-CH2 4.22Å; A312-W325 HydrophobicContact CB-CZ3 3.83Å; L313-W325 HydrophobicContact CD1-CB 4.26Å; L313-W325 HydrophobicContact CD2-CB 3.94Å; L313-W325 HydrophobicContact CD2-CE3 4.03Å; L313-W325 HydrophobicContact CG-CB 4.09Å; L313-W325 HydrophobicContact CG-CE3 4.25Å; N321-W325 HydrophobicContact CB-CD2 3.88Å; N321-W325 HydrophobicContact CB-CE3 4.36Å; N321-W325 HydrophobicContact CB-CG 4.44Å; N321-W325 HydrophobicContact CB-CH2 4Å; N321-W325 HydrophobicContact CB-CZ2 3.47Å; N321-W325 VanDerWaalsContact CB-CZ2 3.47Å; N321-W325 HydrophobicContact CB-CZ3 4.42Å; N321-W325 PolarHBondContact O-N 3.07Å; N322-W325 PolarHBondContact O-N 3.38Å; W325-L328 PolarHBondContact O-N 2.88Å; W325-L329 WeakPolarHBondContact O-CB 3.26Å; W325-L329 PolarHBondContact O-N 3.18Å
326	N	93.3	Very high	91.4	Very high	72 Å²	72	60.9 Å²	60.9	39%	0.385	32%	0.319	S	S	.	.	H	α-helix	trans	-63.8	-42.3	174	-79.3	-42.5	0	0	0	112.1	L313 N322 D323 L329 K330	L313-N326 WeakPolarHBondContact CD1-OD1 3.34Å; N322-N326 WeakPolarHBondContact O-CB 3.33Å; N322-N326 PolarHBondContact O-N 2.59Å; N322-N326 PolarHBondContact O-ND2 3.48Å; N322-N326 PolarHBondContact OD1-ND2 3.08Å; D323-N326 PolarHBondContact O-N 2.87Å; N326-L329 PolarHBondContact O-N 2.92Å; N326-K330 WeakPolarHBondContact O-CB 3.48Å; N326-K330 PolarHBondContact O-N 3.4Å
327	S	91.2	Very high	91.7	Very high	75 Å²	75	58.6 Å²	58.6	52%	0.524	31%	0.307	S	S	.	.	H	α-helix	trans	-61.3	-48.8	175.3	-177.5	0	0	0	0	111.4	D323 K324 L329 K330 V331	D323-S327 WeakPolarHBondContact O-CB 3.12Å; D323-S327 PolarHBondContact O-N 2.88Å; K324-S327 PolarHBondContact O-N 2.94Å; S327-L329 VanDerWaalsContact C-N 3.33Å; S327-L329 PolarHBondContact O-N 3.16Å; S327-K330 PolarHBondContact O-N 3.15Å; S327-V331 WeakPolarHBondContact O-CG2 3.3Å; S327-V331 PolarHBondContact O-N 3.21Å; S327-V331 VanDerWaalsContact O-N 3.1Å
328	L	93.7	Very high	92.1	Very high	38 Å²	38	55.6 Å²	55.6	20%	0.199	29%	0.288	C	S	.	.	H	α-helix	trans	-60	-43.2	174.1	-71.3	171.7	0	0	0	111.4	Q294 L309 K324 W325 K330 V331 N332	Q294-L328 HydrophobicContact CB-CD1 3.96Å; Q294-L328 HydrophobicContact CG-CD1 3.91Å; L309-L328 HydrophobicContact CD1-CB 3.71Å; K324-L328 HydrophobicContact CG-CD1 4.22Å; K324-L328 WeakPolarHBondContact O-CG 3.35Å; K324-L328 PolarHBondContact O-N 3.04Å; W325-L328 PolarHBondContact O-N 2.88Å; L328-K330 PolarHBondContact O-N 3.21Å; L328-V331 PolarHBondContact O-N 3.2Å; L328-N332 WeakPolarHBondContact O-CB 3.27Å; L328-N332 PolarHBondContact O-N 3.14Å; L328-N332 PolarHBondContact O-ND2 3.12Å
329	L	94.2	Very high	92.5	Very high	8 Å²	8	52.7 Å²	52.7	4%	0.042	28%	0.275	C	S	.	.	H	α-helix	trans	-62.6	-44	-179.6	-179.7	60.5	0	0	0	111.3	V306 L309 E310 L313 W325 N326 S327 N332 R333	V306-L329 HydrophobicContact CB-CD1 4.18Å; V306-L329 HydrophobicContact CG1-CD1 3.87Å; V306-L329 HydrophobicContact CG2-CD1 4.17Å; L309-L329 HydrophobicContact CB-CB 4.41Å; L309-L329 HydrophobicContact CB-CD1 4.28Å; L309-L329 HydrophobicContact CD1-CB 4.28Å; E310-L329 HydrophobicContact CG-CD1 3.83Å; E310-L329 HydrophobicContact CG-CD2 4Å; L313-L329 HydrophobicContact CD1-CD2 3.69Å; W325-L329 WeakPolarHBondContact O-CB 3.26Å; W325-L329 PolarHBondContact O-N 3.18Å; N326-L329 PolarHBondContact O-N 2.92Å; S327-L329 VanDerWaalsContact C-N 3.33Å; S327-L329 PolarHBondContact O-N 3.16Å; L329-N332 PolarHBondContact O-N 2.65Å; L329-R333 HydrophobicContact CD1-CG 4Å; L329-R333 HydrophobicContact CG-CG 4.4Å; L329-R333 VanDerWaalsContact O-CB 3.28Å; L329-R333 WeakPolarHBondContact O-CB 3.41Å; L329-R333 VanDerWaalsContact O-CG 3.28Å; L329-R333 WeakPolarHBondContact O-CG 3.36Å; L329-R333 PolarHBondContact O-N 2.67Å
330	K	94.1	Very high	93	Very high	99 Å²	99	55.8 Å²	55.8	43%	0.43	29%	0.288	S	S	.	.	H	α-helix	trans	-58.1	-52.7	175.4	-173.7	-171.9	176.9	-163.2	0	111	N326 S327 L328 N332 R333 Y334 V363 D364	N326-K330 WeakPolarHBondContact O-CB 3.48Å; N326-K330 PolarHBondContact O-N 3.4Å; S327-K330 PolarHBondContact O-N 3.15Å; L328-K330 PolarHBondContact O-N 3.21Å; K330-N332 PolarHBondContact O-N 3.35Å; K330-R333 PolarHBondContact O-N 2.88Å; K330-Y334 PolarHBondContact O-N 3.34Å; K330-V363 WeakPolarHBondContact CE-O 3.46Å; K330-V363 HydrophobicContact CG-CG1 3.77Å; K330-V363 VanDerWaalsContact O-CG1 3.32Å; K330-V363 WeakPolarHBondContact O-CG1 3.47Å; K330-D364 IonicContact NZ-OD2 2.66Å; K330-D364 PolarHBondContact NZ-OD2 3.48Å
331	V	93.2	Very high	93.5	Very high	64 Å²	64	50 Å²	50	39%	0.388	25%	0.247	S	C	.	.	H	α-helix	trans	-61.2	-45.4	-179.8	173.5	0	0	0	0	111.2	S327 L328 Y334 W335	S327-V331 WeakPolarHBondContact O-CG2 3.3Å; S327-V331 PolarHBondContact O-N 3.21Å; S327-V331 VanDerWaalsContact O-N 3.1Å; L328-V331 PolarHBondContact O-N 3.2Å; V331-Y334 PolarHBondContact O-N 3.04Å; V331-W335 PolarHBondContact O-N 3.39Å; V331-W335 VanDerWaalsContact O-N 3.12Å
332	N	95.4	Very high	93.9	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-69.8	-36.3	-179.5	-73.8	-77.5	0	0	0	112.6	S297 R302 A305 V306 L328 L329 K330 L336	S297-N332 VanDerWaalsContact CB-ND2 3.35Å; S297-N332 WeakPolarHBondContact CB-ND2 3.46Å; S297-N332 PolarHBondContact OG-ND2 3.07Å; S297-N332 PolarHBondContact OG-OD1 3.45Å; R302-N332 WeakPolarHBondContact CD-OD1 3.3Å; R302-N332 PolarHBondContact NH1-OD1 2.79Å; A305-N332 HydrophobicContact CB-CB 4.31Å; V306-N332 HydrophobicContact CG2-CB 3.77Å; L328-N332 WeakPolarHBondContact O-CB 3.27Å; L328-N332 PolarHBondContact O-N 3.14Å; L328-N332 PolarHBondContact O-ND2 3.12Å; L329-N332 PolarHBondContact O-N 2.65Å; K330-N332 PolarHBondContact O-N 3.35Å; N332-L336 WeakPolarHBondContact O-CB 3.43Å; N332-L336 PolarHBondContact O-N 3.38Å
333	R	95.6	Very high	94.2	Very high	103 Å²	103	53 Å²	53	39%	0.389	27%	0.271	S	S	.	.	H	α-helix	trans	-64.1	-43.1	174.3	-79.7	178.2	174.7	168.4	-2.8	111.8	V306 E310 L329 K330 A337 V363	V306-R333 HydrophobicContact CG1-CG 4.05Å; V306-R333 HydrophobicContact CG2-CG 3.86Å; E310-R333 IonicContact OE1-CZ 2.73Å; E310-R333 VanDerWaalsContact OE1-CZ 3.3Å; E310-R333 IonicContact OE1-NE 2.66Å; E310-R333 PolarHBondContact OE1-NE 3.07Å; E310-R333 VanDerWaalsContact OE1-NE 3.13Å; E310-R333 IonicContact OE1-NH2 3.56Å; E310-R333 PolarHBondContact OE1-NH2 3.48Å; L329-R333 HydrophobicContact CD1-CG 4Å; L329-R333 HydrophobicContact CG-CG 4.4Å; L329-R333 VanDerWaalsContact O-CB 3.28Å; L329-R333 WeakPolarHBondContact O-CB 3.41Å; L329-R333 VanDerWaalsContact O-CG 3.28Å; L329-R333 WeakPolarHBondContact O-CG 3.36Å; L329-R333 PolarHBondContact O-N 2.67Å; K330-R333 PolarHBondContact O-N 2.88Å; R333-A337 WeakPolarHBondContact O-CB 3.49Å; R333-A337 PolarHBondContact O-N 3.01Å; R333-V363 HydrophobicContact CB-CG1 4.28Å; R333-V363 HydrophobicContact CB-CG2 4.39Å
334	Y	95.8	Very high	94.6	Very high	5 Å²	5	47 Å²	47	2%	0.02	24%	0.24	C	C	.	.	H	α-helix	trans	-56.6	-59	175.2	177.7	-94.5	0	0	0	110.8	K330 V331 L336 A337 I338 A360 D364 D367 A370	K330-Y334 PolarHBondContact O-N 3.34Å; V331-Y334 PolarHBondContact O-N 3.04Å; Y334-L336 VanDerWaalsContact C-N 3.33Å; Y334-L336 PolarHBondContact O-N 3.12Å; Y334-A337 WeakPolarHBondContact O-CB 3.38Å; Y334-A337 PolarHBondContact O-N 3.3Å; Y334-A337 VanDerWaalsContact O-N 3.13Å; Y334-I338 HydrophobicContact CD1-CG1 4.19Å; Y334-I338 HydrophobicContact CE1-CD1 4.34Å; Y334-I338 HydrophobicContact CE1-CG1 3.75Å; Y334-I338 HydrophobicContact CE2-CD1 4.5Å; Y334-I338 WeakPolarHBondContact O-CG1 3.47Å; Y334-I338 PolarHBondContact O-N 2.93Å; Y334-A360 HydrophobicContact CD2-CB 4.04Å; Y334-A360 WeakPolarHBondContact CD2-O 3.35Å; Y334-A360 HydrophobicContact CE2-CB 4.02Å; Y334-D364 HydrophobicContact CD2-CB 3.54Å; Y334-D364 HydrophobicContact CE2-CB 3.93Å; Y334-D364 WeakPolarHBondContact CE2-O 3.18Å; Y334-D364 HydrophobicContact CG-CB 4.17Å; Y334-D367 HydrophobicContact CE1-CB 4.12Å; Y334-D367 HydrophobicContact CE2-CB 4.33Å; Y334-D367 WeakPolarHBondContact OH-CB 3.37Å; Y334-D367 PolarHBondContact OH-OD1 3.38Å; Y334-A370 HydrophobicContact CE2-CB 4.12Å; Y334-A370 PolarHBondContact OH-N 2.88Å; Y334-A370 VanDerWaalsContact OH-N 3.16Å
335	W	94.3	Very high	94.8	Very high	75 Å²	75	44.9 Å²	44.9	28%	0.284	23%	0.232	S	C	.	.	H	α-helix	trans	-67.2	-31.2	-176.7	-73.5	111.1	0	0	0	113.7	R302 V331 I338 Q339 Y369	R302-W335 HydrophobicContact CG-CB 4.49Å; V331-W335 PolarHBondContact O-N 3.39Å; V331-W335 VanDerWaalsContact O-N 3.12Å; W335-I338 HydrophobicContact CE3-CB 4.27Å; W335-I338 HydrophobicContact CE3-CG1 4.33Å; W335-I338 HydrophobicContact CE3-CG2 4.31Å; W335-I338 HydrophobicContact CZ3-CG2 4.36Å; W335-I338 PolarHBondContact O-N 3.09Å; W335-Q339 WeakPolarHBondContact O-CB 3.26Å; W335-Q339 PolarHBondContact O-N 2.89Å; W335-Y369 AromaticContact CH2-CD2 3.44Å; W335-Y369 HydrophobicContact CH2-CD2 3.44Å; W335-Y369 VanDerWaalsContact CH2-CD2 3.44Å; W335-Y369 AromaticContact CH2-CE2 3.73Å; W335-Y369 HydrophobicContact CH2-CE2 3.73Å; W335-Y369 AromaticContact CH2-CG 3.97Å; W335-Y369 HydrophobicContact CH2-CG 3.97Å; W335-Y369 HydrophobicContact CZ2-CD2 4.47Å; W335-Y369 HydrophobicContact CZ3-CD1 4.49Å; W335-Y369 AromaticContact CZ3-CD2 3.98Å; W335-Y369 HydrophobicContact CZ3-CD2 3.98Å; W335-Y369 HydrophobicContact CZ3-CE2 4.39Å; W335-Y369 HydrophobicContact CZ3-CG 4.03Å
336	L	95.6	Very high	94.8	Very high	27 Å²	27	54 Å²	54	14%	0.141	27%	0.272	C	S	.	.	H	α-helix	trans	-63.4	-43.1	172.5	-179.4	61.4	0	0	0	111.2	R302 A303 V306 N332 Y334 Q339 Q340	R302-L336 HydrophobicContact CB-CB 3.95Å; R302-L336 HydrophobicContact CB-CD1 4.18Å; A303-L336 HydrophobicContact CB-CD1 4.07Å; A303-L336 HydrophobicContact CB-CD2 4.49Å; V306-L336 HydrophobicContact CB-CD2 4.5Å; V306-L336 HydrophobicContact CG2-CD2 4.16Å; N332-L336 WeakPolarHBondContact O-CB 3.43Å; N332-L336 PolarHBondContact O-N 3.38Å; Y334-L336 VanDerWaalsContact C-N 3.33Å; Y334-L336 PolarHBondContact O-N 3.12Å; L336-Q339 PolarHBondContact O-N 3.17Å; L336-Q340 HydrophobicContact CD1-CG 4.26Å; L336-Q340 WeakPolarHBondContact O-CB 3.45Å; L336-Q340 VanDerWaalsContact O-CG 3.24Å; L336-Q340 WeakPolarHBondContact O-CG 3.41Å; L336-Q340 PolarHBondContact O-N 2.71Å
337	A	96	Very high	94.9	Very high	3 Å²	3	53.4 Å²	53.4	3%	0.025	28%	0.277	C	S	.	.	H	α-helix	trans	-66.1	-40.7	177.4	0	0	0	0	0	111.8	R333 Y334 Q340 G341 A360	R333-A337 WeakPolarHBondContact O-CB 3.49Å; R333-A337 PolarHBondContact O-N 3.01Å; Y334-A337 WeakPolarHBondContact O-CB 3.38Å; Y334-A337 PolarHBondContact O-N 3.3Å; Y334-A337 VanDerWaalsContact O-N 3.13Å; A337-Q340 PolarHBondContact O-N 3.14Å; A337-G341 PolarHBondContact O-N 3.49Å; A337-A360 HydrophobicContact CB-CB 3.79Å
338	I	96	Very high	95	Very high	5 Å²	5	56 Å²	56	3%	0.026	28%	0.284	C	S	.	.	H	α-helix	trans	-57.7	-54.1	171.1	-62.5	-57.6	0	0	0	110.8	Y334 W335 Q340 G341 D342 F357 A360 A370	Y334-I338 HydrophobicContact CD1-CG1 4.19Å; Y334-I338 HydrophobicContact CE1-CD1 4.34Å; Y334-I338 HydrophobicContact CE1-CG1 3.75Å; Y334-I338 HydrophobicContact CE2-CD1 4.5Å; Y334-I338 WeakPolarHBondContact O-CG1 3.47Å; Y334-I338 PolarHBondContact O-N 2.93Å; W335-I338 HydrophobicContact CE3-CB 4.27Å; W335-I338 HydrophobicContact CE3-CG1 4.33Å; W335-I338 HydrophobicContact CE3-CG2 4.31Å; W335-I338 HydrophobicContact CZ3-CG2 4.36Å; W335-I338 PolarHBondContact O-N 3.09Å; I338-Q340 VanDerWaalsContact C-N 3.3Å; I338-Q340 PolarHBondContact O-N 3.33Å; I338-G341 WeakPolarHBondContact O-CA 3.44Å; I338-G341 PolarHBondContact O-N 3.02Å; I338-D342 PolarHBondContact O-N 3.24Å; I338-F357 HydrophobicContact CD1-CD1 3.8Å; I338-F357 HydrophobicContact CD1-CE1 4.1Å; I338-F357 HydrophobicContact CG2-CE1 4.42Å; I338-A360 HydrophobicContact CD1-CB 3.57Å; I338-A360 HydrophobicContact CG1-CB 4.07Å; I338-A370 HydrophobicContact CD1-CB 3.92Å
339	Q	94.4	Very high	95	Very high	115 Å²	115	58.2 Å²	58.2	54%	0.537	30%	0.297	S	S	.	.	H	α-helix	trans	-58.1	-41.1	-178.9	-178.2	-174.1	-18.6	0	0	112.4	W335 L336 A343	W335-Q339 WeakPolarHBondContact O-CB 3.26Å; W335-Q339 PolarHBondContact O-N 2.89Å; L336-Q339 PolarHBondContact O-N 3.17Å; Q339-A343 WeakPolarHBondContact O-CB 3.38Å; Q339-A343 PolarHBondContact O-N 3.03Å; Q339-A343 VanDerWaalsContact O-N 3.07Å
340	Q	95.9	Very high	95.1	Very high	80 Å²	80	59.1 Å²	59.1	37%	0.374	30%	0.303	S	S	.	.	H	α-helix	trans	-70	-35.7	176.6	-70.8	176.8	-5.1	0	0	111.9	L336 A337 I338 A343 A344 L356	L336-Q340 HydrophobicContact CD1-CG 4.26Å; L336-Q340 WeakPolarHBondContact O-CB 3.45Å; L336-Q340 VanDerWaalsContact O-CG 3.24Å; L336-Q340 WeakPolarHBondContact O-CG 3.41Å; L336-Q340 PolarHBondContact O-N 2.71Å; A337-Q340 PolarHBondContact O-N 3.14Å; I338-Q340 VanDerWaalsContact C-N 3.3Å; I338-Q340 PolarHBondContact O-N 3.33Å; Q340-A343 PolarHBondContact O-N 3.16Å; Q340-A344 WeakPolarHBondContact O-CB 3.39Å; Q340-A344 PolarHBondContact O-N 2.83Å; Q340-L356 HydrophobicContact CB-CD1 3.73Å; Q340-L356 HydrophobicContact CB-CD2 4.02Å; Q340-L356 HydrophobicContact CB-CG 4.42Å; Q340-L356 WeakPolarHBondContact O-CD1 3.47Å
341	G	96.8	Very high	95.1	Very high	0 Å²	0	59.3 Å²	59.3	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-62.9	-48.6	175.2	0	0	0	0	0	111.8	A337 I338 A343 A344 L345 A353 F357	A337-G341 PolarHBondContact O-N 3.49Å; I338-G341 WeakPolarHBondContact O-CA 3.44Å; I338-G341 PolarHBondContact O-N 3.02Å; G341-A343 VanDerWaalsContact C-N 3.35Å; G341-A343 PolarHBondContact O-N 3.05Å; G341-A344 WeakPolarHBondContact O-CB 3.09Å; G341-A344 PolarHBondContact O-N 3.26Å; G341-A344 VanDerWaalsContact O-N 3.14Å; G341-L345 PolarHBondContact O-N 2.78Å; G341-A353 WeakPolarHBondContact O-CB 3.4Å; G341-F357 VanDerWaalsContact C-CZ 3.47Å
342	D	95	Very high	95.3	Very high	74 Å²	74	63.3 Å²	63.3	40%	0.396	32%	0.317	S	S	.	.	H	α-helix	trans	-59.8	-44.1	175.4	-66.2	-25.8	0	0	0	111.6	I338 A344 L345 K346 F357	I338-D342 PolarHBondContact O-N 3.24Å; D342-A344 VanDerWaalsContact C-N 3.32Å; D342-A344 PolarHBondContact O-N 3.22Å; D342-L345 PolarHBondContact O-N 2.59Å; D342-K346 WeakPolarHBondContact O-CB 3.47Å; D342-K346 PolarHBondContact O-N 3.16Å; D342-F357 WeakPolarHBondContact OD1-CZ 3.28Å
343	A	95.3	Very high	95.4	Very high	57 Å²	57	63.3 Å²	63.3	47%	0.471	32%	0.317	S	S	.	.	H	α-helix	trans	-63.3	-38.1	176.2	0	0	0	0	0	112.1	Q339 Q340 G341 K346 A347	Q339-A343 WeakPolarHBondContact O-CB 3.38Å; Q339-A343 PolarHBondContact O-N 3.03Å; Q339-A343 VanDerWaalsContact O-N 3.07Å; Q340-A343 PolarHBondContact O-N 3.16Å; G341-A343 VanDerWaalsContact C-N 3.35Å; G341-A343 PolarHBondContact O-N 3.05Å; A343-K346 PolarHBondContact O-N 3.23Å; A343-A347 WeakPolarHBondContact O-CB 3.32Å; A343-A347 PolarHBondContact O-N 2.93Å
344	A	96.7	Very high	95.5	Very high	7 Å²	7	60.9 Å²	60.9	6%	0.058	31%	0.31	C	S	.	.	H	α-helix	trans	-67.4	-39.7	175.8	0	0	0	0	0	112.1	Q340 G341 D342 A347 N348 N349 R352 A353 L356	Q340-A344 WeakPolarHBondContact O-CB 3.39Å; Q340-A344 PolarHBondContact O-N 2.83Å; G341-A344 WeakPolarHBondContact O-CB 3.09Å; G341-A344 PolarHBondContact O-N 3.26Å; G341-A344 VanDerWaalsContact O-N 3.14Å; D342-A344 VanDerWaalsContact C-N 3.32Å; D342-A344 PolarHBondContact O-N 3.22Å; A344-A347 CarbonylContact O-C 3.53Å; A344-A347 PolarHBondContact O-N 3.38Å; A344-N348 PolarHBondContact O-N 3.1Å; A344-N349 PolarHBondContact O-N 3.41Å; A344-R352 HydrophobicContact CB-CB 4.18Å; A344-R352 HydrophobicContact CB-CG 4.14Å; A344-A353 HydrophobicContact CB-CB 3.91Å; A344-L356 HydrophobicContact CB-CD1 4.35Å
345	L	94.2	Very high	95.5	Very high	33 Å²	33	68.7 Å²	68.7	17%	0.173	34%	0.339	C	S	.	.	H	α-helix	trans	-61	-47.7	171.6	-84.3	176	0	0	0	111.9	G341 D342 A347 N348 A353 F357 D376 V377 A380	G341-L345 PolarHBondContact O-N 2.78Å; D342-L345 PolarHBondContact O-N 2.59Å; L345-A347 PolarHBondContact O-N 3.15Å; L345-N348 WeakPolarHBondContact O-CA 3.36Å; L345-N348 PolarHBondContact O-N 3.23Å; L345-A353 HydrophobicContact CD2-CB 4.08Å; L345-A353 HydrophobicContact CG-CB 3.69Å; L345-F357 HydrophobicContact CD1-CE2 3.71Å; L345-F357 HydrophobicContact CD1-CZ 4.1Å; L345-F357 HydrophobicContact CG-CE2 4.28Å; L345-D376 HydrophobicContact CD1-CB 3.62Å; L345-V377 HydrophobicContact CD1-CG2 4.19Å; L345-V377 HydrophobicContact CD2-CB 4.38Å; L345-V377 HydrophobicContact CD2-CG2 3.74Å; L345-V377 HydrophobicContact CG-CG2 4.11Å; L345-A380 HydrophobicContact CD2-CB 4.03Å
346	K	93.5	Very high	95.7	Very high	195 Å²	195	65.9 Å²	65.9	85%	0.848	33%	0.33	S	S	*	.	H	α-helix	trans	-61.5	-30.9	177.4	-167.7	174.7	-176.6	176.3	0	112.4	D342 A343 N348	D342-K346 WeakPolarHBondContact O-CB 3.47Å; D342-K346 PolarHBondContact O-N 3.16Å; A343-K346 PolarHBondContact O-N 3.23Å; K346-N348 PolarHBondContact O-N 3.08Å
347	A	94.8	Very high	95.8	Very high	59 Å²	59	64.6 Å²	64.6	49%	0.488	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.3	11	173.1	0	0	0	0	0	113.9	A343 A344 L345 N349	A343-A347 WeakPolarHBondContact O-CB 3.32Å; A343-A347 PolarHBondContact O-N 2.93Å; A344-A347 CarbonylContact O-C 3.53Å; A344-A347 PolarHBondContact O-N 3.38Å; L345-A347 PolarHBondContact O-N 3.15Å; A347-N349 VanDerWaalsContact C-N 3.32Å; A347-N349 PolarHBondContact O-N 3.3Å; A347-N349 PolarHBondContact O-ND2 3.1Å
348	N	93.3	Very high	95.8	Very high	128 Å²	128	68.3 Å²	68.3	68%	0.684	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.4	35.3	179.7	-159.8	41.9	0	0	0	114.6	A344 L345 K346 P350	A344-N348 PolarHBondContact O-N 3.1Å; L345-N348 WeakPolarHBondContact O-CA 3.36Å; L345-N348 PolarHBondContact O-N 3.23Å; K346-N348 PolarHBondContact O-N 3.08Å; N348-P350 VanDerWaalsContact C-CD 3.47Å; N348-P350 VanDerWaalsContact O-CD 3.24Å; N348-P350 WeakPolarHBondContact O-CD 3.33Å
349	N	95.6	Very high	95.7	Very high	86 Å²	86	73 Å²	73	46%	0.46	36%	0.362	S	S	.	.			trans	-115	74.7	178.9	-71.1	-51.2	0	0	0	111.5	A344 A347 D351 R352 A353	A344-N349 PolarHBondContact O-N 3.41Å; A347-N349 VanDerWaalsContact C-N 3.32Å; A347-N349 PolarHBondContact O-N 3.3Å; A347-N349 PolarHBondContact O-ND2 3.1Å; N349-D351 VanDerWaalsContact C-N 3.34Å; N349-D351 PolarHBondContact O-N 3.39Å; N349-R352 HydrophobicContact CB-CB 4.31Å; N349-R352 PolarHBondContact O-N 3.44Å; N349-A353 PolarHBondContact O-N 3.23Å; N349-A353 VanDerWaalsContact O-N 3.14Å
350	P	94.8	Very high	95.7	Very high	27 Å²	27	67.5 Å²	67.5	18%	0.175	34%	0.336	C	S	.	.	H	α-helix	trans	-62.5	-34.9	-173.6	24.3	-34.1	0	0	0	113.6	N348 R352 A353 E354 V377 R381	N348-P350 VanDerWaalsContact C-CD 3.47Å; N348-P350 VanDerWaalsContact O-CD 3.24Å; N348-P350 WeakPolarHBondContact O-CD 3.33Å; P350-R352 VanDerWaalsContact C-N 3.32Å; P350-R352 PolarHBondContact O-N 3.39Å; P350-A353 PolarHBondContact O-N 3.22Å; P350-E354 WeakPolarHBondContact O-CB 3.29Å; P350-E354 PolarHBondContact O-N 2.87Å; P350-V377 HydrophobicContact CB-CG1 4.12Å; P350-R381 HydrophobicContact CB-CG 3.99Å; P350-R381 HydrophobicContact CG-CG 4.2Å
351	D	95.4	Very high	95.6	Very high	102 Å²	102	68.1 Å²	68.1	55%	0.545	34%	0.335	S	S	.	.	H	α-helix	trans	-66.7	-33.9	-179.6	-57.5	-18.6	0	0	0	113	N349 R355 R381	N349-D351 VanDerWaalsContact C-N 3.34Å; N349-D351 PolarHBondContact O-N 3.39Å; D351-R355 PolarHBondContact O-NE 3.42Å; D351-R381 IonicContact OD1-CZ 3.71Å; D351-R381 IonicContact OD1-NE 3.48Å; D351-R381 IonicContact OD1-NH2 3.81Å; D351-R381 PolarHBondContact OD1-NH2 2.91Å
352	R	96.7	Very high	95.5	Very high	148 Å²	148	74.9 Å²	74.9	56%	0.558	37%	0.371	S	S	*	.	H	α-helix	trans	-74.2	-42.8	175	-176.4	175.1	-178.8	172.2	0.5	110.2	A344 N349 P350 E354 R355 L356	A344-R352 HydrophobicContact CB-CB 4.18Å; A344-R352 HydrophobicContact CB-CG 4.14Å; N349-R352 HydrophobicContact CB-CB 4.31Å; N349-R352 PolarHBondContact O-N 3.44Å; P350-R352 VanDerWaalsContact C-N 3.32Å; P350-R352 PolarHBondContact O-N 3.39Å; R352-E354 VanDerWaalsContact C-N 3.35Å; R352-R355 PolarHBondContact O-N 2.78Å; R352-L356 HydrophobicContact CG-CD1 3.89Å; R352-L356 WeakPolarHBondContact O-CD1 3.43Å; R352-L356 WeakPolarHBondContact O-CG 3.45Å; R352-L356 PolarHBondContact O-N 3.08Å
353	A	97.2	Very high	95.3	Very high	0 Å²	0	73.1 Å²	73.1	0%	0	36%	0.363	C	S	.	.	H	α-helix	trans	-59.7	-45	177.1	0	0	0	0	0	111.9	G341 A344 L345 N349 P350 R355 L356 F357 V377	G341-A353 WeakPolarHBondContact O-CB 3.4Å; A344-A353 HydrophobicContact CB-CB 3.91Å; L345-A353 HydrophobicContact CD2-CB 4.08Å; L345-A353 HydrophobicContact CG-CB 3.69Å; N349-A353 PolarHBondContact O-N 3.23Å; N349-A353 VanDerWaalsContact O-N 3.14Å; P350-A353 PolarHBondContact O-N 3.22Å; A353-R355 PolarHBondContact O-N 3.36Å; A353-L356 PolarHBondContact O-N 3.48Å; A353-L356 VanDerWaalsContact O-N 3.13Å; A353-F357 HydrophobicContact CB-CD2 4.32Å; A353-F357 HydrophobicContact CB-CE2 4.04Å; A353-F357 WeakPolarHBondContact O-CD2 3.33Å; A353-F357 PolarHBondContact O-N 3.41Å; A353-V377 HydrophobicContact CB-CG2 3.65Å
354	E	97.1	Very high	95	Very high	52 Å²	52	72 Å²	72	24%	0.243	35%	0.349	C	S	.	.	H	α-helix	trans	-55.5	-49.7	178.2	-170.2	176.3	-177.9	0	0	112.3	P350 R352 L356 F357 Q358 L374 V377 R381	P350-E354 WeakPolarHBondContact O-CB 3.29Å; P350-E354 PolarHBondContact O-N 2.87Å; R352-E354 VanDerWaalsContact C-N 3.35Å; E354-L356 VanDerWaalsContact C-N 3.29Å; E354-L356 PolarHBondContact O-N 3.27Å; E354-F357 PolarHBondContact O-N 3.12Å; E354-Q358 WeakPolarHBondContact O-CB 3.34Å; E354-Q358 VanDerWaalsContact O-CG 3.28Å; E354-Q358 WeakPolarHBondContact O-CG 3.45Å; E354-Q358 PolarHBondContact O-N 3.3Å; E354-Q358 PolarHBondContact OE1-NE2 3.1Å; E354-L374 HydrophobicContact CG-CD2 4.01Å; E354-V377 HydrophobicContact CB-CG1 4.12Å; E354-R381 IonicContact OE2-CZ 2.65Å; E354-R381 VanDerWaalsContact OE2-CZ 3.22Å; E354-R381 IonicContact OE2-NH1 3.65Å; E354-R381 PolarHBondContact OE2-NH1 2.96Å; E354-R381 IonicContact OE2-NH2 3.85Å; E354-R381 PolarHBondContact OE2-NH2 3.27Å
355	R	97.3	Very high	94.7	Very high	170 Å²	170	77.1 Å²	77.1	64%	0.642	38%	0.375	S	S	*	.	H	α-helix	trans	-60.5	-38.5	178.3	-73.3	-174.3	-71.5	174.8	-2.8	112.4	D351 R352 A353 Q359	D351-R355 PolarHBondContact O-NE 3.42Å; R352-R355 PolarHBondContact O-N 2.78Å; A353-R355 PolarHBondContact O-N 3.36Å; R355-Q359 WeakPolarHBondContact O-CB 3.27Å; R355-Q359 PolarHBondContact O-N 3.45Å
356	L	97.6	Very high	94.4	Very high	15 Å²	15	80.6 Å²	80.6	8%	0.079	40%	0.398	C	S	.	.	H	α-helix	trans	-70.4	-42.1	179.5	-71	163.6	0	0	0	111.8	Q340 A344 R352 A353 E354 Q359 A360	Q340-L356 HydrophobicContact CB-CD1 3.73Å; Q340-L356 HydrophobicContact CB-CD2 4.02Å; Q340-L356 HydrophobicContact CB-CG 4.42Å; Q340-L356 WeakPolarHBondContact O-CD1 3.47Å; A344-L356 HydrophobicContact CB-CD1 4.35Å; R352-L356 HydrophobicContact CG-CD1 3.89Å; R352-L356 WeakPolarHBondContact O-CD1 3.43Å; R352-L356 WeakPolarHBondContact O-CG 3.45Å; R352-L356 PolarHBondContact O-N 3.08Å; A353-L356 PolarHBondContact O-N 3.48Å; A353-L356 VanDerWaalsContact O-N 3.13Å; E354-L356 VanDerWaalsContact C-N 3.29Å; E354-L356 PolarHBondContact O-N 3.27Å; L356-Q359 WeakPolarHBondContact O-CB 3.43Å; L356-Q359 PolarHBondContact O-N 2.84Å; L356-A360 PolarHBondContact O-N 2.88Å
357	F	97.5	Very high	94.2	Very high	0 Å²	0	73.6 Å²	73.6	0%	0	37%	0.37	C	S	.	.	H	α-helix	trans	-68.4	-35.3	174.3	-67.2	-56.1	0	0	0	112.6	I338 G341 D342 L345 A353 E354 A360 R361 G373 L374 V377	I338-F357 HydrophobicContact CD1-CD1 3.8Å; I338-F357 HydrophobicContact CD1-CE1 4.1Å; I338-F357 HydrophobicContact CG2-CE1 4.42Å; G341-F357 VanDerWaalsContact C-CZ 3.47Å; D342-F357 WeakPolarHBondContact OD1-CZ 3.28Å; L345-F357 HydrophobicContact CD1-CE2 3.71Å; L345-F357 HydrophobicContact CD1-CZ 4.1Å; L345-F357 HydrophobicContact CG-CE2 4.28Å; A353-F357 HydrophobicContact CB-CD2 4.32Å; A353-F357 HydrophobicContact CB-CE2 4.04Å; A353-F357 WeakPolarHBondContact O-CD2 3.33Å; A353-F357 PolarHBondContact O-N 3.41Å; E354-F357 PolarHBondContact O-N 3.12Å; F357-A360 PolarHBondContact O-N 2.87Å; F357-R361 WeakPolarHBondContact O-CB 3.36Å; F357-R361 PolarHBondContact O-N 3.44Å; F357-G373 VanDerWaalsContact CD2-C 3.45Å; F357-G373 WeakPolarHBondContact CD2-O 3.42Å; F357-G373 WeakPolarHBondContact CE2-O 3.46Å; F357-L374 HydrophobicContact CB-CD2 3.93Å; F357-L374 HydrophobicContact CB-CG 3.96Å; F357-V377 HydrophobicContact CD2-CG2 3.92Å; F357-V377 HydrophobicContact CE2-CG2 4.01Å
358	Q	95.9	Very high	94.1	Very high	82 Å²	82	71.2 Å²	71.2	38%	0.383	35%	0.35	S	S	.	.	H	α-helix	trans	-63.3	-41.8	170.3	-73.1	173.9	3.6	0	0	111.5	E354 R361 N362 L374	E354-Q358 WeakPolarHBondContact O-CB 3.34Å; E354-Q358 VanDerWaalsContact O-CG 3.28Å; E354-Q358 WeakPolarHBondContact O-CG 3.45Å; E354-Q358 PolarHBondContact O-N 3.3Å; E354-Q358 PolarHBondContact OE1-NE2 3.1Å; Q358-R361 PolarHBondContact O-N 2.98Å; Q358-N362 PolarHBondContact O-N 3.43Å; Q358-N362 PolarHBondContact O-ND2 3.19Å; Q358-N362 PolarHBondContact O-OD1 3.39Å; Q358-L374 HydrophobicContact CG-CD2 4.2Å
359	Q	94.9	Very high	94.1	Very high	103 Å²	103	69.5 Å²	69.5	48%	0.481	33%	0.334	S	S	.	.	H	α-helix	trans	-61.7	-45.4	173.8	-176.5	-178.5	4.6	0	0	111.4	R355 L356 R361 N362 V363	R355-Q359 WeakPolarHBondContact O-CB 3.27Å; R355-Q359 PolarHBondContact O-N 3.45Å; L356-Q359 WeakPolarHBondContact O-CB 3.43Å; L356-Q359 PolarHBondContact O-N 2.84Å; Q359-R361 VanDerWaalsContact C-N 3.33Å; Q359-R361 PolarHBondContact O-N 3.3Å; Q359-N362 PolarHBondContact O-N 2.86Å; Q359-V363 WeakPolarHBondContact O-CG2 3.43Å; Q359-V363 PolarHBondContact O-N 3.38Å; Q359-V363 VanDerWaalsContact O-N 3.09Å
360	A	94.9	Very high	94	Very high	0 Å²	0	65.4 Å²	65.4	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-56.8	-48.8	175	0	0	0	0	0	110.6	Y334 A337 I338 L356 F357 N362 V363 D364 A370	Y334-A360 HydrophobicContact CD2-CB 4.04Å; Y334-A360 WeakPolarHBondContact CD2-O 3.35Å; Y334-A360 HydrophobicContact CE2-CB 4.02Å; A337-A360 HydrophobicContact CB-CB 3.79Å; I338-A360 HydrophobicContact CD1-CB 3.57Å; I338-A360 HydrophobicContact CG1-CB 4.07Å; L356-A360 PolarHBondContact O-N 2.88Å; F357-A360 PolarHBondContact O-N 2.87Å; A360-N362 VanDerWaalsContact C-N 3.27Å; A360-N362 PolarHBondContact O-N 3.02Å; A360-V363 WeakPolarHBondContact O-CB 3.25Å; A360-V363 PolarHBondContact O-N 2.96Å; A360-D364 PolarHBondContact O-N 3.33Å; A360-A370 HydrophobicContact CB-CB 4.01Å
361	R	94	Very high	94.1	Very high	93 Å²	93	64.2 Å²	64.2	35%	0.351	31%	0.305	S	S	.	.	H	α-helix	trans	-60.7	-32.7	177.7	-170.6	174.6	178.1	-174.9	-2	113.6	F357 Q358 Q359 V363 D364 N365 A370	F357-R361 WeakPolarHBondContact O-CB 3.36Å; F357-R361 PolarHBondContact O-N 3.44Å; Q358-R361 PolarHBondContact O-N 2.98Å; Q359-R361 VanDerWaalsContact C-N 3.33Å; Q359-R361 PolarHBondContact O-N 3.3Å; R361-V363 VanDerWaalsContact C-N 3.34Å; R361-D364 WeakPolarHBondContact CA-O 3.34Å; R361-D364 CarbonylContact O-C 3.55Å; R361-N365 HydrophobicContact CG-CB 4.41Å; R361-N365 WeakPolarHBondContact O-CB 3.43Å; R361-N365 PolarHBondContact O-N 2.87Å; R361-A370 HydrophobicContact CB-CB 3.95Å
362	N	94.1	Very high	94.1	Very high	141 Å²	141	59.6 Å²	59.6	75%	0.754	28%	0.28	S	S	*	.	H	α-helix	trans	-73	-27.3	175.2	-68.5	-20	0	0	0	112.5	Q358 Q359 A360	Q358-N362 PolarHBondContact O-N 3.43Å; Q358-N362 PolarHBondContact O-ND2 3.19Å; Q358-N362 PolarHBondContact O-OD1 3.39Å; Q359-N362 PolarHBondContact O-N 2.86Å; A360-N362 VanDerWaalsContact C-N 3.27Å; A360-N362 PolarHBondContact O-N 3.02Å
363	V	91.5	Very high	94.1	Very high	37 Å²	37	52.6 Å²	52.6	22%	0.224	25%	0.254	C	S	.	.	H	α-helix	trans	-78.6	-45	175.1	175.8	0	0	0	0	110.7	K330 R333 Q359 A360 R361	K330-V363 WeakPolarHBondContact CE-O 3.46Å; K330-V363 HydrophobicContact CG-CG1 3.77Å; K330-V363 VanDerWaalsContact O-CG1 3.32Å; K330-V363 WeakPolarHBondContact O-CG1 3.47Å; R333-V363 HydrophobicContact CB-CG1 4.28Å; R333-V363 HydrophobicContact CB-CG2 4.39Å; Q359-V363 WeakPolarHBondContact O-CG2 3.43Å; Q359-V363 PolarHBondContact O-N 3.38Å; Q359-V363 VanDerWaalsContact O-N 3.09Å; A360-V363 WeakPolarHBondContact O-CB 3.25Å; A360-V363 PolarHBondContact O-N 2.96Å; R361-V363 VanDerWaalsContact C-N 3.34Å
364	D	88.8	Confident	94.1	Very high	33 Å²	33	53 Å²	53	18%	0.176	26%	0.256	C	S	.	.			trans	-144.9	118.5	174.7	-156.6	-36.6	0	0	0	110.6	K330 Y334 A360 R361 T366	K330-D364 IonicContact NZ-OD2 2.66Å; K330-D364 PolarHBondContact NZ-OD2 3.48Å; Y334-D364 HydrophobicContact CD2-CB 3.54Å; Y334-D364 HydrophobicContact CE2-CB 3.93Å; Y334-D364 WeakPolarHBondContact CE2-O 3.18Å; Y334-D364 HydrophobicContact CG-CB 4.17Å; A360-D364 PolarHBondContact O-N 3.33Å; R361-D364 WeakPolarHBondContact CA-O 3.34Å; R361-D364 CarbonylContact O-C 3.55Å; D364-T366 WeakPolarHBondContact OD1-CB 3.37Å; D364-T366 PolarHBondContact OD1-N 3.31Å; D364-T366 PolarHBondContact OD1-OG1 3.01Å
365	N	89.6	Confident	94	Very high	116 Å²	116	50.5 Å²	50.5	62%	0.62	24%	0.244	S	C	*	.	S	Bend	trans	-100.4	1.4	179.4	66.5	2.1	0	0	0	113.1	R361	R361-N365 HydrophobicContact CG-CB 4.41Å; R361-N365 WeakPolarHBondContact O-CB 3.43Å; R361-N365 PolarHBondContact O-N 2.87Å
366	T	88.1	Confident	94	Very high	106 Å²	106	44.6 Å²	44.6	65%	0.65	23%	0.226	S	C	*	.	S	Bend	trans	-87.9	-25.1	-179.2	66.2	0	0	0	0	112.5	D364	D364-T366 WeakPolarHBondContact OD1-CB 3.37Å; D364-T366 PolarHBondContact OD1-N 3.31Å; D364-T366 PolarHBondContact OD1-OG1 3.01Å
367	D	88.8	Confident	94	Very high	47 Å²	47	44 Å²	44	25%	0.251	22%	0.223	S	C	.	.	S	Bend	trans	-89.2	140.4	-179.2	-170.1	-56.2	0	0	0	111.8	Y334 Y369	Y334-D367 HydrophobicContact CE1-CB 4.12Å; Y334-D367 HydrophobicContact CE2-CB 4.33Å; Y334-D367 WeakPolarHBondContact OH-CB 3.37Å; Y334-D367 PolarHBondContact OH-OD1 3.38Å; D367-Y369 VanDerWaalsContact OD1-CD2 3.24Å; D367-Y369 WeakPolarHBondContact OD1-CD2 3.44Å; D367-Y369 PolarHBondContact OD1-N 3.04Å
368	S	92.1	Very high	94	Very high	9 Å²	9	44.3 Å²	44.3	6%	0.063	23%	0.225	C	C	.	.	S	Bend	trans	-78.3	-20.3	-172.9	68.3	0	0	0	0	114.4	A370 V371 L372	S368-A370 VanDerWaalsContact C-N 3.35Å; S368-A370 PolarHBondContact O-N 3.11Å; S368-V371 PolarHBondContact O-N 3.19Å; S368-L372 PolarHBondContact O-N 3.05Å
369	Y	93.9	Very high	93.9	Very high	92 Å²	92	42.5 Å²	42.5	36%	0.361	22%	0.217	S	C	.	.	H	α-helix	trans	-64.3	-34.9	-172.6	-81.1	-84.5	0	0	0	113.7	W335 D367 V371 L372 G373	W335-Y369 AromaticContact CH2-CD2 3.44Å; W335-Y369 HydrophobicContact CH2-CD2 3.44Å; W335-Y369 VanDerWaalsContact CH2-CD2 3.44Å; W335-Y369 AromaticContact CH2-CE2 3.73Å; W335-Y369 HydrophobicContact CH2-CE2 3.73Å; W335-Y369 AromaticContact CH2-CG 3.97Å; W335-Y369 HydrophobicContact CH2-CG 3.97Å; W335-Y369 HydrophobicContact CZ2-CD2 4.47Å; W335-Y369 HydrophobicContact CZ3-CD1 4.49Å; W335-Y369 AromaticContact CZ3-CD2 3.98Å; W335-Y369 HydrophobicContact CZ3-CD2 3.98Å; W335-Y369 HydrophobicContact CZ3-CE2 4.39Å; W335-Y369 HydrophobicContact CZ3-CG 4.03Å; D367-Y369 VanDerWaalsContact OD1-CD2 3.24Å; D367-Y369 WeakPolarHBondContact OD1-CD2 3.44Å; D367-Y369 PolarHBondContact OD1-N 3.04Å; Y369-V371 VanDerWaalsContact C-N 3.31Å; Y369-V371 PolarHBondContact O-N 2.8Å; Y369-L372 HydrophobicContact CD1-CD2 4.23Å; Y369-L372 PolarHBondContact O-N 3.14Å; Y369-G373 PolarHBondContact O-N 3.16Å
370	A	94.1	Very high	93.9	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-65.4	-35.2	175.3	0	0	0	0	0	112.2	Y334 I338 A360 R361 S368 L374	Y334-A370 HydrophobicContact CE2-CB 4.12Å; Y334-A370 PolarHBondContact OH-N 2.88Å; Y334-A370 VanDerWaalsContact OH-N 3.16Å; I338-A370 HydrophobicContact CD1-CB 3.92Å; A360-A370 HydrophobicContact CB-CB 4.01Å; R361-A370 HydrophobicContact CB-CB 3.95Å; S368-A370 VanDerWaalsContact C-N 3.35Å; S368-A370 PolarHBondContact O-N 3.11Å; A370-L374 WeakPolarHBondContact O-CG 3.35Å; A370-L374 PolarHBondContact O-N 3.06Å
371	V	96.1	Very high	93.9	Very high	2 Å²	2	45 Å²	45	1%	0.012	23%	0.233	C	C	.	.	H	α-helix	trans	-75.1	-39.3	176.9	-178	0	0	0	0	110.6	S368 Y369 L374 G375 Y390 Q393 M397	S368-V371 PolarHBondContact O-N 3.19Å; Y369-V371 VanDerWaalsContact C-N 3.31Å; Y369-V371 PolarHBondContact O-N 2.8Å; V371-L374 PolarHBondContact O-N 3.12Å; V371-G375 PolarHBondContact O-N 3.33Å; V371-G375 VanDerWaalsContact O-N 3.1Å; V371-Y390 HydrophobicContact CG1-CD1 4.08Å; V371-Q393 HydrophobicContact CG1-CB 3.92Å; V371-Q393 HydrophobicContact CG1-CG 3.86Å; V371-M397 HydrophobicContact CB-SD 4.45Å; V371-M397 HydrophobicContact CG2-CE 4.47Å; V371-M397 HydrophobicContact CG2-SD 3.86Å
372	L	96.3	Very high	93.8	Very high	6 Å²	6	47.7 Å²	47.7	3%	0.031	25%	0.248	C	C	.	.	H	α-helix	trans	-56.7	-49.9	173	178	68.1	0	0	0	110.9	S368 Y369 L374 G375 D376 Y391 T394 N403 A404	S368-L372 PolarHBondContact O-N 3.05Å; Y369-L372 HydrophobicContact CD1-CD2 4.23Å; Y369-L372 PolarHBondContact O-N 3.14Å; L372-L374 VanDerWaalsContact C-N 3.29Å; L372-L374 PolarHBondContact O-N 2.82Å; L372-G375 CarbonylContact O-C 3.52Å; L372-G375 WeakPolarHBondContact O-CA 3.32Å; L372-G375 PolarHBondContact O-N 3.32Å; L372-D376 PolarHBondContact O-N 2.89Å; L372-Y391 HydrophobicContact CD1-CD1 3.86Å; L372-Y391 HydrophobicContact CD1-CE1 3.75Å; L372-T394 WeakPolarHBondContact CA-OG1 3.34Å; L372-T394 HydrophobicContact CB-CG2 3.93Å; L372-T394 HydrophobicContact CD1-CG2 4.22Å; L372-T394 PolarHBondContact N-OG1 2.87Å; L372-N403 HydrophobicContact CD1-CB 3.91Å; L372-N403 HydrophobicContact CD2-CB 3.71Å; L372-N403 HydrophobicContact CG-CB 4.42Å; L372-A404 HydrophobicContact CD1-CB 4.02Å
373	G	95.8	Very high	93.8	Very high	1 Å²	1	44.7 Å²	44.7	1%	0.01	23%	0.231	C	C	.	.	H	α-helix	trans	-60.4	-34.8	178.8	0	0	0	0	0	113.6	F357 Y369 G375 D376 V377	F357-G373 VanDerWaalsContact CD2-C 3.45Å; F357-G373 WeakPolarHBondContact CD2-O 3.42Å; F357-G373 WeakPolarHBondContact CE2-O 3.46Å; Y369-G373 PolarHBondContact O-N 3.16Å; G373-G375 VanDerWaalsContact C-N 3.34Å; G373-D376 PolarHBondContact O-N 3.36Å; G373-V377 VanDerWaalsContact O-CG2 3.3Å; G373-V377 WeakPolarHBondContact O-CG2 3.34Å; G373-V377 PolarHBondContact O-N 3.43Å
374	L	97.1	Very high	94	Very high	7 Å²	7	45.9 Å²	45.9	4%	0.037	23%	0.232	C	C	.	.	H	α-helix	trans	-66	-35.5	171.3	-68.8	170.4	0	0	0	112.3	E354 F357 Q358 A370 V371 L372 V377 A378 Y390	E354-L374 HydrophobicContact CG-CD2 4.01Å; F357-L374 HydrophobicContact CB-CD2 3.93Å; F357-L374 HydrophobicContact CB-CG 3.96Å; Q358-L374 HydrophobicContact CG-CD2 4.2Å; A370-L374 WeakPolarHBondContact O-CG 3.35Å; A370-L374 PolarHBondContact O-N 3.06Å; V371-L374 PolarHBondContact O-N 3.12Å; L372-L374 VanDerWaalsContact C-N 3.29Å; L372-L374 PolarHBondContact O-N 2.82Å; L374-V377 PolarHBondContact O-N 2.89Å; L374-A378 PolarHBondContact O-N 2.95Å; L374-Y390 HydrophobicContact CB-CD1 4.03Å; L374-Y390 HydrophobicContact CB-CD2 4.13Å; L374-Y390 HydrophobicContact CB-CE1 4.03Å; L374-Y390 HydrophobicContact CB-CE2 4.13Å; L374-Y390 HydrophobicContact CB-CG 4.09Å; L374-Y390 HydrophobicContact CD1-CE1 4.09Å
375	G	96.3	Very high	94.3	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-63.5	-43.7	170.8	0	0	0	0	0	112.6	V371 L372 G373 V377 A378 M379 Y390	V371-G375 PolarHBondContact O-N 3.33Å; V371-G375 VanDerWaalsContact O-N 3.1Å; L372-G375 CarbonylContact O-C 3.52Å; L372-G375 WeakPolarHBondContact O-CA 3.32Å; L372-G375 PolarHBondContact O-N 3.32Å; G373-G375 VanDerWaalsContact C-N 3.34Å; G375-V377 VanDerWaalsContact C-N 3.35Å; G375-V377 PolarHBondContact O-N 3.26Å; G375-A378 PolarHBondContact O-N 3.49Å; G375-M379 PolarHBondContact O-N 3.42Å; G375-Y390 VanDerWaalsContact CA-CB 3.46Å
376	D	96.5	Very high	94.6	Very high	47 Å²	47	44.1 Å²	44.1	25%	0.251	23%	0.231	S	C	.	.	H	α-helix	trans	-65.6	-36	176.8	-65	-26.3	0	0	0	112.2	L345 L372 G373 M379 A380 Y391	L345-D376 HydrophobicContact CD1-CB 3.62Å; L372-D376 PolarHBondContact O-N 2.89Å; G373-D376 PolarHBondContact O-N 3.36Å; D376-M379 PolarHBondContact O-N 3.21Å; D376-A380 WeakPolarHBondContact O-CB 3.3Å; D376-A380 PolarHBondContact O-N 2.83Å; D376-Y391 VanDerWaalsContact OD1-CE1 3.31Å; D376-Y391 WeakPolarHBondContact OD1-CE1 3.46Å; D376-Y391 PolarHBondContact OD1-OH 3.42Å
377	V	97.5	Very high	95	Very high	3 Å²	3	39.1 Å²	39.1	2%	0.018	20%	0.2	C	C	.	.	H	α-helix	trans	-61.3	-46.5	170.1	169.7	0	0	0	0	111.8	L345 P350 A353 E354 F357 G373 L374 G375 M379 A380 R381	L345-V377 HydrophobicContact CD1-CG2 4.19Å; L345-V377 HydrophobicContact CD2-CB 4.38Å; L345-V377 HydrophobicContact CD2-CG2 3.74Å; L345-V377 HydrophobicContact CG-CG2 4.11Å; P350-V377 HydrophobicContact CB-CG1 4.12Å; A353-V377 HydrophobicContact CB-CG2 3.65Å; E354-V377 HydrophobicContact CB-CG1 4.12Å; F357-V377 HydrophobicContact CD2-CG2 3.92Å; F357-V377 HydrophobicContact CE2-CG2 4.01Å; G373-V377 VanDerWaalsContact O-CG2 3.3Å; G373-V377 WeakPolarHBondContact O-CG2 3.34Å; G373-V377 PolarHBondContact O-N 3.43Å; L374-V377 PolarHBondContact O-N 2.89Å; G375-V377 VanDerWaalsContact C-N 3.35Å; G375-V377 PolarHBondContact O-N 3.26Å; V377-M379 VanDerWaalsContact C-N 3.32Å; V377-M379 PolarHBondContact O-N 2.89Å; V377-A380 PolarHBondContact O-N 2.69Å; V377-R381 PolarHBondContact O-N 3.48Å
378	A	97	Very high	95.4	Very high	6 Å²	6	39 Å²	39	5%	0.05	20%	0.198	C	C	.	.	H	α-helix	trans	-62.9	-39.9	177.1	0	0	0	0	0	111.5	L374 G375 R381 K382 D383 A386 A387 Y390	L374-A378 PolarHBondContact O-N 2.95Å; G375-A378 PolarHBondContact O-N 3.49Å; A378-R381 CarbonylContact O-C 3.54Å; A378-R381 PolarHBondContact O-N 3.27Å; A378-K382 PolarHBondContact O-N 3.05Å; A378-K382 VanDerWaalsContact O-N 3.14Å; A378-D383 HydrophobicContact CB-CB 4.45Å; A378-D383 PolarHBondContact O-N 2.82Å; A378-A386 HydrophobicContact CB-CB 3.9Å; A378-A387 HydrophobicContact CB-CB 3.79Å; A378-Y390 HydrophobicContact CB-CD2 4.42Å
379	M	94.8	Very high	95.6	Very high	43 Å²	43	47.7 Å²	47.7	21%	0.212	23%	0.23	C	C	.	.	H	α-helix	trans	-60.8	-46.1	172.7	-78.4	-57.5	-75.5	0	0	112.8	G375 D376 V377 R381 K382 Y384 A387 Y391 I411	G375-M379 PolarHBondContact O-N 3.42Å; D376-M379 PolarHBondContact O-N 3.21Å; V377-M379 VanDerWaalsContact C-N 3.32Å; V377-M379 PolarHBondContact O-N 2.89Å; M379-R381 PolarHBondContact O-N 3.03Å; M379-K382 WeakPolarHBondContact O-CA 3.4Å; M379-K382 PolarHBondContact O-N 3.49Å; M379-Y384 HydrophobicContact CE-CD1 4.35Å; M379-Y384 HydrophobicContact CE-CE1 4.37Å; M379-Y384 HydrophobicContact SD-CD1 3.95Å; M379-Y384 HydrophobicContact SD-CE1 4.45Å; M379-A387 HydrophobicContact CB-CB 4.5Å; M379-A387 HydrophobicContact CG-CB 3.6Å; M379-A387 HydrophobicContact SD-CB 3.55Å; M379-A387 VanDerWaalsContact SD-CB 3.55Å; M379-Y391 HydrophobicContact CG-CE2 3.51Å; M379-Y391 WeakPolarHBondContact CG-OH 3.38Å; M379-Y391 HydrophobicContact SD-CE2 4.17Å; M379-I411 HydrophobicContact CE-CG1 3.78Å; M379-I411 HydrophobicContact SD-CD1 3.56Å; M379-I411 VanDerWaalsContact SD-CD1 3.56Å; M379-I411 HydrophobicContact SD-CG1 3.38Å; M379-I411 WeakPolarHBondContact SD-CG1 3.4Å
380	A	93.7	Very high	95.8	Very high	53 Å²	53	46.4 Å²	46.4	44%	0.438	23%	0.225	S	C	.	.	H	α-helix	trans	-61.2	-33	177.9	0	0	0	0	0	112.1	L345 D376 V377 K382	L345-A380 HydrophobicContact CD2-CB 4.03Å; D376-A380 WeakPolarHBondContact O-CB 3.3Å; D376-A380 PolarHBondContact O-N 2.83Å; V377-A380 PolarHBondContact O-N 2.69Å; A380-K382 VanDerWaalsContact C-N 3.29Å; A380-K382 PolarHBondContact O-N 3.45Å
381	R	94.9	Very high	95.9	Very high	102 Å²	102	46.8 Å²	46.8	39%	0.385	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-2.8	173.2	-70.8	-176.5	176.9	150.9	2.7	114.2	P350 D351 E354 V377 A378 M379 D383	P350-R381 HydrophobicContact CB-CG 3.99Å; P350-R381 HydrophobicContact CG-CG 4.2Å; D351-R381 IonicContact OD1-CZ 3.71Å; D351-R381 IonicContact OD1-NE 3.48Å; D351-R381 IonicContact OD1-NH2 3.81Å; D351-R381 PolarHBondContact OD1-NH2 2.91Å; E354-R381 IonicContact OE2-CZ 2.65Å; E354-R381 VanDerWaalsContact OE2-CZ 3.22Å; E354-R381 IonicContact OE2-NH1 3.65Å; E354-R381 PolarHBondContact OE2-NH1 2.96Å; E354-R381 IonicContact OE2-NH2 3.85Å; E354-R381 PolarHBondContact OE2-NH2 3.27Å; V377-R381 PolarHBondContact O-N 3.48Å; A378-R381 CarbonylContact O-C 3.54Å; A378-R381 PolarHBondContact O-N 3.27Å; M379-R381 PolarHBondContact O-N 3.03Å; R381-D383 PolarHBondContact O-N 3.31Å
382	K	93.1	Very high	95.9	Very high	151 Å²	151	49.7 Å²	49.7	66%	0.657	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	60	22.4	-172.1	-52.2	179.4	179.6	-179.2	0	113.8	A378 M379 A380 Y384	A378-K382 PolarHBondContact O-N 3.05Å; A378-K382 VanDerWaalsContact O-N 3.14Å; M379-K382 WeakPolarHBondContact O-CA 3.4Å; M379-K382 PolarHBondContact O-N 3.49Å; A380-K382 VanDerWaalsContact C-N 3.29Å; A380-K382 PolarHBondContact O-N 3.45Å; K382-Y384 VanDerWaalsContact C-N 3.27Å; K382-Y384 HydrophobicContact CB-CE1 4.49Å; K382-Y384 HydrophobicContact CB-CE2 4.28Å; K382-Y384 WeakPolarHBondContact O-CD2 3.46Å; K382-Y384 PolarHBondContact O-N 3.31Å; K382-Y384 VanDerWaalsContact O-N 3.1Å
383	D	94.9	Very high	95.9	Very high	77 Å²	77	51.9 Å²	51.9	41%	0.412	25%	0.249	S	C	.	.			trans	-84.1	74.8	170.5	-172.4	-11.3	0	0	0	109.1	A378 R381 P385 A386 A387	A378-D383 HydrophobicContact CB-CB 4.45Å; A378-D383 PolarHBondContact O-N 2.82Å; R381-D383 PolarHBondContact O-N 3.31Å; D383-P385 WeakPolarHBondContact OD1-CD 3.39Å; D383-A386 HydrophobicContact CB-CB 4.23Å; D383-A386 PolarHBondContact O-N 3.01Å; D383-A386 WeakPolarHBondContact OD1-CB 3.46Å; D383-A386 PolarHBondContact OD1-N 2.92Å; D383-A386 VanDerWaalsContact OD1-N 3.14Å; D383-A386 WeakPolarHBondContact OD2-CB 3.43Å; D383-A387 WeakPolarHBondContact O-CB 3.46Å; D383-A387 PolarHBondContact O-N 3.36Å
384	Y	94.4	Very high	95.9	Very high	63 Å²	63	51.8 Å²	51.8	25%	0.247	25%	0.249	C	C	.	.	H	α-helix	trans	-59.5	-39.9	-177	-49.9	-64.9	0	0	0	113.6	M379 K382 A386 A387 E388 I411 Q414	M379-Y384 HydrophobicContact CE-CD1 4.35Å; M379-Y384 HydrophobicContact CE-CE1 4.37Å; M379-Y384 HydrophobicContact SD-CD1 3.95Å; M379-Y384 HydrophobicContact SD-CE1 4.45Å; K382-Y384 VanDerWaalsContact C-N 3.27Å; K382-Y384 HydrophobicContact CB-CE1 4.49Å; K382-Y384 HydrophobicContact CB-CE2 4.28Å; K382-Y384 WeakPolarHBondContact O-CD2 3.46Å; K382-Y384 PolarHBondContact O-N 3.31Å; K382-Y384 VanDerWaalsContact O-N 3.1Å; Y384-A386 PolarHBondContact O-N 3.06Å; Y384-A387 PolarHBondContact O-N 3.43Å; Y384-E388 WeakPolarHBondContact O-CB 3.28Å; Y384-E388 PolarHBondContact O-N 3.38Å; Y384-I411 HydrophobicContact CD1-CG1 4.4Å; Y384-Q414 VanDerWaalsContact CZ-OE1 3.25Å; Y384-Q414 PolarHBondContact OH-NE2 2.92Å; Y384-Q414 PolarHBondContact OH-OE1 3.4Å
385	P	95.6	Very high	95.7	Very high	89 Å²	89	52.9 Å²	52.9	58%	0.578	26%	0.255	S	S	*	.	H	α-helix	trans	-61.1	-41.8	175.5	-25.2	35.7	0	0	0	113.4	D383 R389	D383-P385 WeakPolarHBondContact OD1-CD 3.39Å; P385-R389 WeakPolarHBondContact O-CG 3.28Å; P385-R389 PolarHBondContact O-N 3.44Å
386	A	95.9	Very high	95.6	Very high	23 Å²	23	61.7 Å²	61.7	19%	0.19	29%	0.288	C	S	.	.	H	α-helix	trans	-68.4	-43	175.9	0	0	0	0	0	111.5	A378 D383 Y384 E388 R389 Y390	A378-A386 HydrophobicContact CB-CB 3.9Å; D383-A386 HydrophobicContact CB-CB 4.23Å; D383-A386 PolarHBondContact O-N 3.01Å; D383-A386 WeakPolarHBondContact OD1-CB 3.46Å; D383-A386 PolarHBondContact OD1-N 2.92Å; D383-A386 VanDerWaalsContact OD1-N 3.14Å; D383-A386 WeakPolarHBondContact OD2-CB 3.43Å; Y384-A386 PolarHBondContact O-N 3.06Å; A386-E388 PolarHBondContact O-N 2.98Å; A386-R389 PolarHBondContact O-N 3.36Å; A386-Y390 HydrophobicContact CB-CE2 4.48Å; A386-Y390 WeakPolarHBondContact O-CD2 3.19Å; A386-Y390 PolarHBondContact O-N 3.34Å
387	A	96.8	Very high	95.4	Very high	0 Å²	0	63 Å²	63	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-58.4	-46.7	177.3	0	0	0	0	0	112.1	A378 M379 D383 Y384 R389 Y390 Y391 I411	A378-A387 HydrophobicContact CB-CB 3.79Å; M379-A387 HydrophobicContact CB-CB 4.5Å; M379-A387 HydrophobicContact CG-CB 3.6Å; M379-A387 HydrophobicContact SD-CB 3.55Å; M379-A387 VanDerWaalsContact SD-CB 3.55Å; D383-A387 WeakPolarHBondContact O-CB 3.46Å; D383-A387 PolarHBondContact O-N 3.36Å; Y384-A387 PolarHBondContact O-N 3.43Å; A387-R389 VanDerWaalsContact C-N 3.32Å; A387-R389 PolarHBondContact O-N 3.21Å; A387-Y390 PolarHBondContact O-N 3.16Å; A387-Y391 HydrophobicContact CB-CD2 4.41Å; A387-Y391 HydrophobicContact CB-CE2 4.12Å; A387-Y391 WeakPolarHBondContact O-CD2 3.09Å; A387-Y391 PolarHBondContact O-N 3.01Å; A387-I411 HydrophobicContact CB-CD1 3.83Å
388	E	96	Very high	95.1	Very high	45 Å²	45	65.7 Å²	65.7	21%	0.21	31%	0.307	C	S	.	.	H	α-helix	trans	-56.4	-45.4	176.4	178.1	172.3	-171.3	0	0	111.4	Y384 A386 Y390 Y391 Q392 L408 I411 Y412	Y384-E388 WeakPolarHBondContact O-CB 3.28Å; Y384-E388 PolarHBondContact O-N 3.38Å; A386-E388 PolarHBondContact O-N 2.98Å; E388-Y390 PolarHBondContact O-N 2.9Å; E388-Y391 PolarHBondContact O-N 3.37Å; E388-Q392 HydrophobicContact CG-CG 4.46Å; E388-Q392 WeakPolarHBondContact O-CB 3.39Å; E388-Q392 VanDerWaalsContact O-CG 3.24Å; E388-Q392 WeakPolarHBondContact O-CG 3.37Å; E388-Q392 PolarHBondContact O-N 2.91Å; E388-Q392 PolarHBondContact OE1-NE2 3.22Å; E388-L408 HydrophobicContact CB-CD2 4.27Å; E388-L408 HydrophobicContact CG-CD2 3.84Å; E388-I411 HydrophobicContact CB-CD1 4.23Å; E388-Y412 WeakPolarHBondContact OE1-CE1 3.28Å; E388-Y412 PolarHBondContact OE1-OH 3.47Å
389	R	97.2	Very high	94.7	Very high	191 Å²	191	69.5 Å²	69.5	72%	0.721	33%	0.334	S	S	*	.	H	α-helix	trans	-62.7	-43.2	178.2	-69.1	179.6	86.8	122.8	3.8	112.3	P385 A386 A387 Q393	P385-R389 WeakPolarHBondContact O-CG 3.28Å; P385-R389 PolarHBondContact O-N 3.44Å; A386-R389 PolarHBondContact O-N 3.36Å; A387-R389 VanDerWaalsContact C-N 3.32Å; A387-R389 PolarHBondContact O-N 3.21Å; R389-Q393 WeakPolarHBondContact O-CB 3.36Å; R389-Q393 PolarHBondContact O-N 2.83Å
390	Y	97.7	Very high	94.4	Very high	66 Å²	66	69.7 Å²	69.7	26%	0.259	35%	0.347	S	S	.	.	H	α-helix	trans	-69.6	-40.1	179	-73.4	-56.2	0	0	0	112.6	V371 L374 G375 A378 A386 A387 E388 Q393 T394	V371-Y390 HydrophobicContact CG1-CD1 4.08Å; L374-Y390 HydrophobicContact CB-CD1 4.03Å; L374-Y390 HydrophobicContact CB-CD2 4.13Å; L374-Y390 HydrophobicContact CB-CE1 4.03Å; L374-Y390 HydrophobicContact CB-CE2 4.13Å; L374-Y390 HydrophobicContact CB-CG 4.09Å; L374-Y390 HydrophobicContact CD1-CE1 4.09Å; G375-Y390 VanDerWaalsContact CA-CB 3.46Å; A378-Y390 HydrophobicContact CB-CD2 4.42Å; A386-Y390 HydrophobicContact CB-CE2 4.48Å; A386-Y390 WeakPolarHBondContact O-CD2 3.19Å; A386-Y390 PolarHBondContact O-N 3.34Å; A387-Y390 PolarHBondContact O-N 3.16Å; E388-Y390 PolarHBondContact O-N 2.9Å; Y390-Q393 PolarHBondContact O-N 3.38Å; Y390-T394 WeakPolarHBondContact O-CB 3.29Å; Y390-T394 PolarHBondContact O-N 3.47Å; Y390-T394 PolarHBondContact O-OG1 2.98Å
391	Y	97.2	Very high	94.3	Very high	7 Å²	7	67.5 Å²	67.5	3%	0.027	33%	0.328	C	S	.	.	H	α-helix	trans	-67.1	-40.5	175	-66.6	-43.6	0	0	0	112.3	L372 D376 M379 A387 E388 Q393 T394 L395 A404 L408 I411	L372-Y391 HydrophobicContact CD1-CD1 3.86Å; L372-Y391 HydrophobicContact CD1-CE1 3.75Å; D376-Y391 VanDerWaalsContact OD1-CE1 3.31Å; D376-Y391 WeakPolarHBondContact OD1-CE1 3.46Å; D376-Y391 PolarHBondContact OD1-OH 3.42Å; M379-Y391 HydrophobicContact CG-CE2 3.51Å; M379-Y391 WeakPolarHBondContact CG-OH 3.38Å; M379-Y391 HydrophobicContact SD-CE2 4.17Å; A387-Y391 HydrophobicContact CB-CD2 4.41Å; A387-Y391 HydrophobicContact CB-CE2 4.12Å; A387-Y391 WeakPolarHBondContact O-CD2 3.09Å; A387-Y391 PolarHBondContact O-N 3.01Å; E388-Y391 PolarHBondContact O-N 3.37Å; Y391-Q393 VanDerWaalsContact C-N 3.33Å; Y391-Q393 PolarHBondContact O-N 3.33Å; Y391-T394 WeakPolarHBondContact O-CB 3.28Å; Y391-T394 PolarHBondContact O-N 3.45Å; Y391-L395 WeakPolarHBondContact O-CG 3.45Å; Y391-L395 PolarHBondContact O-N 2.95Å; Y391-A404 HydrophobicContact CD1-CB 4.1Å; Y391-L408 HydrophobicContact CD2-CD2 4.45Å; Y391-L408 HydrophobicContact CD2-CG 4.38Å; Y391-L408 HydrophobicContact CG-CG 4.41Å; Y391-I411 HydrophobicContact CD2-CD1 3.87Å; Y391-I411 HydrophobicContact CE2-CD1 3.98Å
392	Q	95.7	Very high	94.2	Very high	63 Å²	63	65.8 Å²	65.8	29%	0.294	33%	0.329	S	S	.	.	H	α-helix	trans	-62.4	-40.6	172.4	-73.9	175.4	-1.4	0	0	111.7	E388 T394 L395 R396 L408 Y412	E388-Q392 HydrophobicContact CG-CG 4.46Å; E388-Q392 WeakPolarHBondContact O-CB 3.39Å; E388-Q392 VanDerWaalsContact O-CG 3.24Å; E388-Q392 WeakPolarHBondContact O-CG 3.37Å; E388-Q392 PolarHBondContact O-N 2.91Å; E388-Q392 PolarHBondContact OE1-NE2 3.22Å; Q392-T394 VanDerWaalsContact C-N 3.33Å; Q392-L395 PolarHBondContact O-N 3.21Å; Q392-R396 WeakPolarHBondContact O-CG 3.42Å; Q392-R396 PolarHBondContact O-N 3.17Å; Q392-L408 HydrophobicContact CG-CD1 4.25Å; Q392-L408 HydrophobicContact CG-CD2 4.28Å; Q392-Y412 PolarHBondContact NE2-OH 3.48Å
393	Q	95.4	Very high	94.2	Very high	52 Å²	52	62.4 Å²	62.4	24%	0.243	32%	0.318	C	S	.	.	H	α-helix	trans	-62.7	-42.4	174.1	-174.7	-175.7	-14.9	0	0	111.1	V371 R389 Y390 Y391 L395 R396 M397	V371-Q393 HydrophobicContact CG1-CB 3.92Å; V371-Q393 HydrophobicContact CG1-CG 3.86Å; R389-Q393 WeakPolarHBondContact O-CB 3.36Å; R389-Q393 PolarHBondContact O-N 2.83Å; Y390-Q393 PolarHBondContact O-N 3.38Å; Y391-Q393 VanDerWaalsContact C-N 3.33Å; Y391-Q393 PolarHBondContact O-N 3.33Å; Q393-L395 VanDerWaalsContact C-N 3.34Å; Q393-L395 PolarHBondContact O-N 3.4Å; Q393-R396 WeakPolarHBondContact O-CB 3.17Å; Q393-R396 PolarHBondContact O-N 3.17Å; Q393-R396 VanDerWaalsContact O-N 3.16Å; Q393-M397 HydrophobicContact CG-SD 4.29Å; Q393-M397 WeakPolarHBondContact O-CG 3.49Å; Q393-M397 PolarHBondContact O-N 3.43Å; Q393-M397 VanDerWaalsContact O-N 3.1Å
394	T	95.9	Very high	94.2	Very high	0 Å²	0	58.8 Å²	58.8	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-58.4	-46.2	175.7	-55.3	0	0	0	0	110.6	L372 Y390 Y391 Q392 R396 M397 D398 N401 A404	L372-T394 WeakPolarHBondContact CA-OG1 3.34Å; L372-T394 HydrophobicContact CB-CG2 3.93Å; L372-T394 HydrophobicContact CD1-CG2 4.22Å; L372-T394 PolarHBondContact N-OG1 2.87Å; Y390-T394 WeakPolarHBondContact O-CB 3.29Å; Y390-T394 PolarHBondContact O-N 3.47Å; Y390-T394 PolarHBondContact O-OG1 2.98Å; Y391-T394 WeakPolarHBondContact O-CB 3.28Å; Y391-T394 PolarHBondContact O-N 3.45Å; Q392-T394 VanDerWaalsContact C-N 3.33Å; T394-R396 VanDerWaalsContact C-N 3.31Å; T394-R396 PolarHBondContact O-N 3.16Å; T394-M397 PolarHBondContact O-N 3.28Å; T394-M397 VanDerWaalsContact O-N 3.11Å; T394-D398 PolarHBondContact O-N 3.02Å; T394-N401 HydrophobicContact CG2-CB 4.07Å; T394-A404 HydrophobicContact CG2-CB 3.8Å
395	L	93.4	Very high	94.3	Very high	30 Å²	30	55.8 Å²	55.8	16%	0.157	29%	0.287	C	S	.	.	H	α-helix	trans	-68.9	-23.2	177.5	-68.4	-180	0	0	0	114.5	Y391 Q392 Q393 D398 S399 N401 A404 V405 L408	Y391-L395 WeakPolarHBondContact O-CG 3.45Å; Y391-L395 PolarHBondContact O-N 2.95Å; Q392-L395 PolarHBondContact O-N 3.21Å; Q393-L395 VanDerWaalsContact C-N 3.34Å; Q393-L395 PolarHBondContact O-N 3.4Å; L395-D398 WeakPolarHBondContact CA-O 3.21Å; L395-D398 CarbonylContact O-C 3.6Å; L395-S399 VanDerWaalsContact O-CA 3.26Å; L395-S399 WeakPolarHBondContact O-CA 3.4Å; L395-S399 PolarHBondContact O-N 3.19Å; L395-N401 HydrophobicContact CD2-CB 4.24Å; L395-N401 WeakPolarHBondContact CD2-O 2.96Å; L395-A404 HydrophobicContact CD2-CB 3.81Å; L395-A404 HydrophobicContact CG-CB 3.8Å; L395-V405 HydrophobicContact CD1-CG2 4.17Å; L395-V405 HydrophobicContact CD2-CG2 3.77Å; L395-L408 HydrophobicContact CD1-CD1 3.57Å
396	R	93.7	Very high	94.2	Very high	185 Å²	185	55.4 Å²	55.4	70%	0.698	27%	0.274	S	S	*	.	H	α-helix	trans	-73.7	-32.1	170	-70	177	-147	140.3	6.5	112.1	Q392 Q393 T394	Q392-R396 WeakPolarHBondContact O-CG 3.42Å; Q392-R396 PolarHBondContact O-N 3.17Å; Q393-R396 WeakPolarHBondContact O-CB 3.17Å; Q393-R396 PolarHBondContact O-N 3.17Å; Q393-R396 VanDerWaalsContact O-N 3.16Å; T394-R396 VanDerWaalsContact C-N 3.31Å; T394-R396 PolarHBondContact O-N 3.16Å
397	M	92.7	Very high	94.1	Very high	75 Å²	75	54.6 Å²	54.6	37%	0.369	27%	0.267	S	S	.	.	H	α-helix	trans	-82.1	-40.9	178.3	-65.7	174.6	69.1	0	0	111.6	V371 Q393 T394	V371-M397 HydrophobicContact CB-SD 4.45Å; V371-M397 HydrophobicContact CG2-CE 4.47Å; V371-M397 HydrophobicContact CG2-SD 3.86Å; Q393-M397 HydrophobicContact CG-SD 4.29Å; Q393-M397 WeakPolarHBondContact O-CG 3.49Å; Q393-M397 PolarHBondContact O-N 3.43Å; Q393-M397 VanDerWaalsContact O-N 3.1Å; T394-M397 PolarHBondContact O-N 3.28Å; T394-M397 VanDerWaalsContact O-N 3.11Å
398	D	91.2	Very high	94.1	Very high	58 Å²	58	54.7 Å²	54.7	31%	0.31	27%	0.268	S	S	.	.			trans	-138.7	94.7	179.4	172.6	15.3	0	0	0	108.9	T394 L395 G400 N401	T394-D398 PolarHBondContact O-N 3.02Å; L395-D398 WeakPolarHBondContact CA-O 3.21Å; L395-D398 CarbonylContact O-C 3.6Å; D398-G400 PolarHBondContact O-N 2.94Å; D398-G400 WeakPolarHBondContact OD1-CA 3.28Å; D398-G400 PolarHBondContact OD1-N 3.26Å; D398-N401 HydrophobicContact CB-CB 4.2Å; D398-N401 WeakPolarHBondContact O-CB 3.49Å; D398-N401 PolarHBondContact O-N 3.26Å; D398-N401 VanDerWaalsContact O-N 3.14Å; D398-N401 PolarHBondContact OD1-N 2.9Å; D398-N401 WeakPolarHBondContact OD2-CB 3.26Å; D398-N401 PolarHBondContact OD2-ND2 3Å; D398-N401 VanDerWaalsContact OD2-ND2 3.15Å
399	S	88.9	Confident	93.9	Very high	87 Å²	87	52.6 Å²	52.6	61%	0.608	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-17.7	179.7	60.8	0	0	0	0	113.1	L395 Q431	L395-S399 VanDerWaalsContact O-CA 3.26Å; L395-S399 WeakPolarHBondContact O-CA 3.4Å; L395-S399 PolarHBondContact O-N 3.19Å; S399-Q431 PolarHBondContact O-NE2 3.33Å
400	G	88.1	Confident	93.7	Very high	47 Å²	47	45.8 Å²	45.8	49%	0.485	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.6	-2.5	177	0	0	0	0	0	114.4	D398 T402	D398-G400 PolarHBondContact O-N 2.94Å; D398-G400 WeakPolarHBondContact OD1-CA 3.28Å; D398-G400 PolarHBondContact OD1-N 3.26Å; G400-T402 PolarHBondContact O-N 3.34Å
401	N	92.3	Very high	93.5	Very high	6 Å²	6	42.7 Å²	42.7	3%	0.032	22%	0.224	C	C	.	.			trans	-69.6	100.1	-172	-159.2	-75.8	0	0	0	112.8	T394 L395 D398 N403 A404 V405	T394-N401 HydrophobicContact CG2-CB 4.07Å; L395-N401 HydrophobicContact CD2-CB 4.24Å; L395-N401 WeakPolarHBondContact CD2-O 2.96Å; D398-N401 HydrophobicContact CB-CB 4.2Å; D398-N401 WeakPolarHBondContact O-CB 3.49Å; D398-N401 PolarHBondContact O-N 3.26Å; D398-N401 VanDerWaalsContact O-N 3.14Å; D398-N401 PolarHBondContact OD1-N 2.9Å; D398-N401 WeakPolarHBondContact OD2-CB 3.26Å; D398-N401 PolarHBondContact OD2-ND2 3Å; D398-N401 VanDerWaalsContact OD2-ND2 3.15Å; N401-N403 VanDerWaalsContact C-N 3.31Å; N401-N403 PolarHBondContact O-N 3.37Å; N401-N403 PolarHBondContact OD1-N 3.16Å; N401-A404 HydrophobicContact CB-CB 4.24Å; N401-A404 PolarHBondContact O-N 3.36Å; N401-A404 PolarHBondContact OD1-N 3.03Å; N401-A404 VanDerWaalsContact OD1-N 3.13Å; N401-V405 PolarHBondContact O-N 3.01Å
402	T	92.6	Very high	93.4	Very high	66 Å²	66	43.7 Å²	43.7	41%	0.405	23%	0.228	S	C	.	.	H	α-helix	trans	-65.8	-30.5	-176.6	52.9	0	0	0	0	113.4	G400 V405 R406 S434	G400-T402 PolarHBondContact O-N 3.34Å; T402-V405 PolarHBondContact O-N 3.49Å; T402-R406 WeakPolarHBondContact O-CB 3.42Å; T402-R406 PolarHBondContact O-N 3.22Å; T402-S434 VanDerWaalsContact CG2-CB 3.48Å
403	N	92.7	Very high	93.2	Very high	81 Å²	81	45.2 Å²	45.2	43%	0.433	23%	0.231	S	C	.	.	H	α-helix	trans	-67.1	-41.9	177.5	-69.1	-24.4	0	0	0	111.6	L372 N401 R406 G407	L372-N403 HydrophobicContact CD1-CB 3.91Å; L372-N403 HydrophobicContact CD2-CB 3.71Å; L372-N403 HydrophobicContact CG-CB 4.42Å; N401-N403 VanDerWaalsContact C-N 3.31Å; N401-N403 PolarHBondContact O-N 3.37Å; N401-N403 PolarHBondContact OD1-N 3.16Å; N403-R406 PolarHBondContact O-N 3.25Å; N403-G407 PolarHBondContact O-N 3.44Å
404	A	95	Very high	92.8	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-66.2	-39.5	175.1	0	0	0	0	0	112.5	L372 Y391 T394 L395 N401 G407 L408	L372-A404 HydrophobicContact CD1-CB 4.02Å; Y391-A404 HydrophobicContact CD1-CB 4.1Å; T394-A404 HydrophobicContact CG2-CB 3.8Å; L395-A404 HydrophobicContact CD2-CB 3.81Å; L395-A404 HydrophobicContact CG-CB 3.8Å; N401-A404 HydrophobicContact CB-CB 4.24Å; N401-A404 PolarHBondContact O-N 3.36Å; N401-A404 PolarHBondContact OD1-N 3.03Å; N401-A404 VanDerWaalsContact OD1-N 3.13Å; A404-G407 PolarHBondContact O-N 2.96Å; A404-L408 PolarHBondContact O-N 2.99Å
405	V	95.5	Very high	92.5	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-59.5	-47.2	173.1	176.1	0	0	0	0	110.7	L395 N401 T402 L408 A409 F423 L427 Q431 I435	L395-V405 HydrophobicContact CD1-CG2 4.17Å; L395-V405 HydrophobicContact CD2-CG2 3.77Å; N401-V405 PolarHBondContact O-N 3.01Å; T402-V405 PolarHBondContact O-N 3.49Å; V405-L408 PolarHBondContact O-N 3.02Å; V405-A409 WeakPolarHBondContact O-CB 3.22Å; V405-A409 PolarHBondContact O-N 3.08Å; V405-F423 HydrophobicContact CG1-CE1 4.28Å; V405-F423 HydrophobicContact CG1-CZ 4.31Å; V405-L427 HydrophobicContact CG1-CD1 3.58Å; V405-L427 HydrophobicContact CG1-CD2 3.94Å; V405-L427 HydrophobicContact CG1-CG 4.42Å; V405-L427 HydrophobicContact CG2-CD2 4.43Å; V405-Q431 HydrophobicContact CG1-CB 4.38Å; V405-Q431 HydrophobicContact CG2-CB 4.12Å; V405-Q431 HydrophobicContact CG2-CG 3.94Å; V405-I435 HydrophobicContact CG1-CD1 4.22Å; V405-I435 HydrophobicContact CG1-CG2 3.98Å
406	R	95	Very high	92.3	Very high	82 Å²	82	52.2 Å²	52.2	31%	0.309	27%	0.266	S	S	.	.	H	α-helix	trans	-63	-41.3	177.5	-179.2	172.4	-71.9	-86	-3	112.1	T402 N403 A409 N410 S434 I435 D437 I438	T402-R406 WeakPolarHBondContact O-CB 3.42Å; T402-R406 PolarHBondContact O-N 3.22Å; N403-R406 PolarHBondContact O-N 3.25Å; R406-A409 PolarHBondContact O-N 2.86Å; R406-N410 WeakPolarHBondContact O-CB 3.4Å; R406-N410 PolarHBondContact O-N 3.39Å; R406-N410 PolarHBondContact O-ND2 3.4Å; R406-S434 PolarHBondContact NH2-O 3.42Å; R406-I435 HydrophobicContact CB-CG2 4.03Å; R406-D437 IonicContact CZ-OD1 2.98Å; R406-D437 IonicContact CZ-OD2 3.42Å; R406-D437 IonicContact NH1-OD1 3.76Å; R406-D437 PolarHBondContact NH1-OD1 3.02Å; R406-D437 IonicContact NH1-OD2 2.75Å; R406-D437 PolarHBondContact NH1-OD2 3.21Å; R406-D437 IonicContact NH2-OD1 3.61Å; R406-D437 PolarHBondContact NH2-OD1 3.17Å; R406-D437 IonicContact NH2-OD2 3.21Å; R406-I438 HydrophobicContact CG-CD1 4.14Å
407	G	93.6	Very high	92	Very high	5 Å²	5	46 Å²	46	5%	0.052	25%	0.25	C	S	.	.	H	α-helix	trans	-56.4	-51.2	174.2	0	0	0	0	0	112.1	N403 A404 N410 I411	N403-G407 PolarHBondContact O-N 3.44Å; A404-G407 PolarHBondContact O-N 2.96Å; G407-N410 PolarHBondContact O-N 3.43Å; G407-I411 WeakPolarHBondContact O-CG1 3.42Å; G407-I411 PolarHBondContact O-N 3.06Å
408	L	95.4	Very high	91.8	Very high	3 Å²	3	48.2 Å²	48.2	2%	0.016	26%	0.259	C	S	.	.	H	α-helix	trans	-64.6	-43	176.4	-72.2	170.4	0	0	0	113	E388 Y391 Q392 L395 A404 V405 N410 I411 Y412 F423	E388-L408 HydrophobicContact CB-CD2 4.27Å; E388-L408 HydrophobicContact CG-CD2 3.84Å; Y391-L408 HydrophobicContact CD2-CD2 4.45Å; Y391-L408 HydrophobicContact CD2-CG 4.38Å; Y391-L408 HydrophobicContact CG-CG 4.41Å; Q392-L408 HydrophobicContact CG-CD1 4.25Å; Q392-L408 HydrophobicContact CG-CD2 4.28Å; L395-L408 HydrophobicContact CD1-CD1 3.57Å; A404-L408 PolarHBondContact O-N 2.99Å; V405-L408 PolarHBondContact O-N 3.02Å; L408-N410 VanDerWaalsContact C-N 3.27Å; L408-N410 PolarHBondContact O-N 3.27Å; L408-I411 PolarHBondContact O-N 2.93Å; L408-Y412 HydrophobicContact CB-CD2 4.38Å; L408-Y412 HydrophobicContact CB-CE2 4.06Å; L408-Y412 HydrophobicContact CD2-CE2 4.29Å; L408-Y412 VanDerWaalsContact O-CD2 3.27Å; L408-Y412 WeakPolarHBondContact O-CD2 3.42Å; L408-Y412 PolarHBondContact O-N 3.44Å; L408-F423 HydrophobicContact CB-CE1 3.79Å; L408-F423 HydrophobicContact CB-CE2 4.13Å; L408-F423 HydrophobicContact CB-CZ 3.51Å; L408-F423 HydrophobicContact CD1-CE2 4.03Å; L408-F423 HydrophobicContact CD1-CZ 3.93Å; L408-F423 HydrophobicContact CG-CZ 4.38Å
409	A	93.4	Very high	91.8	Very high	1 Å²	1	50.6 Å²	50.6	1%	0.008	27%	0.267	C	S	.	.	H	α-helix	trans	-58.8	-40.7	176.9	0	0	0	0	0	111.6	V405 R406 R413 F423 I435 I438	V405-A409 WeakPolarHBondContact O-CB 3.22Å; V405-A409 PolarHBondContact O-N 3.08Å; R406-A409 PolarHBondContact O-N 2.86Å; A409-R413 VanDerWaalsContact O-CB 3.25Å; A409-R413 WeakPolarHBondContact O-CB 3.37Å; A409-R413 PolarHBondContact O-N 2.92Å; A409-F423 HydrophobicContact CB-CD1 4.3Å; A409-F423 HydrophobicContact CB-CE1 4.02Å; A409-I435 HydrophobicContact CB-CD1 3.86Å; A409-I435 HydrophobicContact CB-CG2 4.38Å; A409-I438 HydrophobicContact CB-CD1 3.81Å; A409-I438 HydrophobicContact CB-CG2 4.35Å
410	N	92.6	Very high	91.9	Very high	48 Å²	48	46.5 Å²	46.5	26%	0.257	24%	0.238	S	C	.	.	H	α-helix	trans	-65.4	-44.2	175.1	-78.6	-38.3	0	0	0	112.6	R406 G407 L408 R413 Q414	R406-N410 WeakPolarHBondContact O-CB 3.4Å; R406-N410 PolarHBondContact O-N 3.39Å; R406-N410 PolarHBondContact O-ND2 3.4Å; G407-N410 PolarHBondContact O-N 3.43Å; L408-N410 VanDerWaalsContact C-N 3.27Å; L408-N410 PolarHBondContact O-N 3.27Å; N410-R413 PolarHBondContact OD1-NH2 2.73Å; N410-Q414 PolarHBondContact O-N 2.97Å; N410-Q414 VanDerWaalsContact O-N 3.14Å
411	I	94.3	Very high	92	Very high	1 Å²	1	47.2 Å²	47.2	1%	0.005	23%	0.229	C	C	.	.	H	α-helix	trans	-59.3	-50.5	175.8	-68.3	168.2	0	0	0	110.2	M379 Y384 A387 E388 Y391 G407 L408 Q414 Q415	M379-I411 HydrophobicContact CE-CG1 3.78Å; M379-I411 HydrophobicContact SD-CD1 3.56Å; M379-I411 VanDerWaalsContact SD-CD1 3.56Å; M379-I411 HydrophobicContact SD-CG1 3.38Å; M379-I411 WeakPolarHBondContact SD-CG1 3.4Å; Y384-I411 HydrophobicContact CD1-CG1 4.4Å; A387-I411 HydrophobicContact CB-CD1 3.83Å; E388-I411 HydrophobicContact CB-CD1 4.23Å; Y391-I411 HydrophobicContact CD2-CD1 3.87Å; Y391-I411 HydrophobicContact CE2-CD1 3.98Å; G407-I411 WeakPolarHBondContact O-CG1 3.42Å; G407-I411 PolarHBondContact O-N 3.06Å; L408-I411 PolarHBondContact O-N 2.93Å; I411-Q414 PolarHBondContact O-N 2.97Å; I411-Q415 WeakPolarHBondContact O-CG 3.29Å; I411-Q415 PolarHBondContact O-N 2.93Å
412	Y	94.2	Very high	92	Very high	27 Å²	27	50.2 Å²	50.2	11%	0.106	26%	0.255	C	S	.	.	H	α-helix	trans	-68.5	-38.3	-176.2	-62.9	-37.3	0	0	0	112.4	E388 Q392 L408 Q414 Q415 S416 F423	E388-Y412 WeakPolarHBondContact OE1-CE1 3.28Å; E388-Y412 PolarHBondContact OE1-OH 3.47Å; Q392-Y412 PolarHBondContact NE2-OH 3.48Å; L408-Y412 HydrophobicContact CB-CD2 4.38Å; L408-Y412 HydrophobicContact CB-CE2 4.06Å; L408-Y412 HydrophobicContact CD2-CE2 4.29Å; L408-Y412 VanDerWaalsContact O-CD2 3.27Å; L408-Y412 WeakPolarHBondContact O-CD2 3.42Å; L408-Y412 PolarHBondContact O-N 3.44Å; Y412-Q414 PolarHBondContact O-N 3.35Å; Y412-Q415 PolarHBondContact O-N 3.18Å; Y412-Q415 VanDerWaalsContact O-N 3.12Å; Y412-S416 CarbonylContact O-C 3.55Å; Y412-S416 PolarHBondContact O-N 2.87Å; Y412-F423 HydrophobicContact CD2-CB 3.44Å; Y412-F423 VanDerWaalsContact CD2-CB 3.44Å; Y412-F423 AromaticContact CD2-CD1 3.7Å; Y412-F423 HydrophobicContact CD2-CD1 3.7Å; Y412-F423 AromaticContact CD2-CD2 3.94Å; Y412-F423 HydrophobicContact CD2-CD2 3.94Å; Y412-F423 HydrophobicContact CD2-CE1 4.4Å; Y412-F423 AromaticContact CD2-CG 3.41Å; Y412-F423 HydrophobicContact CD2-CG 3.41Å; Y412-F423 VanDerWaalsContact CD2-CG 3.41Å; Y412-F423 HydrophobicContact CE2-CB 3.83Å; Y412-F423 HydrophobicContact CE2-CD1 4.13Å; Y412-F423 AromaticContact CE2-CD2 3.56Å; Y412-F423 HydrophobicContact CE2-CD2 3.56Å; Y412-F423 HydrophobicContact CE2-CE2 4.08Å; Y412-F423 AromaticContact CE2-CG 3.56Å; Y412-F423 HydrophobicContact CE2-CG 3.56Å; Y412-F423 HydrophobicContact CG-CB 4.43Å
413	R	90.7	Very high	92.1	Very high	95 Å²	95	48.3 Å²	48.3	36%	0.358	24%	0.241	S	C	.	.	H	α-helix	trans	-56.7	-39.5	171.9	175.8	175.6	66.5	172.3	0.1	112.1	A409 N410 A420 L442	A409-R413 VanDerWaalsContact O-CB 3.25Å; A409-R413 WeakPolarHBondContact O-CB 3.37Å; A409-R413 PolarHBondContact O-N 2.92Å; N410-R413 PolarHBondContact OD1-NH2 2.73Å; R413-A420 HydrophobicContact CB-CB 4.29Å; R413-L442 HydrophobicContact CB-CD2 4.49Å; R413-L442 HydrophobicContact CG-CD2 3.91Å; R413-L442 HydrophobicContact CG-CG 4.44Å
414	Q	88.2	Confident	92.1	Very high	120 Å²	120	44.8 Å²	44.8	56%	0.561	22%	0.222	S	C	*	.	H	α-helix	trans	-73.8	-29.6	178.4	-170.8	175.6	11.3	0	0	112.9	Y384 N410 I411 Y412	Y384-Q414 VanDerWaalsContact CZ-OE1 3.25Å; Y384-Q414 PolarHBondContact OH-NE2 2.92Å; Y384-Q414 PolarHBondContact OH-OE1 3.4Å; N410-Q414 PolarHBondContact O-N 2.97Å; N410-Q414 VanDerWaalsContact O-N 3.14Å; I411-Q414 PolarHBondContact O-N 2.97Å; Y412-Q414 PolarHBondContact O-N 3.35Å
415	Q	89.7	Confident	91.9	Very high	82 Å²	82	48.7 Å²	48.7	38%	0.383	25%	0.254	S	S	.	.	H	α-helix	trans	-76.4	-56	177.4	-71.6	-176.3	19	0	0	112.5	I411 Y412 K419	I411-Q415 WeakPolarHBondContact O-CG 3.29Å; I411-Q415 PolarHBondContact O-N 2.93Å; Y412-Q415 PolarHBondContact O-N 3.18Å; Y412-Q415 VanDerWaalsContact O-N 3.12Å; Q415-K419 HydrophobicContact CB-CD 4.26Å
416	S	89.5	Confident	91.8	Very high	27 Å²	27	52.8 Å²	52.8	19%	0.189	28%	0.283	C	S	.	.			trans	-164	146.5	173.8	99.4	0	0	0	0	111.6	Y412 E418 K419 A420	Y412-S416 CarbonylContact O-C 3.55Å; Y412-S416 PolarHBondContact O-N 2.87Å; S416-E418 VanDerWaalsContact C-N 3.26Å; S416-E418 WeakPolarHBondContact CB-OE2 3.25Å; S416-E418 PolarHBondContact O-N 3.33Å; S416-E418 PolarHBondContact OG-N 3.35Å; S416-E418 PolarHBondContact OG-OE2 3.44Å; S416-K419 PolarHBondContact O-N 3.42Å; S416-K419 PolarHBondContact OG-N 3.24Å; S416-K419 VanDerWaalsContact OG-N 3.16Å; S416-A420 PolarHBondContact O-N 3.12Å; S416-A420 VanDerWaalsContact O-N 3.15Å
417	P	85.6	Confident	91.7	Very high	56 Å²	56	49.9 Å²	49.9	36%	0.364	27%	0.273	S	S	.	.	H	α-helix	trans	-56.2	-38.4	175.4	-25	34.7	0	0	0	113.3	A420 E421 L442	P417-A420 WeakPolarHBondContact O-CB 3.35Å; P417-A420 PolarHBondContact O-N 2.88Å; P417-E421 WeakPolarHBondContact O-CG 3.34Å; P417-E421 PolarHBondContact O-N 3.4Å; P417-L442 HydrophobicContact CB-CD2 4.44Å
418	E	88.9	Confident	91.6	Very high	120 Å²	120	52.5 Å²	52.5	56%	0.561	29%	0.291	S	S	*	.	H	α-helix	trans	-66.9	-40.5	-178.1	-52.9	73.5	-159.2	0	0	111.7	S416 A420 E421 A422	S416-E418 VanDerWaalsContact C-N 3.26Å; S416-E418 WeakPolarHBondContact CB-OE2 3.25Å; S416-E418 PolarHBondContact O-N 3.33Å; S416-E418 PolarHBondContact OG-N 3.35Å; S416-E418 PolarHBondContact OG-OE2 3.44Å; E418-A420 VanDerWaalsContact C-N 3.34Å; E418-E421 PolarHBondContact O-N 2.92Å; E418-A422 WeakPolarHBondContact O-CB 3.2Å; E418-A422 PolarHBondContact O-N 3.48Å
419	K	91.2	Very high	91.3	Very high	109 Å²	109	55.9 Å²	55.9	47%	0.474	32%	0.319	S	S	.	.	H	α-helix	trans	-64.5	-41.8	174.8	-76	-169.3	-177.5	-172.2	0	111.3	Q415 S416 E421 A422 F423	Q415-K419 HydrophobicContact CB-CD 4.26Å; S416-K419 PolarHBondContact O-N 3.42Å; S416-K419 PolarHBondContact OG-N 3.24Å; S416-K419 VanDerWaalsContact OG-N 3.16Å; K419-E421 VanDerWaalsContact C-N 3.31Å; K419-E421 PolarHBondContact O-N 3.34Å; K419-A422 PolarHBondContact O-N 3.38Å; K419-F423 WeakPolarHBondContact O-CB 3.36Å; K419-F423 PolarHBondContact O-N 3.09Å
420	A	91.3	Very high	91.1	Very high	1 Å²	1	59.5 Å²	59.5	1%	0.008	34%	0.344	C	S	.	.	H	α-helix	trans	-61.6	-42.5	177.9	0	0	0	0	0	111.2	R413 S416 P417 E418 F423 I424 L442	R413-A420 HydrophobicContact CB-CB 4.29Å; S416-A420 PolarHBondContact O-N 3.12Å; S416-A420 VanDerWaalsContact O-N 3.15Å; P417-A420 WeakPolarHBondContact O-CB 3.35Å; P417-A420 PolarHBondContact O-N 2.88Å; E418-A420 VanDerWaalsContact C-N 3.34Å; A420-F423 PolarHBondContact O-N 2.95Å; A420-I424 WeakPolarHBondContact O-CG1 3.49Å; A420-I424 PolarHBondContact O-N 3.17Å; A420-L442 HydrophobicContact CB-CD1 3.66Å; A420-L442 HydrophobicContact CB-CD2 4.37Å
421	E	89.6	Confident	91.1	Very high	61 Å²	61	58.7 Å²	58.7	29%	0.285	34%	0.339	S	S	.	.	H	α-helix	trans	-69.5	-42.1	178	-74.3	-173	175.2	0	0	113.7	P417 E418 K419 F423 I424 A425 R446	P417-E421 WeakPolarHBondContact O-CG 3.34Å; P417-E421 PolarHBondContact O-N 3.4Å; E418-E421 PolarHBondContact O-N 2.92Å; K419-E421 VanDerWaalsContact C-N 3.31Å; K419-E421 PolarHBondContact O-N 3.34Å; E421-F423 PolarHBondContact O-N 2.7Å; E421-I424 PolarHBondContact O-N 3.5Å; E421-A425 VanDerWaalsContact O-CB 3.29Å; E421-A425 WeakPolarHBondContact O-CB 3.42Å; E421-A425 PolarHBondContact O-N 3.03Å; E421-R446 VanDerWaalsContact CD-CZ 3.42Å; E421-R446 VanDerWaalsContact CD-NH1 3.3Å; E421-R446 IonicContact OE1-CZ 3.7Å; E421-R446 IonicContact OE1-NE 3.55Å; E421-R446 IonicContact OE1-NH1 3.78Å; E421-R446 PolarHBondContact OE1-NH1 3.01Å; E421-R446 IonicContact OE1-NH2 2.85Å; E421-R446 PolarHBondContact OE1-NH2 3.34Å; E421-R446 IonicContact OE2-CZ 3.83Å; E421-R446 VanDerWaalsContact OE2-CZ 3.26Å; E421-R446 IonicContact OE2-NH1 2.86Å; E421-R446 PolarHBondContact OE2-NH1 3.21Å; E421-R446 IonicContact OE2-NH2 2.78Å; E421-R446 PolarHBondContact OE2-NH2 3.38Å
422	A	92.9	Very high	91	Very high	70 Å²	70	63.9 Å²	63.9	58%	0.579	36%	0.359	S	S	*	.	H	α-helix	trans	-58.4	-40	173.7	0	0	0	0	0	111	E418 K419 S426	E418-A422 WeakPolarHBondContact O-CB 3.2Å; E418-A422 PolarHBondContact O-N 3.48Å; K419-A422 PolarHBondContact O-N 3.38Å; A422-S426 PolarHBondContact O-N 3.35Å
423	F	93.9	Very high	90.8	Very high	25 Å²	25	70.7 Å²	70.7	11%	0.11	38%	0.384	C	S	.	.	H	α-helix	trans	-65.8	-50.4	173.6	176.3	-114	0	0	0	112.2	V405 L408 A409 Y412 K419 A420 E421 A425 S426 L427	V405-F423 HydrophobicContact CG1-CE1 4.28Å; V405-F423 HydrophobicContact CG1-CZ 4.31Å; L408-F423 HydrophobicContact CB-CE1 3.79Å; L408-F423 HydrophobicContact CB-CE2 4.13Å; L408-F423 HydrophobicContact CB-CZ 3.51Å; L408-F423 HydrophobicContact CD1-CE2 4.03Å; L408-F423 HydrophobicContact CD1-CZ 3.93Å; L408-F423 HydrophobicContact CG-CZ 4.38Å; A409-F423 HydrophobicContact CB-CD1 4.3Å; A409-F423 HydrophobicContact CB-CE1 4.02Å; Y412-F423 HydrophobicContact CD2-CB 3.44Å; Y412-F423 VanDerWaalsContact CD2-CB 3.44Å; Y412-F423 AromaticContact CD2-CD1 3.7Å; Y412-F423 HydrophobicContact CD2-CD1 3.7Å; Y412-F423 AromaticContact CD2-CD2 3.94Å; Y412-F423 HydrophobicContact CD2-CD2 3.94Å; Y412-F423 HydrophobicContact CD2-CE1 4.4Å; Y412-F423 AromaticContact CD2-CG 3.41Å; Y412-F423 HydrophobicContact CD2-CG 3.41Å; Y412-F423 VanDerWaalsContact CD2-CG 3.41Å; Y412-F423 HydrophobicContact CE2-CB 3.83Å; Y412-F423 HydrophobicContact CE2-CD1 4.13Å; Y412-F423 AromaticContact CE2-CD2 3.56Å; Y412-F423 HydrophobicContact CE2-CD2 3.56Å; Y412-F423 HydrophobicContact CE2-CE2 4.08Å; Y412-F423 AromaticContact CE2-CG 3.56Å; Y412-F423 HydrophobicContact CE2-CG 3.56Å; Y412-F423 HydrophobicContact CG-CB 4.43Å; K419-F423 WeakPolarHBondContact O-CB 3.36Å; K419-F423 PolarHBondContact O-N 3.09Å; A420-F423 PolarHBondContact O-N 2.95Å; E421-F423 PolarHBondContact O-N 2.7Å; F423-A425 VanDerWaalsContact C-N 3.26Å; F423-A425 PolarHBondContact O-N 3Å; F423-S426 WeakPolarHBondContact O-CA 3.25Å; F423-S426 WeakPolarHBondContact O-CB 3.36Å; F423-S426 PolarHBondContact O-N 2.82Å; F423-S426 PolarHBondContact O-OG 3.2Å; F423-L427 HydrophobicContact CE1-CD1 4.14Å; F423-L427 HydrophobicContact CE1-CD2 4.17Å; F423-L427 HydrophobicContact CE1-CG 4.45Å; F423-L427 HydrophobicContact CE2-CD2 3.91Å; F423-L427 HydrophobicContact CZ-CD2 3.71Å; F423-L427 HydrophobicContact CZ-CG 4.44Å; F423-L427 WeakPolarHBondContact O-CG 3.49Å; F423-L427 PolarHBondContact O-N 3.23Å
424	I	92.7	Very high	90.8	Very high	8 Å²	8	67.4 Å²	67.4	4%	0.041	38%	0.376	C	S	.	.	H	α-helix	trans	-57.1	-40.8	178.6	-69.5	164	0	0	0	111	A420 E421 S426 L427 R432 I435 E439 L442	A420-I424 WeakPolarHBondContact O-CG1 3.49Å; A420-I424 PolarHBondContact O-N 3.17Å; E421-I424 PolarHBondContact O-N 3.5Å; I424-S426 VanDerWaalsContact C-N 3.26Å; I424-S426 PolarHBondContact O-N 2.92Å; I424-L427 WeakPolarHBondContact O-CB 3.36Å; I424-L427 PolarHBondContact O-N 3.15Å; I424-R432 HydrophobicContact CG2-CG 4.21Å; I424-I435 HydrophobicContact CG1-CD1 3.83Å; I424-E439 HydrophobicContact CD1-CB 4.29Å; I424-E439 HydrophobicContact CG2-CG 4.43Å; I424-L442 HydrophobicContact CD1-CD1 3.65Å
425	A	91.8	Very high	91	Very high	81 Å²	81	61.7 Å²	61.7	67%	0.669	35%	0.349	S	S	*	.	H	α-helix	trans	-65.9	-26.8	176.7	0	0	0	0	0	113.2	E421 F423 L427	E421-A425 VanDerWaalsContact O-CB 3.29Å; E421-A425 WeakPolarHBondContact O-CB 3.42Å; E421-A425 PolarHBondContact O-N 3.03Å; F423-A425 VanDerWaalsContact C-N 3.26Å; F423-A425 PolarHBondContact O-N 3Å; A425-L427 VanDerWaalsContact C-N 3.33Å
426	S	93.1	Very high	91	Very high	87 Å²	87	60.3 Å²	60.3	61%	0.608	34%	0.344	S	S	*	.	H	α-helix	trans	-79.5	-13.2	176.1	78.8	0	0	0	0	113.9	A422 F423 I424	A422-S426 PolarHBondContact O-N 3.35Å; F423-S426 WeakPolarHBondContact O-CA 3.25Å; F423-S426 WeakPolarHBondContact O-CB 3.36Å; F423-S426 PolarHBondContact O-N 2.82Å; F423-S426 PolarHBondContact O-OG 3.2Å; I424-S426 VanDerWaalsContact C-N 3.26Å; I424-S426 PolarHBondContact O-N 2.92Å
427	L	92.4	Very high	91	Very high	21 Å²	21	62.6 Å²	62.6	11%	0.11	35%	0.354	C	S	.	.	S	Bend	trans	-76.6	145.9	-176.7	-64.1	179	0	0	0	112.8	V405 F423 I424 A425 Q431 R432 I435	V405-L427 HydrophobicContact CG1-CD1 3.58Å; V405-L427 HydrophobicContact CG1-CD2 3.94Å; V405-L427 HydrophobicContact CG1-CG 4.42Å; V405-L427 HydrophobicContact CG2-CD2 4.43Å; F423-L427 HydrophobicContact CE1-CD1 4.14Å; F423-L427 HydrophobicContact CE1-CD2 4.17Å; F423-L427 HydrophobicContact CE1-CG 4.45Å; F423-L427 HydrophobicContact CE2-CD2 3.91Å; F423-L427 HydrophobicContact CZ-CD2 3.71Å; F423-L427 HydrophobicContact CZ-CG 4.44Å; F423-L427 WeakPolarHBondContact O-CG 3.49Å; F423-L427 PolarHBondContact O-N 3.23Å; I424-L427 WeakPolarHBondContact O-CB 3.36Å; I424-L427 PolarHBondContact O-N 3.15Å; A425-L427 VanDerWaalsContact C-N 3.33Å; L427-Q431 HydrophobicContact CB-CB 4Å; L427-Q431 HydrophobicContact CD1-CB 4.42Å; L427-Q431 HydrophobicContact CD2-CB 4.11Å; L427-Q431 HydrophobicContact CG-CB 4.4Å; L427-R432 HydrophobicContact CB-CB 4.36Å; L427-I435 HydrophobicContact CD1-CD1 3.42Å; L427-I435 VanDerWaalsContact CD1-CD1 3.42Å; L427-I435 HydrophobicContact CD1-CG1 4.16Å
428	S	92	Very high	91.2	Very high	59 Å²	59	60 Å²	60	41%	0.413	34%	0.337	S	S	.	.			trans	-64.5	158.6	167.4	68	0	0	0	0	111.6	S430 Q431 R432	S428-S430 PolarHBondContact O-N 3.1Å; S428-S430 VanDerWaalsContact O-N 3.08Å; S428-Q431 PolarHBondContact O-N 3.44Å; S428-Q431 VanDerWaalsContact OG-CD 3.31Å; S428-Q431 VanDerWaalsContact OG-CG 3.3Å; S428-Q431 WeakPolarHBondContact OG-CG 3.47Å; S428-Q431 PolarHBondContact OG-N 2.94Å; S428-Q431 PolarHBondContact OG-OE1 2.91Å; S428-R432 PolarHBondContact O-N 3.36Å
429	A	89.9	Confident	91.2	Very high	75 Å²	75	56.2 Å²	56.2	62%	0.62	32%	0.32	S	S	*	.	H	α-helix	trans	-58.9	-24.5	179.4	0	0	0	0	0	114.2	R433	A429-R433 WeakPolarHBondContact O-CG 3.36Å; A429-R433 PolarHBondContact O-NE 2.99Å
430	S	89.3	Confident	91.1	Very high	76 Å²	76	56.9 Å²	56.9	53%	0.531	32%	0.319	S	S	.	.	H	α-helix	trans	-77.4	-44.5	174.4	-167.6	0	0	0	0	111.7	S428 R433	S428-S430 PolarHBondContact O-N 3.1Å; S428-S430 VanDerWaalsContact O-N 3.08Å; S430-R433 PolarHBondContact O-N 3.29Å
431	Q	91.6	Very high	91	Very high	31 Å²	31	58.8 Å²	58.8	15%	0.145	33%	0.333	C	S	.	.	H	α-helix	trans	-66.4	-42.3	178.7	-69.8	166.7	-45.1	0	0	111.6	S399 V405 L427 S428 R433 S434	S399-Q431 PolarHBondContact O-NE2 3.33Å; V405-Q431 HydrophobicContact CG1-CB 4.38Å; V405-Q431 HydrophobicContact CG2-CB 4.12Å; V405-Q431 HydrophobicContact CG2-CG 3.94Å; L427-Q431 HydrophobicContact CB-CB 4Å; L427-Q431 HydrophobicContact CD1-CB 4.42Å; L427-Q431 HydrophobicContact CD2-CB 4.11Å; L427-Q431 HydrophobicContact CG-CB 4.4Å; S428-Q431 PolarHBondContact O-N 3.44Å; S428-Q431 VanDerWaalsContact OG-CD 3.31Å; S428-Q431 VanDerWaalsContact OG-CG 3.3Å; S428-Q431 WeakPolarHBondContact OG-CG 3.47Å; S428-Q431 PolarHBondContact OG-N 2.94Å; S428-Q431 PolarHBondContact OG-OE1 2.91Å; Q431-R433 VanDerWaalsContact C-N 3.34Å; Q431-R433 PolarHBondContact O-N 3.42Å; Q431-S434 WeakPolarHBondContact O-CB 3.28Å; Q431-S434 PolarHBondContact O-N 3.33Å; Q431-S434 PolarHBondContact O-OG 2.98Å
432	R	91.9	Very high	91	Very high	110 Å²	110	56.5 Å²	56.5	42%	0.415	32%	0.322	S	S	.	.	H	α-helix	trans	-58.6	-45.3	177.9	-172.3	169.5	175.9	-171.6	-0.1	111.9	I424 L427 S428 S434 I435 D436 E439	I424-R432 HydrophobicContact CG2-CG 4.21Å; L427-R432 HydrophobicContact CB-CB 4.36Å; S428-R432 PolarHBondContact O-N 3.36Å; R432-S434 PolarHBondContact O-N 3.46Å; R432-S434 VanDerWaalsContact O-N 3.08Å; R432-I435 CarbonylContact O-C 3.57Å; R432-I435 VanDerWaalsContact O-CG1 3.29Å; R432-I435 WeakPolarHBondContact O-CG1 3.47Å; R432-I435 PolarHBondContact O-N 2.83Å; R432-D436 PolarHBondContact O-N 3.49Å; R432-E439 WeakPolarHBondContact CG-OE2 3.39Å; R432-E439 IonicContact CZ-OE1 2.72Å; R432-E439 IonicContact CZ-OE2 2.67Å; R432-E439 IonicContact NE-OE1 3.37Å; R432-E439 PolarHBondContact NE-OE1 3.02Å; R432-E439 IonicContact NE-OE2 2.74Å; R432-E439 PolarHBondContact NE-OE2 3.07Å; R432-E439 IonicContact NH2-OE1 2.85Å; R432-E439 PolarHBondContact NH2-OE1 3.48Å; R432-E439 IonicContact NH2-OE2 3.19Å
433	R	90.9	Very high	90.9	Very high	170 Å²	170	57.3 Å²	57.3	64%	0.642	31%	0.314	S	S	*	.	H	α-helix	trans	-53.5	-30.5	173.9	-83.2	-177.1	-79.8	148.6	-10.2	114	A429 S430 Q431 I435 D436	A429-R433 WeakPolarHBondContact O-CG 3.36Å; A429-R433 PolarHBondContact O-NE 2.99Å; S430-R433 PolarHBondContact O-N 3.29Å; Q431-R433 VanDerWaalsContact C-N 3.34Å; Q431-R433 PolarHBondContact O-N 3.42Å; R433-I435 VanDerWaalsContact C-N 3.25Å; R433-I435 PolarHBondContact O-N 3.27Å; R433-D436 VanDerWaalsContact CA-OD1 3.25Å; R433-D436 WeakPolarHBondContact CA-OD1 3.3Å
434	S	90.1	Very high	90.8	Very high	27 Å²	27	57.6 Å²	57.6	19%	0.189	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.3	-12	-179.7	77.5	0	0	0	0	114.4	T402 R406 Q431 R432	T402-S434 VanDerWaalsContact CG2-CB 3.48Å; R406-S434 PolarHBondContact NH2-O 3.42Å; Q431-S434 WeakPolarHBondContact O-CB 3.28Å; Q431-S434 PolarHBondContact O-N 3.33Å; Q431-S434 PolarHBondContact O-OG 2.98Å; R432-S434 PolarHBondContact O-N 3.46Å; R432-S434 VanDerWaalsContact O-N 3.08Å
435	I	92.5	Very high	90.7	Very high	0 Å²	0	61 Å²	61	0%	0	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	-129.5	20.7	-178.4	62.2	162.3	0	0	0	112.8	V405 R406 A409 I424 L427 R432 R433 D437 I438 E439	V405-I435 HydrophobicContact CG1-CD1 4.22Å; V405-I435 HydrophobicContact CG1-CG2 3.98Å; R406-I435 HydrophobicContact CB-CG2 4.03Å; A409-I435 HydrophobicContact CB-CD1 3.86Å; A409-I435 HydrophobicContact CB-CG2 4.38Å; I424-I435 HydrophobicContact CG1-CD1 3.83Å; L427-I435 HydrophobicContact CD1-CD1 3.42Å; L427-I435 VanDerWaalsContact CD1-CD1 3.42Å; L427-I435 HydrophobicContact CD1-CG1 4.16Å; R432-I435 CarbonylContact O-C 3.57Å; R432-I435 VanDerWaalsContact O-CG1 3.29Å; R432-I435 WeakPolarHBondContact O-CG1 3.47Å; R432-I435 PolarHBondContact O-N 2.83Å; R433-I435 VanDerWaalsContact C-N 3.25Å; R433-I435 PolarHBondContact O-N 3.27Å; I435-D437 PolarHBondContact O-N 2.87Å; I435-D437 VanDerWaalsContact O-N 3.08Å; I435-I438 HydrophobicContact CB-CB 4.39Å; I435-I438 HydrophobicContact CB-CD1 4.25Å; I435-I438 HydrophobicContact CG2-CD1 4.24Å; I435-I438 WeakPolarHBondContact O-CA 3.18Å; I435-I438 WeakPolarHBondContact O-CB 3.43Å; I435-I438 PolarHBondContact O-N 3.28Å; I435-E439 PolarHBondContact O-N 3.11Å; I435-E439 VanDerWaalsContact O-N 3.1Å
436	D	89.3	Confident	90.6	Very high	52 Å²	52	61.6 Å²	61.6	28%	0.278	32%	0.32	S	S	.	.	H	α-helix	trans	-51.7	-32.5	178.7	-86.1	12.2	0	0	0	112.9	R432 R433 R440	R432-D436 PolarHBondContact O-N 3.49Å; R433-D436 VanDerWaalsContact CA-OD1 3.25Å; R433-D436 WeakPolarHBondContact CA-OD1 3.3Å; D436-R440 WeakPolarHBondContact O-CB 3.44Å; D436-R440 WeakPolarHBondContact O-CG 3.4Å; D436-R440 PolarHBondContact O-N 3.05Å; D436-R440 IonicContact OD2-NH1 2.92Å
437	D	89.3	Confident	90.7	Very high	75 Å²	75	57.9 Å²	57.9	40%	0.401	29%	0.293	S	S	.	.	H	α-helix	trans	-64.9	-40.1	175.1	59.4	-60.8	0	0	0	112.7	R406 I435 S441	R406-D437 IonicContact CZ-OD1 2.98Å; R406-D437 IonicContact CZ-OD2 3.42Å; R406-D437 IonicContact NH1-OD1 3.76Å; R406-D437 PolarHBondContact NH1-OD1 3.02Å; R406-D437 IonicContact NH1-OD2 2.75Å; R406-D437 PolarHBondContact NH1-OD2 3.21Å; R406-D437 IonicContact NH2-OD1 3.61Å; R406-D437 PolarHBondContact NH2-OD1 3.17Å; R406-D437 IonicContact NH2-OD2 3.21Å; I435-D437 PolarHBondContact O-N 2.87Å; I435-D437 VanDerWaalsContact O-N 3.08Å; D437-S441 WeakPolarHBondContact O-CB 3.47Å; D437-S441 PolarHBondContact O-N 3.34Å; D437-S441 VanDerWaalsContact O-N 3.08Å
438	I	90.1	Very high	90.8	Very high	1 Å²	1	58 Å²	58	1%	0.005	30%	0.297	C	S	.	.	H	α-helix	trans	-69.3	-42.3	176.9	-61	177.9	0	0	0	109.9	R406 A409 I435 S441 L442	R406-I438 HydrophobicContact CG-CD1 4.14Å; A409-I438 HydrophobicContact CB-CD1 3.81Å; A409-I438 HydrophobicContact CB-CG2 4.35Å; I435-I438 HydrophobicContact CB-CB 4.39Å; I435-I438 HydrophobicContact CB-CD1 4.25Å; I435-I438 HydrophobicContact CG2-CD1 4.24Å; I435-I438 WeakPolarHBondContact O-CA 3.18Å; I435-I438 WeakPolarHBondContact O-CB 3.43Å; I435-I438 PolarHBondContact O-N 3.28Å; I438-S441 WeakPolarHBondContact O-CB 3.42Å; I438-S441 PolarHBondContact O-N 3.49Å; I438-L442 HydrophobicContact CG2-CD1 4.21Å; I438-L442 PolarHBondContact O-N 3.23Å
439	E	89.4	Confident	90.9	Very high	42 Å²	42	61.4 Å²	61.4	20%	0.196	31%	0.307	C	S	.	.	H	α-helix	trans	-62.9	-46.9	177.4	-176.2	172	-174.1	0	0	111.8	I424 R432 I435 S441 L442 Q443	I424-E439 HydrophobicContact CD1-CB 4.29Å; I424-E439 HydrophobicContact CG2-CG 4.43Å; R432-E439 WeakPolarHBondContact CG-OE2 3.39Å; R432-E439 IonicContact CZ-OE1 2.72Å; R432-E439 IonicContact CZ-OE2 2.67Å; R432-E439 IonicContact NE-OE1 3.37Å; R432-E439 PolarHBondContact NE-OE1 3.02Å; R432-E439 IonicContact NE-OE2 2.74Å; R432-E439 PolarHBondContact NE-OE2 3.07Å; R432-E439 IonicContact NH2-OE1 2.85Å; R432-E439 PolarHBondContact NH2-OE1 3.48Å; R432-E439 IonicContact NH2-OE2 3.19Å; I435-E439 PolarHBondContact O-N 3.11Å; I435-E439 VanDerWaalsContact O-N 3.1Å; E439-S441 VanDerWaalsContact C-N 3.31Å; E439-S441 PolarHBondContact O-N 2.82Å; E439-L442 PolarHBondContact O-N 3.14Å; E439-Q443 PolarHBondContact O-N 3.48Å
440	R	90	Very high	91.1	Very high	122 Å²	122	62.2 Å²	62.2	46%	0.46	30%	0.298	S	S	.	.	H	α-helix	trans	-59.7	-40	175.5	-78.6	-172.4	-77.8	-94.8	1.1	112.4	D436 Q443 N444	D436-R440 WeakPolarHBondContact O-CB 3.44Å; D436-R440 WeakPolarHBondContact O-CG 3.4Å; D436-R440 PolarHBondContact O-N 3.05Å; D436-R440 IonicContact OD2-NH1 2.92Å; R440-Q443 PolarHBondContact O-N 3.19Å; R440-N444 WeakPolarHBondContact O-CB 3.46Å; R440-N444 PolarHBondContact O-N 3Å
441	S	89.1	Confident	91.3	Very high	41 Å²	41	58.6 Å²	58.6	29%	0.287	27%	0.272	S	S	.	.	H	α-helix	trans	-61	-50.3	175.4	-175.6	0	0	0	0	111.6	D437 I438 E439 Q443 N444 D445	D437-S441 WeakPolarHBondContact O-CB 3.47Å; D437-S441 PolarHBondContact O-N 3.34Å; D437-S441 VanDerWaalsContact O-N 3.08Å; I438-S441 WeakPolarHBondContact O-CB 3.42Å; I438-S441 PolarHBondContact O-N 3.49Å; E439-S441 VanDerWaalsContact C-N 3.31Å; E439-S441 PolarHBondContact O-N 2.82Å; S441-Q443 VanDerWaalsContact C-N 3.33Å; S441-Q443 PolarHBondContact O-N 2.91Å; S441-N444 PolarHBondContact O-N 2.92Å; S441-D445 VanDerWaalsContact O-CG 3.24Å; S441-D445 PolarHBondContact O-N 3.35Å
442	L	89.4	Confident	91.4	Very high	13 Å²	13	62.1 Å²	62.1	7%	0.068	29%	0.289	C	S	.	.	H	α-helix	trans	-59.7	-43	178.8	-77.9	166.7	0	0	0	112.1	R413 P417 A420 I424 I438 E439 D445 R446	R413-L442 HydrophobicContact CB-CD2 4.49Å; R413-L442 HydrophobicContact CG-CD2 3.91Å; R413-L442 HydrophobicContact CG-CG 4.44Å; P417-L442 HydrophobicContact CB-CD2 4.44Å; A420-L442 HydrophobicContact CB-CD1 3.66Å; A420-L442 HydrophobicContact CB-CD2 4.37Å; I424-L442 HydrophobicContact CD1-CD1 3.65Å; I438-L442 HydrophobicContact CG2-CD1 4.21Å; I438-L442 PolarHBondContact O-N 3.23Å; E439-L442 PolarHBondContact O-N 3.14Å; L442-D445 PolarHBondContact O-N 3.05Å; L442-R446 PolarHBondContact O-N 3.04Å
443	Q	90.8	Very high	91.5	Very high	87 Å²	87	58.9 Å²	58.9	41%	0.407	29%	0.286	S	S	.	.	H	α-helix	trans	-63.5	-43.5	176.7	-170.5	-177.8	-6.7	0	0	111.5	E439 R440 S441 R446 L447 L473	E439-Q443 PolarHBondContact O-N 3.48Å; R440-Q443 PolarHBondContact O-N 3.19Å; S441-Q443 VanDerWaalsContact C-N 3.33Å; S441-Q443 PolarHBondContact O-N 2.91Å; Q443-R446 PolarHBondContact O-N 3.45Å; Q443-L447 HydrophobicContact CG-CD1 4.21Å; Q443-L447 WeakPolarHBondContact O-CB 3.45Å; Q443-L447 VanDerWaalsContact O-CG 3.27Å; Q443-L447 WeakPolarHBondContact O-CG 3.49Å; Q443-L447 PolarHBondContact O-N 3.2Å; Q443-L473 HydrophobicContact CB-CD1 4.1Å; Q443-L473 HydrophobicContact CG-CD1 3.85Å
444	N	92	Very high	91.7	Very high	32 Å²	32	52 Å²	52	17%	0.171	26%	0.261	C	S	.	.	H	α-helix	trans	-62.6	-43.7	177.5	-173.1	21.9	0	0	0	111.9	R440 S441 L447 A448 R470 L473	R440-N444 WeakPolarHBondContact O-CB 3.46Å; R440-N444 PolarHBondContact O-N 3Å; S441-N444 PolarHBondContact O-N 2.92Å; N444-L447 PolarHBondContact O-N 3.41Å; N444-A448 WeakPolarHBondContact O-CB 3.45Å; N444-A448 PolarHBondContact O-N 3.4Å; N444-R470 PolarHBondContact O-NE 3.5Å; N444-R470 PolarHBondContact OD1-NE 2.94Å; N444-R470 PolarHBondContact OD1-NH2 3.08Å; N444-L473 HydrophobicContact CB-CD1 4.16Å
445	D	89.5	Confident	91.8	Very high	78 Å²	78	52 Å²	52	42%	0.417	26%	0.258	S	S	.	.	H	α-helix	trans	-63.7	-43.2	179.2	-66.8	-25.2	0	0	0	111.7	S441 L442 A448 Q449	S441-D445 VanDerWaalsContact O-CG 3.24Å; S441-D445 PolarHBondContact O-N 3.35Å; L442-D445 PolarHBondContact O-N 3.05Å; D445-A448 WeakPolarHBondContact O-CB 3.36Å; D445-A448 PolarHBondContact O-N 2.85Å; D445-Q449 WeakPolarHBondContact O-CG 3.45Å; D445-Q449 PolarHBondContact O-N 3.39Å
446	R	91.2	Very high	91.7	Very high	95 Å²	95	58.2 Å²	58.2	36%	0.358	29%	0.292	S	S	.	.	H	α-helix	trans	-59.5	-50.4	173.7	170	179.7	-68.8	173.8	-7.7	111.9	E421 L442 Q443 A448 Q449 Q450	E421-R446 VanDerWaalsContact CD-CZ 3.42Å; E421-R446 VanDerWaalsContact CD-NH1 3.3Å; E421-R446 IonicContact OE1-CZ 3.7Å; E421-R446 IonicContact OE1-NE 3.55Å; E421-R446 IonicContact OE1-NH1 3.78Å; E421-R446 PolarHBondContact OE1-NH1 3.01Å; E421-R446 IonicContact OE1-NH2 2.85Å; E421-R446 PolarHBondContact OE1-NH2 3.34Å; E421-R446 IonicContact OE2-CZ 3.83Å; E421-R446 VanDerWaalsContact OE2-CZ 3.26Å; E421-R446 IonicContact OE2-NH1 2.86Å; E421-R446 PolarHBondContact OE2-NH1 3.21Å; E421-R446 IonicContact OE2-NH2 2.78Å; E421-R446 PolarHBondContact OE2-NH2 3.38Å; L442-R446 PolarHBondContact O-N 3.04Å; Q443-R446 PolarHBondContact O-N 3.45Å; R446-A448 PolarHBondContact O-N 2.92Å; R446-Q449 PolarHBondContact O-N 3.17Å; R446-Q450 HydrophobicContact CG-CG 4.5Å; R446-Q450 WeakPolarHBondContact O-CG 3.35Å; R446-Q450 PolarHBondContact O-N 3.11Å
447	L	94.9	Very high	91.7	Very high	9 Å²	9	61.2 Å²	61.2	5%	0.047	30%	0.304	C	S	.	.	H	α-helix	trans	-62.2	-33.7	179.8	-71.3	171.9	0	0	0	111	Q443 N444 A451 L466 Q469 R470 L473	Q443-L447 HydrophobicContact CG-CD1 4.21Å; Q443-L447 WeakPolarHBondContact O-CB 3.45Å; Q443-L447 VanDerWaalsContact O-CG 3.27Å; Q443-L447 WeakPolarHBondContact O-CG 3.49Å; Q443-L447 PolarHBondContact O-N 3.2Å; N444-L447 PolarHBondContact O-N 3.41Å; L447-A451 VanDerWaalsContact O-CB 3.31Å; L447-A451 WeakPolarHBondContact O-CB 3.42Å; L447-A451 PolarHBondContact O-N 2.92Å; L447-L466 HydrophobicContact CD2-CD2 3.96Å; L447-Q469 HydrophobicContact CD1-CB 3.89Å; L447-R470 HydrophobicContact CB-CG 3.38Å; L447-R470 HydrophobicContact CD1-CG 3.9Å; L447-R470 HydrophobicContact CG-CG 4.29Å; L447-L473 HydrophobicContact CD1-CD1 3.82Å
448	A	94.7	Very high	91.7	Very high	23 Å²	23	59.4 Å²	59.4	19%	0.19	30%	0.303	C	S	.	.	H	α-helix	trans	-62.5	-50.1	174.7	0	0	0	0	0	111.4	N444 D445 R446 Q450 A451 E452	N444-A448 WeakPolarHBondContact O-CB 3.45Å; N444-A448 PolarHBondContact O-N 3.4Å; D445-A448 WeakPolarHBondContact O-CB 3.36Å; D445-A448 PolarHBondContact O-N 2.85Å; R446-A448 PolarHBondContact O-N 2.92Å; A448-Q450 VanDerWaalsContact C-N 3.31Å; A448-Q450 PolarHBondContact O-N 3.15Å; A448-A451 PolarHBondContact O-N 3.12Å; A448-E452 WeakPolarHBondContact O-CB 3.21Å; A448-E452 PolarHBondContact O-N 3.05Å
449	Q	92.2	Very high	91.8	Very high	131 Å²	131	63.8 Å²	63.8	61%	0.612	32%	0.322	S	S	*	.	H	α-helix	trans	-61.2	-39.9	178.1	-70.7	177.4	-9.4	0	0	112.1	D445 R446 A453	D445-Q449 WeakPolarHBondContact O-CG 3.45Å; D445-Q449 PolarHBondContact O-N 3.39Å; R446-Q449 PolarHBondContact O-N 3.17Å; Q449-A453 WeakPolarHBondContact O-CB 3.42Å; Q449-A453 PolarHBondContact O-N 3.15Å
450	Q	94.4	Very high	92.1	Very high	92 Å²	92	65.7 Å²	65.7	43%	0.43	33%	0.328	S	S	.	.	H	α-helix	trans	-68.3	-39.8	176.7	-70.8	177.5	-15	0	0	112.2	R446 A448 A453 L454 L466	R446-Q450 HydrophobicContact CG-CG 4.5Å; R446-Q450 WeakPolarHBondContact O-CG 3.35Å; R446-Q450 PolarHBondContact O-N 3.11Å; A448-Q450 VanDerWaalsContact C-N 3.31Å; A448-Q450 PolarHBondContact O-N 3.15Å; Q450-A453 PolarHBondContact O-N 2.9Å; Q450-L454 WeakPolarHBondContact O-CG 3.28Å; Q450-L454 PolarHBondContact O-N 3.17Å; Q450-L454 VanDerWaalsContact O-N 3.14Å; Q450-L466 HydrophobicContact CB-CD1 3.42Å; Q450-L466 VanDerWaalsContact CB-CD1 3.42Å
451	A	94.7	Very high	92.4	Very high	0 Å²	0	62.5 Å²	62.5	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-63.4	-48.8	175.5	0	0	0	0	0	110.8	L447 A448 A453 L454 E455 L466 Q467	L447-A451 VanDerWaalsContact O-CB 3.31Å; L447-A451 WeakPolarHBondContact O-CB 3.42Å; L447-A451 PolarHBondContact O-N 2.92Å; A448-A451 PolarHBondContact O-N 3.12Å; A451-A453 VanDerWaalsContact C-N 3.32Å; A451-A453 PolarHBondContact O-N 3.26Å; A451-L454 CarbonylContact O-C 3.59Å; A451-L454 WeakPolarHBondContact O-CA 3.44Å; A451-L454 WeakPolarHBondContact O-CB 3.37Å; A451-L454 PolarHBondContact O-N 2.9Å; A451-E455 VanDerWaalsContact O-CG 3.3Å; A451-E455 WeakPolarHBondContact O-CG 3.48Å; A451-E455 PolarHBondContact O-N 3.34Å; A451-L466 HydrophobicContact CB-CB 4.12Å; A451-L466 HydrophobicContact CB-CD1 4.4Å; A451-Q467 HydrophobicContact CB-CG 4.38Å
452	E	93.2	Very high	92.7	Very high	104 Å²	104	65.7 Å²	65.7	49%	0.486	34%	0.338	S	S	.	.	H	α-helix	trans	-59.2	-41	177	-176.3	176.9	-176.3	0	0	112.2	A448 L454 E455 N456	A448-E452 WeakPolarHBondContact O-CB 3.21Å; A448-E452 PolarHBondContact O-N 3.05Å; E452-L454 VanDerWaalsContact C-N 3.27Å; E452-L454 PolarHBondContact O-N 3.03Å; E452-E455 PolarHBondContact O-N 2.93Å; E452-N456 WeakPolarHBondContact O-CB 3.28Å; E452-N456 VanDerWaalsContact O-CG 3.31Å; E452-N456 PolarHBondContact O-N 3.36Å; E452-N456 PolarHBondContact O-ND2 2.99Å
453	A	93.8	Very high	93	Very high	43 Å²	43	65 Å²	65	36%	0.355	34%	0.335	S	S	.	.	H	α-helix	trans	-62.9	-32.9	175	0	0	0	0	0	112.9	Q449 Q450 A451 Q457	Q449-A453 WeakPolarHBondContact O-CB 3.42Å; Q449-A453 PolarHBondContact O-N 3.15Å; Q450-A453 PolarHBondContact O-N 2.9Å; A451-A453 VanDerWaalsContact C-N 3.32Å; A451-A453 PolarHBondContact O-N 3.26Å; A453-Q457 VanDerWaalsContact O-CG 3.24Å; A453-Q457 WeakPolarHBondContact O-CG 3.4Å; A453-Q457 PolarHBondContact O-N 3.25Å; A453-Q457 PolarHBondContact O-NE2 3.48Å
454	L	95.8	Very high	93.3	Very high	25 Å²	25	60.9 Å²	60.9	13%	0.131	32%	0.315	C	S	.	.	H	α-helix	trans	-78.6	-37.9	175.8	-70.7	167.7	0	0	0	112.2	Q450 A451 E452 N456 Q457 G458 K459 Q462 A463 L466	Q450-L454 WeakPolarHBondContact O-CG 3.28Å; Q450-L454 PolarHBondContact O-N 3.17Å; Q450-L454 VanDerWaalsContact O-N 3.14Å; A451-L454 CarbonylContact O-C 3.59Å; A451-L454 WeakPolarHBondContact O-CA 3.44Å; A451-L454 WeakPolarHBondContact O-CB 3.37Å; A451-L454 PolarHBondContact O-N 2.9Å; E452-L454 VanDerWaalsContact C-N 3.27Å; E452-L454 PolarHBondContact O-N 3.03Å; L454-N456 VanDerWaalsContact C-N 3.34Å; L454-Q457 CarbonylContact O-C 3.56Å; L454-Q457 PolarHBondContact O-N 2.94Å; L454-Q457 VanDerWaalsContact O-N 3.1Å; L454-G458 PolarHBondContact O-N 2.92Å; L454-K459 HydrophobicContact CB-CB 4.28Å; L454-K459 HydrophobicContact CD2-CB 3.98Å; L454-K459 HydrophobicContact CD2-CD 3.72Å; L454-K459 PolarHBondContact O-N 3.44Å; L454-Q462 HydrophobicContact CD1-CB 3.77Å; L454-Q462 HydrophobicContact CD2-CB 4.24Å; L454-A463 HydrophobicContact CB-CB 4.04Å; L454-L466 HydrophobicContact CD1-CD1 3.6Å; L454-L466 HydrophobicContact CD1-CG 4.29Å
455	E	92.5	Very high	93.6	Very high	27 Å²	27	61.4 Å²	61.4	13%	0.126	32%	0.324	C	S	.	.	H	α-helix	trans	-55.6	-50	171.7	-70.6	164.6	-156.3	0	0	109.6	A451 E452 Q457 G458 W460 A463 Q467 R483 D487	A451-E455 VanDerWaalsContact O-CG 3.3Å; A451-E455 WeakPolarHBondContact O-CG 3.48Å; A451-E455 PolarHBondContact O-N 3.34Å; E452-E455 PolarHBondContact O-N 2.93Å; E455-Q457 PolarHBondContact O-N 3.49Å; E455-Q457 VanDerWaalsContact O-N 3.15Å; E455-G458 PolarHBondContact O-N 3.08Å; E455-W460 HydrophobicContact CB-CZ3 3.97Å; E455-W460 HydrophobicContact CG-CE3 4.44Å; E455-W460 HydrophobicContact CG-CZ3 4.12Å; E455-A463 HydrophobicContact CG-CB 3.83Å; E455-Q467 PolarHBondContact OE1-NE2 3.17Å; E455-R483 IonicContact OE2-NH1 3.97Å; E455-R483 PolarHBondContact OE2-NH1 3.38Å; E455-D487 WeakPolarHBondContact CG-OD1 3.2Å
456	N	89.2	Confident	93.9	Very high	131 Å²	131	58.9 Å²	58.9	70%	0.701	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-19.9	177	-71.7	-31.6	0	0	0	114.1	E452 L454	E452-N456 WeakPolarHBondContact O-CB 3.28Å; E452-N456 VanDerWaalsContact O-CG 3.31Å; E452-N456 PolarHBondContact O-N 3.36Å; E452-N456 PolarHBondContact O-ND2 2.99Å; L454-N456 VanDerWaalsContact C-N 3.34Å
457	Q	89.8	Confident	94.2	Very high	114 Å²	114	54.4 Å²	54.4	53%	0.533	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.4	-0.4	174.2	-70.6	170.3	43	0	0	113.1	A453 L454 E455 K459	A453-Q457 VanDerWaalsContact O-CG 3.24Å; A453-Q457 WeakPolarHBondContact O-CG 3.4Å; A453-Q457 PolarHBondContact O-N 3.25Å; A453-Q457 PolarHBondContact O-NE2 3.48Å; L454-Q457 CarbonylContact O-C 3.56Å; L454-Q457 PolarHBondContact O-N 2.94Å; L454-Q457 VanDerWaalsContact O-N 3.1Å; E455-Q457 PolarHBondContact O-N 3.49Å; E455-Q457 VanDerWaalsContact O-N 3.15Å; Q457-K459 HydrophobicContact CB-CD 4.21Å; Q457-K459 HydrophobicContact CB-CG 4.16Å; Q457-K459 PolarHBondContact O-N 3.02Å
458	G	88.1	Confident	94.3	Very high	38 Å²	38	58.8 Å²	58.8	39%	0.392	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.6	15.7	-173.5	0	0	0	0	0	114.2	L454 E455 W460	L454-G458 PolarHBondContact O-N 2.92Å; E455-G458 PolarHBondContact O-N 3.08Å; G458-W460 VanDerWaalsContact C-N 3.26Å; G458-W460 PolarHBondContact O-N 3.11Å; G458-W460 VanDerWaalsContact O-N 3.12Å; G458-W460 PolarHBondContact O-NE1 3.28Å
459	K	93.9	Very high	94.4	Very high	92 Å²	92	62.4 Å²	62.4	40%	0.4	32%	0.322	S	S	.	.			trans	-88.5	57.3	-179	-69.5	177.2	-179.4	164.5	0	111.5	L454 Q457 A461 Q462 A463	L454-K459 HydrophobicContact CB-CB 4.28Å; L454-K459 HydrophobicContact CD2-CB 3.98Å; L454-K459 HydrophobicContact CD2-CD 3.72Å; L454-K459 PolarHBondContact O-N 3.44Å; Q457-K459 HydrophobicContact CB-CD 4.21Å; Q457-K459 HydrophobicContact CB-CG 4.16Å; Q457-K459 PolarHBondContact O-N 3.02Å; K459-A461 PolarHBondContact O-N 3.49Å; K459-Q462 HydrophobicContact CB-CB 4.47Å; K459-Q462 PolarHBondContact O-N 3.07Å; K459-A463 PolarHBondContact O-N 2.95Å; K459-A463 VanDerWaalsContact O-N 3.07Å
460	W	95.5	Very high	94.5	Very high	82 Å²	82	57.5 Å²	57.5	31%	0.311	30%	0.298	S	S	.	.	H	α-helix	trans	-55.5	-40.9	-170.5	-52.3	113.7	0	0	0	114.8	E455 G458 Q462 A463 A464 Q490 A491	E455-W460 HydrophobicContact CB-CZ3 3.97Å; E455-W460 HydrophobicContact CG-CE3 4.44Å; E455-W460 HydrophobicContact CG-CZ3 4.12Å; G458-W460 VanDerWaalsContact C-N 3.26Å; G458-W460 PolarHBondContact O-N 3.11Å; G458-W460 VanDerWaalsContact O-N 3.12Å; G458-W460 PolarHBondContact O-NE1 3.28Å; W460-Q462 VanDerWaalsContact C-N 3.29Å; W460-Q462 PolarHBondContact O-N 3.21Å; W460-A463 PolarHBondContact O-N 2.89Å; W460-A464 WeakPolarHBondContact O-CB 3.48Å; W460-A464 PolarHBondContact O-N 2.92Å; W460-Q490 HydrophobicContact CB-CB 3.98Å; W460-Q490 HydrophobicContact CD2-CB 3.35Å; W460-Q490 HydrophobicContact CD2-CG 4.05Å; W460-Q490 HydrophobicContact CE3-CB 3.76Å; W460-Q490 HydrophobicContact CE3-CG 4.08Å; W460-Q490 HydrophobicContact CG-CB 3.43Å; W460-Q490 VanDerWaalsContact CG-CB 3.43Å; W460-Q490 HydrophobicContact CH2-CG 4.4Å; W460-Q490 HydrophobicContact CZ2-CB 4.36Å; W460-Q490 HydrophobicContact CZ2-CG 4.35Å; W460-Q490 HydrophobicContact CZ3-CB 4.41Å; W460-Q490 HydrophobicContact CZ3-CG 4.26Å; W460-A491 HydrophobicContact CB-CB 3.83Å
461	A	95.1	Very high	94.6	Very high	55 Å²	55	54.6 Å²	54.6	46%	0.455	29%	0.285	S	S	.	.	H	α-helix	trans	-65.5	-32.4	179.7	0	0	0	0	0	113.1	K459 A465 A491	K459-A461 PolarHBondContact O-N 3.49Å; A461-A465 PolarHBondContact O-N 3.3Å; A461-A491 HydrophobicContact CB-CB 4.23Å
462	Q	95.6	Very high	94.5	Very high	108 Å²	108	58.3 Å²	58.3	51%	0.505	32%	0.316	S	S	.	.	H	α-helix	trans	-78.6	-39.7	177	-60.9	179.9	26	0	0	110.7	L454 K459 W460 A464 A465 L466	L454-Q462 HydrophobicContact CD1-CB 3.77Å; L454-Q462 HydrophobicContact CD2-CB 4.24Å; K459-Q462 HydrophobicContact CB-CB 4.47Å; K459-Q462 PolarHBondContact O-N 3.07Å; W460-Q462 VanDerWaalsContact C-N 3.29Å; W460-Q462 PolarHBondContact O-N 3.21Å; Q462-A464 VanDerWaalsContact C-N 3.34Å; Q462-A464 PolarHBondContact O-N 2.93Å; Q462-A465 WeakPolarHBondContact O-CB 3.2Å; Q462-A465 PolarHBondContact O-N 3.25Å; Q462-A465 VanDerWaalsContact O-N 3.11Å; Q462-L466 PolarHBondContact O-N 2.85Å; Q462-L466 VanDerWaalsContact O-N 3.17Å
463	A	96.9	Very high	94.4	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-56.7	-47.9	171.6	0	0	0	0	0	111	L454 E455 K459 W460 A465 L466 Q467 D487	L454-A463 HydrophobicContact CB-CB 4.04Å; E455-A463 HydrophobicContact CG-CB 3.83Å; K459-A463 PolarHBondContact O-N 2.95Å; K459-A463 VanDerWaalsContact O-N 3.07Å; W460-A463 PolarHBondContact O-N 2.89Å; A463-A465 VanDerWaalsContact C-N 3.26Å; A463-A465 PolarHBondContact O-N 3.39Å; A463-L466 PolarHBondContact O-N 3.12Å; A463-Q467 WeakPolarHBondContact O-CG 3.44Å; A463-Q467 PolarHBondContact O-N 2.97Å; A463-D487 HydrophobicContact CB-CB 4.47Å; A463-D487 WeakPolarHBondContact CB-OD2 3.38Å
464	A	97.1	Very high	94.2	Very high	0 Å²	0	57 Å²	57	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-57.7	-35.7	175	0	0	0	0	0	113	W460 Q462 Q467 R468 L484 D487 L488	W460-A464 WeakPolarHBondContact O-CB 3.48Å; W460-A464 PolarHBondContact O-N 2.92Å; Q462-A464 VanDerWaalsContact C-N 3.34Å; Q462-A464 PolarHBondContact O-N 2.93Å; A464-Q467 PolarHBondContact O-N 3.33Å; A464-R468 WeakPolarHBondContact O-CG 3.39Å; A464-R468 PolarHBondContact O-N 3.29Å; A464-L484 HydrophobicContact CB-CD1 3.87Å; A464-L484 VanDerWaalsContact O-CD1 3.26Å; A464-L484 WeakPolarHBondContact O-CD1 3.47Å; A464-D487 HydrophobicContact CB-CB 3.83Å; A464-D487 PolarHBondContact N-OD2 2.7Å; A464-L488 HydrophobicContact CB-CD2 3.93Å; A464-L488 HydrophobicContact CB-CG 4.22Å
465	A	96.9	Very high	94	Very high	43 Å²	43	60.1 Å²	60.1	36%	0.355	33%	0.328	S	S	.	.	H	α-helix	trans	-65.8	-40.1	176.1	0	0	0	0	0	112	A461 Q462 A463 R468 Q469	A461-A465 PolarHBondContact O-N 3.3Å; Q462-A465 WeakPolarHBondContact O-CB 3.2Å; Q462-A465 PolarHBondContact O-N 3.25Å; Q462-A465 VanDerWaalsContact O-N 3.11Å; A463-A465 VanDerWaalsContact C-N 3.26Å; A463-A465 PolarHBondContact O-N 3.39Å; A465-R468 PolarHBondContact O-N 3.07Å; A465-Q469 PolarHBondContact O-N 2.76Å
466	L	96.9	Very high	93.8	Very high	24 Å²	24	60.4 Å²	60.4	13%	0.126	34%	0.338	C	S	.	.	H	α-helix	trans	-70	-41.1	174.6	-62.2	-175	0	0	0	111.8	L447 Q450 A451 L454 Q462 A463 R468 Q469 R470	L447-L466 HydrophobicContact CD2-CD2 3.96Å; Q450-L466 HydrophobicContact CB-CD1 3.42Å; Q450-L466 VanDerWaalsContact CB-CD1 3.42Å; A451-L466 HydrophobicContact CB-CB 4.12Å; A451-L466 HydrophobicContact CB-CD1 4.4Å; L454-L466 HydrophobicContact CD1-CD1 3.6Å; L454-L466 HydrophobicContact CD1-CG 4.29Å; Q462-L466 PolarHBondContact O-N 2.85Å; Q462-L466 VanDerWaalsContact O-N 3.17Å; A463-L466 PolarHBondContact O-N 3.12Å; L466-R468 VanDerWaalsContact C-N 3.27Å; L466-R468 PolarHBondContact O-N 3.03Å; L466-Q469 WeakPolarHBondContact O-CA 3.46Å; L466-Q469 WeakPolarHBondContact O-CB 3.39Å; L466-Q469 PolarHBondContact O-N 2.72Å; L466-R470 WeakPolarHBondContact O-CG 3.43Å; L466-R470 PolarHBondContact O-N 3.27Å
467	Q	97.2	Very high	94.1	Very high	1 Å²	1	55.1 Å²	55.1	1%	0.005	31%	0.311	C	S	.	.	H	α-helix	trans	-62.1	-33.7	175	-62	-65	1.9	0	0	112	A451 E455 A463 A464 Q469 R470 L471 L484 D487	A451-Q467 HydrophobicContact CB-CG 4.38Å; E455-Q467 PolarHBondContact OE1-NE2 3.17Å; A463-Q467 WeakPolarHBondContact O-CG 3.44Å; A463-Q467 PolarHBondContact O-N 2.97Å; A464-Q467 PolarHBondContact O-N 3.33Å; Q467-Q469 VanDerWaalsContact C-N 3.34Å; Q467-R470 PolarHBondContact O-N 3.34Å; Q467-L471 WeakPolarHBondContact O-CB 3.4Å; Q467-L471 PolarHBondContact O-N 3.35Å; Q467-L484 HydrophobicContact CB-CB 3.79Å; Q467-L484 HydrophobicContact CB-CD1 3.9Å; Q467-L484 HydrophobicContact CB-CG 4.34Å; Q467-D487 WeakPolarHBondContact CG-OD2 3.45Å
468	R	96.9	Very high	94.4	Very high	102 Å²	102	49.8 Å²	49.8	39%	0.385	29%	0.287	S	S	.	.	H	α-helix	trans	-62.5	-39.6	170.9	-75.6	-178.7	-173.5	113.7	-8.7	112.3	A464 A465 L466 L471 A472 L484 Q496	A464-R468 WeakPolarHBondContact O-CG 3.39Å; A464-R468 PolarHBondContact O-N 3.29Å; A465-R468 PolarHBondContact O-N 3.07Å; L466-R468 VanDerWaalsContact C-N 3.27Å; L466-R468 PolarHBondContact O-N 3.03Å; R468-L471 PolarHBondContact O-N 3.14Å; R468-A472 PolarHBondContact O-N 2.96Å; R468-L484 HydrophobicContact CG-CD1 3.88Å; R468-L484 HydrophobicContact CG-CD2 3.77Å; R468-Q496 VanDerWaalsContact NH2-OE1 3.09Å
469	Q	95.8	Very high	94.8	Very high	98 Å²	98	52.6 Å²	52.6	46%	0.458	29%	0.285	S	S	.	.	H	α-helix	trans	-65.4	-40.7	174.4	-65	178.5	13.3	0	0	111.2	L447 A465 L466 Q467 A472 L473	L447-Q469 HydrophobicContact CD1-CB 3.89Å; A465-Q469 PolarHBondContact O-N 2.76Å; L466-Q469 WeakPolarHBondContact O-CA 3.46Å; L466-Q469 WeakPolarHBondContact O-CB 3.39Å; L466-Q469 PolarHBondContact O-N 2.72Å; Q467-Q469 VanDerWaalsContact C-N 3.34Å; Q469-A472 WeakPolarHBondContact O-CB 3.31Å; Q469-A472 PolarHBondContact O-N 3.39Å; Q469-L473 PolarHBondContact O-N 3.02Å
470	R	96.2	Very high	94.9	Very high	28 Å²	28	48.5 Å²	48.5	11%	0.106	27%	0.268	C	S	.	.	H	α-helix	trans	-62.8	-42.8	174.5	-65.9	-179.3	68.9	-153.4	4.4	112.2	N444 L447 L466 Q467 A472 L473 D474 I480	N444-R470 PolarHBondContact O-NE 3.5Å; N444-R470 PolarHBondContact OD1-NE 2.94Å; N444-R470 PolarHBondContact OD1-NH2 3.08Å; L447-R470 HydrophobicContact CB-CG 3.38Å; L447-R470 HydrophobicContact CD1-CG 3.9Å; L447-R470 HydrophobicContact CG-CG 4.29Å; L466-R470 WeakPolarHBondContact O-CG 3.43Å; L466-R470 PolarHBondContact O-N 3.27Å; Q467-R470 PolarHBondContact O-N 3.34Å; R470-A472 PolarHBondContact O-N 3.35Å; R470-L473 WeakPolarHBondContact O-CA 3.35Å; R470-L473 WeakPolarHBondContact O-CB 3.44Å; R470-L473 PolarHBondContact O-N 3.27Å; R470-D474 PolarHBondContact O-N 3.19Å; R470-I480 HydrophobicContact CB-CD1 4.15Å; R470-I480 HydrophobicContact CB-CG2 3.86Å
471	L	94.6	Very high	95	Very high	32 Å²	32	44.9 Å²	44.9	17%	0.168	26%	0.255	C	S	.	.	H	α-helix	trans	-65.3	-30.8	176.2	-170.8	63.5	0	0	0	111.3	Q467 R468 L473 D474 P475 I480 T481 L484 L500	Q467-L471 WeakPolarHBondContact O-CB 3.4Å; Q467-L471 PolarHBondContact O-N 3.35Å; R468-L471 PolarHBondContact O-N 3.14Å; L471-L473 VanDerWaalsContact C-N 3.28Å; L471-L473 PolarHBondContact O-N 3.41Å; L471-D474 CarbonylContact O-C 3.57Å; L471-D474 PolarHBondContact O-N 2.94Å; L471-P475 WeakPolarHBondContact O-CA 3.28Å; L471-P475 WeakPolarHBondContact O-CD 3.46Å; L471-I480 HydrophobicContact CB-CG2 3.89Å; L471-I480 HydrophobicContact CD1-CB 4.48Å; L471-I480 HydrophobicContact CD1-CG2 4.3Å; L471-T481 WeakPolarHBondContact CD1-OG1 3.47Å; L471-L484 HydrophobicContact CD2-CD2 3.99Å; L471-L500 HydrophobicContact CD2-CD1 4.5Å
472	A	93.8	Very high	95.1	Very high	77 Å²	77	43.9 Å²	43.9	64%	0.636	24%	0.239	S	C	*	.	H	α-helix	trans	-68.1	-26.9	172	0	0	0	0	0	113	R468 Q469 R470	R468-A472 PolarHBondContact O-N 2.96Å; Q469-A472 WeakPolarHBondContact O-CB 3.31Å; Q469-A472 PolarHBondContact O-N 3.39Å; R470-A472 PolarHBondContact O-N 3.35Å
473	L	91.5	Very high	95.1	Very high	47 Å²	47	43.8 Å²	43.8	25%	0.246	23%	0.234	C	C	.	.	H	α-helix	trans	-78.2	-33.2	173.6	-62.3	174	0	0	0	112.5	Q443 N444 L447 Q469 R470 L471	Q443-L473 HydrophobicContact CB-CD1 4.1Å; Q443-L473 HydrophobicContact CG-CD1 3.85Å; N444-L473 HydrophobicContact CB-CD1 4.16Å; L447-L473 HydrophobicContact CD1-CD1 3.82Å; Q469-L473 PolarHBondContact O-N 3.02Å; R470-L473 WeakPolarHBondContact O-CA 3.35Å; R470-L473 WeakPolarHBondContact O-CB 3.44Å; R470-L473 PolarHBondContact O-N 3.27Å; L471-L473 VanDerWaalsContact C-N 3.28Å; L471-L473 PolarHBondContact O-N 3.41Å
474	D	89.7	Confident	95.1	Very high	74 Å²	74	44 Å²	44	40%	0.396	24%	0.236	S	C	.	.			trans	-136.4	81.1	175.2	-178.5	11.8	0	0	0	111.6	R470 L471 G476 S477 I480	R470-D474 PolarHBondContact O-N 3.19Å; L471-D474 CarbonylContact O-C 3.57Å; L471-D474 PolarHBondContact O-N 2.94Å; D474-G476 PolarHBondContact O-N 3.08Å; D474-G476 VanDerWaalsContact O-N 3.09Å; D474-S477 WeakPolarHBondContact O-CB 3.24Å; D474-S477 PolarHBondContact O-N 2.97Å; D474-S477 VanDerWaalsContact O-N 3.17Å; D474-S477 VanDerWaalsContact OD2-CB 3.24Å; D474-S477 WeakPolarHBondContact OD2-CB 3.42Å; D474-I480 HydrophobicContact CB-CD1 4.24Å
475	P	90.4	Very high	95.1	Very high	90 Å²	90	44 Å²	44	58%	0.584	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-17.4	-173.8	-25.5	35.3	0	0	0	115.4	L471	L471-P475 WeakPolarHBondContact O-CA 3.28Å; L471-P475 WeakPolarHBondContact O-CD 3.46Å
476	G	89.2	Confident	95	Very high	33 Å²	33	45 Å²	45	34%	0.34	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.7	3.6	-179.1	0	0	0	0	0	114.3	D474 V478 K508	D474-G476 PolarHBondContact O-N 3.08Å; D474-G476 VanDerWaalsContact O-N 3.09Å; G476-V478 PolarHBondContact O-N 3.07Å; G476-K508 WeakPolarHBondContact O-CE 3.43Å; G476-K508 PolarHBondContact O-NZ 2.85Å
477	S	94.6	Very high	95	Very high	19 Å²	19	44 Å²	44	13%	0.133	23%	0.228	C	C	.	.			trans	-73	116.1	-173.5	-164.6	0	0	0	0	112.6	D474 I480 T481	D474-S477 WeakPolarHBondContact O-CB 3.24Å; D474-S477 PolarHBondContact O-N 2.97Å; D474-S477 VanDerWaalsContact O-N 3.17Å; D474-S477 VanDerWaalsContact OD2-CB 3.24Å; D474-S477 WeakPolarHBondContact OD2-CB 3.42Å; S477-I480 WeakPolarHBondContact OG-CD1 3.46Å; S477-I480 WeakPolarHBondContact OG-CG1 3.33Å; S477-I480 PolarHBondContact OG-N 2.66Å; S477-T481 WeakPolarHBondContact O-CB 3.44Å; S477-T481 PolarHBondContact O-N 2.76Å; S477-T481 PolarHBondContact O-OG1 3.46Å
478	V	96.4	Very high	95	Very high	3 Å²	3	44.2 Å²	44.2	2%	0.018	23%	0.229	C	C	.	.	H	α-helix	trans	-62.2	-47.1	175.3	169.4	0	0	0	0	110.8	G476 T481 Y482 L504 K508 E513 Q514 A517	G476-V478 PolarHBondContact O-N 3.07Å; V478-T481 WeakPolarHBondContact O-CB 3.42Å; V478-T481 PolarHBondContact O-N 2.77Å; V478-Y482 PolarHBondContact O-N 3.41Å; V478-L504 HydrophobicContact CG1-CD2 4.25Å; V478-L504 HydrophobicContact CG2-CD1 4.31Å; V478-K508 HydrophobicContact CG2-CD 4.1Å; V478-E513 HydrophobicContact CB-CB 4.39Å; V478-E513 HydrophobicContact CG1-CB 4.13Å; V478-E513 WeakPolarHBondContact CG1-O 3.35Å; V478-E513 HydrophobicContact CG2-CB 4.29Å; V478-Q514 HydrophobicContact CG2-CB 4.24Å; V478-A517 HydrophobicContact CG1-CB 3.52Å
479	W	95.9	Very high	94.8	Very high	96 Å²	96	41.5 Å²	41.5	36%	0.364	22%	0.219	S	C	.	.	H	α-helix	trans	-74.5	-34.5	-173.1	-66.8	110.7	0	0	0	113.8	T481 Y482 R483 Y516 A517 L520	W479-T481 VanDerWaalsContact C-N 3.33Å; W479-Y482 HydrophobicContact CE3-CD1 4.04Å; W479-Y482 HydrophobicContact CZ3-CD1 4.2Å; W479-Y482 HydrophobicContact CZ3-CE1 4.48Å; W479-Y482 PolarHBondContact O-N 2.98Å; W479-R483 WeakPolarHBondContact O-CG 3.3Å; W479-R483 PolarHBondContact O-N 3.33Å; W479-Y516 AromaticContact CH2-CD1 3.54Å; W479-Y516 HydrophobicContact CH2-CD1 3.54Å; W479-Y516 AromaticContact CH2-CE1 3.68Å; W479-Y516 HydrophobicContact CH2-CE1 3.68Å; W479-Y516 AromaticContact CZ2-CD1 3.99Å; W479-Y516 HydrophobicContact CZ2-CD1 3.99Å; W479-Y516 HydrophobicContact CZ2-CE1 4.35Å; W479-A517 HydrophobicContact CZ3-CB 4.25Å; W479-L520 HydrophobicContact CH2-CD1 4.32Å; W479-L520 HydrophobicContact CZ3-CD1 4.25Å
480	I	96.5	Very high	94.7	Very high	7 Å²	7	42 Å²	42	4%	0.036	22%	0.221	C	C	.	.	H	α-helix	trans	-67.6	-40	172.3	-60.3	169.4	0	0	0	109.7	R470 L471 D474 S477 Y482 R483 L484	R470-I480 HydrophobicContact CB-CD1 4.15Å; R470-I480 HydrophobicContact CB-CG2 3.86Å; L471-I480 HydrophobicContact CB-CG2 3.89Å; L471-I480 HydrophobicContact CD1-CB 4.48Å; L471-I480 HydrophobicContact CD1-CG2 4.3Å; D474-I480 HydrophobicContact CB-CD1 4.24Å; S477-I480 WeakPolarHBondContact OG-CD1 3.46Å; S477-I480 WeakPolarHBondContact OG-CG1 3.33Å; S477-I480 PolarHBondContact OG-N 2.66Å; I480-Y482 VanDerWaalsContact C-N 3.35Å; I480-Y482 PolarHBondContact O-N 3.45Å; I480-R483 PolarHBondContact O-N 3.45Å; I480-L484 VanDerWaalsContact O-CB 3.3Å; I480-L484 WeakPolarHBondContact O-CB 3.43Å; I480-L484 PolarHBondContact O-N 2.96Å
481	T	97	Very high	94.5	Very high	6 Å²	6	42.2 Å²	42.2	4%	0.037	23%	0.229	C	C	.	.	H	α-helix	trans	-62.2	-42.5	176.1	-56.8	0	0	0	0	111.8	L471 S477 V478 W479 S485 L500 M501 L504	L471-T481 WeakPolarHBondContact CD1-OG1 3.47Å; S477-T481 WeakPolarHBondContact O-CB 3.44Å; S477-T481 PolarHBondContact O-N 2.76Å; S477-T481 PolarHBondContact O-OG1 3.46Å; V478-T481 WeakPolarHBondContact O-CB 3.42Å; V478-T481 PolarHBondContact O-N 2.77Å; W479-T481 VanDerWaalsContact C-N 3.33Å; T481-S485 WeakPolarHBondContact O-CB 3.48Å; T481-S485 PolarHBondContact O-N 3.47Å; T481-S485 PolarHBondContact O-OG 2.91Å; T481-L500 HydrophobicContact CG2-CD1 3.8Å; T481-L500 HydrophobicContact CG2-CD2 4.08Å; T481-L500 HydrophobicContact CG2-CG 3.57Å; T481-M501 HydrophobicContact CG2-SD 4.37Å; T481-L504 HydrophobicContact CG2-CB 4.05Å; T481-L504 HydrophobicContact CG2-CD1 4.27Å; T481-L504 HydrophobicContact CG2-CD2 3.96Å; T481-L504 HydrophobicContact CG2-CG 4.3Å
482	Y	97.1	Very high	94.3	Very high	33 Å²	33	43.4 Å²	43.4	13%	0.129	25%	0.249	C	C	.	.	H	α-helix	trans	-61.1	-52.2	174	171.9	-107.4	0	0	0	112.2	V478 W479 I480 L484 S485 Q486 M501 A517 L520	V478-Y482 PolarHBondContact O-N 3.41Å; W479-Y482 HydrophobicContact CE3-CD1 4.04Å; W479-Y482 HydrophobicContact CZ3-CD1 4.2Å; W479-Y482 HydrophobicContact CZ3-CE1 4.48Å; W479-Y482 PolarHBondContact O-N 2.98Å; I480-Y482 VanDerWaalsContact C-N 3.35Å; I480-Y482 PolarHBondContact O-N 3.45Å; Y482-L484 PolarHBondContact O-N 2.86Å; Y482-S485 WeakPolarHBondContact O-CA 3.44Å; Y482-S485 WeakPolarHBondContact O-CB 3.48Å; Y482-S485 PolarHBondContact O-N 3.24Å; Y482-Q486 HydrophobicContact CD2-CG 4.5Å; Y482-Q486 VanDerWaalsContact CE1-CD 3.41Å; Y482-Q486 HydrophobicContact CE1-CG 4.31Å; Y482-Q486 HydrophobicContact CE2-CG 4.13Å; Y482-Q486 VanDerWaalsContact CZ-NE2 3.31Å; Y482-Q486 WeakPolarHBondContact O-CG 3.32Å; Y482-Q486 PolarHBondContact O-N 2.75Å; Y482-Q486 PolarHBondContact OH-NE2 2.93Å; Y482-M501 HydrophobicContact CD2-CE 4.38Å; Y482-A517 HydrophobicContact CD2-CB 4.37Å; Y482-A517 WeakPolarHBondContact CD2-O 3.48Å; Y482-A517 WeakPolarHBondContact CE2-O 3.49Å; Y482-A517 HydrophobicContact CG-CB 4.36Å; Y482-L520 HydrophobicContact CE2-CB 3.95Å
483	R	95.9	Very high	94.3	Very high	106 Å²	106	42.5 Å²	42.5	40%	0.4	23%	0.231	S	C	.	.	H	α-helix	trans	-60.2	-44.1	178.5	-76.5	-175.7	171.1	-93.7	1.2	112.4	E455 W479 I480 S485 Q486 D487	E455-R483 IonicContact OE2-NH1 3.97Å; E455-R483 PolarHBondContact OE2-NH1 3.38Å; W479-R483 WeakPolarHBondContact O-CG 3.3Å; W479-R483 PolarHBondContact O-N 3.33Å; I480-R483 PolarHBondContact O-N 3.45Å; R483-S485 VanDerWaalsContact C-N 3.27Å; R483-S485 PolarHBondContact O-N 2.88Å; R483-Q486 WeakPolarHBondContact O-CB 3.35Å; R483-Q486 PolarHBondContact O-N 3.31Å; R483-D487 PolarHBondContact O-N 2.91Å
484	L	97.5	Very high	94.4	Very high	5 Å²	5	47.5 Å²	47.5	3%	0.026	25%	0.247	C	C	.	.	H	α-helix	trans	-58	-41.6	173.3	176.4	54.9	0	0	0	111.6	A464 Q467 R468 L471 I480 Y482 Q486 D487 L488 L500	A464-L484 HydrophobicContact CB-CD1 3.87Å; A464-L484 VanDerWaalsContact O-CD1 3.26Å; A464-L484 WeakPolarHBondContact O-CD1 3.47Å; Q467-L484 HydrophobicContact CB-CB 3.79Å; Q467-L484 HydrophobicContact CB-CD1 3.9Å; Q467-L484 HydrophobicContact CB-CG 4.34Å; R468-L484 HydrophobicContact CG-CD1 3.88Å; R468-L484 HydrophobicContact CG-CD2 3.77Å; L471-L484 HydrophobicContact CD2-CD2 3.99Å; I480-L484 VanDerWaalsContact O-CB 3.3Å; I480-L484 WeakPolarHBondContact O-CB 3.43Å; I480-L484 PolarHBondContact O-N 2.96Å; Y482-L484 PolarHBondContact O-N 2.86Å; L484-Q486 VanDerWaalsContact C-N 3.35Å; L484-D487 PolarHBondContact O-N 2.88Å; L484-L488 HydrophobicContact CD1-CD1 3.92Å; L484-L488 HydrophobicContact CD1-CG 3.94Å; L484-L488 HydrophobicContact CG-CD1 3.93Å; L484-L488 HydrophobicContact CG-CG 4.4Å; L484-L488 WeakPolarHBondContact O-CB 3.49Å; L484-L488 WeakPolarHBondContact O-CG 3.39Å; L484-L488 PolarHBondContact O-N 3.04Å; L484-L500 HydrophobicContact CB-CD2 3.95Å; L484-L500 HydrophobicContact CD2-CD2 3.52Å; L484-L500 HydrophobicContact CG-CD2 3.52Å
485	S	97	Very high	94.6	Very high	0 Å²	0	48 Å²	48	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-65.9	-38	178.2	-57.2	0	0	0	0	111.9	T481 Y482 R483 W489 A497 L500 M501	T481-S485 WeakPolarHBondContact O-CB 3.48Å; T481-S485 PolarHBondContact O-N 3.47Å; T481-S485 PolarHBondContact O-OG 2.91Å; Y482-S485 WeakPolarHBondContact O-CA 3.44Å; Y482-S485 WeakPolarHBondContact O-CB 3.48Å; Y482-S485 PolarHBondContact O-N 3.24Å; R483-S485 VanDerWaalsContact C-N 3.27Å; R483-S485 PolarHBondContact O-N 2.88Å; S485-W489 WeakPolarHBondContact O-CB 3.22Å; S485-W489 PolarHBondContact O-N 2.87Å; S485-A497 WeakPolarHBondContact O-CB 3.18Å; S485-L500 VanDerWaalsContact OG-CD2 3.3Å; S485-L500 WeakPolarHBondContact OG-CD2 3.11Å; S485-M501 WeakPolarHBondContact OG-CG 3.47Å; S485-M501 PolarHBondContact OG-SD 3.4Å
486	Q	95	Very high	94.8	Very high	64 Å²	64	48 Å²	48	30%	0.299	25%	0.248	S	C	.	.	H	α-helix	trans	-63.4	-48.8	173.1	-67.2	-177.1	-64.8	0	0	111.5	Y482 R483 L484 L488 W489 Q490	Y482-Q486 HydrophobicContact CD2-CG 4.5Å; Y482-Q486 VanDerWaalsContact CE1-CD 3.41Å; Y482-Q486 HydrophobicContact CE1-CG 4.31Å; Y482-Q486 HydrophobicContact CE2-CG 4.13Å; Y482-Q486 VanDerWaalsContact CZ-NE2 3.31Å; Y482-Q486 WeakPolarHBondContact O-CG 3.32Å; Y482-Q486 PolarHBondContact O-N 2.75Å; Y482-Q486 PolarHBondContact OH-NE2 2.93Å; R483-Q486 WeakPolarHBondContact O-CB 3.35Å; R483-Q486 PolarHBondContact O-N 3.31Å; L484-Q486 VanDerWaalsContact C-N 3.35Å; Q486-L488 VanDerWaalsContact C-N 3.32Å; Q486-L488 PolarHBondContact O-N 3.49Å; Q486-W489 WeakPolarHBondContact O-CB 3.26Å; Q486-W489 PolarHBondContact O-N 3.24Å; Q486-W489 VanDerWaalsContact O-N 3.16Å; Q486-Q490 WeakPolarHBondContact O-CG 3.3Å; Q486-Q490 PolarHBondContact O-N 3.5Å
487	D	96.3	Very high	95.2	Very high	4 Å²	4	46.4 Å²	46.4	2%	0.021	23%	0.232	C	C	.	.	H	α-helix	trans	-60.6	-41.4	178.5	-70.5	-18.4	0	0	0	112	E455 A463 A464 Q467 R483 L484 W489 Q490 A491	E455-D487 WeakPolarHBondContact CG-OD1 3.2Å; A463-D487 HydrophobicContact CB-CB 4.47Å; A463-D487 WeakPolarHBondContact CB-OD2 3.38Å; A464-D487 HydrophobicContact CB-CB 3.83Å; A464-D487 PolarHBondContact N-OD2 2.7Å; Q467-D487 WeakPolarHBondContact CG-OD2 3.45Å; R483-D487 PolarHBondContact O-N 2.91Å; L484-D487 PolarHBondContact O-N 2.88Å; D487-W489 VanDerWaalsContact C-N 3.35Å; D487-Q490 PolarHBondContact O-N 3.44Å; D487-A491 VanDerWaalsContact O-CB 3.22Å; D487-A491 WeakPolarHBondContact O-CB 3.3Å; D487-A491 PolarHBondContact O-N 3.45Å
488	L	96.7	Very high	95.2	Very high	4 Å²	4	47.6 Å²	47.6	2%	0.021	24%	0.237	C	C	.	.	H	α-helix	trans	-64.6	-40	176.6	-73.6	171.3	0	0	0	112	A464 L484 Q486 A491 G492 Q493 Q496 A497 L500	A464-L488 HydrophobicContact CB-CD2 3.93Å; A464-L488 HydrophobicContact CB-CG 4.22Å; L484-L488 HydrophobicContact CD1-CD1 3.92Å; L484-L488 HydrophobicContact CD1-CG 3.94Å; L484-L488 HydrophobicContact CG-CD1 3.93Å; L484-L488 HydrophobicContact CG-CG 4.4Å; L484-L488 WeakPolarHBondContact O-CB 3.49Å; L484-L488 WeakPolarHBondContact O-CG 3.39Å; L484-L488 PolarHBondContact O-N 3.04Å; Q486-L488 VanDerWaalsContact C-N 3.32Å; Q486-L488 PolarHBondContact O-N 3.49Å; L488-A491 PolarHBondContact O-N 3.21Å; L488-G492 PolarHBondContact O-N 3.03Å; L488-Q493 HydrophobicContact CB-CB 4.37Å; L488-Q493 HydrophobicContact CD2-CB 4.16Å; L488-Q493 CarbonylContact O-C 3.59Å; L488-Q493 WeakPolarHBondContact O-CA 3.42Å; L488-Q493 WeakPolarHBondContact O-CB 3.48Å; L488-Q493 PolarHBondContact O-N 3.1Å; L488-Q496 HydrophobicContact CD1-CB 4.16Å; L488-A497 HydrophobicContact CB-CB 3.93Å; L488-L500 HydrophobicContact CD1-CD2 4.24Å
489	W	94.6	Very high	95.2	Very high	45 Å²	45	50 Å²	50	17%	0.17	25%	0.252	C	S	.	.	H	α-helix	trans	-63	-49.2	176.4	-172.6	-81.1	0	0	0	111.5	S485 Q486 D487 A491 G492 R494 A497 H525	S485-W489 WeakPolarHBondContact O-CB 3.22Å; S485-W489 PolarHBondContact O-N 2.87Å; Q486-W489 WeakPolarHBondContact O-CB 3.26Å; Q486-W489 PolarHBondContact O-N 3.24Å; Q486-W489 VanDerWaalsContact O-N 3.16Å; D487-W489 VanDerWaalsContact C-N 3.35Å; W489-A491 PolarHBondContact O-N 2.9Å; W489-G492 PolarHBondContact O-N 3.44Å; W489-R494 HydrophobicContact CD2-CB 4.46Å; W489-R494 HydrophobicContact CD2-CG 3.96Å; W489-R494 HydrophobicContact CE3-CB 3.97Å; W489-R494 HydrophobicContact CE3-CG 3.97Å; W489-R494 HydrophobicContact CZ2-CG 4.47Å; W489-R494 HydrophobicContact CZ3-CB 4.1Å; W489-R494 HydrophobicContact CZ3-CG 4.28Å; W489-A497 HydrophobicContact CB-CB 4.29Å; W489-A497 HydrophobicContact CE3-CB 4.38Å; W489-H525 AromaticContact CD1-CD2 3.5Å; W489-H525 AromaticContact CD1-NE2 3.26Å; W489-H525 VanDerWaalsContact CD1-NE2 3.26Å; W489-H525 AromaticContact CD2-CD2 3.42Å; W489-H525 VanDerWaalsContact CD2-CD2 3.42Å; W489-H525 AromaticContact CD2-NE2 3.38Å; W489-H525 AromaticContact CE2-CD2 3.03Å; W489-H525 AromaticContact CE2-CG 3.74Å; W489-H525 AromaticContact CE2-NE2 3.52Å; W489-H525 AromaticContact CG-CD2 3.7Å; W489-H525 AromaticContact CG-NE2 3.22Å; W489-H525 HydrophobicContact CH2-CB 3.93Å; W489-H525 AromaticContact CH2-CG 3.95Å; W489-H525 HydrophobicContact CZ2-CB 3.82Å; W489-H525 AromaticContact CZ2-CD2 3.4Å; W489-H525 VanDerWaalsContact CZ2-CD2 3.4Å; W489-H525 WeakPolarHBondContact CZ2-CD2 3.35Å; W489-H525 AromaticContact CZ2-CG 3.69Å; W489-H525 AromaticContact NE1-CD2 3.12Å; W489-H525 PolarHBondContact NE1-CD2 3.38Å; W489-H525 AromaticContact NE1-NE2 3.45Å; W489-H525 PolarHBondContact NE1-NE2 3.18Å
490	Q	92	Very high	95.2	Very high	109 Å²	109	47 Å²	47	51%	0.509	24%	0.243	S	C	.	.	H	α-helix	trans	-65.4	-27.9	178.4	-63	-63.7	-9.1	0	0	112.5	W460 Q486 D487 G492	W460-Q490 HydrophobicContact CB-CB 3.98Å; W460-Q490 HydrophobicContact CD2-CB 3.35Å; W460-Q490 HydrophobicContact CD2-CG 4.05Å; W460-Q490 HydrophobicContact CE3-CB 3.76Å; W460-Q490 HydrophobicContact CE3-CG 4.08Å; W460-Q490 HydrophobicContact CG-CB 3.43Å; W460-Q490 VanDerWaalsContact CG-CB 3.43Å; W460-Q490 HydrophobicContact CH2-CG 4.4Å; W460-Q490 HydrophobicContact CZ2-CB 4.36Å; W460-Q490 HydrophobicContact CZ2-CG 4.35Å; W460-Q490 HydrophobicContact CZ3-CB 4.41Å; W460-Q490 HydrophobicContact CZ3-CG 4.26Å; Q486-Q490 WeakPolarHBondContact O-CG 3.3Å; Q486-Q490 PolarHBondContact O-N 3.5Å; D487-Q490 PolarHBondContact O-N 3.44Å; Q490-G492 PolarHBondContact O-N 3.42Å
491	A	93.2	Very high	95.2	Very high	32 Å²	32	46.7 Å²	46.7	26%	0.264	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.6	1.8	171.3	0	0	0	0	0	114.3	W460 A461 D487 L488 W489 Q493	W460-A491 HydrophobicContact CB-CB 3.83Å; A461-A491 HydrophobicContact CB-CB 4.23Å; D487-A491 VanDerWaalsContact O-CB 3.22Å; D487-A491 WeakPolarHBondContact O-CB 3.3Å; D487-A491 PolarHBondContact O-N 3.45Å; L488-A491 PolarHBondContact O-N 3.21Å; W489-A491 PolarHBondContact O-N 2.9Å; A491-Q493 VanDerWaalsContact C-N 3.32Å; A491-Q493 PolarHBondContact O-N 3.21Å
492	G	90.5	Very high	95.1	Very high	57 Å²	57	52.6 Å²	52.6	59%	0.588	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.3	2.7	-178.2	0	0	0	0	0	114.9	L488 W489 Q490 R494	L488-G492 PolarHBondContact O-N 3.03Å; W489-G492 PolarHBondContact O-N 3.44Å; Q490-G492 PolarHBondContact O-N 3.42Å; G492-R494 VanDerWaalsContact C-N 3.28Å; G492-R494 PolarHBondContact O-N 2.98Å; G492-R494 VanDerWaalsContact O-N 3.16Å
493	Q	93.6	Very high	95	Very high	59 Å²	59	54.2 Å²	54.2	28%	0.276	27%	0.274	S	S	.	.			trans	-90.2	53.3	-179.6	-61	177	37.6	0	0	111.5	L488 A491 S495 Q496 A497	L488-Q493 HydrophobicContact CB-CB 4.37Å; L488-Q493 HydrophobicContact CD2-CB 4.16Å; L488-Q493 CarbonylContact O-C 3.59Å; L488-Q493 WeakPolarHBondContact O-CA 3.42Å; L488-Q493 WeakPolarHBondContact O-CB 3.48Å; L488-Q493 PolarHBondContact O-N 3.1Å; A491-Q493 VanDerWaalsContact C-N 3.32Å; A491-Q493 PolarHBondContact O-N 3.21Å; Q493-S495 PolarHBondContact O-N 2.77Å; Q493-Q496 HydrophobicContact CB-CB 4.41Å; Q493-Q496 PolarHBondContact O-N 2.74Å; Q493-Q496 VanDerWaalsContact O-N 3.14Å; Q493-Q496 VanDerWaalsContact OE1-NE2 3.11Å; Q493-A497 PolarHBondContact O-N 3.35Å
494	R	93.7	Very high	95	Very high	151 Å²	151	49.4 Å²	49.4	57%	0.57	26%	0.256	S	S	*	.	H	α-helix	trans	-56.2	-45.9	-171.6	-59.9	-175.2	-174.9	179.7	0.1	113.6	W489 G492 Q496 A497 D498	W489-R494 HydrophobicContact CD2-CB 4.46Å; W489-R494 HydrophobicContact CD2-CG 3.96Å; W489-R494 HydrophobicContact CE3-CB 3.97Å; W489-R494 HydrophobicContact CE3-CG 3.97Å; W489-R494 HydrophobicContact CZ2-CG 4.47Å; W489-R494 HydrophobicContact CZ3-CB 4.1Å; W489-R494 HydrophobicContact CZ3-CG 4.28Å; G492-R494 VanDerWaalsContact C-N 3.28Å; G492-R494 PolarHBondContact O-N 2.98Å; G492-R494 VanDerWaalsContact O-N 3.16Å; R494-Q496 VanDerWaalsContact C-N 3.25Å; R494-Q496 PolarHBondContact O-N 2.62Å; R494-A497 WeakPolarHBondContact O-CB 3.12Å; R494-A497 PolarHBondContact O-N 2.84Å; R494-A497 VanDerWaalsContact O-N 3.09Å; R494-D498 PolarHBondContact O-N 2.89Å
495	S	94	Very high	94.8	Very high	84 Å²	84	50 Å²	50	59%	0.587	26%	0.261	S	S	*	.	H	α-helix	trans	-61.9	-32.2	-179	60.3	0	0	0	0	113.4	Q493 T499	Q493-S495 PolarHBondContact O-N 2.77Å; S495-T499 VanDerWaalsContact O-CB 3.28Å; S495-T499 WeakPolarHBondContact O-CB 3.48Å; S495-T499 PolarHBondContact O-N 3.4Å; S495-T499 VanDerWaalsContact O-N 3.12Å; S495-T499 PolarHBondContact O-OG1 3.3Å
496	Q	95	Very high	94.7	Very high	90 Å²	90	57.1 Å²	57.1	42%	0.421	29%	0.294	S	S	.	.	H	α-helix	trans	-72.4	-42.7	175.4	-68.2	-175.4	44.1	0	0	110.8	R468 L488 Q493 R494 T499 L500	R468-Q496 VanDerWaalsContact NH2-OE1 3.09Å; L488-Q496 HydrophobicContact CD1-CB 4.16Å; Q493-Q496 HydrophobicContact CB-CB 4.41Å; Q493-Q496 PolarHBondContact O-N 2.74Å; Q493-Q496 VanDerWaalsContact O-N 3.14Å; Q493-Q496 VanDerWaalsContact OE1-NE2 3.11Å; R494-Q496 VanDerWaalsContact C-N 3.25Å; R494-Q496 PolarHBondContact O-N 2.62Å; Q496-T499 PolarHBondContact O-N 2.97Å; Q496-L500 VanDerWaalsContact O-CB 3.28Å; Q496-L500 WeakPolarHBondContact O-CB 3.44Å; Q496-L500 PolarHBondContact O-N 2.99Å
497	A	95.7	Very high	94.6	Very high	0 Å²	0	60.4 Å²	60.4	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-59.7	-48.4	175.7	0	0	0	0	0	111.7	S485 L488 W489 Q493 R494 T499 L500 M501 Y521	S485-A497 WeakPolarHBondContact O-CB 3.18Å; L488-A497 HydrophobicContact CB-CB 3.93Å; W489-A497 HydrophobicContact CB-CB 4.29Å; W489-A497 HydrophobicContact CE3-CB 4.38Å; Q493-A497 PolarHBondContact O-N 3.35Å; R494-A497 WeakPolarHBondContact O-CB 3.12Å; R494-A497 PolarHBondContact O-N 2.84Å; R494-A497 VanDerWaalsContact O-N 3.09Å; A497-T499 VanDerWaalsContact C-N 3.32Å; A497-T499 PolarHBondContact O-N 3.04Å; A497-L500 WeakPolarHBondContact O-CB 3.43Å; A497-L500 PolarHBondContact O-N 2.74Å; A497-M501 PolarHBondContact O-N 3.48Å; A497-Y521 HydrophobicContact CB-CE2 4.27Å; A497-Y521 WeakPolarHBondContact CB-OH 3.48Å
498	D	95.2	Very high	94.5	Very high	45 Å²	45	63.2 Å²	63.2	24%	0.241	32%	0.322	C	S	.	.	H	α-helix	trans	-61.9	-41	178.6	-70.1	-37.8	0	0	0	112.2	R494 L500 R502 Y521	R494-D498 PolarHBondContact O-N 2.89Å; D498-L500 VanDerWaalsContact C-N 3.35Å; D498-R502 WeakPolarHBondContact O-CB 3.3Å; D498-R502 VanDerWaalsContact O-CG 3.29Å; D498-R502 WeakPolarHBondContact O-CG 3.44Å; D498-R502 PolarHBondContact O-N 3.43Å; D498-R502 PolarHBondContact O-NE 3.42Å; D498-Y521 PolarHBondContact N-OH 2.69Å; D498-Y521 PolarHBondContact OD1-OH 3.3Å
499	T	96.1	Very high	94.2	Very high	54 Å²	54	66.9 Å²	66.9	33%	0.331	35%	0.346	S	S	.	.	H	α-helix	trans	-67.4	-39.5	178.5	-59.9	0	0	0	0	111	S495 Q496 A497 R502 N503	S495-T499 VanDerWaalsContact O-CB 3.28Å; S495-T499 WeakPolarHBondContact O-CB 3.48Å; S495-T499 PolarHBondContact O-N 3.4Å; S495-T499 VanDerWaalsContact O-N 3.12Å; S495-T499 PolarHBondContact O-OG1 3.3Å; Q496-T499 PolarHBondContact O-N 2.97Å; A497-T499 VanDerWaalsContact C-N 3.32Å; A497-T499 PolarHBondContact O-N 3.04Å; T499-R502 PolarHBondContact O-N 3.28Å; T499-R502 PolarHBondContact OG1-NH2 3.49Å; T499-R502 VanDerWaalsContact OG1-NH2 3.17Å; T499-N503 WeakPolarHBondContact O-CB 3.49Å; T499-N503 PolarHBondContact O-N 2.82Å; T499-N503 PolarHBondContact O-ND2 3.08Å; T499-N503 PolarHBondContact O-OD1 3.1Å
500	L	95.7	Very high	93.9	Very high	33 Å²	33	69.8 Å²	69.8	17%	0.173	37%	0.365	C	S	.	.	H	α-helix	trans	-62.8	-45.9	178.3	-176.4	60.1	0	0	0	111.6	L471 T481 L484 S485 L488 Q496 A497 D498 N503 L504	L471-L500 HydrophobicContact CD2-CD1 4.5Å; T481-L500 HydrophobicContact CG2-CD1 3.8Å; T481-L500 HydrophobicContact CG2-CD2 4.08Å; T481-L500 HydrophobicContact CG2-CG 3.57Å; L484-L500 HydrophobicContact CB-CD2 3.95Å; L484-L500 HydrophobicContact CD2-CD2 3.52Å; L484-L500 HydrophobicContact CG-CD2 3.52Å; S485-L500 VanDerWaalsContact OG-CD2 3.3Å; S485-L500 WeakPolarHBondContact OG-CD2 3.11Å; L488-L500 HydrophobicContact CD1-CD2 4.24Å; Q496-L500 VanDerWaalsContact O-CB 3.28Å; Q496-L500 WeakPolarHBondContact O-CB 3.44Å; Q496-L500 PolarHBondContact O-N 2.99Å; A497-L500 WeakPolarHBondContact O-CB 3.43Å; A497-L500 PolarHBondContact O-N 2.74Å; D498-L500 VanDerWaalsContact C-N 3.35Å; L500-N503 PolarHBondContact O-N 3.31Å; L500-L504 PolarHBondContact O-N 2.63Å
501	M	96.4	Very high	94	Very high	0 Å²	0	66.3 Å²	66.3	0%	0	35%	0.35	C	S	.	.	H	α-helix	trans	-69.2	-37.1	177.7	-67.6	-55.8	-68	0	0	113.3	T481 Y482 S485 A497 L504 A505 Y518 Y521	T481-M501 HydrophobicContact CG2-SD 4.37Å; Y482-M501 HydrophobicContact CD2-CE 4.38Å; S485-M501 WeakPolarHBondContact OG-CG 3.47Å; S485-M501 PolarHBondContact OG-SD 3.4Å; A497-M501 PolarHBondContact O-N 3.48Å; M501-L504 HydrophobicContact CE-CD2 4.1Å; M501-L504 WeakPolarHBondContact O-CB 3.42Å; M501-L504 PolarHBondContact O-N 2.92Å; M501-L504 HydrophobicContact SD-CD2 4.29Å; M501-A505 PolarHBondContact O-N 3.26Å; M501-Y518 HydrophobicContact CB-CD2 3.62Å; M501-Y518 HydrophobicContact CB-CE2 3.48Å; M501-Y518 VanDerWaalsContact CB-CE2 3.48Å; M501-Y518 HydrophobicContact CB-CG 4.36Å; M501-Y518 VanDerWaalsContact CE-CA 3.44Å; M501-Y518 HydrophobicContact CE-CD2 3.82Å; M501-Y518 HydrophobicContact CE-CG 4.05Å; M501-Y518 HydrophobicContact CG-CD2 4.24Å; M501-Y518 HydrophobicContact CG-CE2 4.39Å; M501-Y521 HydrophobicContact CB-CD1 4.27Å; M501-Y521 HydrophobicContact CB-CE1 4.36Å; M501-Y521 HydrophobicContact CE-CG 4.41Å; M501-Y521 HydrophobicContact CG-CD1 3.86Å; M501-Y521 HydrophobicContact CG-CD2 3.99Å; M501-Y521 HydrophobicContact CG-CE1 4.04Å; M501-Y521 HydrophobicContact CG-CE2 4.18Å; M501-Y521 HydrophobicContact CG-CG 3.81Å
502	R	95.3	Very high	94.1	Very high	130 Å²	130	66.6 Å²	66.6	49%	0.491	35%	0.349	S	S	.	.	H	α-helix	trans	-63.1	-41.7	172.7	-75.5	-175.9	-63.6	162.2	2.4	112.1	D498 T499 L504 A505 Q506 Y518	D498-R502 WeakPolarHBondContact O-CB 3.3Å; D498-R502 VanDerWaalsContact O-CG 3.29Å; D498-R502 WeakPolarHBondContact O-CG 3.44Å; D498-R502 PolarHBondContact O-N 3.43Å; D498-R502 PolarHBondContact O-NE 3.42Å; T499-R502 PolarHBondContact O-N 3.28Å; T499-R502 PolarHBondContact OG1-NH2 3.49Å; T499-R502 VanDerWaalsContact OG1-NH2 3.17Å; R502-L504 VanDerWaalsContact C-N 3.32Å; R502-L504 PolarHBondContact O-N 3.23Å; R502-A505 WeakPolarHBondContact O-CB 3.24Å; R502-A505 PolarHBondContact O-N 2.91Å; R502-Q506 WeakPolarHBondContact O-CG 3.09Å; R502-Q506 PolarHBondContact O-N 3.06Å; R502-Y518 WeakPolarHBondContact CG-OH 3.38Å
503	N	95.7	Very high	94.3	Very high	67 Å²	67	68.3 Å²	68.3	36%	0.358	34%	0.342	S	S	.	.	H	α-helix	trans	-63.1	-40.4	175.9	-70.9	-12.9	0	0	0	111.3	T499 L500 A505 Q506 Q507	T499-N503 WeakPolarHBondContact O-CB 3.49Å; T499-N503 PolarHBondContact O-N 2.82Å; T499-N503 PolarHBondContact O-ND2 3.08Å; T499-N503 PolarHBondContact O-OD1 3.1Å; L500-N503 PolarHBondContact O-N 3.31Å; N503-A505 PolarHBondContact O-N 3.29Å; N503-Q506 PolarHBondContact O-N 3.13Å; N503-Q507 VanDerWaalsContact O-CG 3.28Å; N503-Q507 WeakPolarHBondContact O-CG 3.47Å; N503-Q507 PolarHBondContact O-N 2.81Å
504	L	95.1	Very high	94.3	Very high	5 Å²	5	65.6 Å²	65.6	3%	0.026	33%	0.329	C	S	.	.	H	α-helix	trans	-59.6	-44.9	174.5	-176.3	67.9	0	0	0	111.8	V478 T481 L500 M501 R502 Q506 Q507 K508 Q514	V478-L504 HydrophobicContact CG1-CD2 4.25Å; V478-L504 HydrophobicContact CG2-CD1 4.31Å; T481-L504 HydrophobicContact CG2-CB 4.05Å; T481-L504 HydrophobicContact CG2-CD1 4.27Å; T481-L504 HydrophobicContact CG2-CD2 3.96Å; T481-L504 HydrophobicContact CG2-CG 4.3Å; L500-L504 PolarHBondContact O-N 2.63Å; M501-L504 HydrophobicContact CE-CD2 4.1Å; M501-L504 WeakPolarHBondContact O-CB 3.42Å; M501-L504 PolarHBondContact O-N 2.92Å; M501-L504 HydrophobicContact SD-CD2 4.29Å; R502-L504 VanDerWaalsContact C-N 3.32Å; R502-L504 PolarHBondContact O-N 3.23Å; L504-Q506 VanDerWaalsContact C-N 3.32Å; L504-Q506 PolarHBondContact O-N 2.82Å; L504-Q507 PolarHBondContact O-N 3.46Å; L504-K508 PolarHBondContact O-N 3.1Å; L504-Q514 HydrophobicContact CD2-CG 4.04Å; L504-Q514 HydrophobicContact CG-CG 3.77Å
505	A	94.6	Very high	94.5	Very high	17 Å²	17	58.4 Å²	58.4	14%	0.14	30%	0.302	C	S	.	.	H	α-helix	trans	-60.9	-39.6	176.8	0	0	0	0	0	112.7	M501 R502 N503 K508 P509 Q514 Y518	M501-A505 PolarHBondContact O-N 3.26Å; R502-A505 WeakPolarHBondContact O-CB 3.24Å; R502-A505 PolarHBondContact O-N 2.91Å; N503-A505 PolarHBondContact O-N 3.29Å; A505-K508 CarbonylContact O-C 3.46Å; A505-P509 WeakPolarHBondContact O-CA 3.36Å; A505-Q514 VanDerWaalsContact CA-NE2 3.3Å; A505-Q514 VanDerWaalsContact CB-NE2 3.28Å; A505-Y518 HydrophobicContact CB-CD1 3.95Å; A505-Y518 HydrophobicContact CB-CE1 4.04Å
506	Q	94.1	Very high	94.6	Very high	149 Å²	149	56.2 Å²	56.2	70%	0.696	28%	0.281	S	S	*	.	H	α-helix	trans	-69.3	-36.6	176.7	-71.2	176.5	-4.5	0	0	112.7	R502 N503 L504	R502-Q506 WeakPolarHBondContact O-CG 3.09Å; R502-Q506 PolarHBondContact O-N 3.06Å; N503-Q506 PolarHBondContact O-N 3.13Å; L504-Q506 VanDerWaalsContact C-N 3.32Å; L504-Q506 PolarHBondContact O-N 2.82Å
507	Q	93.8	Very high	94.6	Very high	134 Å²	134	52 Å²	52	63%	0.626	26%	0.261	S	S	*	.	H	α-helix	trans	-73.7	-30.2	179	-71.1	173.8	15.8	0	0	112.5	N503 L504	N503-Q507 VanDerWaalsContact O-CG 3.28Å; N503-Q507 WeakPolarHBondContact O-CG 3.47Å; N503-Q507 PolarHBondContact O-N 2.81Å; L504-Q507 PolarHBondContact O-N 3.46Å
508	K	93.8	Very high	94.7	Very high	63 Å²	63	53.3 Å²	53.3	27%	0.274	27%	0.266	S	S	.	.			trans	-131.5	65.3	-176.8	-58.9	-156.9	-175.7	-169.6	0	113.5	G476 V478 L504 A505 N510 D511 Q514	G476-K508 WeakPolarHBondContact O-CE 3.43Å; G476-K508 PolarHBondContact O-NZ 2.85Å; V478-K508 HydrophobicContact CG2-CD 4.1Å; L504-K508 PolarHBondContact O-N 3.1Å; A505-K508 CarbonylContact O-C 3.46Å; K508-N510 PolarHBondContact O-N 2.86Å; K508-D511 HydrophobicContact CB-CB 3.81Å; K508-D511 HydrophobicContact CD-CB 4.1Å; K508-D511 WeakPolarHBondContact CD-OD2 3.36Å; K508-D511 IonicContact NZ-OD2 3.28Å; K508-D511 PolarHBondContact NZ-OD2 2.81Å; K508-D511 PolarHBondContact O-N 3.46Å; K508-Q514 HydrophobicContact CB-CB 4.21Å; K508-Q514 HydrophobicContact CB-CG 4.29Å
509	P	89.6	Confident	94.7	Very high	80 Å²	80	51.2 Å²	51.2	52%	0.519	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69	-5.5	-168.9	26.6	-35.6	0	0	0	116.3	A505	A505-P509 WeakPolarHBondContact O-CA 3.36Å
510	N	88.4	Confident	94.7	Very high	107 Å²	107	50.4 Å²	50.4	57%	0.572	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-139.2	22.8	-179.9	-64	-57	0	0	0	112.3	K508 P512	K508-N510 PolarHBondContact O-N 2.86Å; N510-P512 WeakPolarHBondContact O-CD 3.24Å
511	D	93.7	Very high	94.7	Very high	36 Å²	36	48.9 Å²	48.9	19%	0.193	24%	0.24	C	C	.	.			trans	-89.3	116.2	178.1	-178.3	-8.9	0	0	0	109.5	K508 E513 Q514 V515	K508-D511 HydrophobicContact CB-CB 3.81Å; K508-D511 HydrophobicContact CD-CB 4.1Å; K508-D511 WeakPolarHBondContact CD-OD2 3.36Å; K508-D511 IonicContact NZ-OD2 3.28Å; K508-D511 PolarHBondContact NZ-OD2 2.81Å; K508-D511 PolarHBondContact O-N 3.46Å; D511-E513 PolarHBondContact O-N 3.45Å; D511-E513 WeakPolarHBondContact OD1-CB 3.49Å; D511-E513 PolarHBondContact OD1-N 3.13Å; D511-Q514 HydrophobicContact CB-CB 3.88Å; D511-Q514 WeakPolarHBondContact O-CB 3.4Å; D511-Q514 PolarHBondContact O-N 3.31Å; D511-Q514 VanDerWaalsContact O-N 3.08Å; D511-V515 WeakPolarHBondContact O-CG2 3.34Å; D511-V515 PolarHBondContact O-N 3.15Å
512	P	94.9	Very high	94.7	Very high	37 Å²	37	49.2 Å²	49.2	24%	0.24	24%	0.242	C	C	.	.	H	α-helix	trans	-56.7	-33	177.9	-25	34.9	0	0	0	113.5	N510 Y516 L538 Q542 I547	N510-P512 WeakPolarHBondContact O-CD 3.24Å; P512-Y516 WeakPolarHBondContact O-CB 3.47Å; P512-Y516 PolarHBondContact O-N 3.29Å; P512-L538 HydrophobicContact CB-CD2 4.08Å; P512-L538 HydrophobicContact CG-CD2 4.25Å; P512-Q542 HydrophobicContact CG-CB 4.41Å; P512-I547 HydrophobicContact CB-CD1 4.04Å
513	E	94.9	Very high	94.6	Very high	94 Å²	94	43.6 Å²	43.6	44%	0.439	22%	0.223	S	C	.	.	H	α-helix	trans	-67	-42.9	176.7	-64.9	-165.3	158.7	0	0	111.1	V478 D511 Y516 A517	V478-E513 HydrophobicContact CB-CB 4.39Å; V478-E513 HydrophobicContact CG1-CB 4.13Å; V478-E513 WeakPolarHBondContact CG1-O 3.35Å; V478-E513 HydrophobicContact CG2-CB 4.29Å; D511-E513 PolarHBondContact O-N 3.45Å; D511-E513 WeakPolarHBondContact OD1-CB 3.49Å; D511-E513 PolarHBondContact OD1-N 3.13Å; E513-Y516 PolarHBondContact O-N 3.48Å; E513-A517 VanDerWaalsContact O-CB 3.3Å; E513-A517 WeakPolarHBondContact O-CB 3.37Å; E513-A517 PolarHBondContact O-N 3.49Å
514	Q	95.3	Very high	94.3	Very high	1 Å²	1	43.2 Å²	43.2	1%	0.005	24%	0.235	C	C	.	.	H	α-helix	trans	-60.4	-49.2	176.8	-178.4	-77	-35.2	0	0	110.7	V478 L504 A505 K508 D511 Y516 A517 Y518 H534	V478-Q514 HydrophobicContact CG2-CB 4.24Å; L504-Q514 HydrophobicContact CD2-CG 4.04Å; L504-Q514 HydrophobicContact CG-CG 3.77Å; A505-Q514 VanDerWaalsContact CA-NE2 3.3Å; A505-Q514 VanDerWaalsContact CB-NE2 3.28Å; K508-Q514 HydrophobicContact CB-CB 4.21Å; K508-Q514 HydrophobicContact CB-CG 4.29Å; D511-Q514 HydrophobicContact CB-CB 3.88Å; D511-Q514 WeakPolarHBondContact O-CB 3.4Å; D511-Q514 PolarHBondContact O-N 3.31Å; D511-Q514 VanDerWaalsContact O-N 3.08Å; Q514-Y516 VanDerWaalsContact C-N 3.26Å; Q514-Y516 PolarHBondContact O-N 3.35Å; Q514-A517 PolarHBondContact O-N 2.94Å; Q514-Y518 WeakPolarHBondContact O-CB 3.31Å; Q514-Y518 PolarHBondContact O-N 3.41Å; Q514-H534 PolarHBondContact NE2-NE2 3.2Å; Q514-H534 PolarHBondContact OE1-NE2 3.32Å; Q514-H534 VanDerWaalsContact OE1-NE2 3.12Å
515	V	96	Very high	94	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-61.7	-41.6	-176.7	172.3	0	0	0	0	110.1	D511 G519 I535 L538	D511-V515 WeakPolarHBondContact O-CG2 3.34Å; D511-V515 PolarHBondContact O-N 3.15Å; V515-G519 PolarHBondContact O-N 3.28Å; V515-I535 HydrophobicContact CG1-CB 4.22Å; V515-I535 HydrophobicContact CG1-CG1 4.08Å; V515-I535 HydrophobicContact CG1-CG2 4.36Å; V515-L538 HydrophobicContact CB-CD2 4.2Å; V515-L538 HydrophobicContact CG1-CB 4.08Å; V515-L538 HydrophobicContact CG1-CD2 4.21Å; V515-L538 HydrophobicContact CG2-CB 4.14Å; V515-L538 HydrophobicContact CG2-CD1 4.27Å; V515-L538 HydrophobicContact CG2-CD2 4.31Å; V515-L538 HydrophobicContact CG2-CG 4.48Å
516	Y	96.4	Very high	93.5	Very high	39 Å²	39	51 Å²	51	15%	0.153	27%	0.273	C	S	.	.	H	α-helix	trans	-64.3	-50.3	174.6	-177	-126.1	0	0	0	112.2	W479 P512 E513 Q514 Y518 G519 L520 N546 I547 L550	W479-Y516 AromaticContact CH2-CD1 3.54Å; W479-Y516 HydrophobicContact CH2-CD1 3.54Å; W479-Y516 AromaticContact CH2-CE1 3.68Å; W479-Y516 HydrophobicContact CH2-CE1 3.68Å; W479-Y516 AromaticContact CZ2-CD1 3.99Å; W479-Y516 HydrophobicContact CZ2-CD1 3.99Å; W479-Y516 HydrophobicContact CZ2-CE1 4.35Å; P512-Y516 WeakPolarHBondContact O-CB 3.47Å; P512-Y516 PolarHBondContact O-N 3.29Å; E513-Y516 PolarHBondContact O-N 3.48Å; Q514-Y516 VanDerWaalsContact C-N 3.26Å; Q514-Y516 PolarHBondContact O-N 3.35Å; Y516-Y518 PolarHBondContact O-N 2.97Å; Y516-G519 PolarHBondContact O-N 2.99Å; Y516-L520 HydrophobicContact CD1-CD1 4.14Å; Y516-L520 HydrophobicContact CD2-CG 4.29Å; Y516-L520 HydrophobicContact CE1-CD1 3.6Å; Y516-L520 HydrophobicContact CE1-CG 4.29Å; Y516-L520 HydrophobicContact CE2-CD1 4.08Å; Y516-L520 HydrophobicContact CE2-CD2 4Å; Y516-L520 HydrophobicContact CE2-CG 3.86Å; Y516-L520 WeakPolarHBondContact O-CG 3.42Å; Y516-L520 PolarHBondContact O-N 3.4Å; Y516-N546 HydrophobicContact CD1-CB 4.16Å; Y516-N546 HydrophobicContact CD2-CB 4.19Å; Y516-N546 HydrophobicContact CE1-CB 3.74Å; Y516-N546 HydrophobicContact CE2-CB 3.78Å; Y516-N546 WeakPolarHBondContact CE2-O 3.38Å; Y516-N546 HydrophobicContact CG-CB 4.39Å; Y516-I547 HydrophobicContact CD2-CG1 4.09Å; Y516-I547 HydrophobicContact CG-CG1 4.23Å; Y516-L550 HydrophobicContact CD2-CD2 3.94Å; Y516-L550 HydrophobicContact CE2-CB 4.06Å; Y516-L550 HydrophobicContact CE2-CD2 3.92Å
517	A	96.1	Very high	93.3	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-62.8	-39.6	-179.2	0	0	0	0	0	112.7	V478 W479 Y482 E513 Q514 L520 Y521	V478-A517 HydrophobicContact CG1-CB 3.52Å; W479-A517 HydrophobicContact CZ3-CB 4.25Å; Y482-A517 HydrophobicContact CD2-CB 4.37Å; Y482-A517 WeakPolarHBondContact CD2-O 3.48Å; Y482-A517 WeakPolarHBondContact CE2-O 3.49Å; Y482-A517 HydrophobicContact CG-CB 4.36Å; E513-A517 VanDerWaalsContact O-CB 3.3Å; E513-A517 WeakPolarHBondContact O-CB 3.37Å; E513-A517 PolarHBondContact O-N 3.49Å; Q514-A517 PolarHBondContact O-N 2.94Å; A517-L520 PolarHBondContact O-N 3.06Å; A517-Y521 WeakPolarHBondContact O-CB 3.44Å; A517-Y521 PolarHBondContact O-N 2.91Å
518	Y	97	Very high	93.1	Very high	29 Å²	29	43.3 Å²	43.3	11%	0.114	24%	0.238	C	C	.	.	H	α-helix	trans	-72.5	-36.2	175.3	-163.7	-164.6	0	0	0	112	M501 R502 A505 Q514 Y516 Y521 L522 H534	M501-Y518 HydrophobicContact CB-CD2 3.62Å; M501-Y518 HydrophobicContact CB-CE2 3.48Å; M501-Y518 VanDerWaalsContact CB-CE2 3.48Å; M501-Y518 HydrophobicContact CB-CG 4.36Å; M501-Y518 VanDerWaalsContact CE-CA 3.44Å; M501-Y518 HydrophobicContact CE-CD2 3.82Å; M501-Y518 HydrophobicContact CE-CG 4.05Å; M501-Y518 HydrophobicContact CG-CD2 4.24Å; M501-Y518 HydrophobicContact CG-CE2 4.39Å; R502-Y518 WeakPolarHBondContact CG-OH 3.38Å; A505-Y518 HydrophobicContact CB-CD1 3.95Å; A505-Y518 HydrophobicContact CB-CE1 4.04Å; Q514-Y518 WeakPolarHBondContact O-CB 3.31Å; Q514-Y518 PolarHBondContact O-N 3.41Å; Y516-Y518 PolarHBondContact O-N 2.97Å; Y518-Y521 AromaticContact CD2-CD1 3.88Å; Y518-Y521 HydrophobicContact CD2-CD1 3.88Å; Y518-Y521 HydrophobicContact CD2-CG 4.46Å; Y518-Y521 AromaticContact CE2-CD1 3.81Å; Y518-Y521 HydrophobicContact CE2-CD1 3.81Å; Y518-Y521 HydrophobicContact CE2-CE1 4.31Å; Y518-Y521 PolarHBondContact O-N 3.48Å; Y518-L522 HydrophobicContact CD2-CD1 4Å; Y518-L522 HydrophobicContact CD2-CD2 4.38Å; Y518-L522 HydrophobicContact CD2-CG 3.83Å; Y518-L522 HydrophobicContact CE1-CD1 4.5Å; Y518-L522 HydrophobicContact CE2-CD1 3.96Å; Y518-L522 HydrophobicContact CE2-CD2 3.76Å; Y518-L522 HydrophobicContact CE2-CG 3.72Å; Y518-L522 HydrophobicContact CG-CD1 4.3Å; Y518-L522 WeakPolarHBondContact O-CB 3.2Å; Y518-L522 VanDerWaalsContact O-CG 3.28Å; Y518-L522 WeakPolarHBondContact O-CG 3.44Å; Y518-L522 PolarHBondContact O-N 3.36Å; Y518-H534 AromaticContact CD1-CD2 3.71Å; Y518-H534 AromaticContact CD1-CE1 3.71Å; Y518-H534 AromaticContact CD1-CG 3.87Å; Y518-H534 AromaticContact CD1-ND1 3.86Å; Y518-H534 AromaticContact CD1-NE2 3.6Å
519	G	95.6	Very high	93	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-58.8	-45.7	170	0	0	0	0	0	112.7	V515 Y516 L522 S523	V515-G519 PolarHBondContact O-N 3.28Å; Y516-G519 PolarHBondContact O-N 2.99Å; G519-L522 PolarHBondContact O-N 2.69Å; G519-S523 WeakPolarHBondContact O-CB 3.28Å; G519-S523 PolarHBondContact O-N 2.95Å
520	L	96.1	Very high	93.1	Very high	37 Å²	37	44.6 Å²	44.6	19%	0.194	24%	0.241	C	C	.	.	H	α-helix	trans	-61.6	-42.7	174.1	-75.1	177.9	0	0	0	111.9	W479 Y482 Y516 A517 G524 L550	W479-L520 HydrophobicContact CH2-CD1 4.32Å; W479-L520 HydrophobicContact CZ3-CD1 4.25Å; Y482-L520 HydrophobicContact CE2-CB 3.95Å; Y516-L520 HydrophobicContact CD1-CD1 4.14Å; Y516-L520 HydrophobicContact CD2-CG 4.29Å; Y516-L520 HydrophobicContact CE1-CD1 3.6Å; Y516-L520 HydrophobicContact CE1-CG 4.29Å; Y516-L520 HydrophobicContact CE2-CD1 4.08Å; Y516-L520 HydrophobicContact CE2-CD2 4Å; Y516-L520 HydrophobicContact CE2-CG 3.86Å; Y516-L520 WeakPolarHBondContact O-CG 3.42Å; Y516-L520 PolarHBondContact O-N 3.4Å; A517-L520 PolarHBondContact O-N 3.06Å; L520-G524 PolarHBondContact O-N 3.45Å; L520-L550 HydrophobicContact CD2-CD1 4.3Å; L520-L550 HydrophobicContact CD2-CD2 4.12Å; L520-L550 HydrophobicContact CG-CD2 4.29Å
521	Y	96.5	Very high	93.4	Very high	1 Å²	1	39.5 Å²	39.5	0%	0.004	21%	0.213	C	C	.	.	H	α-helix	trans	-61.7	-49.1	177.3	175.5	-94.6	0	0	0	111.3	A497 D498 M501 A517 Y518 G524 H525	A497-Y521 HydrophobicContact CB-CE2 4.27Å; A497-Y521 WeakPolarHBondContact CB-OH 3.48Å; D498-Y521 PolarHBondContact N-OH 2.69Å; D498-Y521 PolarHBondContact OD1-OH 3.3Å; M501-Y521 HydrophobicContact CB-CD1 4.27Å; M501-Y521 HydrophobicContact CB-CE1 4.36Å; M501-Y521 HydrophobicContact CE-CG 4.41Å; M501-Y521 HydrophobicContact CG-CD1 3.86Å; M501-Y521 HydrophobicContact CG-CD2 3.99Å; M501-Y521 HydrophobicContact CG-CE1 4.04Å; M501-Y521 HydrophobicContact CG-CE2 4.18Å; M501-Y521 HydrophobicContact CG-CG 3.81Å; A517-Y521 WeakPolarHBondContact O-CB 3.44Å; A517-Y521 PolarHBondContact O-N 2.91Å; Y518-Y521 AromaticContact CD2-CD1 3.88Å; Y518-Y521 HydrophobicContact CD2-CD1 3.88Å; Y518-Y521 HydrophobicContact CD2-CG 4.46Å; Y518-Y521 AromaticContact CE2-CD1 3.81Å; Y518-Y521 HydrophobicContact CE2-CD1 3.81Å; Y518-Y521 HydrophobicContact CE2-CE1 4.31Å; Y518-Y521 PolarHBondContact O-N 3.48Å; Y521-G524 PolarHBondContact O-N 2.92Å; Y521-H525 AromaticContact CD2-CE1 3.6Å; Y521-H525 AromaticContact CD2-ND1 3.85Å; Y521-H525 AromaticContact CE2-CE1 3.45Å; Y521-H525 VanDerWaalsContact CE2-CE1 3.45Å; Y521-H525 WeakPolarHBondContact CE2-CE1 3.38Å; Y521-H525 AromaticContact CE2-ND1 3.78Å; Y521-H525 PolarHBondContact O-ND1 2.87Å
522	L	95.2	Very high	93.4	Very high	8 Å²	8	38.2 Å²	38.2	4%	0.042	21%	0.206	C	C	.	.	H	α-helix	trans	-63.9	-44.3	179.8	-68.4	168.1	0	0	0	111.3	Y518 G519 H525 Q527 A530 A531 H534	Y518-L522 HydrophobicContact CD2-CD1 4Å; Y518-L522 HydrophobicContact CD2-CD2 4.38Å; Y518-L522 HydrophobicContact CD2-CG 3.83Å; Y518-L522 HydrophobicContact CE1-CD1 4.5Å; Y518-L522 HydrophobicContact CE2-CD1 3.96Å; Y518-L522 HydrophobicContact CE2-CD2 3.76Å; Y518-L522 HydrophobicContact CE2-CG 3.72Å; Y518-L522 HydrophobicContact CG-CD1 4.3Å; Y518-L522 WeakPolarHBondContact O-CB 3.2Å; Y518-L522 VanDerWaalsContact O-CG 3.28Å; Y518-L522 WeakPolarHBondContact O-CG 3.44Å; Y518-L522 PolarHBondContact O-N 3.36Å; G519-L522 PolarHBondContact O-N 2.69Å; L522-H525 CarbonylContact O-C 3.59Å; L522-H525 PolarHBondContact O-N 3.11Å; L522-Q527 HydrophobicContact CB-CB 4.2Å; L522-Q527 HydrophobicContact CD2-CB 4.27Å; L522-Q527 WeakPolarHBondContact O-CA 3.4Å; L522-Q527 WeakPolarHBondContact O-CB 3.46Å; L522-Q527 PolarHBondContact O-N 3.34Å; L522-A530 HydrophobicContact CD1-CB 4.26Å; L522-A530 HydrophobicContact CD2-CB 4.35Å; L522-A531 HydrophobicContact CB-CB 3.71Å; L522-A531 HydrophobicContact CD1-CB 4.48Å; L522-H534 HydrophobicContact CD1-CB 4.15Å
523	S	93	Very high	93.4	Very high	12 Å²	12	39.6 Å²	39.6	8%	0.084	22%	0.221	C	C	.	.	H	α-helix	trans	-65.4	-39.5	178.3	-176.6	0	0	0	0	112.7	G519 H525 D526 D528 R553 L554	G519-S523 WeakPolarHBondContact O-CB 3.28Å; G519-S523 PolarHBondContact O-N 2.95Å; S523-H525 PolarHBondContact O-N 3.13Å; S523-D526 PolarHBondContact O-N 3.38Å; S523-D528 VanDerWaalsContact CA-OD1 3.29Å; S523-D528 WeakPolarHBondContact CA-OD1 3.37Å; S523-D528 WeakPolarHBondContact CB-OD1 3.34Å; S523-D528 PolarHBondContact OG-OD1 2.84Å; S523-R553 PolarHBondContact OG-NH2 3.27Å; S523-L554 WeakPolarHBondContact OG-CD2 3.5Å
524	G	90.1	Very high	93.4	Very high	59 Å²	59	36.8 Å²	36.8	61%	0.608	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-6.7	176.5	0	0	0	0	0	114.8	L520 Y521	L520-G524 PolarHBondContact O-N 3.45Å; Y521-G524 PolarHBondContact O-N 2.92Å
525	H	89.4	Confident	93.4	Very high	30 Å²	30	36.8 Å²	36.8	14%	0.139	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-125.9	29.9	178.6	-57	106.1	0	0	0	112.1	W489 Y521 L522 S523 Q527	W489-H525 AromaticContact CD1-CD2 3.5Å; W489-H525 AromaticContact CD1-NE2 3.26Å; W489-H525 VanDerWaalsContact CD1-NE2 3.26Å; W489-H525 AromaticContact CD2-CD2 3.42Å; W489-H525 VanDerWaalsContact CD2-CD2 3.42Å; W489-H525 AromaticContact CD2-NE2 3.38Å; W489-H525 AromaticContact CE2-CD2 3.03Å; W489-H525 AromaticContact CE2-CG 3.74Å; W489-H525 AromaticContact CE2-NE2 3.52Å; W489-H525 AromaticContact CG-CD2 3.7Å; W489-H525 AromaticContact CG-NE2 3.22Å; W489-H525 HydrophobicContact CH2-CB 3.93Å; W489-H525 AromaticContact CH2-CG 3.95Å; W489-H525 HydrophobicContact CZ2-CB 3.82Å; W489-H525 AromaticContact CZ2-CD2 3.4Å; W489-H525 VanDerWaalsContact CZ2-CD2 3.4Å; W489-H525 WeakPolarHBondContact CZ2-CD2 3.35Å; W489-H525 AromaticContact CZ2-CG 3.69Å; W489-H525 AromaticContact NE1-CD2 3.12Å; W489-H525 PolarHBondContact NE1-CD2 3.38Å; W489-H525 AromaticContact NE1-NE2 3.45Å; W489-H525 PolarHBondContact NE1-NE2 3.18Å; Y521-H525 AromaticContact CD2-CE1 3.6Å; Y521-H525 AromaticContact CD2-ND1 3.85Å; Y521-H525 AromaticContact CE2-CE1 3.45Å; Y521-H525 VanDerWaalsContact CE2-CE1 3.45Å; Y521-H525 WeakPolarHBondContact CE2-CE1 3.38Å; Y521-H525 AromaticContact CE2-ND1 3.78Å; Y521-H525 PolarHBondContact O-ND1 2.87Å; L522-H525 CarbonylContact O-C 3.59Å; L522-H525 PolarHBondContact O-N 3.11Å; S523-H525 PolarHBondContact O-N 3.13Å; H525-Q527 PolarHBondContact O-N 3.08Å
526	D	84	Confident	93.3	Very high	155 Å²	155	40.7 Å²	40.7	83%	0.829	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.5	23.5	175.2	-52.9	-51.1	0	0	0	114.8	S523	S523-D526 PolarHBondContact O-N 3.38Å
527	Q	89.2	Confident	93.1	Very high	81 Å²	81	42 Å²	42	38%	0.379	24%	0.244	S	C	.	.			trans	-103.3	44.9	177.6	-61.4	-177.3	-27.5	0	0	111.9	L522 H525 R529 A530 A531	L522-Q527 HydrophobicContact CB-CB 4.2Å; L522-Q527 HydrophobicContact CD2-CB 4.27Å; L522-Q527 WeakPolarHBondContact O-CA 3.4Å; L522-Q527 WeakPolarHBondContact O-CB 3.46Å; L522-Q527 PolarHBondContact O-N 3.34Å; H525-Q527 PolarHBondContact O-N 3.08Å; Q527-R529 VanDerWaalsContact C-N 3.31Å; Q527-R529 PolarHBondContact O-N 2.87Å; Q527-A530 HydrophobicContact CB-CB 4.14Å; Q527-A530 WeakPolarHBondContact O-CA 3.48Å; Q527-A530 WeakPolarHBondContact O-CB 3.29Å; Q527-A530 PolarHBondContact O-N 2.98Å; Q527-A531 PolarHBondContact O-N 3.19Å
528	D	90.3	Very high	93	Very high	41 Å²	41	42.2 Å²	42.2	22%	0.219	25%	0.245	C	C	.	.	H	α-helix	trans	-57.5	-36.9	-172.6	-73.4	-20	0	0	0	114.1	S523 A531 L532 L554	S523-D528 VanDerWaalsContact CA-OD1 3.29Å; S523-D528 WeakPolarHBondContact CA-OD1 3.37Å; S523-D528 WeakPolarHBondContact CB-OD1 3.34Å; S523-D528 PolarHBondContact OG-OD1 2.84Å; D528-A531 WeakPolarHBondContact O-CB 3.27Å; D528-A531 PolarHBondContact O-N 2.89Å; D528-L532 PolarHBondContact O-N 3.06Å; D528-L554 HydrophobicContact CB-CD2 3.75Å; D528-L554 WeakPolarHBondContact OD1-CD2 3.38Å
529	R	90.5	Very high	92.9	Very high	124 Å²	124	44 Å²	44	47%	0.468	26%	0.26	S	S	.	.	H	α-helix	trans	-67.4	-38.9	175.3	-65.7	-169.1	-166.8	175.7	13.3	112.5	Q527 A531 L532 A533 E561	Q527-R529 VanDerWaalsContact C-N 3.31Å; Q527-R529 PolarHBondContact O-N 2.87Å; R529-A531 VanDerWaalsContact C-N 3.32Å; R529-L532 PolarHBondContact O-N 3.14Å; R529-A533 WeakPolarHBondContact O-CB 3.27Å; R529-A533 PolarHBondContact O-N 3.47Å; R529-E561 IonicContact CZ-OE1 2.76Å; R529-E561 IonicContact NH2-OE1 2.67Å; R529-E561 PolarHBondContact NH2-OE1 3.28Å
530	A	93	Very high	92.7	Very high	45 Å²	45	52.9 Å²	52.9	37%	0.372	29%	0.293	S	S	.	.	H	α-helix	trans	-68	-38.3	175	0	0	0	0	0	110.2	L522 Q527 A533 H534	L522-A530 HydrophobicContact CD1-CB 4.26Å; L522-A530 HydrophobicContact CD2-CB 4.35Å; Q527-A530 HydrophobicContact CB-CB 4.14Å; Q527-A530 WeakPolarHBondContact O-CA 3.48Å; Q527-A530 WeakPolarHBondContact O-CB 3.29Å; Q527-A530 PolarHBondContact O-N 2.98Å; A530-A533 PolarHBondContact O-N 3.14Å; A530-H534 WeakPolarHBondContact O-CB 3.49Å; A530-H534 PolarHBondContact O-N 3.12Å
531	A	94.4	Very high	92.5	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-58.4	-50.6	173.4	0	0	0	0	0	111.1	L522 Q527 D528 R529 A533 H534 I535 L554	L522-A531 HydrophobicContact CB-CB 3.71Å; L522-A531 HydrophobicContact CD1-CB 4.48Å; Q527-A531 PolarHBondContact O-N 3.19Å; D528-A531 WeakPolarHBondContact O-CB 3.27Å; D528-A531 PolarHBondContact O-N 2.89Å; R529-A531 VanDerWaalsContact C-N 3.32Å; A531-A533 PolarHBondContact O-N 3.05Å; A531-H534 PolarHBondContact O-N 3.19Å; A531-I535 WeakPolarHBondContact O-CB 3.49Å; A531-I535 WeakPolarHBondContact O-CD1 3.47Å; A531-I535 WeakPolarHBondContact O-CG1 3.47Å; A531-I535 PolarHBondContact O-N 2.96Å; A531-L554 HydrophobicContact CB-CD1 3.83Å
532	L	94.3	Very high	92.4	Very high	9 Å²	9	60 Å²	60	5%	0.047	34%	0.344	C	S	.	.	H	α-helix	trans	-61.4	-43.2	176.2	-77.8	172.7	0	0	0	112.5	D528 R529 I535 N536 V551 L554 Q555	D528-L532 PolarHBondContact O-N 3.06Å; R529-L532 PolarHBondContact O-N 3.14Å; L532-I535 PolarHBondContact O-N 3.4Å; L532-N536 VanDerWaalsContact O-CB 3.28Å; L532-N536 WeakPolarHBondContact O-CB 3.36Å; L532-N536 PolarHBondContact O-N 3.35Å; L532-N536 PolarHBondContact O-ND2 2.87Å; L532-V551 HydrophobicContact CD2-CG1 4.21Å; L532-V551 HydrophobicContact CD2-CG2 4.48Å; L532-L554 HydrophobicContact CD1-CB 4Å; L532-L554 HydrophobicContact CD2-CB 3.69Å; L532-L554 HydrophobicContact CD2-CD1 4.09Å; L532-L554 HydrophobicContact CG-CB 3.75Å; L532-L554 HydrophobicContact CG-CD1 4.06Å; L532-Q555 HydrophobicContact CD1-CG 4.35Å; L532-Q555 HydrophobicContact CD2-CG 3.97Å
533	A	94.3	Very high	92.3	Very high	66 Å²	66	61.4 Å²	61.4	55%	0.545	35%	0.349	S	S	.	.	H	α-helix	trans	-61.9	-43.3	177.5	0	0	0	0	0	111.7	R529 A530 A531 N536 S537	R529-A533 WeakPolarHBondContact O-CB 3.27Å; R529-A533 PolarHBondContact O-N 3.47Å; A530-A533 PolarHBondContact O-N 3.14Å; A531-A533 PolarHBondContact O-N 3.05Å; A533-N536 PolarHBondContact O-N 2.94Å; A533-S537 PolarHBondContact O-N 2.93Å
534	H	94.9	Very high	92.3	Very high	35 Å²	35	63.7 Å²	63.7	16%	0.162	36%	0.36	C	S	.	.	H	α-helix	trans	-65.3	-45.9	176.3	-172.1	65	0	0	0	111.4	Q514 Y518 L522 A530 A531 N536 S537	Q514-H534 PolarHBondContact NE2-NE2 3.2Å; Q514-H534 PolarHBondContact OE1-NE2 3.32Å; Q514-H534 VanDerWaalsContact OE1-NE2 3.12Å; Y518-H534 AromaticContact CD1-CD2 3.71Å; Y518-H534 AromaticContact CD1-CE1 3.71Å; Y518-H534 AromaticContact CD1-CG 3.87Å; Y518-H534 AromaticContact CD1-ND1 3.86Å; Y518-H534 AromaticContact CD1-NE2 3.6Å; L522-H534 HydrophobicContact CD1-CB 4.15Å; A530-H534 WeakPolarHBondContact O-CB 3.49Å; A530-H534 PolarHBondContact O-N 3.12Å; A531-H534 PolarHBondContact O-N 3.19Å; H534-N536 VanDerWaalsContact C-N 3.31Å; H534-N536 PolarHBondContact O-N 3.38Å; H534-S537 VanDerWaalsContact O-CB 3.26Å; H534-S537 WeakPolarHBondContact O-CB 3.42Å; H534-S537 PolarHBondContact O-N 2.88Å; H534-S537 PolarHBondContact O-OG 3.36Å
535	I	95.2	Very high	92.4	Very high	1 Å²	1	65 Å²	65	1%	0.005	36%	0.36	C	S	.	.	H	α-helix	trans	-62.1	-40.3	178.5	-65.8	161.7	0	0	0	111.7	V515 A531 L532 S537 L538 W543 I547 L550 V551 L554	V515-I535 HydrophobicContact CG1-CB 4.22Å; V515-I535 HydrophobicContact CG1-CG1 4.08Å; V515-I535 HydrophobicContact CG1-CG2 4.36Å; A531-I535 WeakPolarHBondContact O-CB 3.49Å; A531-I535 WeakPolarHBondContact O-CD1 3.47Å; A531-I535 WeakPolarHBondContact O-CG1 3.47Å; A531-I535 PolarHBondContact O-N 2.96Å; L532-I535 PolarHBondContact O-N 3.4Å; I535-S537 PolarHBondContact O-N 3.35Å; I535-L538 WeakPolarHBondContact O-CB 3.45Å; I535-L538 PolarHBondContact O-N 3.15Å; I535-W543 HydrophobicContact CG2-CZ2 4.22Å; I535-I547 HydrophobicContact CG2-CG2 3.62Å; I535-L550 HydrophobicContact CD1-CD2 3.74Å; I535-L550 HydrophobicContact CD1-CG 4.08Å; I535-V551 HydrophobicContact CB-CG2 4.29Å; I535-V551 HydrophobicContact CD1-CG2 4.15Å; I535-V551 HydrophobicContact CG2-CG2 3.42Å; I535-V551 VanDerWaalsContact CG2-CG2 3.42Å; I535-L554 HydrophobicContact CD1-CD1 4.04Å
536	N	93.9	Very high	92.6	Very high	83 Å²	83	66.9 Å²	66.9	44%	0.444	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-8.7	177.6	-73.8	-43.8	0	0	0	113.9	L532 A533 H534	L532-N536 VanDerWaalsContact O-CB 3.28Å; L532-N536 WeakPolarHBondContact O-CB 3.36Å; L532-N536 PolarHBondContact O-N 3.35Å; L532-N536 PolarHBondContact O-ND2 2.87Å; A533-N536 PolarHBondContact O-N 2.94Å; H534-N536 VanDerWaalsContact C-N 3.31Å; H534-N536 PolarHBondContact O-N 3.38Å
537	S	92.4	Very high	93.1	Very high	67 Å²	67	59.5 Å²	59.5	47%	0.469	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-23.8	168.8	75.7	0	0	0	0	112.4	A533 H534 I535	A533-S537 PolarHBondContact O-N 2.93Å; H534-S537 VanDerWaalsContact O-CB 3.26Å; H534-S537 WeakPolarHBondContact O-CB 3.42Å; H534-S537 PolarHBondContact O-N 2.88Å; H534-S537 PolarHBondContact O-OG 3.36Å; I535-S537 PolarHBondContact O-N 3.35Å
538	L	94	Very high	93.3	Very high	4 Å²	4	59.3 Å²	59.3	2%	0.021	33%	0.33	C	S	.	.	S	Bend	trans	-84.9	128.2	176.6	-169.6	70.8	0	0	0	110.5	P512 V515 I535 R540 Q542 W543 I547	P512-L538 HydrophobicContact CB-CD2 4.08Å; P512-L538 HydrophobicContact CG-CD2 4.25Å; V515-L538 HydrophobicContact CB-CD2 4.2Å; V515-L538 HydrophobicContact CG1-CB 4.08Å; V515-L538 HydrophobicContact CG1-CD2 4.21Å; V515-L538 HydrophobicContact CG2-CB 4.14Å; V515-L538 HydrophobicContact CG2-CD1 4.27Å; V515-L538 HydrophobicContact CG2-CD2 4.31Å; V515-L538 HydrophobicContact CG2-CG 4.48Å; I535-L538 WeakPolarHBondContact O-CB 3.45Å; I535-L538 PolarHBondContact O-N 3.15Å; L538-R540 PolarHBondContact O-N 3.16Å; L538-Q542 HydrophobicContact CD1-CB 4.27Å; L538-Q542 VanDerWaalsContact CD1-OE1 3.22Å; L538-Q542 HydrophobicContact CD2-CB 4.24Å; L538-Q542 HydrophobicContact CG-CB 4.1Å; L538-W543 PolarHBondContact O-NE1 3.24Å; L538-I547 HydrophobicContact CD2-CD1 3.78Å
539	P	93.9	Very high	93.3	Very high	66 Å²	66	63.9 Å²	63.9	43%	0.429	35%	0.351	S	S	.	.			trans	-55.6	134.3	176.1	-25	34.1	0	0	0	112	A541 Q542	P539-A541 PolarHBondContact O-N 3.29Å; P539-Q542 WeakPolarHBondContact O-CB 3.5Å; P539-Q542 PolarHBondContact O-N 2.94Å
540	R	91.7	Very high	93.4	Very high	186 Å²	186	58.3 Å²	58.3	70%	0.702	33%	0.33	S	S	*	.	G	3₁₀ helix	trans	-53.2	-30.9	-177.1	-73	-172.9	176.6	-174	-0.6	114.6	L538 Q542 W543	L538-R540 PolarHBondContact O-N 3.16Å; R540-Q542 PolarHBondContact O-N 2.86Å; R540-W543 HydrophobicContact CB-CD2 4.45Å; R540-W543 HydrophobicContact CG-CD2 4.24Å; R540-W543 HydrophobicContact CG-CE3 4.37Å; R540-W543 HydrophobicContact CG-CH2 3.98Å; R540-W543 HydrophobicContact CG-CZ2 3.8Å; R540-W543 HydrophobicContact CG-CZ3 4.25Å; R540-W543 WeakPolarHBondContact O-CB 3.39Å; R540-W543 PolarHBondContact O-N 2.62Å; R540-W543 VanDerWaalsContact O-N 3.17Å
541	A	93.1	Very high	93.4	Very high	105 Å²	105	56.2 Å²	56.2	87%	0.868	31%	0.313	S	S	*	.	G	3₁₀ helix	trans	-63.7	-17	177.2	0	0	0	0	0	113.8	P539	P539-A541 PolarHBondContact O-N 3.29Å
542	Q	93.7	Very high	93.2	Very high	84 Å²	84	60.3 Å²	60.3	39%	0.393	33%	0.334	S	S	.	.	G	3₁₀ helix	trans	-100.3	0.9	179.5	-58.9	-177.2	10.3	0	0	112.9	P512 L538 P539 R540 N544	P512-Q542 HydrophobicContact CG-CB 4.41Å; L538-Q542 HydrophobicContact CD1-CB 4.27Å; L538-Q542 VanDerWaalsContact CD1-OE1 3.22Å; L538-Q542 HydrophobicContact CD2-CB 4.24Å; L538-Q542 HydrophobicContact CG-CB 4.1Å; P539-Q542 WeakPolarHBondContact O-CB 3.5Å; P539-Q542 PolarHBondContact O-N 2.94Å; R540-Q542 PolarHBondContact O-N 2.86Å; Q542-N544 PolarHBondContact O-N 3.35Å
543	W	93.4	Very high	93	Very high	37 Å²	37	65 Å²	65	14%	0.14	35%	0.352	C	S	.	.			trans	-71.6	128	179.7	-66.5	7.8	0	0	0	110.2	I535 L538 R540 I547 V551	I535-W543 HydrophobicContact CG2-CZ2 4.22Å; L538-W543 PolarHBondContact O-NE1 3.24Å; R540-W543 HydrophobicContact CB-CD2 4.45Å; R540-W543 HydrophobicContact CG-CD2 4.24Å; R540-W543 HydrophobicContact CG-CE3 4.37Å; R540-W543 HydrophobicContact CG-CH2 3.98Å; R540-W543 HydrophobicContact CG-CZ2 3.8Å; R540-W543 HydrophobicContact CG-CZ3 4.25Å; R540-W543 WeakPolarHBondContact O-CB 3.39Å; R540-W543 PolarHBondContact O-N 2.62Å; R540-W543 VanDerWaalsContact O-N 3.17Å; W543-I547 HydrophobicContact CB-CB 4.36Å; W543-I547 HydrophobicContact CB-CG2 4.04Å; W543-I547 HydrophobicContact CD2-CG2 3.92Å; W543-I547 HydrophobicContact CE3-CG2 4.41Å; W543-I547 HydrophobicContact CG-CG2 3.74Å; W543-V551 HydrophobicContact CH2-CG1 4.15Å; W543-V551 HydrophobicContact CH2-CG2 4.19Å; W543-V551 HydrophobicContact CZ3-CB 4.39Å; W543-V551 HydrophobicContact CZ3-CG1 4.04Å; W543-V551 HydrophobicContact CZ3-CG2 4.2Å
544	N	92.3	Very high	92.8	Very high	60 Å²	60	61.9 Å²	61.9	32%	0.321	33%	0.326	S	S	.	.			trans	-90.1	175	169.1	63.9	31.7	0	0	0	110.5	Q542 N546 I547 Q548	Q542-N544 PolarHBondContact O-N 3.35Å; N544-N546 PolarHBondContact O-N 3.35Å; N544-N546 PolarHBondContact OD1-N 3.47Å; N544-I547 PolarHBondContact O-N 2.94Å; N544-I547 WeakPolarHBondContact OD1-CG1 3.5Å; N544-I547 PolarHBondContact OD1-N 3.41Å; N544-Q548 PolarHBondContact O-N 3.2Å
545	S	92.8	Very high	92.6	Very high	87 Å²	87	63.8 Å²	63.8	61%	0.608	33%	0.334	S	S	*	.	H	α-helix	trans	-55.3	-39.8	-179.7	52.6	0	0	0	0	113	Q548 E549	S545-Q548 PolarHBondContact O-N 3.35Å; S545-E549 WeakPolarHBondContact O-CB 3.29Å; S545-E549 PolarHBondContact O-N 3Å
546	N	92.5	Very high	92.2	Very high	68 Å²	68	65.4 Å²	65.4	36%	0.364	35%	0.346	S	S	.	.	H	α-helix	trans	-68.6	-40.9	-176.9	-60.6	-8	0	0	0	111.5	Y516 N544 L550	Y516-N546 HydrophobicContact CD1-CB 4.16Å; Y516-N546 HydrophobicContact CD2-CB 4.19Å; Y516-N546 HydrophobicContact CE1-CB 3.74Å; Y516-N546 HydrophobicContact CE2-CB 3.78Å; Y516-N546 WeakPolarHBondContact CE2-O 3.38Å; Y516-N546 HydrophobicContact CG-CB 4.39Å; N544-N546 PolarHBondContact O-N 3.35Å; N544-N546 PolarHBondContact OD1-N 3.47Å; N546-L550 WeakPolarHBondContact O-CB 3.34Å; N546-L550 PolarHBondContact O-N 3.29Å
547	I	95.2	Very high	91.7	Very high	0 Å²	0	62.9 Å²	62.9	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-62.5	-46.3	172.8	-68.2	171.4	0	0	0	109.9	P512 Y516 I535 L538 W543 N544 E549 L550 V551	P512-I547 HydrophobicContact CB-CD1 4.04Å; Y516-I547 HydrophobicContact CD2-CG1 4.09Å; Y516-I547 HydrophobicContact CG-CG1 4.23Å; I535-I547 HydrophobicContact CG2-CG2 3.62Å; L538-I547 HydrophobicContact CD2-CD1 3.78Å; W543-I547 HydrophobicContact CB-CB 4.36Å; W543-I547 HydrophobicContact CB-CG2 4.04Å; W543-I547 HydrophobicContact CD2-CG2 3.92Å; W543-I547 HydrophobicContact CE3-CG2 4.41Å; W543-I547 HydrophobicContact CG-CG2 3.74Å; N544-I547 PolarHBondContact O-N 2.94Å; N544-I547 WeakPolarHBondContact OD1-CG1 3.5Å; N544-I547 PolarHBondContact OD1-N 3.41Å; I547-E549 VanDerWaalsContact C-N 3.34Å; I547-E549 PolarHBondContact O-N 3.06Å; I547-L550 PolarHBondContact O-N 2.9Å; I547-V551 HydrophobicContact CG2-CG2 4.22Å; I547-V551 WeakPolarHBondContact O-CB 3.47Å; I547-V551 VanDerWaalsContact O-CG2 3.3Å; I547-V551 WeakPolarHBondContact O-CG2 3.36Å; I547-V551 PolarHBondContact O-N 3.08Å
548	Q	93.1	Very high	91.5	Very high	77 Å²	77	63 Å²	63	36%	0.36	33%	0.326	S	S	.	.	H	α-helix	trans	-61.6	-42.8	-179.4	-172.3	65.4	54.3	0	0	111.8	N544 S545 V551 N552	N544-Q548 PolarHBondContact O-N 3.2Å; S545-Q548 PolarHBondContact O-N 3.35Å; Q548-V551 PolarHBondContact O-N 3.37Å; Q548-N552 PolarHBondContact NE2-OD1 3.35Å; Q548-N552 WeakPolarHBondContact O-CB 3.5Å; Q548-N552 PolarHBondContact O-N 2.95Å; Q548-N552 PolarHBondContact O-ND2 3.21Å; Q548-N552 PolarHBondContact O-OD1 3.38Å
549	E	90	Very high	91.4	Very high	138 Å²	138	64.1 Å²	64.1	65%	0.645	33%	0.333	S	S	*	.	H	α-helix	trans	-62.3	-46.9	177.2	-173.5	178.8	170.2	0	0	111.6	S545 I547 N552 R553	S545-E549 WeakPolarHBondContact O-CB 3.29Å; S545-E549 PolarHBondContact O-N 3Å; I547-E549 VanDerWaalsContact C-N 3.34Å; I547-E549 PolarHBondContact O-N 3.06Å; E549-N552 PolarHBondContact O-N 2.65Å; E549-R553 PolarHBondContact O-N 3.01Å
550	L	93.7	Very high	91.1	Very high	7 Å²	7	61.5 Å²	61.5	4%	0.037	32%	0.315	C	S	.	.	H	α-helix	trans	-60.8	-47.2	176.2	179.2	59.9	0	0	0	111.6	Y516 L520 I535 N546 I547 N552 R553 L554	Y516-L550 HydrophobicContact CD2-CD2 3.94Å; Y516-L550 HydrophobicContact CE2-CB 4.06Å; Y516-L550 HydrophobicContact CE2-CD2 3.92Å; L520-L550 HydrophobicContact CD2-CD1 4.3Å; L520-L550 HydrophobicContact CD2-CD2 4.12Å; L520-L550 HydrophobicContact CG-CD2 4.29Å; I535-L550 HydrophobicContact CD1-CD2 3.74Å; I535-L550 HydrophobicContact CD1-CG 4.08Å; N546-L550 WeakPolarHBondContact O-CB 3.34Å; N546-L550 PolarHBondContact O-N 3.29Å; I547-L550 PolarHBondContact O-N 2.9Å; L550-N552 PolarHBondContact O-N 2.83Å; L550-R553 PolarHBondContact O-N 3.04Å; L550-L554 HydrophobicContact CD1-CD1 3.87Å; L550-L554 HydrophobicContact CD1-CD2 4.47Å; L550-L554 HydrophobicContact CD1-CG 3.95Å; L550-L554 HydrophobicContact CG-CD1 3.8Å; L550-L554 HydrophobicContact CG-CG 4.29Å; L550-L554 WeakPolarHBondContact O-CB 3.39Å; L550-L554 WeakPolarHBondContact O-CG 3.47Å; L550-L554 PolarHBondContact O-N 3.1Å
551	V	93.6	Very high	90.9	Very high	1 Å²	1	56.3 Å²	56.3	1%	0.006	30%	0.299	C	S	.	.	H	α-helix	trans	-60.7	-45.8	178	170.1	0	0	0	0	111.4	L532 I535 W543 I547 Q548 R553 L554 Q555	L532-V551 HydrophobicContact CD2-CG1 4.21Å; L532-V551 HydrophobicContact CD2-CG2 4.48Å; I535-V551 HydrophobicContact CB-CG2 4.29Å; I535-V551 HydrophobicContact CD1-CG2 4.15Å; I535-V551 HydrophobicContact CG2-CG2 3.42Å; I535-V551 VanDerWaalsContact CG2-CG2 3.42Å; W543-V551 HydrophobicContact CH2-CG1 4.15Å; W543-V551 HydrophobicContact CH2-CG2 4.19Å; W543-V551 HydrophobicContact CZ3-CB 4.39Å; W543-V551 HydrophobicContact CZ3-CG1 4.04Å; W543-V551 HydrophobicContact CZ3-CG2 4.2Å; I547-V551 HydrophobicContact CG2-CG2 4.22Å; I547-V551 WeakPolarHBondContact O-CB 3.47Å; I547-V551 VanDerWaalsContact O-CG2 3.3Å; I547-V551 WeakPolarHBondContact O-CG2 3.36Å; I547-V551 PolarHBondContact O-N 3.08Å; Q548-V551 PolarHBondContact O-N 3.37Å; V551-R553 VanDerWaalsContact C-N 3.31Å; V551-R553 PolarHBondContact O-N 2.83Å; V551-L554 PolarHBondContact O-N 3.26Å; V551-Q555 HydrophobicContact CG1-CG 4.07Å; V551-Q555 WeakPolarHBondContact O-CB 3.37Å; V551-Q555 VanDerWaalsContact O-CG 3.3Å; V551-Q555 WeakPolarHBondContact O-CG 3.29Å; V551-Q555 PolarHBondContact O-N 2.92Å
552	N	89.3	Confident	90.8	Very high	85 Å²	85	53.1 Å²	53.1	46%	0.455	27%	0.268	S	S	.	.	H	α-helix	trans	-60.1	-43.2	179.3	-72.1	-11	0	0	0	111.3	Q548 E549 L550 S556	Q548-N552 PolarHBondContact NE2-OD1 3.35Å; Q548-N552 WeakPolarHBondContact O-CB 3.5Å; Q548-N552 PolarHBondContact O-N 2.95Å; Q548-N552 PolarHBondContact O-ND2 3.21Å; Q548-N552 PolarHBondContact O-OD1 3.38Å; E549-N552 PolarHBondContact O-N 2.65Å; L550-N552 PolarHBondContact O-N 2.83Å; N552-S556 VanDerWaalsContact O-CB 3.32Å; N552-S556 WeakPolarHBondContact O-CB 3.4Å; N552-S556 PolarHBondContact O-N 3.3Å; N552-S556 VanDerWaalsContact O-N 3.09Å
553	R	89.4	Confident	90.7	Very high	109 Å²	109	49.1 Å²	49.1	41%	0.411	25%	0.25	S	C	.	.	H	α-helix	trans	-61.5	-53.4	175.6	-175.8	178	64.8	77.4	-5.7	111.1	S523 E549 L550 V551 Q555 S556 D557	S523-R553 PolarHBondContact OG-NH2 3.27Å; E549-R553 PolarHBondContact O-N 3.01Å; L550-R553 PolarHBondContact O-N 3.04Å; V551-R553 VanDerWaalsContact C-N 3.31Å; V551-R553 PolarHBondContact O-N 2.83Å; R553-Q555 PolarHBondContact O-N 3.25Å; R553-S556 WeakPolarHBondContact O-CB 3.45Å; R553-S556 PolarHBondContact O-N 2.71Å; R553-D557 IonicContact NH1-OD2 3.77Å; R553-D557 PolarHBondContact O-N 2.99Å
554	L	91.5	Very high	90.4	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-61.2	-40.3	-178.3	-69.5	176.8	0	0	0	113.2	S523 D528 A531 L532 I535 L550 V551 D557 Q558	S523-L554 WeakPolarHBondContact OG-CD2 3.5Å; D528-L554 HydrophobicContact CB-CD2 3.75Å; D528-L554 WeakPolarHBondContact OD1-CD2 3.38Å; A531-L554 HydrophobicContact CB-CD1 3.83Å; L532-L554 HydrophobicContact CD1-CB 4Å; L532-L554 HydrophobicContact CD2-CB 3.69Å; L532-L554 HydrophobicContact CD2-CD1 4.09Å; L532-L554 HydrophobicContact CG-CB 3.75Å; L532-L554 HydrophobicContact CG-CD1 4.06Å; I535-L554 HydrophobicContact CD1-CD1 4.04Å; L550-L554 HydrophobicContact CD1-CD1 3.87Å; L550-L554 HydrophobicContact CD1-CD2 4.47Å; L550-L554 HydrophobicContact CD1-CG 3.95Å; L550-L554 HydrophobicContact CG-CD1 3.8Å; L550-L554 HydrophobicContact CG-CG 4.29Å; L550-L554 WeakPolarHBondContact O-CB 3.39Å; L550-L554 WeakPolarHBondContact O-CG 3.47Å; L550-L554 PolarHBondContact O-N 3.1Å; V551-L554 PolarHBondContact O-N 3.26Å; L554-D557 PolarHBondContact O-N 3.44Å; L554-Q558 WeakPolarHBondContact O-CB 3.35Å; L554-Q558 PolarHBondContact O-N 2.66Å
555	Q	89.6	Confident	90.2	Very high	74 Å²	74	52.4 Å²	52.4	35%	0.346	26%	0.262	S	S	.	.	H	α-helix	trans	-67	-41.4	176.7	-75.1	177.9	-16	0	0	111.6	L532 V551 R553 Q558 V559	L532-Q555 HydrophobicContact CD1-CG 4.35Å; L532-Q555 HydrophobicContact CD2-CG 3.97Å; V551-Q555 HydrophobicContact CG1-CG 4.07Å; V551-Q555 WeakPolarHBondContact O-CB 3.37Å; V551-Q555 VanDerWaalsContact O-CG 3.3Å; V551-Q555 WeakPolarHBondContact O-CG 3.29Å; V551-Q555 PolarHBondContact O-N 2.92Å; R553-Q555 PolarHBondContact O-N 3.25Å; Q555-Q558 PolarHBondContact O-N 3.02Å; Q555-V559 WeakPolarHBondContact O-CG2 3.44Å; Q555-V559 PolarHBondContact O-N 3.38Å
556	S	86.2	Confident	90.1	Very high	36 Å²	36	50.1 Å²	50.1	25%	0.252	24%	0.243	S	C	.	.	H	α-helix	trans	-61.5	-44.8	174.8	-172.2	0	0	0	0	111.4	N552 R553 V559 L560	N552-S556 VanDerWaalsContact O-CB 3.32Å; N552-S556 WeakPolarHBondContact O-CB 3.4Å; N552-S556 PolarHBondContact O-N 3.3Å; N552-S556 VanDerWaalsContact O-N 3.09Å; R553-S556 WeakPolarHBondContact O-CB 3.45Å; R553-S556 PolarHBondContact O-N 2.71Å; S556-V559 PolarHBondContact O-N 3.5Å; S556-L560 PolarHBondContact O-N 3.36Å; S556-L560 VanDerWaalsContact O-N 3.11Å
557	D	85.4	Confident	89.9	Confident	30 Å²	30	49.4 Å²	49.4	16%	0.16	24%	0.235	C	C	.	.	H	α-helix	trans	-61.5	-44	175.6	-69.6	-32.1	0	0	0	111.4	R553 L554 V559 L560 E561 R587	R553-D557 IonicContact NH1-OD2 3.77Å; R553-D557 PolarHBondContact O-N 2.99Å; L554-D557 PolarHBondContact O-N 3.44Å; D557-V559 PolarHBondContact O-N 3.35Å; D557-L560 PolarHBondContact O-N 2.79Å; D557-E561 WeakPolarHBondContact O-CB 3.39Å; D557-E561 PolarHBondContact O-N 3.27Å; D557-R587 IonicContact OD1-CZ 3.32Å; D557-R587 IonicContact OD1-NH1 3.06Å; D557-R587 PolarHBondContact OD1-NH1 3.26Å; D557-R587 IonicContact OD1-NH2 3.04Å; D557-R587 PolarHBondContact OD1-NH2 3.06Å
558	Q	88.1	Confident	89.3	Confident	70 Å²	70	57 Å²	57	33%	0.327	27%	0.271	S	S	.	.	H	α-helix	trans	-63.8	-37.9	178.1	-173.5	178.2	17.4	0	0	113.1	L554 Q555 T562	L554-Q558 WeakPolarHBondContact O-CB 3.35Å; L554-Q558 PolarHBondContact O-N 2.66Å; Q555-Q558 PolarHBondContact O-N 3.02Å; Q558-T562 WeakPolarHBondContact O-CB 3.49Å; Q558-T562 PolarHBondContact O-N 2.89Å; Q558-T562 PolarHBondContact O-OG1 3Å
559	V	90.5	Very high	89.1	Confident	27 Å²	27	56.9 Å²	56.9	16%	0.164	28%	0.279	C	S	.	.	H	α-helix	trans	-64.4	-46.5	175.9	165.6	0	0	0	0	110.4	Q555 S556 D557 T562 A563 M578 L579 Q582	Q555-V559 WeakPolarHBondContact O-CG2 3.44Å; Q555-V559 PolarHBondContact O-N 3.38Å; S556-V559 PolarHBondContact O-N 3.5Å; D557-V559 PolarHBondContact O-N 3.35Å; V559-T562 PolarHBondContact O-N 2.87Å; V559-A563 WeakPolarHBondContact O-CB 3.26Å; V559-A563 PolarHBondContact O-N 2.83Å; V559-M578 HydrophobicContact CG1-CE 4.18Å; V559-L579 HydrophobicContact CG1-CD2 3.86Å; V559-Q582 HydrophobicContact CG1-CG 3.82Å
560	L	88.6	Confident	89	Confident	10 Å²	10	53.6 Å²	53.6	5%	0.052	28%	0.281	C	S	.	.	H	α-helix	trans	-65	-41.7	177.3	-71.5	169	0	0	0	112.1	S556 D557 T562 A563 N564 L579 R587 I588 T591	S556-L560 PolarHBondContact O-N 3.36Å; S556-L560 VanDerWaalsContact O-N 3.11Å; D557-L560 PolarHBondContact O-N 2.79Å; L560-T562 VanDerWaalsContact C-N 3.31Å; L560-T562 PolarHBondContact O-N 3.35Å; L560-A563 PolarHBondContact O-N 3.08Å; L560-N564 WeakPolarHBondContact O-CB 3.41Å; L560-N564 PolarHBondContact O-N 2.85Å; L560-N564 PolarHBondContact O-ND2 2.88Å; L560-L579 HydrophobicContact CD2-CD2 3.9Å; L560-R587 HydrophobicContact CD1-CG 3.97Å; L560-R587 VanDerWaalsContact CD1-NE 3.26Å; L560-I588 HydrophobicContact CD2-CG1 4.47Å; L560-T591 HydrophobicContact CD2-CG2 4.2Å
561	E	86.5	Confident	89	Confident	78 Å²	78	57.8 Å²	57.8	36%	0.364	30%	0.299	S	S	.	.	H	α-helix	trans	-59.6	-42.4	174.7	-170.9	-148.8	132	0	0	111.3	R529 D557 R565	R529-E561 IonicContact CZ-OE1 2.76Å; R529-E561 IonicContact NH2-OE1 2.67Å; R529-E561 PolarHBondContact NH2-OE1 3.28Å; D557-E561 WeakPolarHBondContact O-CB 3.39Å; D557-E561 PolarHBondContact O-N 3.27Å; E561-R565 WeakPolarHBondContact O-CG 3.42Å; E561-R565 PolarHBondContact O-N 2.79Å; E561-R565 IonicContact OE1-CZ 2.87Å; E561-R565 VanDerWaalsContact OE1-CZ 3.32Å; E561-R565 IonicContact OE1-NE 3.19Å; E561-R565 PolarHBondContact OE1-NE 3.08Å; E561-R565 IonicContact OE1-NH2 3.41Å; E561-R565 PolarHBondContact OE1-NH2 3.21Å
562	T	90.8	Very high	89	Confident	38 Å²	38	60 Å²	60	23%	0.233	31%	0.31	C	S	.	.	H	α-helix	trans	-67.6	-41.7	178	-55.9	0	0	0	0	111.5	Q558 V559 L560 R565 L566 M578	Q558-T562 WeakPolarHBondContact O-CB 3.49Å; Q558-T562 PolarHBondContact O-N 2.89Å; Q558-T562 PolarHBondContact O-OG1 3Å; V559-T562 PolarHBondContact O-N 2.87Å; L560-T562 VanDerWaalsContact C-N 3.31Å; L560-T562 PolarHBondContact O-N 3.35Å; T562-R565 PolarHBondContact O-N 3.18Å; T562-R565 PolarHBondContact OG1-NH2 2.75Å; T562-R565 VanDerWaalsContact OG1-NH2 3.14Å; T562-L566 WeakPolarHBondContact O-CG 3.39Å; T562-L566 PolarHBondContact O-N 2.98Å; T562-M578 HydrophobicContact CG2-CE 3.83Å; T562-M578 HydrophobicContact CG2-SD 4.04Å
563	A	91.3	Very high	89.2	Confident	0 Å²	0	59.7 Å²	59.7	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-64.8	-42.3	176.3	0	0	0	0	0	111.6	V559 L560 L566 R567 A575 L579 W595	V559-A563 WeakPolarHBondContact O-CB 3.26Å; V559-A563 PolarHBondContact O-N 2.83Å; L560-A563 PolarHBondContact O-N 3.08Å; A563-L566 PolarHBondContact O-N 3.04Å; A563-R567 WeakPolarHBondContact O-CB 3.49Å; A563-R567 PolarHBondContact O-N 3.28Å; A563-A575 HydrophobicContact CB-CB 4.29Å; A563-A575 VanDerWaalsContact O-CB 3.3Å; A563-A575 WeakPolarHBondContact O-CB 3.35Å; A563-L579 HydrophobicContact CB-CD1 3.92Å; A563-L579 HydrophobicContact CB-CD2 3.74Å; A563-L579 HydrophobicContact CB-CG 3.71Å; A563-W595 HydrophobicContact CB-CH2 3.86Å
564	N	88	Confident	89.4	Confident	63 Å²	63	59.7 Å²	59.7	34%	0.337	32%	0.323	S	S	.	.	H	α-helix	trans	-60.7	-46.2	173.4	-79.8	-36.4	0	0	0	111.6	L560 L566 R567 E568 W595	L560-N564 WeakPolarHBondContact O-CB 3.41Å; L560-N564 PolarHBondContact O-N 2.85Å; L560-N564 PolarHBondContact O-ND2 2.88Å; N564-L566 VanDerWaalsContact C-N 3.33Å; N564-L566 PolarHBondContact O-N 2.85Å; N564-R567 WeakPolarHBondContact O-CB 3.39Å; N564-R567 PolarHBondContact O-N 3.47Å; N564-R567 VanDerWaalsContact O-N 3.14Å; N564-E568 WeakPolarHBondContact O-CB 3.26Å; N564-E568 WeakPolarHBondContact O-CG 3.25Å; N564-E568 PolarHBondContact O-N 3.16Å; N564-W595 WeakPolarHBondContact OD1-CZ2 3.44Å
565	R	87.8	Confident	89.5	Confident	102 Å²	102	59.7 Å²	59.7	39%	0.385	32%	0.323	S	S	.	.	H	α-helix	trans	-61.3	-39.2	175.7	-79.6	-174.8	-73.9	127.8	10.8	112.8	E561 T562 S569	E561-R565 WeakPolarHBondContact O-CG 3.42Å; E561-R565 PolarHBondContact O-N 2.79Å; E561-R565 IonicContact OE1-CZ 2.87Å; E561-R565 VanDerWaalsContact OE1-CZ 3.32Å; E561-R565 IonicContact OE1-NE 3.19Å; E561-R565 PolarHBondContact OE1-NE 3.08Å; E561-R565 IonicContact OE1-NH2 3.41Å; E561-R565 PolarHBondContact OE1-NH2 3.21Å; T562-R565 PolarHBondContact O-N 3.18Å; T562-R565 PolarHBondContact OG1-NH2 2.75Å; T562-R565 VanDerWaalsContact OG1-NH2 3.14Å; R565-S569 WeakPolarHBondContact O-CB 3.18Å; R565-S569 PolarHBondContact O-N 3.13Å; R565-S569 PolarHBondContact O-OG 3.47Å
566	L	91	Very high	89.7	Confident	39 Å²	39	56.8 Å²	56.8	20%	0.204	31%	0.31	C	S	.	.	H	α-helix	trans	-61.4	-46	173.3	-79	171.3	0	0	0	111	T562 A563 N564 S569 G570 K571 A575 M578	T562-L566 WeakPolarHBondContact O-CG 3.39Å; T562-L566 PolarHBondContact O-N 2.98Å; A563-L566 PolarHBondContact O-N 3.04Å; N564-L566 VanDerWaalsContact C-N 3.33Å; N564-L566 PolarHBondContact O-N 2.85Å; L566-S569 WeakPolarHBondContact CA-OG 3.17Å; L566-S569 CarbonylContact O-C 3.57Å; L566-S569 PolarHBondContact O-N 3.33Å; L566-S569 VanDerWaalsContact O-N 3.16Å; L566-S569 PolarHBondContact O-OG 3.27Å; L566-G570 PolarHBondContact O-N 3.4Å; L566-K571 HydrophobicContact CB-CB 4.44Å; L566-K571 HydrophobicContact CD2-CB 4.29Å; L566-K571 HydrophobicContact CD2-CD 3.95Å; L566-K571 WeakPolarHBondContact O-CA 3.32Å; L566-K571 WeakPolarHBondContact O-CB 3.29Å; L566-K571 PolarHBondContact O-N 3.07Å; L566-A575 HydrophobicContact CB-CB 3.77Å; L566-A575 HydrophobicContact CD1-CB 4.42Å; L566-M578 HydrophobicContact CD1-SD 4.05Å
567	R	89.1	Confident	90	Very high	53 Å²	53	57 Å²	57	20%	0.2	31%	0.314	C	S	.	.	H	α-helix	trans	-61.2	-46.9	176.8	-176.5	174.9	-179.6	-132.2	-7.8	112.3	A563 N564 S569 G570 E572 A575 W595 Q598	A563-R567 WeakPolarHBondContact O-CB 3.49Å; A563-R567 PolarHBondContact O-N 3.28Å; N564-R567 WeakPolarHBondContact O-CB 3.39Å; N564-R567 PolarHBondContact O-N 3.47Å; N564-R567 VanDerWaalsContact O-N 3.14Å; R567-S569 PolarHBondContact O-N 3.15Å; R567-G570 PolarHBondContact O-N 3.46Å; R567-E572 HydrophobicContact CG-CB 4.23Å; R567-E572 HydrophobicContact CG-CG 4.1Å; R567-E572 IonicContact CZ-OE2 3.65Å; R567-E572 IonicContact NE-OE2 3.65Å; R567-E572 PolarHBondContact NE-OE2 3Å; R567-E572 IonicContact NH2-OE2 2.82Å; R567-A575 HydrophobicContact CB-CB 4.46Å; R567-W595 HydrophobicContact CB-CH2 4.25Å; R567-W595 HydrophobicContact CB-CZ2 4.46Å; R567-W595 VanDerWaalsContact CD-CE2 3.47Å; R567-Q598 VanDerWaalsContact CZ-OE1 3.27Å
568	E	81.3	Confident	90.4	Very high	160 Å²	160	58 Å²	58	75%	0.748	32%	0.319	S	S	*	.	H	α-helix	trans	-60.1	-31	174.8	-72.6	172.9	179.1	0	0	112.3	N564 G570	N564-E568 WeakPolarHBondContact O-CB 3.26Å; N564-E568 WeakPolarHBondContact O-CG 3.25Å; N564-E568 PolarHBondContact O-N 3.16Å; E568-G570 PolarHBondContact O-N 3.43Å
569	S	89.4	Confident	90.6	Very high	75 Å²	75	54.7 Å²	54.7	52%	0.524	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.4	4.1	173.8	76.5	0	0	0	0	114.7	R565 L566 R567	R565-S569 WeakPolarHBondContact O-CB 3.18Å; R565-S569 PolarHBondContact O-N 3.13Å; R565-S569 PolarHBondContact O-OG 3.47Å; L566-S569 WeakPolarHBondContact CA-OG 3.17Å; L566-S569 CarbonylContact O-C 3.57Å; L566-S569 PolarHBondContact O-N 3.33Å; L566-S569 VanDerWaalsContact O-N 3.16Å; L566-S569 PolarHBondContact O-OG 3.27Å; R567-S569 PolarHBondContact O-N 3.15Å
570	G	88.7	Confident	90.7	Very high	68 Å²	68	60.7 Å²	60.7	70%	0.701	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.1	9.3	-179	0	0	0	0	0	115	L566 R567 E568	L566-G570 PolarHBondContact O-N 3.4Å; R567-G570 PolarHBondContact O-N 3.46Å; E568-G570 PolarHBondContact O-N 3.43Å
571	K	93.6	Very high	90.9	Very high	95 Å²	95	67.7 Å²	67.7	41%	0.413	36%	0.355	S	S	.	.			trans	-104.4	48.4	-177.1	-60.3	178.9	171.7	-163.9	0	112.5	L566 A573 E574 A575	L566-K571 HydrophobicContact CB-CB 4.44Å; L566-K571 HydrophobicContact CD2-CB 4.29Å; L566-K571 HydrophobicContact CD2-CD 3.95Å; L566-K571 WeakPolarHBondContact O-CA 3.32Å; L566-K571 WeakPolarHBondContact O-CB 3.29Å; L566-K571 PolarHBondContact O-N 3.07Å; K571-A573 PolarHBondContact O-N 3.18Å; K571-E574 HydrophobicContact CB-CB 4.28Å; K571-E574 HydrophobicContact CB-CG 4.47Å; K571-E574 WeakPolarHBondContact CD-OE1 3.4Å; K571-E574 PolarHBondContact O-N 3.47Å; K571-A575 PolarHBondContact O-N 3.36Å
572	E	92.5	Very high	91	Very high	48 Å²	48	67.1 Å²	67.1	22%	0.224	35%	0.352	C	S	.	.	H	α-helix	trans	-60	-41.6	-174.6	-172.3	169.1	127.4	0	0	112.9	R567 E574 A575 E576 W595 R599	R567-E572 HydrophobicContact CG-CB 4.23Å; R567-E572 HydrophobicContact CG-CG 4.1Å; R567-E572 IonicContact CZ-OE2 3.65Å; R567-E572 IonicContact NE-OE2 3.65Å; R567-E572 PolarHBondContact NE-OE2 3Å; R567-E572 IonicContact NH2-OE2 2.82Å; E572-E574 VanDerWaalsContact C-N 3.32Å; E572-E574 PolarHBondContact O-N 3.05Å; E572-A575 WeakPolarHBondContact O-CB 3.44Å; E572-A575 PolarHBondContact O-N 2.82Å; E572-A575 VanDerWaalsContact O-N 3.11Å; E572-E576 HydrophobicContact CG-CG 4.44Å; E572-E576 WeakPolarHBondContact O-CG 3.5Å; E572-E576 PolarHBondContact O-N 3.37Å; E572-W595 HydrophobicContact CG-CE3 4.28Å; E572-R599 IonicContact OE1-NH1 3.78Å; E572-R599 PolarHBondContact OE1-NH1 3.41Å
573	A	93.2	Very high	90.8	Very high	79 Å²	79	70.1 Å²	70.1	65%	0.653	37%	0.373	S	S	*	.	H	α-helix	trans	-61.9	-38.6	179.1	0	0	0	0	0	112.9	K571 A577	K571-A573 PolarHBondContact O-N 3.18Å; A573-A577 WeakPolarHBondContact O-CB 3.25Å; A573-A577 PolarHBondContact O-N 2.98Å
574	E	94	Very high	90.4	Very high	108 Å²	108	76 Å²	76	51%	0.505	41%	0.411	S	S	.	.	H	α-helix	trans	-66.9	-41.3	174	-65.5	176.7	-123.6	0	0	110.8	K571 E572 A577 M578	K571-E574 HydrophobicContact CB-CB 4.28Å; K571-E574 HydrophobicContact CB-CG 4.47Å; K571-E574 WeakPolarHBondContact CD-OE1 3.4Å; K571-E574 PolarHBondContact O-N 3.47Å; E572-E574 VanDerWaalsContact C-N 3.32Å; E572-E574 PolarHBondContact O-N 3.05Å; E574-A577 PolarHBondContact O-N 3.12Å; E574-M578 WeakPolarHBondContact O-CB 3.29Å; E574-M578 PolarHBondContact O-N 3.32Å
575	A	93.5	Very high	90.4	Very high	0 Å²	0	74.7 Å²	74.7	0%	0	41%	0.407	C	S	.	.	H	α-helix	trans	-61.7	-46.3	176.8	0	0	0	0	0	111.9	A563 L566 R567 K571 E572 M578 L579 W595	A563-A575 HydrophobicContact CB-CB 4.29Å; A563-A575 VanDerWaalsContact O-CB 3.3Å; A563-A575 WeakPolarHBondContact O-CB 3.35Å; L566-A575 HydrophobicContact CB-CB 3.77Å; L566-A575 HydrophobicContact CD1-CB 4.42Å; R567-A575 HydrophobicContact CB-CB 4.46Å; K571-A575 PolarHBondContact O-N 3.36Å; E572-A575 WeakPolarHBondContact O-CB 3.44Å; E572-A575 PolarHBondContact O-N 2.82Å; E572-A575 VanDerWaalsContact O-N 3.11Å; A575-M578 PolarHBondContact O-N 3.31Å; A575-L579 WeakPolarHBondContact O-CG 3.21Å; A575-L579 PolarHBondContact O-N 2.82Å; A575-W595 HydrophobicContact CB-CH2 3.84Å; A575-W595 HydrophobicContact CB-CZ3 3.71Å
576	E	93.9	Very high	90.5	Very high	13 Å²	13	71.1 Å²	71.1	6%	0.061	40%	0.396	C	S	.	.	H	α-helix	trans	-64	-42	176.3	-67.9	-168.8	-179	0	0	112.1	E572 M578 L579 R580 L592 W595 R599	E572-E576 HydrophobicContact CG-CG 4.44Å; E572-E576 WeakPolarHBondContact O-CG 3.5Å; E572-E576 PolarHBondContact O-N 3.37Å; E576-M578 VanDerWaalsContact C-N 3.31Å; E576-M578 PolarHBondContact O-N 3Å; E576-L579 PolarHBondContact O-N 3.49Å; E576-R580 WeakPolarHBondContact O-CB 3.45Å; E576-R580 WeakPolarHBondContact O-CG 3.25Å; E576-R580 PolarHBondContact O-N 3.33Å; E576-R580 IonicContact OE2-CZ 3.5Å; E576-R580 IonicContact OE2-NH1 3.72Å; E576-R580 PolarHBondContact OE2-NH1 3.36Å; E576-R580 IonicContact OE2-NH2 2.77Å; E576-R580 PolarHBondContact OE2-NH2 2.93Å; E576-L592 HydrophobicContact CB-CD2 3.95Å; E576-L592 HydrophobicContact CG-CD2 3.73Å; E576-W595 HydrophobicContact CG-CE3 3.99Å; E576-W595 HydrophobicContact CG-CZ3 4.15Å; E576-R599 IonicContact OE1-CZ 2.74Å; E576-R599 IonicContact OE1-NH1 3.97Å; E576-R599 PolarHBondContact OE1-NH1 2.9Å; E576-R599 IonicContact OE1-NH2 3.35Å
577	A	93.7	Very high	90.4	Very high	42 Å²	42	75 Å²	75	35%	0.347	41%	0.408	S	S	.	.	H	α-helix	trans	-61.5	-41.7	177.1	0	0	0	0	0	111.2	A573 E574 R580 Q581	A573-A577 WeakPolarHBondContact O-CB 3.25Å; A573-A577 PolarHBondContact O-N 2.98Å; E574-A577 PolarHBondContact O-N 3.12Å; A577-R580 PolarHBondContact O-N 2.83Å; A577-Q581 VanDerWaalsContact O-CG 3.28Å; A577-Q581 WeakPolarHBondContact O-CG 3.44Å; A577-Q581 PolarHBondContact O-N 2.87Å; A577-Q581 VanDerWaalsContact O-N 3.17Å
578	M	92.7	Very high	90.5	Very high	50 Å²	50	73 Å²	73	25%	0.246	40%	0.402	C	S	.	.	H	α-helix	trans	-61.7	-41.8	175.1	176.4	178.2	170.2	0	0	112.1	V559 T562 L566 E574 A575 E576 Q581 Q582	V559-M578 HydrophobicContact CG1-CE 4.18Å; T562-M578 HydrophobicContact CG2-CE 3.83Å; T562-M578 HydrophobicContact CG2-SD 4.04Å; L566-M578 HydrophobicContact CD1-SD 4.05Å; E574-M578 WeakPolarHBondContact O-CB 3.29Å; E574-M578 PolarHBondContact O-N 3.32Å; A575-M578 PolarHBondContact O-N 3.31Å; E576-M578 VanDerWaalsContact C-N 3.31Å; E576-M578 PolarHBondContact O-N 3Å; M578-Q581 PolarHBondContact O-N 2.97Å; M578-Q582 PolarHBondContact O-NE2 3.07Å; M578-Q582 VanDerWaalsContact O-NE2 3.16Å
579	L	93.4	Very high	91	Very high	1 Å²	1	67.1 Å²	67.1	1%	0.005	38%	0.375	C	S	.	.	H	α-helix	trans	-68	-41.9	177.5	-73.4	-178.2	0	0	0	112.3	V559 L560 A563 A575 E576 Q581 Q582 I588 T591 L592 W595	V559-L579 HydrophobicContact CG1-CD2 3.86Å; L560-L579 HydrophobicContact CD2-CD2 3.9Å; A563-L579 HydrophobicContact CB-CD1 3.92Å; A563-L579 HydrophobicContact CB-CD2 3.74Å; A563-L579 HydrophobicContact CB-CG 3.71Å; A575-L579 WeakPolarHBondContact O-CG 3.21Å; A575-L579 PolarHBondContact O-N 2.82Å; E576-L579 PolarHBondContact O-N 3.49Å; L579-Q581 PolarHBondContact O-N 3.45Å; L579-Q582 VanDerWaalsContact O-CB 3.31Å; L579-Q582 WeakPolarHBondContact O-CB 3.49Å; L579-Q582 WeakPolarHBondContact O-CG 3.2Å; L579-Q582 PolarHBondContact O-N 2.89Å; L579-Q582 VanDerWaalsContact O-N 3.1Å; L579-I588 HydrophobicContact CB-CG2 3.83Å; L579-I588 HydrophobicContact CD2-CG2 4.39Å; L579-I588 HydrophobicContact CG-CG2 4.49Å; L579-T591 HydrophobicContact CD1-CG2 4.4Å; L579-L592 HydrophobicContact CB-CD1 4.5Å; L579-L592 HydrophobicContact CB-CD2 4.22Å; L579-L592 HydrophobicContact CD1-CD2 3.88Å; L579-L592 HydrophobicContact CD1-CG 4.3Å; L579-W595 HydrophobicContact CD1-CH2 3.7Å; L579-W595 HydrophobicContact CD1-CZ2 4.28Å; L579-W595 HydrophobicContact CD1-CZ3 3.89Å
580	R	91.6	Very high	91.2	Very high	152 Å²	152	64.7 Å²	64.7	57%	0.574	36%	0.356	S	S	*	.	H	α-helix	trans	-67.6	-19.9	177.5	-71.3	-177.6	-175.3	111.5	6.8	113.9	E576 A577 Q582 L592	E576-R580 WeakPolarHBondContact O-CB 3.45Å; E576-R580 WeakPolarHBondContact O-CG 3.25Å; E576-R580 PolarHBondContact O-N 3.33Å; E576-R580 IonicContact OE2-CZ 3.5Å; E576-R580 IonicContact OE2-NH1 3.72Å; E576-R580 PolarHBondContact OE2-NH1 3.36Å; E576-R580 IonicContact OE2-NH2 2.77Å; E576-R580 PolarHBondContact OE2-NH2 2.93Å; A577-R580 PolarHBondContact O-N 2.83Å; R580-Q582 VanDerWaalsContact C-N 3.29Å; R580-L592 HydrophobicContact CG-CD1 3.99Å
581	Q	92.1	Very high	91.4	Very high	158 Å²	158	62.6 Å²	62.6	74%	0.738	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.5	-12.7	173.6	-73.8	171.8	26.2	0	0	113.2	A577 M578 L579	A577-Q581 VanDerWaalsContact O-CG 3.28Å; A577-Q581 WeakPolarHBondContact O-CG 3.44Å; A577-Q581 PolarHBondContact O-N 2.87Å; A577-Q581 VanDerWaalsContact O-N 3.17Å; M578-Q581 PolarHBondContact O-N 2.97Å; L579-Q581 PolarHBondContact O-N 3.45Å
582	Q	90	Very high	91.4	Very high	65 Å²	65	58.7 Å²	58.7	30%	0.304	31%	0.313	S	S	.	.	S	Bend	trans	-75.6	159.6	176.7	-54.9	-55.1	-49.8	0	0	111.2	V559 M578 L579 R580 I588	V559-Q582 HydrophobicContact CG1-CG 3.82Å; M578-Q582 PolarHBondContact O-NE2 3.07Å; M578-Q582 VanDerWaalsContact O-NE2 3.16Å; L579-Q582 VanDerWaalsContact O-CB 3.31Å; L579-Q582 WeakPolarHBondContact O-CB 3.49Å; L579-Q582 WeakPolarHBondContact O-CG 3.2Å; L579-Q582 PolarHBondContact O-N 2.89Å; L579-Q582 VanDerWaalsContact O-N 3.1Å; R580-Q582 VanDerWaalsContact C-N 3.29Å; Q582-I588 HydrophobicContact CB-CD1 3.51Å; Q582-I588 HydrophobicContact CG-CD1 3.85Å
583	P	86.2	Confident	91.4	Very high	101 Å²	101	56.4 Å²	56.4	66%	0.656	30%	0.302	S	S	*	.	P	Polyproline II helix	trans	-53.7	146.5	169.5	-24.6	34.5	0	0	0	111.8	S585	P583-S585 PolarHBondContact O-N 3.27Å; P583-S585 VanDerWaalsContact O-N 3.17Å
584	P	83.4	Confident	91.4	Very high	124 Å²	124	55.6 Å²	55.6	81%	0.805	29%	0.287	S	S	*	.	P	Polyproline II helix	trans	-51.2	123.6	178.7	-27.4	34.6	0	0	0	111.7
585	S	86.7	Confident	91.3	Very high	35 Å²	35	50.8 Å²	50.8	25%	0.245	27%	0.265	C	S	.	.			trans	-143.9	125.8	-175.5	168.3	0	0	0	0	109.5	P583 R587 I588 D589	P583-S585 PolarHBondContact O-N 3.27Å; P583-S585 VanDerWaalsContact O-N 3.17Å; S585-R587 PolarHBondContact O-N 3.27Å; S585-R587 PolarHBondContact OG-N 2.92Å; S585-I588 PolarHBondContact O-N 3.29Å; S585-D589 PolarHBondContact O-N 3.5Å
586	T	90.7	Very high	91.4	Very high	27 Å²	27	51 Å²	51	17%	0.166	27%	0.266	C	S	.	.	H	α-helix	trans	-57.5	-36.7	177.4	-65.7	0	0	0	0	111.9	I588 D589 L590 V612 E616	T586-I588 VanDerWaalsContact C-N 3.35Å; T586-I588 PolarHBondContact O-N 3.3Å; T586-D589 PolarHBondContact O-N 3.14Å; T586-L590 HydrophobicContact CG2-CD1 3.98Å; T586-L590 HydrophobicContact CG2-CG 4.34Å; T586-L590 WeakPolarHBondContact O-CB 3.46Å; T586-L590 VanDerWaalsContact O-CG 3.27Å; T586-L590 WeakPolarHBondContact O-CG 3.48Å; T586-L590 PolarHBondContact O-N 3.3Å; T586-V612 HydrophobicContact CG2-CG1 3.69Å; T586-E616 WeakPolarHBondContact CB-OE1 3.48Å; T586-E616 PolarHBondContact OG1-OE1 2.79Å
587	R	88.9	Confident	91.3	Very high	121 Å²	121	52.3 Å²	52.3	46%	0.457	27%	0.272	S	S	.	.	H	α-helix	trans	-64.3	-38.6	176.4	-173.7	173.6	178.1	-169.6	-8.4	112.5	D557 L560 S585 T591	D557-R587 IonicContact OD1-CZ 3.32Å; D557-R587 IonicContact OD1-NH1 3.06Å; D557-R587 PolarHBondContact OD1-NH1 3.26Å; D557-R587 IonicContact OD1-NH2 3.04Å; D557-R587 PolarHBondContact OD1-NH2 3.06Å; L560-R587 HydrophobicContact CD1-CG 3.97Å; L560-R587 VanDerWaalsContact CD1-NE 3.26Å; S585-R587 PolarHBondContact O-N 3.27Å; S585-R587 PolarHBondContact OG-N 2.92Å; R587-T591 WeakPolarHBondContact O-CB 3.43Å; R587-T591 PolarHBondContact O-N 2.91Å; R587-T591 PolarHBondContact O-OG1 3.1Å
588	I	91	Very high	91	Very high	12 Å²	12	56.3 Å²	56.3	6%	0.062	28%	0.284	C	S	.	.	H	α-helix	trans	-68.9	-46.1	177.8	-67.1	179.9	0	0	0	110.2	L560 L579 Q582 S585 T586 L590 T591 L592	L560-I588 HydrophobicContact CD2-CG1 4.47Å; L579-I588 HydrophobicContact CB-CG2 3.83Å; L579-I588 HydrophobicContact CD2-CG2 4.39Å; L579-I588 HydrophobicContact CG-CG2 4.49Å; Q582-I588 HydrophobicContact CB-CD1 3.51Å; Q582-I588 HydrophobicContact CG-CD1 3.85Å; S585-I588 PolarHBondContact O-N 3.29Å; T586-I588 VanDerWaalsContact C-N 3.35Å; T586-I588 PolarHBondContact O-N 3.3Å; I588-L590 VanDerWaalsContact C-N 3.35Å; I588-L590 PolarHBondContact O-N 3.38Å; I588-T591 WeakPolarHBondContact O-CB 3.46Å; I588-T591 PolarHBondContact O-N 3.3Å; I588-T591 VanDerWaalsContact O-N 3.16Å; I588-L592 HydrophobicContact CG2-CD1 4.02Å; I588-L592 HydrophobicContact CG2-CG 4.39Å; I588-L592 WeakPolarHBondContact O-CG 3.46Å; I588-L592 PolarHBondContact O-N 2.55Å
589	D	92	Very high	90.9	Very high	35 Å²	35	58.9 Å²	58.9	19%	0.187	29%	0.29	C	S	.	.	H	α-helix	trans	-63	-40.9	179.8	-72.2	-15.9	0	0	0	112.1	S585 T586 L592 A593 V612 R615	S585-D589 PolarHBondContact O-N 3.5Å; T586-D589 PolarHBondContact O-N 3.14Å; D589-L592 PolarHBondContact O-N 2.92Å; D589-A593 WeakPolarHBondContact O-CB 3.33Å; D589-A593 PolarHBondContact O-N 2.85Å; D589-V612 HydrophobicContact CB-CG2 3.54Å; D589-R615 IonicContact OD2-CZ 3.92Å; D589-R615 IonicContact OD2-NH1 3.9Å; D589-R615 PolarHBondContact OD2-NH1 3.05Å; D589-R615 IonicContact OD2-NH2 2.95Å; D589-R615 PolarHBondContact OD2-NH2 3.47Å
590	L	93.6	Very high	90.8	Very high	24 Å²	24	67.9 Å²	67.9	13%	0.126	32%	0.324	C	S	.	.	H	α-helix	trans	-62	-43.3	172.8	-72	173.1	0	0	0	111.6	T586 I588 L592 A593 D594 Y609 V612 D621 A622	T586-L590 HydrophobicContact CG2-CD1 3.98Å; T586-L590 HydrophobicContact CG2-CG 4.34Å; T586-L590 WeakPolarHBondContact O-CB 3.46Å; T586-L590 VanDerWaalsContact O-CG 3.27Å; T586-L590 WeakPolarHBondContact O-CG 3.48Å; T586-L590 PolarHBondContact O-N 3.3Å; I588-L590 VanDerWaalsContact C-N 3.35Å; I588-L590 PolarHBondContact O-N 3.38Å; L590-L592 PolarHBondContact O-N 3.13Å; L590-A593 WeakPolarHBondContact O-CB 3.31Å; L590-A593 PolarHBondContact O-N 3.36Å; L590-D594 VanDerWaalsContact O-CG 3.23Å; L590-D594 PolarHBondContact O-N 3.5Å; L590-Y609 HydrophobicContact CD2-CD1 3.87Å; L590-Y609 HydrophobicContact CD2-CE1 3.81Å; L590-V612 HydrophobicContact CD2-CG2 4.32Å; L590-V612 HydrophobicContact CG-CG2 4.36Å; L590-D621 HydrophobicContact CD1-CB 3.95Å; L590-D621 HydrophobicContact CD2-CB 4.29Å; L590-A622 HydrophobicContact CD2-CB 3.99Å
591	T	92	Very high	90.9	Very high	24 Å²	24	62.8 Å²	62.8	15%	0.147	31%	0.309	C	S	.	.	H	α-helix	trans	-60.8	-45.5	177.2	-58.1	0	0	0	0	111.5	L560 L579 R587 I588 A593 D594 W595	L560-T591 HydrophobicContact CD2-CG2 4.2Å; L579-T591 HydrophobicContact CD1-CG2 4.4Å; R587-T591 WeakPolarHBondContact O-CB 3.43Å; R587-T591 PolarHBondContact O-N 2.91Å; R587-T591 PolarHBondContact O-OG1 3.1Å; I588-T591 WeakPolarHBondContact O-CB 3.46Å; I588-T591 PolarHBondContact O-N 3.3Å; I588-T591 VanDerWaalsContact O-N 3.16Å; T591-A593 VanDerWaalsContact C-N 3.32Å; T591-A593 PolarHBondContact O-N 3.36Å; T591-D594 PolarHBondContact O-N 2.63Å; T591-W595 HydrophobicContact CG2-CD2 4.34Å; T591-W595 HydrophobicContact CG2-CZ2 3.88Å; T591-W595 VanDerWaalsContact O-CG 3.25Å; T591-W595 PolarHBondContact O-N 3.41Å
592	L	93.7	Very high	91	Very high	13 Å²	13	58 Å²	58	7%	0.068	28%	0.284	C	S	.	.	H	α-helix	trans	-64.3	-37.1	176.9	-69.3	172.6	0	0	0	111.9	E576 L579 R580 I588 D589 L590 W595 A596	E576-L592 HydrophobicContact CB-CD2 3.95Å; E576-L592 HydrophobicContact CG-CD2 3.73Å; L579-L592 HydrophobicContact CB-CD1 4.5Å; L579-L592 HydrophobicContact CB-CD2 4.22Å; L579-L592 HydrophobicContact CD1-CD2 3.88Å; L579-L592 HydrophobicContact CD1-CG 4.3Å; R580-L592 HydrophobicContact CG-CD1 3.99Å; I588-L592 HydrophobicContact CG2-CD1 4.02Å; I588-L592 HydrophobicContact CG2-CG 4.39Å; I588-L592 WeakPolarHBondContact O-CG 3.46Å; I588-L592 PolarHBondContact O-N 2.55Å; D589-L592 PolarHBondContact O-N 2.92Å; L590-L592 PolarHBondContact O-N 3.13Å; L592-W595 HydrophobicContact CD2-CE3 4.32Å; L592-W595 PolarHBondContact O-N 3.33Å; L592-A596 PolarHBondContact O-N 3.14Å
593	A	94.2	Very high	91.3	Very high	0 Å²	0	60 Å²	60	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-64.2	-46.7	175	0	0	0	0	0	111.7	D589 L590 T591 W595 A596 Q597 A608 Y609	D589-A593 WeakPolarHBondContact O-CB 3.33Å; D589-A593 PolarHBondContact O-N 2.85Å; L590-A593 WeakPolarHBondContact O-CB 3.31Å; L590-A593 PolarHBondContact O-N 3.36Å; T591-A593 VanDerWaalsContact C-N 3.32Å; T591-A593 PolarHBondContact O-N 3.36Å; A593-W595 VanDerWaalsContact C-N 3.31Å; A593-W595 PolarHBondContact O-N 3.01Å; A593-A596 WeakPolarHBondContact O-CB 3.38Å; A593-A596 PolarHBondContact O-N 3.41Å; A593-Q597 PolarHBondContact O-N 3.35Å; A593-A608 HydrophobicContact CB-CB 3.55Å; A593-Y609 HydrophobicContact CB-CD1 3.7Å; A593-Y609 HydrophobicContact CB-CD2 4.06Å; A593-Y609 HydrophobicContact CB-CE1 3.45Å; A593-Y609 VanDerWaalsContact CB-CE1 3.45Å; A593-Y609 HydrophobicContact CB-CE2 3.83Å; A593-Y609 HydrophobicContact CB-CG 3.99Å
594	D	92	Very high	91.6	Very high	62 Å²	62	56.8 Å²	56.8	33%	0.332	28%	0.283	S	S	.	.	H	α-helix	trans	-61.8	-39.3	177.7	-67	-9	0	0	0	111.2	L590 T591 Q597 Q598 Y609	L590-D594 VanDerWaalsContact O-CG 3.23Å; L590-D594 PolarHBondContact O-N 3.5Å; T591-D594 PolarHBondContact O-N 2.63Å; D594-Q597 PolarHBondContact O-N 2.84Å; D594-Q598 VanDerWaalsContact O-CG 3.28Å; D594-Q598 WeakPolarHBondContact O-CG 3.27Å; D594-Q598 PolarHBondContact O-N 3.45Å; D594-Y609 PolarHBondContact OD1-OH 3.16Å
595	W	93.3	Very high	92.2	Very high	8 Å²	8	50.9 Å²	50.9	3%	0.03	25%	0.245	C	C	.	.	H	α-helix	trans	-64.5	-44.7	175.9	-69.6	9.4	0	0	0	111.7	A563 N564 R567 E572 A575 E576 L579 T591 L592 A593 Q597 Q598 R599	A563-W595 HydrophobicContact CB-CH2 3.86Å; N564-W595 WeakPolarHBondContact OD1-CZ2 3.44Å; R567-W595 HydrophobicContact CB-CH2 4.25Å; R567-W595 HydrophobicContact CB-CZ2 4.46Å; R567-W595 VanDerWaalsContact CD-CE2 3.47Å; E572-W595 HydrophobicContact CG-CE3 4.28Å; A575-W595 HydrophobicContact CB-CH2 3.84Å; A575-W595 HydrophobicContact CB-CZ3 3.71Å; E576-W595 HydrophobicContact CG-CE3 3.99Å; E576-W595 HydrophobicContact CG-CZ3 4.15Å; L579-W595 HydrophobicContact CD1-CH2 3.7Å; L579-W595 HydrophobicContact CD1-CZ2 4.28Å; L579-W595 HydrophobicContact CD1-CZ3 3.89Å; T591-W595 HydrophobicContact CG2-CD2 4.34Å; T591-W595 HydrophobicContact CG2-CZ2 3.88Å; T591-W595 VanDerWaalsContact O-CG 3.25Å; T591-W595 PolarHBondContact O-N 3.41Å; L592-W595 HydrophobicContact CD2-CE3 4.32Å; L592-W595 PolarHBondContact O-N 3.33Å; A593-W595 VanDerWaalsContact C-N 3.31Å; A593-W595 PolarHBondContact O-N 3.01Å; W595-Q597 VanDerWaalsContact C-N 3.31Å; W595-Q597 PolarHBondContact O-N 2.76Å; W595-Q598 PolarHBondContact O-N 2.99Å; W595-R599 WeakPolarHBondContact O-CG 3.39Å; W595-R599 PolarHBondContact O-N 3.24Å; W595-R599 VanDerWaalsContact O-N 3.12Å
596	A	93.8	Very high	92.6	Very high	3 Å²	3	52.5 Å²	52.5	3%	0.025	25%	0.245	C	C	.	.	H	α-helix	trans	-60.5	-40	174.2	0	0	0	0	0	112.1	L592 A593 R599 R600 D601 A604 A605	L592-A596 PolarHBondContact O-N 3.14Å; A593-A596 WeakPolarHBondContact O-CB 3.38Å; A593-A596 PolarHBondContact O-N 3.41Å; A596-R599 WeakPolarHBondContact O-CG 3.43Å; A596-R600 PolarHBondContact O-N 3.48Å; A596-D601 HydrophobicContact CB-CB 4.48Å; A596-D601 PolarHBondContact O-N 3.28Å; A596-A604 HydrophobicContact CB-CB 3.97Å; A596-A605 HydrophobicContact CB-CB 3.91Å
597	Q	91.8	Very high	92.7	Very high	42 Å²	42	53.3 Å²	53.3	20%	0.196	26%	0.255	C	S	.	.	H	α-helix	trans	-64.5	-44.4	175	-179.5	-177.4	-2.2	0	0	112	A593 D594 W595 R599 R600 A605 Y609 V629	A593-Q597 PolarHBondContact O-N 3.35Å; D594-Q597 PolarHBondContact O-N 2.84Å; W595-Q597 VanDerWaalsContact C-N 3.31Å; W595-Q597 PolarHBondContact O-N 2.76Å; Q597-R599 VanDerWaalsContact C-N 3.3Å; Q597-R599 PolarHBondContact O-N 2.64Å; Q597-R600 WeakPolarHBondContact O-CA 3.35Å; Q597-R600 PolarHBondContact O-N 3.25Å; Q597-A605 HydrophobicContact CB-CB 4.2Å; Q597-Y609 PolarHBondContact OE1-OH 3.02Å; Q597-V629 HydrophobicContact CB-CG2 4.06Å; Q597-V629 HydrophobicContact CG-CG2 3.83Å
598	Q	88.3	Confident	92.9	Very high	126 Å²	126	48.4 Å²	48.4	59%	0.589	24%	0.24	S	C	*	.	H	α-helix	trans	-62.3	-35.8	179.9	-75.2	174.2	12.8	0	0	112.5	R567 D594 W595 R600	R567-Q598 VanDerWaalsContact CZ-OE1 3.27Å; D594-Q598 VanDerWaalsContact O-CG 3.28Å; D594-Q598 WeakPolarHBondContact O-CG 3.27Å; D594-Q598 PolarHBondContact O-N 3.45Å; W595-Q598 PolarHBondContact O-N 2.99Å; Q598-R600 PolarHBondContact O-N 3.06Å
599	R	90.7	Very high	93.2	Very high	103 Å²	103	47.9 Å²	47.9	39%	0.389	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.3	4.3	172.6	72.8	-176.5	-170.4	-155.9	0.9	114.2	E572 E576 W595 A596 Q597 D601	E572-R599 IonicContact OE1-NH1 3.78Å; E572-R599 PolarHBondContact OE1-NH1 3.41Å; E576-R599 IonicContact OE1-CZ 2.74Å; E576-R599 IonicContact OE1-NH1 3.97Å; E576-R599 PolarHBondContact OE1-NH1 2.9Å; E576-R599 IonicContact OE1-NH2 3.35Å; W595-R599 WeakPolarHBondContact O-CG 3.39Å; W595-R599 PolarHBondContact O-N 3.24Å; W595-R599 VanDerWaalsContact O-N 3.12Å; A596-R599 WeakPolarHBondContact O-CG 3.43Å; Q597-R599 VanDerWaalsContact C-N 3.3Å; Q597-R599 PolarHBondContact O-N 2.64Å; R599-D601 VanDerWaalsContact C-N 3.25Å; R599-D601 HydrophobicContact CG-CB 3.86Å; R599-D601 IonicContact CZ-OD2 3.53Å; R599-D601 IonicContact NE-OD2 3.6Å; R599-D601 PolarHBondContact NE-OD2 3.09Å; R599-D601 IonicContact NH2-OD2 3.66Å; R599-D601 PolarHBondContact NH2-OD2 3.32Å; R599-D601 PolarHBondContact O-N 3.44Å
600	R	91.2	Very high	93.3	Very high	190 Å²	190	50.9 Å²	50.9	72%	0.717	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	63	22.5	-177.9	-51.9	-176.3	178	-157.2	-0.5	115.2	A596 Q597 Q598 Y602	A596-R600 PolarHBondContact O-N 3.48Å; Q597-R600 WeakPolarHBondContact O-CA 3.35Å; Q597-R600 PolarHBondContact O-N 3.25Å; Q598-R600 PolarHBondContact O-N 3.06Å; R600-Y602 HydrophobicContact CB-CE1 4.26Å; R600-Y602 HydrophobicContact CB-CE2 4.34Å; R600-Y602 PolarHBondContact O-N 3.33Å
601	D	93.8	Very high	93.2	Very high	46 Å²	46	54.2 Å²	54.2	25%	0.246	27%	0.269	C	S	.	.			trans	-82.9	73.6	169.3	-177.6	-4.2	0	0	0	109.4	A596 R599 T603 A604 A605	A596-D601 HydrophobicContact CB-CB 4.48Å; A596-D601 PolarHBondContact O-N 3.28Å; R599-D601 VanDerWaalsContact C-N 3.25Å; R599-D601 HydrophobicContact CG-CB 3.86Å; R599-D601 IonicContact CZ-OD2 3.53Å; R599-D601 IonicContact NE-OD2 3.6Å; R599-D601 PolarHBondContact NE-OD2 3.09Å; R599-D601 IonicContact NH2-OD2 3.66Å; R599-D601 PolarHBondContact NH2-OD2 3.32Å; R599-D601 PolarHBondContact O-N 3.44Å; D601-T603 PolarHBondContact O-N 3.5Å; D601-T603 PolarHBondContact OD1-OG1 3.05Å; D601-A604 HydrophobicContact CB-CB 4.4Å; D601-A604 PolarHBondContact O-N 3.44Å; D601-A604 WeakPolarHBondContact OD1-CB 3.31Å; D601-A604 PolarHBondContact OD1-N 3.49Å; D601-A604 WeakPolarHBondContact OD2-CB 3.36Å; D601-A605 WeakPolarHBondContact O-CB 3.28Å; D601-A605 PolarHBondContact O-N 3.04Å
602	Y	94.6	Very high	93.4	Very high	57 Å²	57	53.1 Å²	53.1	22%	0.224	26%	0.262	C	S	.	.	H	α-helix	trans	-62.3	-27.5	-176.8	-55.5	-47.6	0	0	0	112.6	R600 R606 V629 A632 A633	R600-Y602 HydrophobicContact CB-CE1 4.26Å; R600-Y602 HydrophobicContact CB-CE2 4.34Å; R600-Y602 PolarHBondContact O-N 3.33Å; Y602-R606 WeakPolarHBondContact O-CB 3.49Å; Y602-R606 WeakPolarHBondContact O-CG 3.47Å; Y602-R606 PolarHBondContact O-N 2.85Å; Y602-V629 HydrophobicContact CD1-CG1 3.97Å; Y602-V629 HydrophobicContact CG-CG1 4.28Å; Y602-A632 HydrophobicContact CE1-CB 3.67Å; Y602-A633 HydrophobicContact CD2-CB 3.89Å; Y602-A633 HydrophobicContact CE2-CB 4.41Å; Y602-A633 HydrophobicContact CG-CB 4.13Å
603	T	94.7	Very high	93.4	Very high	108 Å²	108	53.9 Å²	53.9	66%	0.663	27%	0.266	S	S	*	.	H	α-helix	trans	-64.5	-51	175.2	33.5	0	0	0	0	112.1	D601 A607	D601-T603 PolarHBondContact O-N 3.5Å; D601-T603 PolarHBondContact OD1-OG1 3.05Å; T603-A607 PolarHBondContact O-N 2.74Å
604	A	93.4	Very high	93.4	Very high	33 Å²	33	59.3 Å²	59.3	27%	0.273	30%	0.299	S	S	.	.	H	α-helix	trans	-68	-39	177.6	0	0	0	0	0	111.7	A596 D601 A607 A608	A596-A604 HydrophobicContact CB-CB 3.97Å; D601-A604 HydrophobicContact CB-CB 4.4Å; D601-A604 PolarHBondContact O-N 3.44Å; D601-A604 WeakPolarHBondContact OD1-CB 3.31Å; D601-A604 PolarHBondContact OD1-N 3.49Å; D601-A604 WeakPolarHBondContact OD2-CB 3.36Å; A604-A607 PolarHBondContact O-N 2.67Å; A604-A608 WeakPolarHBondContact O-CB 3.36Å; A604-A608 PolarHBondContact O-N 2.72Å
605	A	95.5	Very high	93.5	Very high	0 Å²	0	61.9 Å²	61.9	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-61.3	-46.8	177.8	0	0	0	0	0	111.9	A596 Q597 D601 A607 A608 Y609 V629	A596-A605 HydrophobicContact CB-CB 3.91Å; Q597-A605 HydrophobicContact CB-CB 4.2Å; D601-A605 WeakPolarHBondContact O-CB 3.28Å; D601-A605 PolarHBondContact O-N 3.04Å; A605-A607 PolarHBondContact O-N 3.5Å; A605-A608 PolarHBondContact O-N 2.92Å; A605-Y609 HydrophobicContact CB-CE2 4.48Å; A605-Y609 WeakPolarHBondContact O-CD2 3.37Å; A605-Y609 PolarHBondContact O-N 3.47Å; A605-V629 HydrophobicContact CB-CG1 4.35Å; A605-V629 HydrophobicContact CB-CG2 3.74Å
606	R	95.2	Very high	93.5	Very high	68 Å²	68	65.1 Å²	65.1	26%	0.257	32%	0.319	S	S	.	.	H	α-helix	trans	-56.9	-48	174.9	-78.7	174.4	174.3	156.1	-2.3	111.9	Y602 A608 Y609 Q610 L626 V629 D630	Y602-R606 WeakPolarHBondContact O-CB 3.49Å; Y602-R606 WeakPolarHBondContact O-CG 3.47Å; Y602-R606 PolarHBondContact O-N 2.85Å; R606-A608 VanDerWaalsContact C-N 3.33Å; R606-A608 PolarHBondContact O-N 3.37Å; R606-Y609 PolarHBondContact O-N 3.23Å; R606-Q610 WeakPolarHBondContact O-CB 3.45Å; R606-Q610 WeakPolarHBondContact O-CG 3.46Å; R606-Q610 PolarHBondContact O-N 3.15Å; R606-L626 HydrophobicContact CB-CD1 4.11Å; R606-L626 HydrophobicContact CG-CD1 3.71Å; R606-V629 HydrophobicContact CG-CG1 3.74Å; R606-D630 IonicContact CZ-OD1 3.88Å; R606-D630 IonicContact NE-OD1 2.82Å; R606-D630 PolarHBondContact NE-OD1 3.3Å; R606-D630 IonicContact NH2-OD1 3.53Å; R606-D630 PolarHBondContact NH2-OD1 3.2Å
607	A	93.9	Very high	93.4	Very high	45 Å²	45	69.8 Å²	69.8	37%	0.372	35%	0.35	S	S	.	.	H	α-helix	trans	-61.8	-42.1	179.6	0	0	0	0	0	111.8	T603 A604 A605 Q610 N611	T603-A607 PolarHBondContact O-N 2.74Å; A604-A607 PolarHBondContact O-N 2.67Å; A605-A607 PolarHBondContact O-N 3.5Å; A607-Q610 PolarHBondContact O-N 2.88Å; A607-N611 PolarHBondContact O-N 3.27Å; A607-N611 PolarHBondContact O-ND2 2.93Å
608	A	92.8	Very high	93.4	Very high	18 Å²	18	71.1 Å²	71.1	15%	0.149	37%	0.368	C	S	.	.	H	α-helix	trans	-65.7	-46.3	179	0	0	0	0	0	112.5	A593 A604 A605 R606 Q610 N611 V612	A593-A608 HydrophobicContact CB-CB 3.55Å; A604-A608 WeakPolarHBondContact O-CB 3.36Å; A604-A608 PolarHBondContact O-N 2.72Å; A605-A608 PolarHBondContact O-N 2.92Å; R606-A608 VanDerWaalsContact C-N 3.33Å; R606-A608 PolarHBondContact O-N 3.37Å; A608-Q610 PolarHBondContact O-N 3.38Å; A608-N611 WeakPolarHBondContact O-CB 3.4Å; A608-N611 PolarHBondContact O-N 3.2Å; A608-V612 PolarHBondContact O-N 3.09Å
609	Y	96	Very high	93.6	Very high	0 Å²	0	66.2 Å²	66.2	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-64.1	-39.5	174.9	-69.6	-55.3	0	0	0	112.4	L590 A593 D594 Q597 A605 R606 N611 V612 L613 A622 G625 L626 V629	L590-Y609 HydrophobicContact CD2-CD1 3.87Å; L590-Y609 HydrophobicContact CD2-CE1 3.81Å; A593-Y609 HydrophobicContact CB-CD1 3.7Å; A593-Y609 HydrophobicContact CB-CD2 4.06Å; A593-Y609 HydrophobicContact CB-CE1 3.45Å; A593-Y609 VanDerWaalsContact CB-CE1 3.45Å; A593-Y609 HydrophobicContact CB-CE2 3.83Å; A593-Y609 HydrophobicContact CB-CG 3.99Å; D594-Y609 PolarHBondContact OD1-OH 3.16Å; Q597-Y609 PolarHBondContact OE1-OH 3.02Å; A605-Y609 HydrophobicContact CB-CE2 4.48Å; A605-Y609 WeakPolarHBondContact O-CD2 3.37Å; A605-Y609 PolarHBondContact O-N 3.47Å; R606-Y609 PolarHBondContact O-N 3.23Å; Y609-N611 VanDerWaalsContact C-N 3.3Å; Y609-N611 PolarHBondContact O-N 3.37Å; Y609-V612 PolarHBondContact O-N 3.39Å; Y609-L613 WeakPolarHBondContact O-CG 3.44Å; Y609-L613 PolarHBondContact O-N 3.16Å; Y609-A622 HydrophobicContact CD1-CB 4.25Å; Y609-G625 WeakPolarHBondContact CE2-O 3.41Å; Y609-G625 VanDerWaalsContact CZ-CA 3.48Å; Y609-L626 HydrophobicContact CD2-CB 4.34Å; Y609-L626 HydrophobicContact CG-CB 4.4Å; Y609-V629 HydrophobicContact CD2-CG2 4.25Å; Y609-V629 HydrophobicContact CE2-CG2 3.76Å
610	Q	94.4	Very high	93.7	Very high	98 Å²	98	62.7 Å²	62.7	46%	0.458	34%	0.338	S	S	.	.	H	α-helix	trans	-62.9	-36.2	175.8	-74.7	171.5	4	0	0	112.5	R606 A607 A608 V612 L613 T614 L626	R606-Q610 WeakPolarHBondContact O-CB 3.45Å; R606-Q610 WeakPolarHBondContact O-CG 3.46Å; R606-Q610 PolarHBondContact O-N 3.15Å; A607-Q610 PolarHBondContact O-N 2.88Å; A608-Q610 PolarHBondContact O-N 3.38Å; Q610-V612 VanDerWaalsContact C-N 3.34Å; Q610-V612 PolarHBondContact O-N 3.2Å; Q610-L613 PolarHBondContact O-N 3.38Å; Q610-T614 PolarHBondContact O-N 2.92Å; Q610-T614 PolarHBondContact O-OG1 3.46Å; Q610-L626 HydrophobicContact CG-CD2 4.41Å
611	N	92.6	Very high	93.7	Very high	95 Å²	95	56.9 Å²	56.9	51%	0.508	32%	0.322	S	S	.	.	H	α-helix	trans	-62.8	-40.5	174.2	-73.8	-22.2	0	0	0	111.9	A607 A608 Y609 T614	A607-N611 PolarHBondContact O-N 3.27Å; A607-N611 PolarHBondContact O-ND2 2.93Å; A608-N611 WeakPolarHBondContact O-CB 3.4Å; A608-N611 PolarHBondContact O-N 3.2Å; Y609-N611 VanDerWaalsContact C-N 3.3Å; Y609-N611 PolarHBondContact O-N 3.37Å; N611-T614 PolarHBondContact O-N 3.4Å
612	V	94.8	Very high	93.8	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-63.1	-49.3	173	176.4	0	0	0	0	110.4	T586 D589 L590 A608 Y609 Q610 T614 R615 E616 N619 A622	T586-V612 HydrophobicContact CG2-CG1 3.69Å; D589-V612 HydrophobicContact CB-CG2 3.54Å; L590-V612 HydrophobicContact CD2-CG2 4.32Å; L590-V612 HydrophobicContact CG-CG2 4.36Å; A608-V612 PolarHBondContact O-N 3.09Å; Y609-V612 PolarHBondContact O-N 3.39Å; Q610-V612 VanDerWaalsContact C-N 3.34Å; Q610-V612 PolarHBondContact O-N 3.2Å; V612-T614 PolarHBondContact O-N 3.22Å; V612-R615 PolarHBondContact O-N 2.96Å; V612-E616 PolarHBondContact O-N 3.2Å; V612-N619 HydrophobicContact CG1-CB 4.25Å; V612-A622 HydrophobicContact CB-CB 3.98Å; V612-A622 HydrophobicContact CG1-CB 3.7Å
613	L	95	Very high	93.8	Very high	30 Å²	30	52.1 Å²	52.1	16%	0.157	30%	0.3	C	S	.	.	H	α-helix	trans	-64.3	-24.7	-178.7	-66.8	172.4	0	0	0	113.7	Y609 Q610 R615 E616 P617 A622 I623 L626	Y609-L613 WeakPolarHBondContact O-CG 3.44Å; Y609-L613 PolarHBondContact O-N 3.16Å; Q610-L613 PolarHBondContact O-N 3.38Å; L613-R615 VanDerWaalsContact C-N 3.28Å; L613-R615 PolarHBondContact O-N 3.33Å; L613-E616 CarbonylContact O-C 3.31Å; L613-P617 VanDerWaalsContact O-CA 3.25Å; L613-P617 WeakPolarHBondContact O-CA 3.4Å; L613-A622 HydrophobicContact CD2-CB 3.66Å; L613-A622 HydrophobicContact CG-CB 3.8Å; L613-I623 HydrophobicContact CD2-CG1 3.63Å; L613-L626 HydrophobicContact CD1-CD2 3.94Å
614	T	94.2	Very high	93.9	Very high	114 Å²	114	47 Å²	47	70%	0.699	27%	0.269	S	S	*	.	H	α-helix	trans	-65.8	-34.4	173.8	-59.1	0	0	0	0	111.4	Q610 N611 V612	Q610-T614 PolarHBondContact O-N 2.92Å; Q610-T614 PolarHBondContact O-OG1 3.46Å; N611-T614 PolarHBondContact O-N 3.4Å; V612-T614 PolarHBondContact O-N 3.22Å
615	R	93.6	Very high	93.9	Very high	116 Å²	116	45.4 Å²	45.4	44%	0.438	26%	0.256	S	S	.	.	H	α-helix	trans	-90.1	-37.1	177.9	-57.8	-176.6	-54.9	-107.2	0.4	112	D589 V612 L613	D589-R615 IonicContact OD2-CZ 3.92Å; D589-R615 IonicContact OD2-NH1 3.9Å; D589-R615 PolarHBondContact OD2-NH1 3.05Å; D589-R615 IonicContact OD2-NH2 2.95Å; D589-R615 PolarHBondContact OD2-NH2 3.47Å; V612-R615 PolarHBondContact O-N 2.96Å; L613-R615 VanDerWaalsContact C-N 3.28Å; L613-R615 PolarHBondContact O-N 3.33Å
616	E	93	Very high	94	Very high	75 Å²	75	45.5 Å²	45.5	35%	0.35	26%	0.256	S	S	.	.			trans	-130.1	80.2	-175.9	-62.6	175.5	-147	0	0	110.6	T586 V612 L613 A618 N619	T586-E616 WeakPolarHBondContact CB-OE1 3.48Å; T586-E616 PolarHBondContact OG1-OE1 2.79Å; V612-E616 PolarHBondContact O-N 3.2Å; L613-E616 CarbonylContact O-C 3.31Å; E616-A618 PolarHBondContact O-N 3.13Å; E616-N619 HydrophobicContact CB-CB 3.81Å; E616-N619 WeakPolarHBondContact O-CB 3.36Å; E616-N619 PolarHBondContact O-N 3Å; E616-N619 PolarHBondContact OE2-ND2 2.94Å
617	P	92.9	Very high	94	Very high	102 Å²	102	42.3 Å²	42.3	66%	0.662	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-19.9	-173.8	-26.4	35	0	0	0	115.6	L613	L613-P617 VanDerWaalsContact O-CA 3.25Å; L613-P617 WeakPolarHBondContact O-CA 3.4Å
618	A	90.6	Very high	94.1	Very high	69 Å²	69	42 Å²	42	57%	0.57	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-105.9	11.7	180	0	0	0	0	0	113.5	E616 A620	E616-A618 PolarHBondContact O-N 3.13Å; A618-A620 PolarHBondContact O-N 3.43Å; A618-A620 VanDerWaalsContact O-N 3.08Å
619	N	92.3	Very high	94.2	Very high	23 Å²	23	41.1 Å²	41.1	12%	0.123	23%	0.228	C	C	.	.			trans	-65.8	109.1	179.8	-174.8	-64.1	0	0	0	110.6	V612 E616 D621 A622 I623	V612-N619 HydrophobicContact CG1-CB 4.25Å; E616-N619 HydrophobicContact CB-CB 3.81Å; E616-N619 WeakPolarHBondContact O-CB 3.36Å; E616-N619 PolarHBondContact O-N 3Å; E616-N619 PolarHBondContact OE2-ND2 2.94Å; N619-D621 VanDerWaalsContact C-N 3.33Å; N619-D621 PolarHBondContact O-N 2.86Å; N619-D621 PolarHBondContact OD1-N 3.03Å; N619-D621 VanDerWaalsContact OD1-N 3.16Å; N619-A622 HydrophobicContact CB-CB 4.16Å; N619-A622 PolarHBondContact O-N 3.47Å; N619-A622 PolarHBondContact OD1-N 3.18Å; N619-I623 WeakPolarHBondContact O-CG1 3.29Å; N619-I623 PolarHBondContact O-N 3.34Å
620	A	92.5	Very high	94.2	Very high	29 Å²	29	41.4 Å²	41.4	24%	0.24	23%	0.229	C	C	.	.	H	α-helix	trans	-61.5	-38.8	-174.5	0	0	0	0	0	113	A618 I623 L624 L646 T656	A618-A620 PolarHBondContact O-N 3.43Å; A618-A620 VanDerWaalsContact O-N 3.08Å; A620-I623 PolarHBondContact O-N 3Å; A620-L624 WeakPolarHBondContact O-CB 3.46Å; A620-L624 WeakPolarHBondContact O-CG 3.46Å; A620-L624 PolarHBondContact O-N 3.21Å; A620-L646 HydrophobicContact CB-CD1 3.85Å; A620-T656 HydrophobicContact CB-CG2 4.36Å
621	D	92.5	Very high	94.3	Very high	69 Å²	69	37.9 Å²	37.9	37%	0.369	21%	0.213	S	C	.	.	H	α-helix	trans	-66.6	-39.7	-179.9	-72.3	-49.3	0	0	0	112	L590 N619 G625 R659	L590-D621 HydrophobicContact CD1-CB 3.95Å; L590-D621 HydrophobicContact CD2-CB 4.29Å; N619-D621 VanDerWaalsContact C-N 3.33Å; N619-D621 PolarHBondContact O-N 2.86Å; N619-D621 PolarHBondContact OD1-N 3.03Å; N619-D621 VanDerWaalsContact OD1-N 3.16Å; D621-G625 PolarHBondContact O-N 3.42Å; D621-R659 IonicContact OD1-NH1 3.87Å; D621-R659 PolarHBondContact OD1-NH1 3.06Å
622	A	95	Very high	94.2	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-71.1	-38.3	176.9	0	0	0	0	0	112.7	L590 Y609 V612 L613 N619 L626	L590-A622 HydrophobicContact CD2-CB 3.99Å; Y609-A622 HydrophobicContact CD1-CB 4.25Å; V612-A622 HydrophobicContact CB-CB 3.98Å; V612-A622 HydrophobicContact CG1-CB 3.7Å; L613-A622 HydrophobicContact CD2-CB 3.66Å; L613-A622 HydrophobicContact CG-CB 3.8Å; N619-A622 HydrophobicContact CB-CB 4.16Å; N619-A622 PolarHBondContact O-N 3.47Å; N619-A622 PolarHBondContact OD1-N 3.18Å; A622-L626 VanDerWaalsContact O-CB 3.29Å; A622-L626 WeakPolarHBondContact O-CB 3.42Å; A622-L626 PolarHBondContact O-N 3.43Å
623	I	95.7	Very high	94.1	Very high	3 Å²	3	37.9 Å²	37.9	2%	0.015	23%	0.226	C	C	.	.	H	α-helix	trans	-63.3	-46.5	174.6	-66.4	172.5	0	0	0	110.3	L613 N619 A620 T627 Q642 K645 L646	L613-I623 HydrophobicContact CD2-CG1 3.63Å; N619-I623 WeakPolarHBondContact O-CG1 3.29Å; N619-I623 PolarHBondContact O-N 3.34Å; A620-I623 PolarHBondContact O-N 3Å; I623-T627 WeakPolarHBondContact O-CB 3.48Å; I623-T627 PolarHBondContact O-N 3.4Å; I623-T627 PolarHBondContact O-OG1 2.9Å; I623-Q642 WeakPolarHBondContact CG2-O 3.34Å; I623-K645 HydrophobicContact CD1-CB 4.38Å; I623-L646 HydrophobicContact CB-CD1 3.94Å; I623-L646 HydrophobicContact CD1-CD1 4.3Å; I623-L646 HydrophobicContact CG2-CB 4.17Å; I623-L646 HydrophobicContact CG2-CD1 3.86Å
624	L	95.2	Very high	94	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-68.1	-43.8	179.5	-74.3	170.8	0	0	0	112.2	A620 L626 T627 E628 L643 L646 T656 R659 V660	A620-L624 WeakPolarHBondContact O-CB 3.46Å; A620-L624 WeakPolarHBondContact O-CG 3.46Å; A620-L624 PolarHBondContact O-N 3.21Å; L624-L626 VanDerWaalsContact C-N 3.33Å; L624-L626 PolarHBondContact O-N 3.26Å; L624-T627 WeakPolarHBondContact O-CB 3.29Å; L624-T627 PolarHBondContact O-N 3.31Å; L624-T627 VanDerWaalsContact O-N 3.14Å; L624-E628 VanDerWaalsContact O-CG 3.28Å; L624-E628 WeakPolarHBondContact O-CG 3.42Å; L624-E628 PolarHBondContact O-N 3.16Å; L624-L643 HydrophobicContact CD2-CD1 3.99Å; L624-L646 HydrophobicContact CD2-CD2 4.13Å; L624-L646 HydrophobicContact CG-CD1 4.1Å; L624-L646 HydrophobicContact CG-CD2 4.35Å; L624-T656 HydrophobicContact CD1-CG2 3.77Å; L624-R659 HydrophobicContact CD1-CB 3.97Å; L624-R659 HydrophobicContact CD2-CB 4.49Å; L624-V660 HydrophobicContact CD1-CG2 4.37Å; L624-V660 HydrophobicContact CD2-CG2 3.78Å
625	G	94.8	Very high	93.9	Very high	0 Å²	0	37 Å²	37	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-60.3	-43.2	176.4	0	0	0	0	0	112.1	Y609 D621 T627 E628 V629	Y609-G625 WeakPolarHBondContact CE2-O 3.41Å; Y609-G625 VanDerWaalsContact CZ-CA 3.48Å; D621-G625 PolarHBondContact O-N 3.42Å; G625-T627 VanDerWaalsContact C-N 3.34Å; G625-T627 PolarHBondContact O-N 3.37Å; G625-E628 PolarHBondContact O-N 3.5Å; G625-V629 WeakPolarHBondContact O-CG2 3.37Å; G625-V629 PolarHBondContact O-N 2.67Å
626	L	96.2	Very high	94	Very high	2 Å²	2	36.6 Å²	36.6	1%	0.01	23%	0.232	C	C	.	.	H	α-helix	trans	-63.6	-39.8	174.3	-172.8	60.6	0	0	0	112.2	R606 Y609 Q610 L613 A622 L624 V629 D630 Q642	R606-L626 HydrophobicContact CB-CD1 4.11Å; R606-L626 HydrophobicContact CG-CD1 3.71Å; Y609-L626 HydrophobicContact CD2-CB 4.34Å; Y609-L626 HydrophobicContact CG-CB 4.4Å; Q610-L626 HydrophobicContact CG-CD2 4.41Å; L613-L626 HydrophobicContact CD1-CD2 3.94Å; A622-L626 VanDerWaalsContact O-CB 3.29Å; A622-L626 WeakPolarHBondContact O-CB 3.42Å; A622-L626 PolarHBondContact O-N 3.43Å; L624-L626 VanDerWaalsContact C-N 3.33Å; L624-L626 PolarHBondContact O-N 3.26Å; L626-V629 PolarHBondContact O-N 3.45Å; L626-D630 WeakPolarHBondContact O-CB 3.45Å; L626-D630 PolarHBondContact O-N 3.21Å; L626-Q642 VanDerWaalsContact CD2-CD 3.49Å; L626-Q642 HydrophobicContact CD2-CG 3.97Å; L626-Q642 HydrophobicContact CG-CG 4.02Å
627	T	96.1	Very high	94	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-60.1	-46.7	174.1	-57.7	0	0	0	0	111.3	I623 L624 G625 D630 I631 A639 Q642 L643 A663	I623-T627 WeakPolarHBondContact O-CB 3.48Å; I623-T627 PolarHBondContact O-N 3.4Å; I623-T627 PolarHBondContact O-OG1 2.9Å; L624-T627 WeakPolarHBondContact O-CB 3.29Å; L624-T627 PolarHBondContact O-N 3.31Å; L624-T627 VanDerWaalsContact O-N 3.14Å; G625-T627 VanDerWaalsContact C-N 3.34Å; G625-T627 PolarHBondContact O-N 3.37Å; T627-D630 PolarHBondContact O-N 3.02Å; T627-I631 HydrophobicContact CG2-CD1 4.06Å; T627-I631 VanDerWaalsContact O-CG1 3.31Å; T627-I631 WeakPolarHBondContact O-CG1 3.44Å; T627-I631 PolarHBondContact O-N 2.91Å; T627-A639 HydrophobicContact CG2-CB 4.17Å; T627-Q642 WeakPolarHBondContact OG1-CB 3.5Å; T627-L643 HydrophobicContact CG2-CB 4.04Å; T627-L643 PolarHBondContact OG1-N 3.28Å; T627-A663 HydrophobicContact CG2-CB 4.13Å
628	E	95.5	Very high	94.1	Very high	39 Å²	39	32.7 Å²	32.7	18%	0.182	22%	0.221	C	C	.	.	H	α-helix	trans	-64.8	-38.4	179.5	-70.3	161.5	-175.5	0	0	111.7	L624 G625 A632 R659	L624-E628 VanDerWaalsContact O-CG 3.28Å; L624-E628 WeakPolarHBondContact O-CG 3.42Å; L624-E628 PolarHBondContact O-N 3.16Å; G625-E628 PolarHBondContact O-N 3.5Å; E628-A632 WeakPolarHBondContact O-CB 3.47Å; E628-A632 PolarHBondContact O-N 3.33Å; E628-R659 VanDerWaalsContact CD-NH2 3.27Å; E628-R659 IonicContact OE1-CZ 2.79Å; E628-R659 IonicContact OE1-NE 3.5Å; E628-R659 PolarHBondContact OE1-NE 3.42Å; E628-R659 IonicContact OE1-NH2 3.35Å; E628-R659 PolarHBondContact OE1-NH2 3.17Å; E628-R659 VanDerWaalsContact OE1-NH2 3.1Å; E628-R659 IonicContact OE2-CZ 2.86Å; E628-R659 IonicContact OE2-NE 3.8Å; E628-R659 IonicContact OE2-NH2 3.73Å; E628-R659 PolarHBondContact OE2-NH2 3.45Å
629	V	96.1	Very high	94.4	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-64.1	-44.4	172.9	170	0	0	0	0	111.4	Q597 Y602 A605 R606 Y609 G625 L626 A632 A633	Q597-V629 HydrophobicContact CB-CG2 4.06Å; Q597-V629 HydrophobicContact CG-CG2 3.83Å; Y602-V629 HydrophobicContact CD1-CG1 3.97Å; Y602-V629 HydrophobicContact CG-CG1 4.28Å; A605-V629 HydrophobicContact CB-CG1 4.35Å; A605-V629 HydrophobicContact CB-CG2 3.74Å; R606-V629 HydrophobicContact CG-CG1 3.74Å; Y609-V629 HydrophobicContact CD2-CG2 4.25Å; Y609-V629 HydrophobicContact CE2-CG2 3.76Å; G625-V629 WeakPolarHBondContact O-CG2 3.37Å; G625-V629 PolarHBondContact O-N 2.67Å; L626-V629 PolarHBondContact O-N 3.45Å; V629-A632 PolarHBondContact O-N 3.13Å; V629-A633 VanDerWaalsContact O-CB 3.32Å; V629-A633 WeakPolarHBondContact O-CB 3.38Å; V629-A633 PolarHBondContact O-N 3.17Å
630	D	96.3	Very high	94.5	Very high	6 Å²	6	33.7 Å²	33.7	3%	0.032	21%	0.208	C	C	.	.	H	α-helix	trans	-65.2	-38.7	178.9	-74.2	-23.3	0	0	0	112	R606 L626 T627 A633 G634 D635 A638 A639	R606-D630 IonicContact CZ-OD1 3.88Å; R606-D630 IonicContact NE-OD1 2.82Å; R606-D630 PolarHBondContact NE-OD1 3.3Å; R606-D630 IonicContact NH2-OD1 3.53Å; R606-D630 PolarHBondContact NH2-OD1 3.2Å; L626-D630 WeakPolarHBondContact O-CB 3.45Å; L626-D630 PolarHBondContact O-N 3.21Å; T627-D630 PolarHBondContact O-N 3.02Å; D630-A633 PolarHBondContact O-N 3.34Å; D630-G634 PolarHBondContact O-N 3.11Å; D630-D635 CarbonylContact O-C 3.55Å; D630-D635 PolarHBondContact O-N 2.93Å; D630-A638 HydrophobicContact CB-CB 4.2Å; D630-A638 WeakPolarHBondContact OD2-CB 3.33Å; D630-A639 HydrophobicContact CB-CB 3.75Å
631	I	95.2	Very high	94.7	Very high	24 Å²	24	35.4 Å²	35.4	12%	0.123	22%	0.219	C	C	.	.	H	α-helix	trans	-60.5	-50.2	171.4	-68.6	166.6	0	0	0	110.6	T627 A633 G634 A639 A663 Q666 L667	T627-I631 HydrophobicContact CG2-CD1 4.06Å; T627-I631 VanDerWaalsContact O-CG1 3.31Å; T627-I631 WeakPolarHBondContact O-CG1 3.44Å; T627-I631 PolarHBondContact O-N 2.91Å; I631-A633 VanDerWaalsContact C-N 3.29Å; I631-A633 PolarHBondContact O-N 3.29Å; I631-G634 PolarHBondContact O-N 2.87Å; I631-A639 HydrophobicContact CD1-CB 4.48Å; I631-A639 HydrophobicContact CG1-CB 3.65Å; I631-A663 HydrophobicContact CD1-CB 3.99Å; I631-Q666 HydrophobicContact CD1-CB 4.19Å; I631-Q666 HydrophobicContact CG2-CB 3.87Å; I631-L667 HydrophobicContact CD1-CD1 4.3Å; I631-L667 HydrophobicContact CD1-CD2 4.26Å; I631-L667 HydrophobicContact CD1-CG 3.94Å; I631-L667 HydrophobicContact CG1-CD2 3.85Å; I631-L667 HydrophobicContact CG1-CG 4.1Å
632	A	91.8	Very high	94.7	Very high	50 Å²	50	33.4 Å²	33.4	41%	0.413	21%	0.207	S	C	.	.	H	α-helix	trans	-65	-32.1	-177.9	0	0	0	0	0	112.9	Y602 E628 V629 G634	Y602-A632 HydrophobicContact CE1-CB 3.67Å; E628-A632 WeakPolarHBondContact O-CB 3.47Å; E628-A632 PolarHBondContact O-N 3.33Å; V629-A632 PolarHBondContact O-N 3.13Å; A632-G634 VanDerWaalsContact C-N 3.25Å; A632-G634 PolarHBondContact O-N 2.65Å
633	A	92.1	Very high	94.6	Very high	44 Å²	44	34.7 Å²	34.7	36%	0.364	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-6.3	173.9	0	0	0	0	0	113.7	Y602 V629 D630 I631	Y602-A633 HydrophobicContact CD2-CB 3.89Å; Y602-A633 HydrophobicContact CE2-CB 4.41Å; Y602-A633 HydrophobicContact CG-CB 4.13Å; V629-A633 VanDerWaalsContact O-CB 3.32Å; V629-A633 WeakPolarHBondContact O-CB 3.38Å; V629-A633 PolarHBondContact O-N 3.17Å; D630-A633 PolarHBondContact O-N 3.34Å; I631-A633 VanDerWaalsContact C-N 3.29Å; I631-A633 PolarHBondContact O-N 3.29Å
634	G	91.6	Very high	94.5	Very high	56 Å²	56	38.6 Å²	38.6	58%	0.577	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	85.3	2.2	-179.3	0	0	0	0	0	115.2	D630 I631 A632 K636	D630-G634 PolarHBondContact O-N 3.11Å; I631-G634 PolarHBondContact O-N 2.87Å; A632-G634 VanDerWaalsContact C-N 3.25Å; A632-G634 PolarHBondContact O-N 2.65Å; G634-K636 PolarHBondContact O-N 3.49Å; G634-K636 VanDerWaalsContact O-N 3.13Å
635	D	94.1	Very high	94.4	Very high	71 Å²	71	44.2 Å²	44.2	38%	0.38	27%	0.271	S	S	.	.			trans	-87.9	74.4	178.5	-166.7	-16	0	0	0	111.4	D630 A637 A638 A639	D630-D635 CarbonylContact O-C 3.55Å; D630-D635 PolarHBondContact O-N 2.93Å; D635-A637 PolarHBondContact O-N 3.14Å; D635-A637 PolarHBondContact OD1-N 2.93Å; D635-A638 HydrophobicContact CB-CB 4.14Å; D635-A638 PolarHBondContact O-N 2.86Å; D635-A638 WeakPolarHBondContact OD1-CB 3.3Å; D635-A638 PolarHBondContact OD1-N 3.26Å; D635-A638 WeakPolarHBondContact OD2-CB 3.44Å; D635-A639 PolarHBondContact O-N 3.14Å; D635-A639 VanDerWaalsContact O-N 3.08Å
636	K	94.1	Very high	94.2	Very high	106 Å²	106	45.5 Å²	45.5	46%	0.461	28%	0.278	S	S	.	.	H	α-helix	trans	-62.2	-25.6	-179.9	-63.6	-171.4	178.5	-170.9	0	113.2	G634 R640 L667	G634-K636 PolarHBondContact O-N 3.49Å; G634-K636 VanDerWaalsContact O-N 3.13Å; K636-R640 WeakPolarHBondContact O-CG 3.32Å; K636-R640 PolarHBondContact O-N 3.31Å; K636-R640 VanDerWaalsContact O-N 3.13Å; K636-L667 HydrophobicContact CB-CD2 3.98Å; K636-L667 HydrophobicContact CG-CD2 4.21Å
637	A	94.6	Very high	93.6	Very high	71 Å²	71	48.5 Å²	48.5	59%	0.587	30%	0.297	S	S	*	.	H	α-helix	trans	-73.8	-46.9	-179.8	0	0	0	0	0	110.9	D635 A639 R640 S641	D635-A637 PolarHBondContact O-N 3.14Å; D635-A637 PolarHBondContact OD1-N 2.93Å; A637-A639 VanDerWaalsContact C-N 3.35Å; A637-R640 PolarHBondContact O-N 3.45Å; A637-S641 PolarHBondContact O-N 3.33Å; A637-S641 VanDerWaalsContact O-N 3.14Å
638	A	94.7	Very high	92.8	Very high	24 Å²	24	53 Å²	53	20%	0.198	34%	0.335	C	S	.	.	H	α-helix	trans	-59.4	-47.3	173.1	0	0	0	0	0	110.9	D630 D635 R640 S641 Q642	D630-A638 HydrophobicContact CB-CB 4.2Å; D630-A638 WeakPolarHBondContact OD2-CB 3.33Å; D635-A638 HydrophobicContact CB-CB 4.14Å; D635-A638 PolarHBondContact O-N 2.86Å; D635-A638 WeakPolarHBondContact OD1-CB 3.3Å; D635-A638 PolarHBondContact OD1-N 3.26Å; D635-A638 WeakPolarHBondContact OD2-CB 3.44Å; A638-R640 PolarHBondContact O-N 2.88Å; A638-S641 CarbonylContact O-C 3.47Å; A638-S641 WeakPolarHBondContact O-CA 3.46Å; A638-S641 WeakPolarHBondContact O-CB 3.41Å; A638-S641 PolarHBondContact O-N 3.22Å; A638-Q642 WeakPolarHBondContact O-CG 3.04Å; A638-Q642 PolarHBondContact O-N 3.44Å
639	A	95.7	Very high	91.6	Very high	0 Å²	0	53 Å²	53	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-55.6	-45.8	178.3	0	0	0	0	0	113.2	T627 D630 I631 D635 A637 S641 Q642 L643 L667	T627-A639 HydrophobicContact CG2-CB 4.17Å; D630-A639 HydrophobicContact CB-CB 3.75Å; I631-A639 HydrophobicContact CD1-CB 4.48Å; I631-A639 HydrophobicContact CG1-CB 3.65Å; D635-A639 PolarHBondContact O-N 3.14Å; D635-A639 VanDerWaalsContact O-N 3.08Å; A637-A639 VanDerWaalsContact C-N 3.35Å; A639-S641 VanDerWaalsContact C-N 3.31Å; A639-S641 PolarHBondContact O-N 3.07Å; A639-Q642 PolarHBondContact O-N 3.01Å; A639-L643 WeakPolarHBondContact O-CB 3.48Å; A639-L643 PolarHBondContact O-N 3.46Å; A639-L667 HydrophobicContact CB-CD1 4.4Å; A639-L667 HydrophobicContact CB-CD2 3.75Å
640	R	95.7	Very high	90.4	Very high	113 Å²	113	58.5 Å²	58.5	43%	0.426	37%	0.367	S	S	.	.	H	α-helix	trans	-61.1	-40	174.8	-76.1	-175.5	-173.9	115.3	-1.6	112.4	K636 A637 A638 A644 L667	K636-R640 WeakPolarHBondContact O-CG 3.32Å; K636-R640 PolarHBondContact O-N 3.31Å; K636-R640 VanDerWaalsContact O-N 3.13Å; A637-R640 PolarHBondContact O-N 3.45Å; A638-R640 PolarHBondContact O-N 2.88Å; R640-A644 WeakPolarHBondContact O-CB 3.41Å; R640-A644 PolarHBondContact O-N 2.78Å; R640-A644 VanDerWaalsContact O-N 3.12Å; R640-L667 HydrophobicContact CG-CD1 3.95Å; R640-L667 HydrophobicContact CG-CD2 4.17Å; R640-L667 HydrophobicContact CG-CG 4.5Å; R640-L667 PolarHBondContact NH2-O 3.24Å
641	S	94.9	Very high	89.3	Confident	66 Å²	66	66.2 Å²	66.2	46%	0.462	41%	0.408	S	S	.	.	H	α-helix	trans	-65.7	-38.5	177.3	-176.6	0	0	0	0	112.3	A637 A638 A639	A637-S641 PolarHBondContact O-N 3.33Å; A637-S641 VanDerWaalsContact O-N 3.14Å; A638-S641 CarbonylContact O-C 3.47Å; A638-S641 WeakPolarHBondContact O-CA 3.46Å; A638-S641 WeakPolarHBondContact O-CB 3.41Å; A638-S641 PolarHBondContact O-N 3.22Å; A639-S641 VanDerWaalsContact C-N 3.31Å; A639-S641 PolarHBondContact O-N 3.07Å
642	Q	94.4	Very high	88.7	Confident	27 Å²	27	66.5 Å²	66.5	13%	0.126	41%	0.414	C	S	.	.	H	α-helix	trans	-69.3	-47.2	176.3	-58.9	-55.7	-8.4	0	0	111.4	I623 L626 T627 A638 A639 A644 K645	I623-Q642 WeakPolarHBondContact CG2-O 3.34Å; L626-Q642 VanDerWaalsContact CD2-CD 3.49Å; L626-Q642 HydrophobicContact CD2-CG 3.97Å; L626-Q642 HydrophobicContact CG-CG 4.02Å; T627-Q642 WeakPolarHBondContact OG1-CB 3.5Å; A638-Q642 WeakPolarHBondContact O-CG 3.04Å; A638-Q642 PolarHBondContact O-N 3.44Å; A639-Q642 PolarHBondContact O-N 3.01Å; Q642-A644 PolarHBondContact O-N 2.89Å; Q642-K645 WeakPolarHBondContact O-CB 3.42Å; Q642-K645 PolarHBondContact O-N 2.94Å
643	L	92.9	Very high	88.5	Confident	26 Å²	26	67 Å²	67	14%	0.136	41%	0.414	C	S	.	.	H	α-helix	trans	-58.8	-35.5	179.7	-172	59.9	0	0	0	112.1	L624 T627 A639 K645 L646 V660 A663 Q664 L667	L624-L643 HydrophobicContact CD2-CD1 3.99Å; T627-L643 HydrophobicContact CG2-CB 4.04Å; T627-L643 PolarHBondContact OG1-N 3.28Å; A639-L643 WeakPolarHBondContact O-CB 3.48Å; A639-L643 PolarHBondContact O-N 3.46Å; L643-K645 PolarHBondContact O-N 3.43Å; L643-L646 HydrophobicContact CD1-CD2 4.43Å; L643-L646 VanDerWaalsContact O-CB 3.25Å; L643-L646 WeakPolarHBondContact O-CB 3.32Å; L643-L646 PolarHBondContact O-N 2.91Å; L643-L646 VanDerWaalsContact O-N 3.15Å; L643-V660 HydrophobicContact CD1-CG1 4.48Å; L643-V660 HydrophobicContact CD1-CG2 4.46Å; L643-A663 HydrophobicContact CD2-CB 4.38Å; L643-Q664 HydrophobicContact CD2-CG 4.08Å; L643-L667 HydrophobicContact CD2-CD1 4.08Å
644	A	92.2	Very high	88.3	Confident	85 Å²	85	65.4 Å²	65.4	70%	0.702	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-17.4	176.2	0	0	0	0	0	114.4	R640 Q642 L646	R640-A644 WeakPolarHBondContact O-CB 3.41Å; R640-A644 PolarHBondContact O-N 2.78Å; R640-A644 VanDerWaalsContact O-N 3.12Å; Q642-A644 PolarHBondContact O-N 2.89Å; A644-L646 VanDerWaalsContact C-N 3.33Å
645	K	92.9	Very high	88.2	Confident	119 Å²	119	64.9 Å²	64.9	52%	0.517	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.2	-11.1	175.4	-62	171.3	-169.9	169.4	0	112.9	I623 Q642 L643	I623-K645 HydrophobicContact CD1-CB 4.38Å; Q642-K645 WeakPolarHBondContact O-CB 3.42Å; Q642-K645 PolarHBondContact O-N 2.94Å; L643-K645 PolarHBondContact O-N 3.43Å
646	L	90.5	Very high	88	Confident	26 Å²	26	62.1 Å²	62.1	14%	0.136	37%	0.369	C	S	.	.	S	Bend	trans	-64.4	128.8	-178	-163.9	72.9	0	0	0	109.8	A620 I623 L624 L643 A644 T649 V660	A620-L646 HydrophobicContact CB-CD1 3.85Å; I623-L646 HydrophobicContact CB-CD1 3.94Å; I623-L646 HydrophobicContact CD1-CD1 4.3Å; I623-L646 HydrophobicContact CG2-CB 4.17Å; I623-L646 HydrophobicContact CG2-CD1 3.86Å; L624-L646 HydrophobicContact CD2-CD2 4.13Å; L624-L646 HydrophobicContact CG-CD1 4.1Å; L624-L646 HydrophobicContact CG-CD2 4.35Å; L643-L646 HydrophobicContact CD1-CD2 4.43Å; L643-L646 VanDerWaalsContact O-CB 3.25Å; L643-L646 WeakPolarHBondContact O-CB 3.32Å; L643-L646 PolarHBondContact O-N 2.91Å; L643-L646 VanDerWaalsContact O-N 3.15Å; A644-L646 VanDerWaalsContact C-N 3.33Å; L646-T649 HydrophobicContact CD2-CG2 3.58Å; L646-T649 HydrophobicContact CG-CG2 4.16Å; L646-V660 HydrophobicContact CD2-CG2 3.33Å
647	P	84.6	Confident	88	Confident	65 Å²	65	57.6 Å²	57.6	42%	0.422	35%	0.35	S	S	.	.	P	Polyproline II helix	trans	-62.7	159.7	176.2	25.2	-32.7	0	0	0	111.4	T649	P647-T649 WeakPolarHBondContact O-CG2 3.41Å; P647-T649 PolarHBondContact O-N 2.89Å; P647-T649 VanDerWaalsContact O-N 3.16Å
648	A	79	Confident	88	Confident	95 Å²	95	55.7 Å²	55.7	79%	0.785	33%	0.328	S	S	*	.	P	Polyproline II helix	trans	-52	121.8	-178.3	0	0	0	0	0	111.7	D650	A648-D650 PolarHBondContact O-N 3.48Å
649	T	71.1	Confident	88	Confident	38 Å²	38	55.8 Å²	55.8	23%	0.233	32%	0.323	C	S	.	.			trans	-91.3	11.3	-168.9	56.6	0	0	0	0	114.1	L646 P647 N651 A652 V660	L646-T649 HydrophobicContact CD2-CG2 3.58Å; L646-T649 HydrophobicContact CG-CG2 4.16Å; P647-T649 WeakPolarHBondContact O-CG2 3.41Å; P647-T649 PolarHBondContact O-N 2.89Å; P647-T649 VanDerWaalsContact O-N 3.16Å; T649-N651 PolarHBondContact O-N 2.93Å; T649-A652 HydrophobicContact CG2-CB 4.37Å; T649-A652 VanDerWaalsContact O-CB 3.31Å; T649-A652 WeakPolarHBondContact O-CB 3.37Å; T649-A652 PolarHBondContact O-N 3.48Å; T649-V660 HydrophobicContact CG2-CG2 4.39Å
650	D	69.7	Low	87.9	Confident	116 Å²	116	56.2 Å²	56.2	62%	0.62	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-31	-173.4	-75.3	-40	0	0	0	113.4	A648 K679	A648-D650 PolarHBondContact O-N 3.48Å; D650-K679 IonicContact OD1-NZ 3.2Å
651	N	73.8	Confident	87.9	Confident	168 Å²	168	50.9 Å²	50.9	90%	0.898	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.7	10.7	174.3	-67.7	-18.7	0	0	0	113.2	T649	T649-N651 PolarHBondContact O-N 2.93Å
652	A	83	Confident	87.9	Confident	30 Å²	30	49.9 Å²	49.9	25%	0.248	30%	0.295	C	S	.	.	S	Bend	trans	-75.6	157.4	-179.5	0	0	0	0	0	111.6	T649 T656 Q657	T649-A652 HydrophobicContact CG2-CB 4.37Å; T649-A652 VanDerWaalsContact O-CB 3.31Å; T649-A652 WeakPolarHBondContact O-CB 3.37Å; T649-A652 PolarHBondContact O-N 3.48Å; A652-T656 HydrophobicContact CB-CG2 3.97Å; A652-Q657 HydrophobicContact CB-CG 4.29Å; A652-Q657 PolarHBondContact O-NE2 3.07Å
653	S	86.2	Confident	87.9	Confident	60 Å²	60	48.7 Å²	48.7	42%	0.42	29%	0.289	S	S	.	.			trans	-57.8	155	175.7	63.1	0	0	0	0	112.1	N655 T656 Q657	S653-N655 PolarHBondContact O-N 3.33Å; S653-T656 WeakPolarHBondContact O-CB 3.43Å; S653-T656 PolarHBondContact O-N 3.05Å; S653-T656 VanDerWaalsContact O-N 3.08Å; S653-T656 PolarHBondContact OG-N 3.48Å; S653-T656 PolarHBondContact OG-OG1 2.97Å; S653-Q657 PolarHBondContact O-N 3.29Å; S653-Q657 VanDerWaalsContact O-N 3.1Å
654	L	88.1	Confident	88	Confident	12 Å²	12	49 Å²	49	6%	0.063	29%	0.29	C	S	.	.	H	α-helix	trans	-57.6	-38.4	177.4	-72.3	178.4	0	0	0	110.8	T656 Q657 R658 L680 Q683 Q687 E692 V696	L654-T656 PolarHBondContact O-N 3.2Å; L654-Q657 PolarHBondContact O-N 2.7Å; L654-R658 WeakPolarHBondContact O-CB 3.37Å; L654-R658 PolarHBondContact O-N 3.32Å; L654-L680 HydrophobicContact CD2-CD2 3.56Å; L654-Q683 HydrophobicContact CD2-CB 4.09Å; L654-Q687 VanDerWaalsContact CD1-CD 3.5Å; L654-E692 HydrophobicContact CB-CG 3.92Å; L654-E692 WeakPolarHBondContact CB-OE1 3.5Å; L654-E692 PolarHBondContact N-OE1 2.92Å; L654-E692 VanDerWaalsContact N-OE1 3.14Å; L654-V696 HydrophobicContact CB-CG2 4.11Å
655	N	89.7	Confident	88.1	Confident	44 Å²	44	46 Å²	46	24%	0.235	27%	0.266	C	S	.	.	H	α-helix	trans	-62.7	-40.3	177	-172.8	48.1	0	0	0	112.8	S653 R658 R659 E692	S653-N655 PolarHBondContact O-N 3.33Å; N655-R658 WeakPolarHBondContact O-CB 3.24Å; N655-R658 PolarHBondContact O-N 2.9Å; N655-R658 VanDerWaalsContact OD1-CZ 3.32Å; N655-R658 PolarHBondContact OD1-NE 2.89Å; N655-R658 PolarHBondContact OD1-NH2 3.44Å; N655-R659 WeakPolarHBondContact O-CG 3.46Å; N655-R659 PolarHBondContact O-N 3.2Å; N655-E692 HydrophobicContact CB-CG 4.23Å; N655-E692 WeakPolarHBondContact CB-OE1 3.34Å; N655-E692 PolarHBondContact N-OE1 3.3Å
656	T	90.9	Very high	88.1	Confident	13 Å²	13	45.3 Å²	45.3	8%	0.08	26%	0.264	C	S	.	.	H	α-helix	trans	-63.9	-47.9	176.8	-56.6	0	0	0	0	110.2	A620 L624 A652 S653 L654 R658 R659 V660	A620-T656 HydrophobicContact CB-CG2 4.36Å; L624-T656 HydrophobicContact CD1-CG2 3.77Å; A652-T656 HydrophobicContact CB-CG2 3.97Å; S653-T656 WeakPolarHBondContact O-CB 3.43Å; S653-T656 PolarHBondContact O-N 3.05Å; S653-T656 VanDerWaalsContact O-N 3.08Å; S653-T656 PolarHBondContact OG-N 3.48Å; S653-T656 PolarHBondContact OG-OG1 2.97Å; L654-T656 PolarHBondContact O-N 3.2Å; T656-R658 VanDerWaalsContact C-N 3.32Å; T656-R658 PolarHBondContact O-N 3.14Å; T656-R659 PolarHBondContact O-N 2.88Å; T656-V660 WeakPolarHBondContact O-CG2 3.31Å; T656-V660 PolarHBondContact O-N 2.92Å
657	Q	92.9	Very high	88.3	Confident	12 Å²	12	44.2 Å²	44.2	6%	0.056	26%	0.258	C	S	.	.	H	α-helix	trans	-64.4	-36.3	178.7	-64.4	-178	57	0	0	111.9	A652 S653 L654 V660 A661 T676 L680	A652-Q657 HydrophobicContact CB-CG 4.29Å; A652-Q657 PolarHBondContact O-NE2 3.07Å; S653-Q657 PolarHBondContact O-N 3.29Å; S653-Q657 VanDerWaalsContact O-N 3.1Å; L654-Q657 PolarHBondContact O-N 2.7Å; Q657-V660 WeakPolarHBondContact O-CB 3.48Å; Q657-V660 PolarHBondContact O-N 2.94Å; Q657-A661 PolarHBondContact O-N 2.89Å; Q657-T676 HydrophobicContact CB-CG2 4.46Å; Q657-L680 HydrophobicContact CB-CD1 3.74Å; Q657-L680 HydrophobicContact CB-CD2 3.59Å; Q657-L680 HydrophobicContact CB-CG 4.15Å; Q657-L680 HydrophobicContact CG-CD2 4.32Å
658	R	94.6	Very high	88.6	Confident	30 Å²	30	43.5 Å²	43.5	11%	0.113	26%	0.263	C	S	.	.	H	α-helix	trans	-58.7	-50.5	172.4	179.3	-167.5	68.2	97.8	1.7	111.4	L654 N655 T656 V660 A661 L662 L680 V696 D699	L654-R658 WeakPolarHBondContact O-CB 3.37Å; L654-R658 PolarHBondContact O-N 3.32Å; N655-R658 WeakPolarHBondContact O-CB 3.24Å; N655-R658 PolarHBondContact O-N 2.9Å; N655-R658 VanDerWaalsContact OD1-CZ 3.32Å; N655-R658 PolarHBondContact OD1-NE 2.89Å; N655-R658 PolarHBondContact OD1-NH2 3.44Å; T656-R658 VanDerWaalsContact C-N 3.32Å; T656-R658 PolarHBondContact O-N 3.14Å; R658-V660 VanDerWaalsContact C-N 3.31Å; R658-V660 PolarHBondContact O-N 3.31Å; R658-A661 PolarHBondContact O-N 3.37Å; R658-A661 VanDerWaalsContact O-N 3.16Å; R658-L662 HydrophobicContact CG-CD1 4.27Å; R658-L662 WeakPolarHBondContact O-CG 3.2Å; R658-L662 PolarHBondContact O-N 3.1Å; R658-L680 HydrophobicContact CB-CD1 4.47Å; R658-V696 HydrophobicContact CB-CG2 4.16Å; R658-V696 HydrophobicContact CG-CG2 4.44Å; R658-D699 WeakPolarHBondContact CD-OD2 3.42Å; R658-D699 HydrophobicContact CG-CB 4.42Å; R658-D699 IonicContact CZ-OD2 3.29Å; R658-D699 IonicContact NE-OD2 3.77Å; R658-D699 IonicContact NH1-OD2 2.79Å; R658-D699 PolarHBondContact NH1-OD2 3.02Å
659	R	94.7	Very high	89.3	Confident	26 Å²	26	42.1 Å²	42.1	10%	0.098	24%	0.242	C	C	.	.	H	α-helix	trans	-60.7	-40.3	178.7	-71.9	175.9	70.7	-172.3	8.9	111.8	D621 L624 E628 N655 T656 L662 A663	D621-R659 IonicContact OD1-NH1 3.87Å; D621-R659 PolarHBondContact OD1-NH1 3.06Å; L624-R659 HydrophobicContact CD1-CB 3.97Å; L624-R659 HydrophobicContact CD2-CB 4.49Å; E628-R659 VanDerWaalsContact CD-NH2 3.27Å; E628-R659 IonicContact OE1-CZ 2.79Å; E628-R659 IonicContact OE1-NE 3.5Å; E628-R659 PolarHBondContact OE1-NE 3.42Å; E628-R659 IonicContact OE1-NH2 3.35Å; E628-R659 PolarHBondContact OE1-NH2 3.17Å; E628-R659 VanDerWaalsContact OE1-NH2 3.1Å; E628-R659 IonicContact OE2-CZ 2.86Å; E628-R659 IonicContact OE2-NE 3.8Å; E628-R659 IonicContact OE2-NH2 3.73Å; E628-R659 PolarHBondContact OE2-NH2 3.45Å; N655-R659 WeakPolarHBondContact O-CG 3.46Å; N655-R659 PolarHBondContact O-N 3.2Å; T656-R659 PolarHBondContact O-N 2.88Å; R659-L662 PolarHBondContact O-N 3.1Å; R659-A663 WeakPolarHBondContact O-CB 3.38Å; R659-A663 PolarHBondContact O-N 3.49Å
660	V	94.4	Very high	90.3	Very high	10 Å²	10	43.6 Å²	43.6	6%	0.061	25%	0.252	C	S	.	.	H	α-helix	trans	-58.6	-48.7	172.7	171.5	0	0	0	0	111.3	L624 L643 L646 T649 T656 Q657 R658 L662 A663 Q664	L624-V660 HydrophobicContact CD1-CG2 4.37Å; L624-V660 HydrophobicContact CD2-CG2 3.78Å; L643-V660 HydrophobicContact CD1-CG1 4.48Å; L643-V660 HydrophobicContact CD1-CG2 4.46Å; L646-V660 HydrophobicContact CD2-CG2 3.33Å; T649-V660 HydrophobicContact CG2-CG2 4.39Å; T656-V660 WeakPolarHBondContact O-CG2 3.31Å; T656-V660 PolarHBondContact O-N 2.92Å; Q657-V660 WeakPolarHBondContact O-CB 3.48Å; Q657-V660 PolarHBondContact O-N 2.94Å; R658-V660 VanDerWaalsContact C-N 3.31Å; R658-V660 PolarHBondContact O-N 3.31Å; V660-L662 VanDerWaalsContact C-N 3.33Å; V660-L662 PolarHBondContact O-N 2.93Å; V660-A663 PolarHBondContact O-N 3.28Å; V660-Q664 HydrophobicContact CG1-CG 4.37Å; V660-Q664 WeakPolarHBondContact O-CB 3.49Å; V660-Q664 VanDerWaalsContact O-CG 3.25Å; V660-Q664 WeakPolarHBondContact O-CG 3.45Å; V660-Q664 PolarHBondContact O-N 3.22Å
661	A	94.4	Very high	91.5	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-62	-40.5	179.8	0	0	0	0	0	112.2	Q657 R658 Q664 A665 A673 T676 F677	Q657-A661 PolarHBondContact O-N 2.89Å; R658-A661 PolarHBondContact O-N 3.37Å; R658-A661 VanDerWaalsContact O-N 3.16Å; A661-Q664 PolarHBondContact O-N 3.07Å; A661-A665 WeakPolarHBondContact O-CB 3.37Å; A661-A665 PolarHBondContact O-N 3.3Å; A661-A673 WeakPolarHBondContact O-CB 3.45Å; A661-T676 HydrophobicContact CB-CG2 3.78Å; A661-F677 HydrophobicContact CB-CD1 4.46Å; A661-F677 HydrophobicContact CB-CD2 3.77Å; A661-F677 HydrophobicContact CB-CE1 4.2Å; A661-F677 HydrophobicContact CB-CE2 3.47Å; A661-F677 VanDerWaalsContact CB-CE2 3.47Å; A661-F677 HydrophobicContact CB-CG 4.27Å; A661-F677 HydrophobicContact CB-CZ 3.7Å
662	L	95.4	Very high	92.4	Very high	45 Å²	45	34.1 Å²	34.1	24%	0.236	21%	0.213	C	C	.	.	H	α-helix	trans	-64	-45.3	175	-73.5	173.3	0	0	0	112.2	R658 R659 V660 Q664 A665 Q666 F677 D699	R658-L662 HydrophobicContact CG-CD1 4.27Å; R658-L662 WeakPolarHBondContact O-CG 3.2Å; R658-L662 PolarHBondContact O-N 3.1Å; R659-L662 PolarHBondContact O-N 3.1Å; V660-L662 VanDerWaalsContact C-N 3.33Å; V660-L662 PolarHBondContact O-N 2.93Å; L662-Q664 VanDerWaalsContact C-N 3.34Å; L662-Q664 PolarHBondContact O-N 2.88Å; L662-A665 PolarHBondContact O-N 3.45Å; L662-Q666 WeakPolarHBondContact O-CG 3.16Å; L662-Q666 PolarHBondContact O-N 3.36Å; L662-F677 HydrophobicContact CD2-CZ 4.31Å; L662-F677 HydrophobicContact CG-CZ 4.39Å; L662-D699 HydrophobicContact CD1-CB 4.38Å; L662-D699 HydrophobicContact CD2-CB 4.14Å
663	A	95.1	Very high	92.9	Very high	2 Å²	2	32.7 Å²	32.7	2%	0.017	20%	0.201	C	C	.	.	H	α-helix	trans	-61.6	-43.4	176	0	0	0	0	0	111.2	T627 I631 L643 R659 V660 A665 Q666 L667	T627-A663 HydrophobicContact CG2-CB 4.13Å; I631-A663 HydrophobicContact CD1-CB 3.99Å; L643-A663 HydrophobicContact CD2-CB 4.38Å; R659-A663 WeakPolarHBondContact O-CB 3.38Å; R659-A663 PolarHBondContact O-N 3.49Å; V660-A663 PolarHBondContact O-N 3.28Å; A663-A665 PolarHBondContact O-N 2.8Å; A663-Q666 PolarHBondContact O-N 3.07Å; A663-L667 WeakPolarHBondContact O-CB 3.27Å; A663-L667 WeakPolarHBondContact O-CG 3.34Å; A663-L667 PolarHBondContact O-N 3.21Å
664	Q	94.8	Very high	93.3	Very high	32 Å²	32	32.6 Å²	32.6	15%	0.15	19%	0.194	C	C	.	.	H	α-helix	trans	-58.2	-47.4	174	-73.2	168.8	-14.1	0	0	111.4	L643 V660 A661 L662 Q666 L667 G668 D669 A672 A673 T676	L643-Q664 HydrophobicContact CD2-CG 4.08Å; V660-Q664 HydrophobicContact CG1-CG 4.37Å; V660-Q664 WeakPolarHBondContact O-CB 3.49Å; V660-Q664 VanDerWaalsContact O-CG 3.25Å; V660-Q664 WeakPolarHBondContact O-CG 3.45Å; V660-Q664 PolarHBondContact O-N 3.22Å; A661-Q664 PolarHBondContact O-N 3.07Å; L662-Q664 VanDerWaalsContact C-N 3.34Å; L662-Q664 PolarHBondContact O-N 2.88Å; Q664-Q666 PolarHBondContact O-N 2.78Å; Q664-L667 PolarHBondContact O-N 3.47Å; Q664-G668 PolarHBondContact O-N 3.46Å; Q664-D669 HydrophobicContact CB-CB 4.31Å; Q664-D669 PolarHBondContact O-N 3.47Å; Q664-A672 HydrophobicContact CB-CB 4.46Å; Q664-A672 HydrophobicContact CG-CB 4.25Å; Q664-A672 VanDerWaalsContact OE1-C 3.24Å; Q664-A672 PolarHBondContact OE1-O 3.15Å; Q664-A673 HydrophobicContact CB-CB 3.99Å; Q664-T676 PolarHBondContact OE1-OG1 3.42Å
665	A	94	Very high	93.6	Very high	23 Å²	23	40.2 Å²	40.2	19%	0.19	22%	0.222	C	C	.	.	H	α-helix	trans	-60.8	-46	178.4	0	0	0	0	0	111.8	A661 L662 A663 L667 G668 A673 F703	A661-A665 WeakPolarHBondContact O-CB 3.37Å; A661-A665 PolarHBondContact O-N 3.3Å; L662-A665 PolarHBondContact O-N 3.45Å; A663-A665 PolarHBondContact O-N 2.8Å; A665-L667 VanDerWaalsContact C-N 3.29Å; A665-L667 PolarHBondContact O-N 2.91Å; A665-G668 PolarHBondContact O-N 3.24Å; A665-A673 HydrophobicContact CB-CB 3.92Å; A665-F703 HydrophobicContact CB-CD2 3.82Å; A665-F703 HydrophobicContact CB-CE2 3.86Å
666	Q	93.1	Very high	93.8	Very high	105 Å²	105	39.3 Å²	39.3	49%	0.491	22%	0.218	S	C	.	.	H	α-helix	trans	-66.7	-28.6	178.6	-71	174.8	-14.5	0	0	113.4	I631 L662 A663 Q664 G668	I631-Q666 HydrophobicContact CD1-CB 4.19Å; I631-Q666 HydrophobicContact CG2-CB 3.87Å; L662-Q666 WeakPolarHBondContact O-CG 3.16Å; L662-Q666 PolarHBondContact O-N 3.36Å; A663-Q666 PolarHBondContact O-N 3.07Å; Q664-Q666 PolarHBondContact O-N 2.78Å; Q666-G668 PolarHBondContact O-N 2.92Å
667	L	94.6	Very high	94	Very high	2 Å²	2	38.7 Å²	38.7	1%	0.01	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.7	-6.1	173.5	-70.2	170.2	0	0	0	113.4	I631 K636 A639 R640 L643 A663 Q664 A665	I631-L667 HydrophobicContact CD1-CD1 4.3Å; I631-L667 HydrophobicContact CD1-CD2 4.26Å; I631-L667 HydrophobicContact CD1-CG 3.94Å; I631-L667 HydrophobicContact CG1-CD2 3.85Å; I631-L667 HydrophobicContact CG1-CG 4.1Å; K636-L667 HydrophobicContact CB-CD2 3.98Å; K636-L667 HydrophobicContact CG-CD2 4.21Å; A639-L667 HydrophobicContact CB-CD1 4.4Å; A639-L667 HydrophobicContact CB-CD2 3.75Å; R640-L667 HydrophobicContact CG-CD1 3.95Å; R640-L667 HydrophobicContact CG-CD2 4.17Å; R640-L667 HydrophobicContact CG-CG 4.5Å; R640-L667 PolarHBondContact NH2-O 3.24Å; L643-L667 HydrophobicContact CD2-CD1 4.08Å; A663-L667 WeakPolarHBondContact O-CB 3.27Å; A663-L667 WeakPolarHBondContact O-CG 3.34Å; A663-L667 PolarHBondContact O-N 3.21Å; Q664-L667 PolarHBondContact O-N 3.47Å; A665-L667 VanDerWaalsContact C-N 3.29Å; A665-L667 PolarHBondContact O-N 2.91Å
668	G	91.2	Very high	94	Very high	51 Å²	51	42.6 Å²	42.6	53%	0.526	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	85.5	8.9	-178.3	0	0	0	0	0	114.2	Q664 A665 Q666 T670	Q664-G668 PolarHBondContact O-N 3.46Å; A665-G668 PolarHBondContact O-N 3.24Å; Q666-G668 PolarHBondContact O-N 2.92Å; G668-T670 PolarHBondContact O-N 2.75Å
669	D	93.1	Very high	94	Very high	65 Å²	65	45.1 Å²	45.1	35%	0.348	25%	0.247	S	C	.	.			trans	-85.3	54.9	178	-62.2	-37.9	0	0	0	110.6	Q664 A671 A672 A673	Q664-D669 HydrophobicContact CB-CB 4.31Å; Q664-D669 PolarHBondContact O-N 3.47Å; D669-A671 VanDerWaalsContact C-N 3.27Å; D669-A671 PolarHBondContact O-N 3.21Å; D669-A671 VanDerWaalsContact O-N 3.16Å; D669-A672 HydrophobicContact CB-CB 4.2Å; D669-A672 WeakPolarHBondContact O-CB 3.49Å; D669-A672 PolarHBondContact O-N 3.29Å; D669-A673 PolarHBondContact O-N 2.93Å; D669-A673 VanDerWaalsContact O-N 3.07Å
670	T	92.6	Very high	93.9	Very high	70 Å²	70	43.9 Å²	43.9	43%	0.429	24%	0.242	S	C	.	.	H	α-helix	trans	-54.2	-39.4	-171.7	-48.1	0	0	0	0	112.9	G668 A672 A673 Q674 F703	G668-T670 PolarHBondContact O-N 2.75Å; T670-A672 VanDerWaalsContact C-N 3.33Å; T670-A672 PolarHBondContact O-N 3.41Å; T670-A673 PolarHBondContact O-N 2.96Å; T670-Q674 WeakPolarHBondContact O-CB 3.3Å; T670-Q674 PolarHBondContact O-N 2.88Å; T670-F703 HydrophobicContact CG2-CE2 4.01Å; T670-F703 HydrophobicContact CG2-CZ 3.82Å
671	A	94.2	Very high	94	Very high	66 Å²	66	43.9 Å²	43.9	55%	0.545	24%	0.242	S	C	.	.	H	α-helix	trans	-66.1	-33.6	178.3	0	0	0	0	0	113	D669 R675	D669-A671 VanDerWaalsContact C-N 3.27Å; D669-A671 PolarHBondContact O-N 3.21Å; D669-A671 VanDerWaalsContact O-N 3.16Å; A671-R675 WeakPolarHBondContact O-CG 3.47Å; A671-R675 PolarHBondContact O-N 3.28Å
672	A	92.7	Very high	94.1	Very high	19 Å²	19	47.4 Å²	47.4	16%	0.157	27%	0.265	C	S	.	.	H	α-helix	trans	-72.6	-45.2	175.8	0	0	0	0	0	110.7	Q664 D669 T670 Q674 R675 T676	Q664-A672 HydrophobicContact CB-CB 4.46Å; Q664-A672 HydrophobicContact CG-CB 4.25Å; Q664-A672 VanDerWaalsContact OE1-C 3.24Å; Q664-A672 PolarHBondContact OE1-O 3.15Å; D669-A672 HydrophobicContact CB-CB 4.2Å; D669-A672 WeakPolarHBondContact O-CB 3.49Å; D669-A672 PolarHBondContact O-N 3.29Å; T670-A672 VanDerWaalsContact C-N 3.33Å; T670-A672 PolarHBondContact O-N 3.41Å; A672-Q674 VanDerWaalsContact C-N 3.32Å; A672-Q674 PolarHBondContact O-N 3.18Å; A672-R675 PolarHBondContact O-N 3.46Å; A672-T676 PolarHBondContact O-N 3.36Å; A672-T676 VanDerWaalsContact O-N 3.1Å; A672-T676 PolarHBondContact O-OG1 3.03Å; A672-T676 VanDerWaalsContact O-OG1 3.1Å
673	A	94.6	Very high	93.9	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-57.6	-45	175.2	0	0	0	0	0	111.6	A661 Q664 A665 D669 T670 R675 T676 F677 F703	A661-A673 WeakPolarHBondContact O-CB 3.45Å; Q664-A673 HydrophobicContact CB-CB 3.99Å; A665-A673 HydrophobicContact CB-CB 3.92Å; D669-A673 PolarHBondContact O-N 2.93Å; D669-A673 VanDerWaalsContact O-N 3.07Å; T670-A673 PolarHBondContact O-N 2.96Å; A673-R675 PolarHBondContact O-N 3.41Å; A673-T676 PolarHBondContact O-N 3.3Å; A673-F677 WeakPolarHBondContact O-CD2 3.32Å; A673-F677 PolarHBondContact O-N 3.23Å; A673-F703 HydrophobicContact CB-CD2 4.33Å; A673-F703 HydrophobicContact CB-CE1 4.45Å; A673-F703 HydrophobicContact CB-CE2 3.59Å; A673-F703 HydrophobicContact CB-CZ 3.67Å
674	Q	94.9	Very high	93.9	Very high	57 Å²	57	48.5 Å²	48.5	27%	0.266	27%	0.269	S	S	.	.	H	α-helix	trans	-59.8	-45.1	176.9	-172.4	73.8	55.7	0	0	112.2	T670 A672 T676 F677 N678 F703	T670-Q674 WeakPolarHBondContact O-CB 3.3Å; T670-Q674 PolarHBondContact O-N 2.88Å; A672-Q674 VanDerWaalsContact C-N 3.32Å; A672-Q674 PolarHBondContact O-N 3.18Å; Q674-T676 VanDerWaalsContact C-N 3.28Å; Q674-T676 PolarHBondContact O-N 3.01Å; Q674-F677 PolarHBondContact O-N 3.14Å; Q674-N678 PolarHBondContact NE2-OD1 3.38Å; Q674-N678 VanDerWaalsContact O-CB 3.28Å; Q674-N678 WeakPolarHBondContact O-CB 3.35Å; Q674-N678 PolarHBondContact O-N 3.3Å; Q674-N678 PolarHBondContact O-OD1 2.91Å; Q674-F703 HydrophobicContact CB-CE1 3.92Å; Q674-F703 HydrophobicContact CB-CZ 4.09Å; Q674-F703 HydrophobicContact CG-CE1 4.46Å; Q674-F703 VanDerWaalsContact OE1-CE1 3.24Å
675	R	94	Very high	93.7	Very high	173 Å²	173	51.1 Å²	51.1	65%	0.653	28%	0.279	S	S	*	.	H	α-helix	trans	-60	-41.3	176.9	-75.9	-172.2	-62.2	-109.6	2	111.7	A671 A672 A673 K679	A671-R675 WeakPolarHBondContact O-CG 3.47Å; A671-R675 PolarHBondContact O-N 3.28Å; A672-R675 PolarHBondContact O-N 3.46Å; A673-R675 PolarHBondContact O-N 3.41Å; R675-K679 PolarHBondContact O-N 2.88Å
676	T	92.7	Very high	93.5	Very high	25 Å²	25	54.8 Å²	54.8	15%	0.153	30%	0.304	C	S	.	.	H	α-helix	trans	-67.1	-49.4	178.7	-51	0	0	0	0	110.8	Q657 A661 Q664 A672 A673 Q674 N678 K679 L680	Q657-T676 HydrophobicContact CB-CG2 4.46Å; A661-T676 HydrophobicContact CB-CG2 3.78Å; Q664-T676 PolarHBondContact OE1-OG1 3.42Å; A672-T676 PolarHBondContact O-N 3.36Å; A672-T676 VanDerWaalsContact O-N 3.1Å; A672-T676 PolarHBondContact O-OG1 3.03Å; A672-T676 VanDerWaalsContact O-OG1 3.1Å; A673-T676 PolarHBondContact O-N 3.3Å; Q674-T676 VanDerWaalsContact C-N 3.28Å; Q674-T676 PolarHBondContact O-N 3.01Å; T676-N678 PolarHBondContact O-N 3.28Å; T676-K679 WeakPolarHBondContact O-CB 3.46Å; T676-K679 PolarHBondContact O-N 3.09Å; T676-K679 VanDerWaalsContact O-N 3.12Å; T676-L680 HydrophobicContact CG2-CD1 3.89Å; T676-L680 HydrophobicContact CG2-CG 4.31Å; T676-L680 WeakPolarHBondContact O-CG 3.39Å; T676-L680 PolarHBondContact O-N 3.36Å
677	F	95.3	Very high	93.2	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-64	-36.9	177.8	-80.1	-60.7	0	0	0	113.4	A661 L662 A673 Q674 K679 L680 I681 D699 F703	A661-F677 HydrophobicContact CB-CD1 4.46Å; A661-F677 HydrophobicContact CB-CD2 3.77Å; A661-F677 HydrophobicContact CB-CE1 4.2Å; A661-F677 HydrophobicContact CB-CE2 3.47Å; A661-F677 VanDerWaalsContact CB-CE2 3.47Å; A661-F677 HydrophobicContact CB-CG 4.27Å; A661-F677 HydrophobicContact CB-CZ 3.7Å; L662-F677 HydrophobicContact CD2-CZ 4.31Å; L662-F677 HydrophobicContact CG-CZ 4.39Å; A673-F677 WeakPolarHBondContact O-CD2 3.32Å; A673-F677 PolarHBondContact O-N 3.23Å; Q674-F677 PolarHBondContact O-N 3.14Å; F677-K679 PolarHBondContact O-N 3.47Å; F677-L680 PolarHBondContact O-N 2.95Å; F677-L680 VanDerWaalsContact O-N 3.11Å; F677-I681 HydrophobicContact CB-CD1 4.24Å; F677-I681 WeakPolarHBondContact O-CB 3.36Å; F677-I681 WeakPolarHBondContact O-CG1 3.31Å; F677-I681 PolarHBondContact O-N 3.12Å; F677-D699 HydrophobicContact CE1-CB 4.49Å; F677-D699 HydrophobicContact CZ-CB 4.4Å; F677-F703 HydrophobicContact CB-CD1 4.45Å; F677-F703 HydrophobicContact CD2-CB 3.94Å; F677-F703 AromaticContact CD2-CD1 3.5Å; F677-F703 HydrophobicContact CD2-CD1 3.5Å; F677-F703 VanDerWaalsContact CD2-CD1 3.5Å; F677-F703 HydrophobicContact CD2-CD2 4.36Å; F677-F703 HydrophobicContact CD2-CE1 4.08Å; F677-F703 AromaticContact CD2-CG 3.65Å; F677-F703 HydrophobicContact CD2-CG 3.65Å; F677-F703 HydrophobicContact CE2-CB 3.7Å; F677-F703 HydrophobicContact CE2-CD1 4.08Å; F677-F703 HydrophobicContact CE2-CD2 4.24Å; F677-F703 AromaticContact CE2-CG 3.73Å; F677-F703 HydrophobicContact CE2-CG 3.73Å; F677-F703 HydrophobicContact CG-CD1 4.27Å; F677-F703 HydrophobicContact CZ-CB 4.36Å
678	N	93.8	Very high	92.6	Very high	94 Å²	94	58.4 Å²	58.4	50%	0.503	33%	0.33	S	S	.	.	H	α-helix	trans	-60	-27.5	174.5	-74.7	-0.5	0	0	0	112.9	Q674 T676 P682	Q674-N678 PolarHBondContact NE2-OD1 3.38Å; Q674-N678 VanDerWaalsContact O-CB 3.28Å; Q674-N678 WeakPolarHBondContact O-CB 3.35Å; Q674-N678 PolarHBondContact O-N 3.3Å; Q674-N678 PolarHBondContact O-OD1 2.91Å; T676-N678 PolarHBondContact O-N 3.28Å; N678-P682 VanDerWaalsContact O-CD 3.24Å; N678-P682 WeakPolarHBondContact O-CD 3.37Å; N678-P682 WeakPolarHBondContact O-CG 3.04Å
679	K	93.8	Very high	92.3	Very high	82 Å²	82	60.2 Å²	60.2	36%	0.357	33%	0.332	S	S	.	.	H	α-helix	trans	-82.5	-43.5	172.5	-176.5	-176	175.9	-169.5	0	111.4	D650 R675 T676 F677 Q683	D650-K679 IonicContact OD1-NZ 3.2Å; R675-K679 PolarHBondContact O-N 2.88Å; T676-K679 WeakPolarHBondContact O-CB 3.46Å; T676-K679 PolarHBondContact O-N 3.09Å; T676-K679 VanDerWaalsContact O-N 3.12Å; F677-K679 PolarHBondContact O-N 3.47Å; K679-Q683 VanDerWaalsContact O-CG 3.28Å; K679-Q683 WeakPolarHBondContact O-CG 3.37Å
680	L	94.1	Very high	91.9	Very high	0 Å²	0	59.2 Å²	59.2	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-74.5	-40.4	-172.4	-68.3	178.6	0	0	0	114.2	L654 Q657 R658 T676 F677 Q683 A684 V696	L654-L680 HydrophobicContact CD2-CD2 3.56Å; Q657-L680 HydrophobicContact CB-CD1 3.74Å; Q657-L680 HydrophobicContact CB-CD2 3.59Å; Q657-L680 HydrophobicContact CB-CG 4.15Å; Q657-L680 HydrophobicContact CG-CD2 4.32Å; R658-L680 HydrophobicContact CB-CD1 4.47Å; T676-L680 HydrophobicContact CG2-CD1 3.89Å; T676-L680 HydrophobicContact CG2-CG 4.31Å; T676-L680 WeakPolarHBondContact O-CG 3.39Å; T676-L680 PolarHBondContact O-N 3.36Å; F677-L680 PolarHBondContact O-N 2.95Å; F677-L680 VanDerWaalsContact O-N 3.11Å; L680-Q683 PolarHBondContact O-N 3.42Å; L680-Q683 VanDerWaalsContact O-N 3.16Å; L680-A684 WeakPolarHBondContact O-CB 3.41Å; L680-A684 PolarHBondContact O-N 3.14Å; L680-V696 HydrophobicContact CB-CG1 3.79Å
681	I	96	Very high	91.6	Very high	10 Å²	10	60.9 Å²	60.9	5%	0.051	33%	0.334	C	S	.	.	H	α-helix	trans	-59.5	-50.3	-175.7	-71.6	172.7	0	0	0	110.9	F677 Q683 A684 K685 L697 E704 T716	F677-I681 HydrophobicContact CB-CD1 4.24Å; F677-I681 WeakPolarHBondContact O-CB 3.36Å; F677-I681 WeakPolarHBondContact O-CG1 3.31Å; F677-I681 PolarHBondContact O-N 3.12Å; I681-Q683 VanDerWaalsContact C-N 3.31Å; I681-Q683 PolarHBondContact O-N 3.45Å; I681-A684 PolarHBondContact O-N 3.14Å; I681-K685 HydrophobicContact CG2-CD 4.41Å; I681-K685 VanDerWaalsContact CG2-CE 3.44Å; I681-K685 WeakPolarHBondContact O-CG 3.37Å; I681-K685 PolarHBondContact O-N 2.93Å; I681-L697 HydrophobicContact CG2-CD2 4.08Å; I681-E704 VanDerWaalsContact CD1-OE1 3.28Å; I681-E704 WeakPolarHBondContact CD1-OE1 3.44Å; I681-T716 HydrophobicContact CD1-CG2 4.44Å; I681-T716 HydrophobicContact CG2-CG2 4.43Å
682	P	95.2	Very high	91.3	Very high	74 Å²	74	60.8 Å²	60.8	48%	0.481	32%	0.323	S	S	.	.	H	α-helix	trans	-61.4	-36	175.1	-24.7	35.1	0	0	0	113.9	N678 K685 S686	N678-P682 VanDerWaalsContact O-CD 3.24Å; N678-P682 WeakPolarHBondContact O-CD 3.37Å; N678-P682 WeakPolarHBondContact O-CG 3.04Å; P682-K685 PolarHBondContact O-N 3.12Å; P682-S686 PolarHBondContact O-N 3.3Å; P682-S686 VanDerWaalsContact O-N 3.16Å
683	Q	92.8	Very high	91.3	Very high	70 Å²	70	59.9 Å²	59.9	33%	0.327	32%	0.315	S	S	.	.	H	α-helix	trans	-68	-41.5	177.6	-70.5	178.6	-4	0	0	112.1	L654 K679 L680 I681 K685 S686 Q687	L654-Q683 HydrophobicContact CD2-CB 4.09Å; K679-Q683 VanDerWaalsContact O-CG 3.28Å; K679-Q683 WeakPolarHBondContact O-CG 3.37Å; L680-Q683 PolarHBondContact O-N 3.42Å; L680-Q683 VanDerWaalsContact O-N 3.16Å; I681-Q683 VanDerWaalsContact C-N 3.31Å; I681-Q683 PolarHBondContact O-N 3.45Å; Q683-K685 VanDerWaalsContact C-N 3.32Å; Q683-K685 PolarHBondContact O-N 2.98Å; Q683-S686 PolarHBondContact O-N 2.93Å; Q683-S686 PolarHBondContact O-OG 3.18Å; Q683-Q687 WeakPolarHBondContact O-CG 3.48Å; Q683-Q687 PolarHBondContact O-N 3.38Å
684	A	93.7	Very high	91.3	Very high	1 Å²	1	59.9 Å²	59.9	1%	0.008	32%	0.315	C	S	.	.	H	α-helix	trans	-65.6	-36.5	175.9	0	0	0	0	0	111.6	L680 I681 Q687 S693 V696 L697	L680-A684 WeakPolarHBondContact O-CB 3.41Å; L680-A684 PolarHBondContact O-N 3.14Å; I681-A684 PolarHBondContact O-N 3.14Å; A684-Q687 PolarHBondContact O-N 2.89Å; A684-S693 WeakPolarHBondContact O-CB 3.46Å; A684-V696 HydrophobicContact CB-CB 3.94Å; A684-V696 HydrophobicContact CB-CG1 3.73Å; A684-L697 HydrophobicContact CB-CD2 4.29Å; A684-L697 HydrophobicContact CB-CG 4.08Å
685	K	91.6	Very high	91.3	Very high	86 Å²	86	58.2 Å²	58.2	37%	0.374	31%	0.308	S	S	.	.	H	α-helix	trans	-67.2	-31.4	175.7	-68.8	-177.1	-165.4	-166	0	113.5	I681 P682 Q683 Q687 L697 D719	I681-K685 HydrophobicContact CG2-CD 4.41Å; I681-K685 VanDerWaalsContact CG2-CE 3.44Å; I681-K685 WeakPolarHBondContact O-CG 3.37Å; I681-K685 PolarHBondContact O-N 2.93Å; P682-K685 PolarHBondContact O-N 3.12Å; Q683-K685 VanDerWaalsContact C-N 3.32Å; Q683-K685 PolarHBondContact O-N 2.98Å; K685-Q687 VanDerWaalsContact C-N 3.34Å; K685-L697 HydrophobicContact CG-CD2 3.84Å; K685-D719 HydrophobicContact CD-CB 4.47Å; K685-D719 WeakPolarHBondContact CE-OD2 3.41Å; K685-D719 HydrophobicContact CG-CB 4.39Å; K685-D719 IonicContact NZ-OD2 2.88Å; K685-D719 PolarHBondContact NZ-OD2 2.68Å
686	S	90	Very high	91.4	Very high	100 Å²	100	50 Å²	50	70%	0.699	28%	0.277	S	S	*	.	H	α-helix	trans	-82.4	-13	-179.8	68	0	0	0	0	113.6	P682 Q683	P682-S686 PolarHBondContact O-N 3.3Å; P682-S686 VanDerWaalsContact O-N 3.16Å; Q683-S686 PolarHBondContact O-N 2.93Å; Q683-S686 PolarHBondContact O-OG 3.18Å
687	Q	86.5	Confident	91.7	Very high	80 Å²	80	48.9 Å²	48.9	37%	0.374	27%	0.27	S	S	.	.	S	Bend	trans	-84.2	154	175.9	-73.5	-175.1	1.8	0	0	112.1	L654 Q683 A684 K685	L654-Q687 VanDerWaalsContact CD1-CD 3.5Å; Q683-Q687 WeakPolarHBondContact O-CG 3.48Å; Q683-Q687 PolarHBondContact O-N 3.38Å; A684-Q687 PolarHBondContact O-N 2.89Å; K685-Q687 VanDerWaalsContact C-N 3.34Å
688	P	81.5	Confident	91.8	Very high	103 Å²	103	50.2 Å²	50.2	67%	0.669	28%	0.275	S	S	*	.	P	Polyproline II helix	trans	-54.6	151.9	169.5	-23.9	33.9	0	0	0	112.1	S690 S693	P688-S690 PolarHBondContact O-N 3.3Å; P688-S693 PolarHBondContact O-OG 3.07Å
689	P	84.8	Confident	91.9	Very high	90 Å²	90	46.2 Å²	46.2	58%	0.584	25%	0.253	S	S	*	.	S	Bend	trans	-50.6	124.6	173.2	-28.3	36.1	0	0	0	111.8	A723	P689-A723 CarbonylContact C-O 3.57Å
690	S	85	Confident	92.1	Very high	44 Å²	44	42.3 Å²	42.3	31%	0.308	24%	0.236	S	C	.	.			trans	-156.6	161.5	-177.8	74.1	0	0	0	0	110.3	P688 E692 S693 A694 A723	P688-S690 PolarHBondContact O-N 3.3Å; S690-E692 VanDerWaalsContact C-N 3.25Å; S690-E692 PolarHBondContact O-N 3.45Å; S690-S693 PolarHBondContact N-OG 3.33Å; S690-S693 PolarHBondContact O-N 2.95Å; S690-S693 PolarHBondContact O-OG 2.74Å; S690-S693 PolarHBondContact OG-N 3.41Å; S690-S693 VanDerWaalsContact OG-N 3.12Å; S690-S693 PolarHBondContact OG-OG 3.17Å; S690-A694 VanDerWaalsContact O-CB 3.26Å; S690-A694 WeakPolarHBondContact O-CB 3.36Å; S690-A694 PolarHBondContact O-N 3.34Å; S690-A723 PolarHBondContact N-O 2.88Å; S690-A723 VanDerWaalsContact N-O 3.14Å
691	M	85.5	Confident	92.2	Very high	104 Å²	104	42.3 Å²	42.3	51%	0.512	24%	0.236	S	C	.	.	H	α-helix	trans	-60	-37.3	175.2	-168.5	-176.3	173.6	0	0	112	M695 W749 L750	M691-M695 HydrophobicContact CE-CE 4.43Å; M691-M695 HydrophobicContact CE-SD 4.29Å; M691-M695 HydrophobicContact CG-CE 4.07Å; M691-M695 WeakPolarHBondContact O-CE 3.41Å; M691-M695 WeakPolarHBondContact O-CG 3.41Å; M691-M695 PolarHBondContact O-N 3.03Å; M691-W749 HydrophobicContact CE-CZ2 3.55Å; M691-L750 HydrophobicContact CG-CD2 3.73Å
692	E	88.5	Confident	92.1	Very high	64 Å²	64	46.3 Å²	46.3	30%	0.299	25%	0.254	S	S	.	.	H	α-helix	trans	-67.8	-49.7	-179.7	-172.7	173.9	-159.2	0	0	111.7	L654 N655 S690 A694 M695 V696	L654-E692 HydrophobicContact CB-CG 3.92Å; L654-E692 WeakPolarHBondContact CB-OE1 3.5Å; L654-E692 PolarHBondContact N-OE1 2.92Å; L654-E692 VanDerWaalsContact N-OE1 3.14Å; N655-E692 HydrophobicContact CB-CG 4.23Å; N655-E692 WeakPolarHBondContact CB-OE1 3.34Å; N655-E692 PolarHBondContact N-OE1 3.3Å; S690-E692 VanDerWaalsContact C-N 3.25Å; S690-E692 PolarHBondContact O-N 3.45Å; E692-A694 VanDerWaalsContact C-N 3.31Å; E692-A694 PolarHBondContact O-N 3.33Å; E692-M695 PolarHBondContact O-N 2.96Å; E692-V696 WeakPolarHBondContact O-CG2 3.12Å; E692-V696 PolarHBondContact O-N 2.86Å; E692-V696 VanDerWaalsContact O-N 3.14Å
693	S	92.8	Very high	92.2	Very high	1 Å²	1	43.1 Å²	43.1	1%	0.007	23%	0.232	C	C	.	.	H	α-helix	trans	-62.8	-38.5	176.9	55.7	0	0	0	0	111.8	A684 P688 S690 V696 L697	A684-S693 WeakPolarHBondContact O-CB 3.46Å; P688-S693 PolarHBondContact O-OG 3.07Å; S690-S693 PolarHBondContact N-OG 3.33Å; S690-S693 PolarHBondContact O-N 2.95Å; S690-S693 PolarHBondContact O-OG 2.74Å; S690-S693 PolarHBondContact OG-N 3.41Å; S690-S693 VanDerWaalsContact OG-N 3.12Å; S690-S693 PolarHBondContact OG-OG 3.17Å; S693-V696 PolarHBondContact O-N 2.95Å; S693-L697 VanDerWaalsContact O-CG 3.28Å; S693-L697 WeakPolarHBondContact O-CG 3.38Å; S693-L697 PolarHBondContact O-N 3.43Å; S693-L697 VanDerWaalsContact O-N 3.08Å
694	A	95.2	Very high	92.3	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-64.1	-42	175.8	0	0	0	0	0	113.7	S690 E692 L697 R698 A723 L750	S690-A694 VanDerWaalsContact O-CB 3.26Å; S690-A694 WeakPolarHBondContact O-CB 3.36Å; S690-A694 PolarHBondContact O-N 3.34Å; E692-A694 VanDerWaalsContact C-N 3.31Å; E692-A694 PolarHBondContact O-N 3.33Å; A694-L697 PolarHBondContact O-N 3.29Å; A694-R698 WeakPolarHBondContact O-CB 3.29Å; A694-R698 PolarHBondContact O-N 3.01Å; A694-A723 HydrophobicContact CB-CB 4Å; A694-L750 HydrophobicContact CB-CD2 3.77Å
695	M	95.1	Very high	92.1	Very high	22 Å²	22	41.8 Å²	41.8	11%	0.108	23%	0.231	C	C	.	.	H	α-helix	trans	-64	-42	176.2	-76.2	-175.4	-67.9	0	0	112	M691 E692 L697 R698 D699 W749 L750	M691-M695 HydrophobicContact CE-CE 4.43Å; M691-M695 HydrophobicContact CE-SD 4.29Å; M691-M695 HydrophobicContact CG-CE 4.07Å; M691-M695 WeakPolarHBondContact O-CE 3.41Å; M691-M695 WeakPolarHBondContact O-CG 3.41Å; M691-M695 PolarHBondContact O-N 3.03Å; E692-M695 PolarHBondContact O-N 2.96Å; M695-L697 VanDerWaalsContact C-N 3.33Å; M695-L697 PolarHBondContact O-N 3.19Å; M695-R698 PolarHBondContact O-N 3.3Å; M695-D699 WeakPolarHBondContact O-CB 3.4Å; M695-D699 PolarHBondContact O-N 3.29Å; M695-W749 HydrophobicContact CG-CH2 4.45Å; M695-W749 HydrophobicContact SD-CH2 4.12Å; M695-W749 HydrophobicContact SD-CZ2 4.18Å; M695-L750 HydrophobicContact CG-CD1 3.85Å; M695-L750 HydrophobicContact CG-CD2 3.85Å
696	V	96.3	Very high	92	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-59.7	-46	175.9	172.5	0	0	0	0	110.8	L654 R658 L680 A684 E692 S693 G700	L654-V696 HydrophobicContact CB-CG2 4.11Å; R658-V696 HydrophobicContact CB-CG2 4.16Å; R658-V696 HydrophobicContact CG-CG2 4.44Å; L680-V696 HydrophobicContact CB-CG1 3.79Å; A684-V696 HydrophobicContact CB-CB 3.94Å; A684-V696 HydrophobicContact CB-CG1 3.73Å; E692-V696 WeakPolarHBondContact O-CG2 3.12Å; E692-V696 PolarHBondContact O-N 2.86Å; E692-V696 VanDerWaalsContact O-N 3.14Å; S693-V696 PolarHBondContact O-N 2.95Å; V696-G700 WeakPolarHBondContact O-CA 3.27Å; V696-G700 PolarHBondContact O-N 3.45Å
697	L	97.6	Very high	91.9	Very high	2 Å²	2	41.8 Å²	41.8	1%	0.01	23%	0.23	C	C	.	.	H	α-helix	trans	-69	-42	-178.7	-67.4	167.2	0	0	0	112	I681 A684 K685 S693 A694 M695 A701 T716 D719 A720 A723	I681-L697 HydrophobicContact CG2-CD2 4.08Å; A684-L697 HydrophobicContact CB-CD2 4.29Å; A684-L697 HydrophobicContact CB-CG 4.08Å; K685-L697 HydrophobicContact CG-CD2 3.84Å; S693-L697 VanDerWaalsContact O-CG 3.28Å; S693-L697 WeakPolarHBondContact O-CG 3.38Å; S693-L697 PolarHBondContact O-N 3.43Å; S693-L697 VanDerWaalsContact O-N 3.08Å; A694-L697 PolarHBondContact O-N 3.29Å; M695-L697 VanDerWaalsContact C-N 3.33Å; M695-L697 PolarHBondContact O-N 3.19Å; L697-A701 VanDerWaalsContact O-CB 3.27Å; L697-A701 WeakPolarHBondContact O-CB 3.49Å; L697-A701 PolarHBondContact O-N 3.15Å; L697-T716 HydrophobicContact CB-CG2 4.25Å; L697-T716 HydrophobicContact CD2-CG2 3.92Å; L697-T716 VanDerWaalsContact O-CG2 3.3Å; L697-T716 WeakPolarHBondContact O-CG2 3.27Å; L697-D719 HydrophobicContact CD1-CB 4.14Å; L697-D719 HydrophobicContact CD2-CB 4.42Å; L697-A720 HydrophobicContact CB-CB 3.71Å; L697-A723 HydrophobicContact CD1-CB 3.69Å
698	R	97	Very high	91.9	Very high	28 Å²	28	41 Å²	41	11%	0.106	24%	0.243	C	C	.	.	H	α-helix	trans	-59.3	-51.4	175.2	-174	-159.1	65.9	-157.3	-1	111.5	A694 M695 A701 K702 Y717 L750 V754	A694-R698 WeakPolarHBondContact O-CB 3.29Å; A694-R698 PolarHBondContact O-N 3.01Å; M695-R698 PolarHBondContact O-N 3.3Å; R698-A701 PolarHBondContact O-N 2.83Å; R698-K702 WeakPolarHBondContact O-CB 3.47Å; R698-K702 PolarHBondContact O-N 3.05Å; R698-Y717 HydrophobicContact CG-CE1 4.06Å; R698-L750 VanDerWaalsContact NH1-CD1 3.35Å; R698-V754 HydrophobicContact CB-CG2 3.97Å; R698-V754 HydrophobicContact CG-CG2 3.98Å
699	D	97	Very high	92.4	Very high	9 Å²	9	39.7 Å²	39.7	5%	0.048	23%	0.23	C	C	.	.	H	α-helix	trans	-72.7	-32.7	-175.9	-68	-19.2	0	0	0	112	R658 L662 F677 M695 K702 F703	R658-D699 WeakPolarHBondContact CD-OD2 3.42Å; R658-D699 HydrophobicContact CG-CB 4.42Å; R658-D699 IonicContact CZ-OD2 3.29Å; R658-D699 IonicContact NE-OD2 3.77Å; R658-D699 IonicContact NH1-OD2 2.79Å; R658-D699 PolarHBondContact NH1-OD2 3.02Å; L662-D699 HydrophobicContact CD1-CB 4.38Å; L662-D699 HydrophobicContact CD2-CB 4.14Å; F677-D699 HydrophobicContact CE1-CB 4.49Å; F677-D699 HydrophobicContact CZ-CB 4.4Å; M695-D699 WeakPolarHBondContact O-CB 3.4Å; M695-D699 PolarHBondContact O-N 3.29Å; D699-K702 PolarHBondContact O-N 2.98Å; D699-F703 WeakPolarHBondContact O-CB 3.46Å; D699-F703 PolarHBondContact O-N 2.98Å
700	G	96.8	Very high	92.7	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-61.5	-47.9	169.8	0	0	0	0	0	111.7	V696 K702 F703 E704	V696-G700 WeakPolarHBondContact O-CA 3.27Å; V696-G700 PolarHBondContact O-N 3.45Å; G700-K702 VanDerWaalsContact C-N 3.34Å; G700-K702 PolarHBondContact O-N 3.2Å; G700-F703 PolarHBondContact O-N 3.27Å; G700-E704 VanDerWaalsContact O-CG 3.32Å; G700-E704 WeakPolarHBondContact O-CG 3.34Å; G700-E704 PolarHBondContact O-N 2.97Å
701	A	96.8	Very high	93	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-60.9	-42.7	175.5	0	0	0	0	0	111.9	L697 R698 F703 E704 A705 A713 T716 Y717	L697-A701 VanDerWaalsContact O-CB 3.27Å; L697-A701 WeakPolarHBondContact O-CB 3.49Å; L697-A701 PolarHBondContact O-N 3.15Å; R698-A701 PolarHBondContact O-N 2.83Å; A701-F703 VanDerWaalsContact C-N 3.31Å; A701-F703 PolarHBondContact O-N 3.28Å; A701-E704 PolarHBondContact O-N 3.31Å; A701-A705 PolarHBondContact O-N 3.02Å; A701-A713 HydrophobicContact CB-CB 4.4Å; A701-A713 WeakPolarHBondContact CB-O 3.37Å; A701-A713 WeakPolarHBondContact O-CB 3.46Å; A701-T716 HydrophobicContact CB-CG2 3.86Å; A701-Y717 HydrophobicContact CB-CD1 3.88Å; A701-Y717 HydrophobicContact CB-CD2 3.74Å; A701-Y717 HydrophobicContact CB-CE1 3.75Å; A701-Y717 HydrophobicContact CB-CE2 3.61Å; A701-Y717 HydrophobicContact CB-CG 3.85Å
702	K	95.2	Very high	93.4	Very high	95 Å²	95	37.6 Å²	37.6	41%	0.413	22%	0.216	S	C	.	.	H	α-helix	trans	-60.2	-42.3	174.7	-174	170.9	-173.9	161.3	0	112	R698 D699 G700 Q706	R698-K702 WeakPolarHBondContact O-CB 3.47Å; R698-K702 PolarHBondContact O-N 3.05Å; D699-K702 PolarHBondContact O-N 2.98Å; G700-K702 VanDerWaalsContact C-N 3.34Å; G700-K702 PolarHBondContact O-N 3.2Å; K702-Q706 VanDerWaalsContact O-CG 3.31Å; K702-Q706 WeakPolarHBondContact O-CG 3.44Å; K702-Q706 PolarHBondContact O-N 3.4Å
703	F	95.6	Very high	93.7	Very high	7 Å²	7	34.6 Å²	34.6	3%	0.031	20%	0.201	C	C	.	.	H	α-helix	trans	-67.3	-43.3	175.9	176.4	-98.8	0	0	0	112.1	A665 T670 A673 Q674 F677 D699 G700 A701 A705 Q706 A707	A665-F703 HydrophobicContact CB-CD2 3.82Å; A665-F703 HydrophobicContact CB-CE2 3.86Å; T670-F703 HydrophobicContact CG2-CE2 4.01Å; T670-F703 HydrophobicContact CG2-CZ 3.82Å; A673-F703 HydrophobicContact CB-CD2 4.33Å; A673-F703 HydrophobicContact CB-CE1 4.45Å; A673-F703 HydrophobicContact CB-CE2 3.59Å; A673-F703 HydrophobicContact CB-CZ 3.67Å; Q674-F703 HydrophobicContact CB-CE1 3.92Å; Q674-F703 HydrophobicContact CB-CZ 4.09Å; Q674-F703 HydrophobicContact CG-CE1 4.46Å; Q674-F703 VanDerWaalsContact OE1-CE1 3.24Å; F677-F703 HydrophobicContact CB-CD1 4.45Å; F677-F703 HydrophobicContact CD2-CB 3.94Å; F677-F703 AromaticContact CD2-CD1 3.5Å; F677-F703 HydrophobicContact CD2-CD1 3.5Å; F677-F703 VanDerWaalsContact CD2-CD1 3.5Å; F677-F703 HydrophobicContact CD2-CD2 4.36Å; F677-F703 HydrophobicContact CD2-CE1 4.08Å; F677-F703 AromaticContact CD2-CG 3.65Å; F677-F703 HydrophobicContact CD2-CG 3.65Å; F677-F703 HydrophobicContact CE2-CB 3.7Å; F677-F703 HydrophobicContact CE2-CD1 4.08Å; F677-F703 HydrophobicContact CE2-CD2 4.24Å; F677-F703 AromaticContact CE2-CG 3.73Å; F677-F703 HydrophobicContact CE2-CG 3.73Å; F677-F703 HydrophobicContact CG-CD1 4.27Å; F677-F703 HydrophobicContact CZ-CB 4.36Å; D699-F703 WeakPolarHBondContact O-CB 3.46Å; D699-F703 PolarHBondContact O-N 2.98Å; G700-F703 PolarHBondContact O-N 3.27Å; A701-F703 VanDerWaalsContact C-N 3.31Å; A701-F703 PolarHBondContact O-N 3.28Å; F703-A705 VanDerWaalsContact C-N 3.31Å; F703-A705 PolarHBondContact O-N 2.69Å; F703-Q706 PolarHBondContact O-N 2.92Å; F703-A707 HydrophobicContact CE1-CB 4.41Å; F703-A707 HydrophobicContact CZ-CB 4.49Å; F703-A707 VanDerWaalsContact O-CB 3.26Å; F703-A707 WeakPolarHBondContact O-CB 3.33Å; F703-A707 PolarHBondContact O-N 2.93Å
704	E	94.9	Very high	93.8	Very high	13 Å²	13	35.7 Å²	35.7	6%	0.061	21%	0.207	C	C	.	.	H	α-helix	trans	-55.5	-45.6	174.2	-74.3	169.8	159.7	0	0	111	I681 G700 A701 A707 G708 D709 Q712 A713 T716	I681-E704 VanDerWaalsContact CD1-OE1 3.28Å; I681-E704 WeakPolarHBondContact CD1-OE1 3.44Å; G700-E704 VanDerWaalsContact O-CG 3.32Å; G700-E704 WeakPolarHBondContact O-CG 3.34Å; G700-E704 PolarHBondContact O-N 2.97Å; A701-E704 PolarHBondContact O-N 3.31Å; E704-A707 PolarHBondContact O-N 3.31Å; E704-G708 PolarHBondContact O-N 3.43Å; E704-D709 CarbonylContact O-C 3.44Å; E704-D709 WeakPolarHBondContact O-CA 3.35Å; E704-D709 PolarHBondContact O-N 3.03Å; E704-Q712 HydrophobicContact CG-CG 4.49Å; E704-A713 HydrophobicContact CB-CB 3.82Å; E704-A713 WeakPolarHBondContact OE2-CA 3.37Å; E704-T716 PolarHBondContact OE1-OG1 3.29Å; E704-T716 WeakPolarHBondContact OE2-CB 3.49Å; E704-T716 PolarHBondContact OE2-OG1 2.84Å
705	A	91	Very high	93.9	Very high	29 Å²	29	38.4 Å²	38.4	24%	0.24	22%	0.22	C	C	.	.	H	α-helix	trans	-62.4	-45.1	176.2	0	0	0	0	0	112.2	A701 F703 A707 G708 A713 L761	A701-A705 PolarHBondContact O-N 3.02Å; F703-A705 VanDerWaalsContact C-N 3.31Å; F703-A705 PolarHBondContact O-N 2.69Å; A705-A707 VanDerWaalsContact C-N 3.3Å; A705-A707 PolarHBondContact O-N 2.92Å; A705-G708 PolarHBondContact O-N 2.88Å; A705-A713 HydrophobicContact CB-CB 3.86Å; A705-L761 HydrophobicContact CB-CD1 3.91Å; A705-L761 HydrophobicContact CB-CD2 4.03Å
706	Q	88.4	Confident	94	Very high	138 Å²	138	37.4 Å²	37.4	65%	0.645	22%	0.215	S	C	*	.	H	α-helix	trans	-66.7	-30	176.9	-72.5	176.1	-7.8	0	0	113.2	K702 F703 G708	K702-Q706 VanDerWaalsContact O-CG 3.31Å; K702-Q706 WeakPolarHBondContact O-CG 3.44Å; K702-Q706 PolarHBondContact O-N 3.4Å; F703-Q706 PolarHBondContact O-N 2.92Å; Q706-G708 PolarHBondContact O-N 3.32Å
707	A	89	Confident	94.1	Very high	49 Å²	49	37.7 Å²	37.7	41%	0.405	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.8	0.4	176.8	0	0	0	0	0	113.1	F703 E704 A705	F703-A707 HydrophobicContact CE1-CB 4.41Å; F703-A707 HydrophobicContact CZ-CB 4.49Å; F703-A707 VanDerWaalsContact O-CB 3.26Å; F703-A707 WeakPolarHBondContact O-CB 3.33Å; F703-A707 PolarHBondContact O-N 2.93Å; E704-A707 PolarHBondContact O-N 3.31Å; A705-A707 VanDerWaalsContact C-N 3.3Å; A705-A707 PolarHBondContact O-N 2.92Å
708	G	86.5	Confident	94	Very high	64 Å²	64	38.4 Å²	38.4	66%	0.66	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	91.3	17.9	177	0	0	0	0	0	114.8	E704 A705 Q706 P710	E704-G708 PolarHBondContact O-N 3.43Å; A705-G708 PolarHBondContact O-N 2.88Å; Q706-G708 PolarHBondContact O-N 3.32Å; G708-P710 VanDerWaalsContact O-CD 3.3Å; G708-P710 WeakPolarHBondContact O-CD 3.43Å
709	D	91.1	Very high	94	Very high	75 Å²	75	38.3 Å²	38.3	40%	0.401	22%	0.22	S	C	.	.			trans	-118.3	67.9	174.9	-162.1	-13.2	0	0	0	112.2	E704 T711 Q712 A713	E704-D709 CarbonylContact O-C 3.44Å; E704-D709 WeakPolarHBondContact O-CA 3.35Å; E704-D709 PolarHBondContact O-N 3.03Å; D709-T711 PolarHBondContact O-N 2.89Å; D709-Q712 HydrophobicContact CB-CB 4.21Å; D709-Q712 PolarHBondContact O-N 2.84Å; D709-Q712 WeakPolarHBondContact OD1-CB 3.3Å; D709-Q712 PolarHBondContact OD1-N 3.42Å; D709-Q712 WeakPolarHBondContact OD2-CB 3.4Å; D709-A713 WeakPolarHBondContact O-CB 3.38Å; D709-A713 PolarHBondContact O-N 3.29Å
710	P	90.9	Very high	94.1	Very high	25 Å²	25	37.9 Å²	37.9	16%	0.162	22%	0.218	C	C	.	.	H	α-helix	trans	-66.1	-27.9	-179.1	28.5	-36.2	0	0	0	112.7	G708 A713 L714 L761 Q765	G708-P710 VanDerWaalsContact O-CD 3.3Å; G708-P710 WeakPolarHBondContact O-CD 3.43Å; P710-A713 PolarHBondContact O-N 2.84Å; P710-L714 WeakPolarHBondContact O-CG 3.48Å; P710-L714 PolarHBondContact O-N 2.89Å; P710-L761 HydrophobicContact CB-CD1 3.89Å; P710-Q765 VanDerWaalsContact CB-CD 3.47Å; P710-Q765 HydrophobicContact CB-CG 3.94Å; P710-Q765 HydrophobicContact CG-CG 4.48Å
711	T	91.4	Very high	94.1	Very high	98 Å²	98	37.9 Å²	37.9	60%	0.601	22%	0.218	S	C	*	.	H	α-helix	trans	-67.5	-48.1	178.2	-54.6	0	0	0	0	110.5	D709 A713 L714 E715	D709-T711 PolarHBondContact O-N 2.89Å; T711-A713 VanDerWaalsContact C-N 3.33Å; T711-L714 PolarHBondContact O-N 2.8Å; T711-E715 PolarHBondContact O-N 3.34Å
712	Q	94.7	Very high	94	Very high	71 Å²	71	39.6 Å²	39.6	33%	0.332	23%	0.229	S	C	.	.	H	α-helix	trans	-65.2	-39.1	175.6	-175.8	53.5	46.5	0	0	111.4	E704 D709 L714 E715 T716	E704-Q712 HydrophobicContact CG-CG 4.49Å; D709-Q712 HydrophobicContact CB-CB 4.21Å; D709-Q712 PolarHBondContact O-N 2.84Å; D709-Q712 WeakPolarHBondContact OD1-CB 3.3Å; D709-Q712 PolarHBondContact OD1-N 3.42Å; D709-Q712 WeakPolarHBondContact OD2-CB 3.4Å; Q712-L714 VanDerWaalsContact C-N 3.32Å; Q712-L714 PolarHBondContact O-N 3.32Å; Q712-E715 WeakPolarHBondContact O-CA 3.42Å; Q712-E715 WeakPolarHBondContact O-CB 3.44Å; Q712-E715 PolarHBondContact O-N 2.92Å; Q712-T716 PolarHBondContact NE2-OG1 3.31Å; Q712-T716 PolarHBondContact O-N 3.41Å; Q712-T716 PolarHBondContact O-OG1 2.98Å
713	A	95.3	Very high	94	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-57.5	-42.7	175.1	0	0	0	0	0	112.7	A701 E704 A705 D709 P710 T711 E715 T716 Y717 L761	A701-A713 HydrophobicContact CB-CB 4.4Å; A701-A713 WeakPolarHBondContact CB-O 3.37Å; A701-A713 WeakPolarHBondContact O-CB 3.46Å; E704-A713 HydrophobicContact CB-CB 3.82Å; E704-A713 WeakPolarHBondContact OE2-CA 3.37Å; A705-A713 HydrophobicContact CB-CB 3.86Å; D709-A713 WeakPolarHBondContact O-CB 3.38Å; D709-A713 PolarHBondContact O-N 3.29Å; P710-A713 PolarHBondContact O-N 2.84Å; T711-A713 VanDerWaalsContact C-N 3.33Å; A713-E715 VanDerWaalsContact C-N 3.35Å; A713-E715 PolarHBondContact O-N 3.49Å; A713-T716 PolarHBondContact O-N 2.76Å; A713-Y717 WeakPolarHBondContact O-CD2 3.38Å; A713-Y717 PolarHBondContact O-N 2.94Å; A713-L761 HydrophobicContact CB-CD2 3.52Å
714	L	95.3	Very high	93.9	Very high	24 Å²	24	35.9 Å²	35.9	13%	0.126	22%	0.216	C	C	.	.	H	α-helix	trans	-62.2	-40.8	174	-72.4	172.5	0	0	0	111.9	P710 T711 Q712 T716 Y717 K718 F737 L761 Y762 Q765	P710-L714 WeakPolarHBondContact O-CG 3.48Å; P710-L714 PolarHBondContact O-N 2.89Å; T711-L714 PolarHBondContact O-N 2.8Å; Q712-L714 VanDerWaalsContact C-N 3.32Å; Q712-L714 PolarHBondContact O-N 3.32Å; L714-T716 VanDerWaalsContact C-N 3.33Å; L714-T716 PolarHBondContact O-N 3.1Å; L714-Y717 PolarHBondContact O-N 3Å; L714-K718 WeakPolarHBondContact O-CG 3.46Å; L714-K718 PolarHBondContact O-N 3.44Å; L714-K718 VanDerWaalsContact O-N 3.08Å; L714-F737 HydrophobicContact CD2-CE1 3.89Å; L714-F737 HydrophobicContact CD2-CZ 4.02Å; L714-L761 HydrophobicContact CD2-CB 4.28Å; L714-L761 HydrophobicContact CD2-CD2 3.93Å; L714-L761 HydrophobicContact CD2-CG 4.01Å; L714-L761 HydrophobicContact CG-CD2 3.92Å; L714-L761 HydrophobicContact CG-CG 4.19Å; L714-Y762 HydrophobicContact CD1-CD2 4.36Å; L714-Y762 HydrophobicContact CD2-CD2 4.3Å; L714-Q765 HydrophobicContact CD1-CG 4.36Å
715	E	95.8	Very high	93.8	Very high	58 Å²	58	37.6 Å²	37.6	27%	0.271	24%	0.237	S	C	.	.	H	α-helix	trans	-63.2	-38.6	174.3	-68.1	-57.9	121.1	0	0	112.3	T711 Q712 A713 K718 D719 R730	T711-E715 PolarHBondContact O-N 3.34Å; Q712-E715 WeakPolarHBondContact O-CA 3.42Å; Q712-E715 WeakPolarHBondContact O-CB 3.44Å; Q712-E715 PolarHBondContact O-N 2.92Å; A713-E715 VanDerWaalsContact C-N 3.35Å; A713-E715 PolarHBondContact O-N 3.49Å; E715-K718 WeakPolarHBondContact O-CB 3.35Å; E715-K718 PolarHBondContact O-N 3.36Å; E715-K718 WeakPolarHBondContact OE1-CE 3.35Å; E715-K718 IonicContact OE1-NZ 3.21Å; E715-K718 PolarHBondContact OE1-NZ 3.17Å; E715-K718 IonicContact OE2-NZ 3.62Å; E715-D719 PolarHBondContact O-N 3.4Å; E715-R730 PolarHBondContact O-NH2 3.41Å; E715-R730 VanDerWaalsContact O-NH2 3.07Å; E715-R730 IonicContact OE2-CZ 2.66Å; E715-R730 VanDerWaalsContact OE2-CZ 3.24Å; E715-R730 IonicContact OE2-NH1 2.81Å; E715-R730 PolarHBondContact OE2-NH1 3.41Å; E715-R730 IonicContact OE2-NH2 2.77Å; E715-R730 PolarHBondContact OE2-NH2 2.99Å
716	T	97.2	Very high	93.9	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-70	-35.2	175.8	-57.5	0	0	0	0	111.7	I681 L697 A701 E704 Q712 A713 L714 K718 D719 A720	I681-T716 HydrophobicContact CD1-CG2 4.44Å; I681-T716 HydrophobicContact CG2-CG2 4.43Å; L697-T716 HydrophobicContact CB-CG2 4.25Å; L697-T716 HydrophobicContact CD2-CG2 3.92Å; L697-T716 VanDerWaalsContact O-CG2 3.3Å; L697-T716 WeakPolarHBondContact O-CG2 3.27Å; A701-T716 HydrophobicContact CB-CG2 3.86Å; E704-T716 PolarHBondContact OE1-OG1 3.29Å; E704-T716 WeakPolarHBondContact OE2-CB 3.49Å; E704-T716 PolarHBondContact OE2-OG1 2.84Å; Q712-T716 PolarHBondContact NE2-OG1 3.31Å; Q712-T716 PolarHBondContact O-N 3.41Å; Q712-T716 PolarHBondContact O-OG1 2.98Å; A713-T716 PolarHBondContact O-N 2.76Å; L714-T716 VanDerWaalsContact C-N 3.33Å; L714-T716 PolarHBondContact O-N 3.1Å; T716-K718 VanDerWaalsContact C-N 3.34Å; T716-K718 PolarHBondContact O-N 3.37Å; T716-D719 WeakPolarHBondContact O-CB 3.32Å; T716-D719 PolarHBondContact O-N 2.91Å; T716-D719 VanDerWaalsContact O-N 3.14Å; T716-A720 PolarHBondContact O-N 2.96Å
717	Y	97.8	Very high	94.2	Very high	6 Å²	6	31.6 Å²	31.6	2%	0.024	21%	0.207	C	C	.	.	H	α-helix	trans	-64	-36.1	171.8	-81	-57.3	0	0	0	112.7	R698 A701 A713 L714 D719 A720 M721 V754 D757 A758 L761	R698-Y717 HydrophobicContact CG-CE1 4.06Å; A701-Y717 HydrophobicContact CB-CD1 3.88Å; A701-Y717 HydrophobicContact CB-CD2 3.74Å; A701-Y717 HydrophobicContact CB-CE1 3.75Å; A701-Y717 HydrophobicContact CB-CE2 3.61Å; A701-Y717 HydrophobicContact CB-CG 3.85Å; A713-Y717 WeakPolarHBondContact O-CD2 3.38Å; A713-Y717 PolarHBondContact O-N 2.94Å; L714-Y717 PolarHBondContact O-N 3Å; Y717-D719 PolarHBondContact O-N 3.35Å; Y717-A720 WeakPolarHBondContact O-CB 3.24Å; Y717-A720 PolarHBondContact O-N 3.19Å; Y717-A720 VanDerWaalsContact O-N 3.16Å; Y717-M721 WeakPolarHBondContact O-CG 3.48Å; Y717-M721 PolarHBondContact O-N 3.43Å; Y717-V754 HydrophobicContact CD1-CG1 4.49Å; Y717-D757 HydrophobicContact CE1-CB 3.89Å; Y717-D757 WeakPolarHBondContact OH-CB 3.23Å; Y717-A758 HydrophobicContact CD1-CB 4.06Å; Y717-A758 HydrophobicContact CD2-CB 4.14Å; Y717-A758 HydrophobicContact CG-CB 3.79Å; Y717-L761 HydrophobicContact CD2-CD2 3.99Å; Y717-L761 HydrophobicContact CE2-CB 4.43Å; Y717-L761 HydrophobicContact CE2-CD2 3.72Å
718	K	97.4	Very high	94.3	Very high	18 Å²	18	35.7 Å²	35.7	8%	0.078	23%	0.227	C	C	.	.	H	α-helix	trans	-58.3	-40.1	171.9	-65.4	175.7	-177.6	171.7	0	111.2	L714 E715 T716 V722 R730 P731 F737	L714-K718 WeakPolarHBondContact O-CG 3.46Å; L714-K718 PolarHBondContact O-N 3.44Å; L714-K718 VanDerWaalsContact O-N 3.08Å; E715-K718 WeakPolarHBondContact O-CB 3.35Å; E715-K718 PolarHBondContact O-N 3.36Å; E715-K718 WeakPolarHBondContact OE1-CE 3.35Å; E715-K718 IonicContact OE1-NZ 3.21Å; E715-K718 PolarHBondContact OE1-NZ 3.17Å; E715-K718 IonicContact OE2-NZ 3.62Å; T716-K718 VanDerWaalsContact C-N 3.34Å; T716-K718 PolarHBondContact O-N 3.37Å; K718-V722 PolarHBondContact O-N 2.77Å; K718-R730 HydrophobicContact CB-CG 4.24Å; K718-P731 HydrophobicContact CB-CG 4.03Å; K718-P731 HydrophobicContact CD-CG 4.29Å; K718-P731 HydrophobicContact CG-CG 3.82Å; K718-F737 HydrophobicContact CD-CD2 4.47Å; K718-F737 HydrophobicContact CG-CD2 3.55Å; K718-F737 HydrophobicContact CG-CE2 3.64Å; K718-F737 HydrophobicContact CG-CG 4.34Å
719	D	97	Very high	94.6	Very high	25 Å²	25	37.1 Å²	37.1	13%	0.134	22%	0.223	C	C	.	.	H	α-helix	trans	-72	-37.2	176.6	-58.5	-36.5	0	0	0	111.4	K685 L697 E715 T716 Y717 M721 V722 A723 R730	K685-D719 HydrophobicContact CD-CB 4.47Å; K685-D719 WeakPolarHBondContact CE-OD2 3.41Å; K685-D719 HydrophobicContact CG-CB 4.39Å; K685-D719 IonicContact NZ-OD2 2.88Å; K685-D719 PolarHBondContact NZ-OD2 2.68Å; L697-D719 HydrophobicContact CD1-CB 4.14Å; L697-D719 HydrophobicContact CD2-CB 4.42Å; E715-D719 PolarHBondContact O-N 3.4Å; T716-D719 WeakPolarHBondContact O-CB 3.32Å; T716-D719 PolarHBondContact O-N 2.91Å; T716-D719 VanDerWaalsContact O-N 3.14Å; Y717-D719 PolarHBondContact O-N 3.35Å; D719-M721 VanDerWaalsContact C-N 3.31Å; D719-M721 PolarHBondContact O-N 3.39Å; D719-V722 PolarHBondContact O-N 3.28Å; D719-V722 VanDerWaalsContact O-N 3.15Å; D719-A723 PolarHBondContact O-N 2.75Å; D719-R730 IonicContact OD1-CZ 3.27Å; D719-R730 IonicContact OD1-NE 3.21Å; D719-R730 PolarHBondContact OD1-NE 3.45Å; D719-R730 IonicContact OD1-NH2 3.5Å; D719-R730 IonicContact OD2-NH2 3.08Å
720	A	97.2	Very high	94.7	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-62.2	-36.1	174.4	0	0	0	0	0	112.3	L697 T716 Y717 V722 A723 S724 V754	L697-A720 HydrophobicContact CB-CB 3.71Å; T716-A720 PolarHBondContact O-N 2.96Å; Y717-A720 WeakPolarHBondContact O-CB 3.24Å; Y717-A720 PolarHBondContact O-N 3.19Å; Y717-A720 VanDerWaalsContact O-N 3.16Å; A720-V722 VanDerWaalsContact C-N 3.31Å; A720-V722 PolarHBondContact O-N 3.13Å; A720-A723 PolarHBondContact O-N 3.36Å; A720-S724 VanDerWaalsContact O-CB 3.26Å; A720-S724 WeakPolarHBondContact O-CB 3.47Å; A720-S724 PolarHBondContact O-N 3.29Å; A720-S724 PolarHBondContact O-OG 2.85Å; A720-V754 HydrophobicContact CB-CG1 4.03Å; A720-V754 HydrophobicContact CB-CG2 4.25Å
721	M	97.1	Very high	94.9	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-63.6	-36.9	174.1	-71.7	178.5	174	0	0	112.1	Y717 D719 S724 G725 V726 T727 F737 L740 T741 V754 A758	Y717-M721 WeakPolarHBondContact O-CG 3.48Å; Y717-M721 PolarHBondContact O-N 3.43Å; D719-M721 VanDerWaalsContact C-N 3.31Å; D719-M721 PolarHBondContact O-N 3.39Å; M721-S724 PolarHBondContact O-OG 3.19Å; M721-G725 PolarHBondContact O-N 2.99Å; M721-V726 HydrophobicContact CB-CB 4.08Å; M721-V726 HydrophobicContact CB-CG1 4.23Å; M721-V726 HydrophobicContact CG-CB 4.38Å; M721-V726 HydrophobicContact CG-CG1 4.2Å; M721-V726 WeakPolarHBondContact O-CB 3.48Å; M721-V726 PolarHBondContact O-N 3.36Å; M721-T727 HydrophobicContact CB-CG2 4.04Å; M721-T727 PolarHBondContact O-N 2.83Å; M721-F737 HydrophobicContact CE-CD2 3.85Å; M721-F737 HydrophobicContact CE-CE2 3.5Å; M721-F737 VanDerWaalsContact CE-CE2 3.5Å; M721-F737 HydrophobicContact CE-CZ 4.22Å; M721-F737 HydrophobicContact SD-CD2 3.77Å; M721-F737 HydrophobicContact SD-CE2 3.76Å; M721-L740 HydrophobicContact CE-CB 4.07Å; M721-L740 HydrophobicContact SD-CB 3.74Å; M721-L740 HydrophobicContact SD-CD1 4.13Å; M721-T741 HydrophobicContact CE-CG2 3.57Å; M721-V754 HydrophobicContact CG-CG1 3.91Å; M721-A758 HydrophobicContact CE-CB 4.15Å
722	V	96.2	Very high	94.9	Very high	36 Å²	36	39.1 Å²	39.1	22%	0.218	22%	0.218	C	C	.	.	H	α-helix	trans	-70	-48.6	174.5	178.9	0	0	0	0	110.6	K718 D719 A720 S724 G725 T727 R730	K718-V722 PolarHBondContact O-N 2.77Å; D719-V722 PolarHBondContact O-N 3.28Å; D719-V722 VanDerWaalsContact O-N 3.15Å; A720-V722 VanDerWaalsContact C-N 3.31Å; A720-V722 PolarHBondContact O-N 3.13Å; V722-S724 VanDerWaalsContact C-N 3.33Å; V722-S724 PolarHBondContact O-N 3.03Å; V722-G725 PolarHBondContact O-N 3.47Å; V722-G725 VanDerWaalsContact O-N 3.14Å; V722-T727 WeakPolarHBondContact CA-O 3.24Å; V722-T727 HydrophobicContact CG2-CG2 4.11Å; V722-R730 HydrophobicContact CG2-CB 4.17Å
723	A	94.5	Very high	94.8	Very high	9 Å²	9	39.1 Å²	39.1	7%	0.074	22%	0.22	C	C	.	.	H	α-helix	trans	-64.5	-35.7	-177.4	0	0	0	0	0	113.2	P689 S690 A694 L697 D719 A720 G725	P689-A723 CarbonylContact C-O 3.57Å; S690-A723 PolarHBondContact N-O 2.88Å; S690-A723 VanDerWaalsContact N-O 3.14Å; A694-A723 HydrophobicContact CB-CB 4Å; L697-A723 HydrophobicContact CD1-CB 3.69Å; D719-A723 PolarHBondContact O-N 2.75Å; A720-A723 PolarHBondContact O-N 3.36Å; A723-G725 VanDerWaalsContact C-N 3.29Å
724	S	93.5	Very high	94.7	Very high	16 Å²	16	42.2 Å²	42.2	11%	0.112	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.2	-10.9	177.3	58	0	0	0	0	113.6	A720 M721 V722 V726 K751	A720-S724 VanDerWaalsContact O-CB 3.26Å; A720-S724 WeakPolarHBondContact O-CB 3.47Å; A720-S724 PolarHBondContact O-N 3.29Å; A720-S724 PolarHBondContact O-OG 2.85Å; M721-S724 PolarHBondContact O-OG 3.19Å; V722-S724 VanDerWaalsContact C-N 3.33Å; V722-S724 PolarHBondContact O-N 3.03Å; S724-V726 WeakPolarHBondContact OG-CG2 3.4Å; S724-K751 WeakPolarHBondContact O-CE 3.49Å
725	G	92	Very high	94.6	Very high	48 Å²	48	43.5 Å²	43.5	50%	0.495	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	76.1	20.1	-176.2	0	0	0	0	0	114.4	M721 V722 A723	M721-G725 PolarHBondContact O-N 2.99Å; V722-G725 PolarHBondContact O-N 3.47Å; V722-G725 VanDerWaalsContact O-N 3.14Å; A723-G725 VanDerWaalsContact C-N 3.29Å
726	V	94	Very high	94.6	Very high	19 Å²	19	42.6 Å²	42.6	12%	0.115	24%	0.242	C	C	.	.	S	Bend	trans	-62.2	-34.7	166.3	166.6	0	0	0	0	110.4	M721 S724 L740 K751	M721-V726 HydrophobicContact CB-CB 4.08Å; M721-V726 HydrophobicContact CB-CG1 4.23Å; M721-V726 HydrophobicContact CG-CB 4.38Å; M721-V726 HydrophobicContact CG-CG1 4.2Å; M721-V726 WeakPolarHBondContact O-CB 3.48Å; M721-V726 PolarHBondContact O-N 3.36Å; S724-V726 WeakPolarHBondContact OG-CG2 3.4Å; V726-L740 HydrophobicContact CG1-CB 4.2Å; V726-L740 HydrophobicContact CG1-CD2 4.21Å; V726-K751 HydrophobicContact CG2-CB 3.98Å; V726-K751 HydrophobicContact CG2-CD 4.36Å; V726-K751 HydrophobicContact CG2-CG 3.92Å
727	T	94.9	Very high	94.5	Very high	23 Å²	23	42.7 Å²	42.7	14%	0.141	24%	0.243	C	C	.	.			trans	-145.4	154.4	172.5	178.1	0	0	0	0	110	M721 V722 T729 L740	M721-T727 HydrophobicContact CB-CG2 4.04Å; M721-T727 PolarHBondContact O-N 2.83Å; V722-T727 WeakPolarHBondContact CA-O 3.24Å; V722-T727 HydrophobicContact CG2-CG2 4.11Å; T727-T729 WeakPolarHBondContact CG2-O 3.35Å; T727-T729 PolarHBondContact OG1-N 3.48Å; T727-T729 PolarHBondContact OG1-O 3.37Å; T727-L740 HydrophobicContact CG2-CD1 3.8Å
728	T	90.7	Very high	94.5	Very high	134 Å²	134	42.4 Å²	42.4	82%	0.822	24%	0.242	S	C	*	.	S	Bend	trans	-86.3	-18.7	171.8	54.3	0	0	0	0	112.7
729	T	91.9	Very high	94.3	Very high	95 Å²	95	46.4 Å²	46.4	58%	0.583	26%	0.256	S	S	*	.	S	Bend	trans	-122.2	137.6	-176.4	51.9	0	0	0	0	110.4	T727	T727-T729 WeakPolarHBondContact CG2-O 3.35Å; T727-T729 PolarHBondContact OG1-N 3.48Å; T727-T729 PolarHBondContact OG1-O 3.37Å
730	R	93.4	Very high	94.3	Very high	81 Å²	81	46.7 Å²	46.7	31%	0.306	26%	0.257	S	S	.	.			trans	-63.3	125.5	177.4	-167.9	-178	-163.6	-95.6	-1.9	109.7	E715 K718 D719 V722 Q732	E715-R730 PolarHBondContact O-NH2 3.41Å; E715-R730 VanDerWaalsContact O-NH2 3.07Å; E715-R730 IonicContact OE2-CZ 2.66Å; E715-R730 VanDerWaalsContact OE2-CZ 3.24Å; E715-R730 IonicContact OE2-NH1 2.81Å; E715-R730 PolarHBondContact OE2-NH1 3.41Å; E715-R730 IonicContact OE2-NH2 2.77Å; E715-R730 PolarHBondContact OE2-NH2 2.99Å; K718-R730 HydrophobicContact CB-CG 4.24Å; D719-R730 IonicContact OD1-CZ 3.27Å; D719-R730 IonicContact OD1-NE 3.21Å; D719-R730 PolarHBondContact OD1-NE 3.45Å; D719-R730 IonicContact OD1-NH2 3.5Å; D719-R730 IonicContact OD2-NH2 3.08Å; V722-R730 HydrophobicContact CG2-CB 4.17Å; R730-Q732 PolarHBondContact O-N 3.12Å; R730-Q732 PolarHBondContact O-NE2 3.49Å
731	P	94.9	Very high	94.3	Very high	3 Å²	3	46.8 Å²	46.8	2%	0.019	26%	0.258	C	S	.	.			trans	-65.5	132.1	178.9	26.8	-34.1	0	0	0	110.7	K718 T736 F737 L740	K718-P731 HydrophobicContact CB-CG 4.03Å; K718-P731 HydrophobicContact CD-CG 4.29Å; K718-P731 HydrophobicContact CG-CG 3.82Å; P731-T736 HydrophobicContact CB-CG2 3.93Å; P731-F737 HydrophobicContact CB-CB 4.04Å; P731-F737 HydrophobicContact CG-CB 4.16Å; P731-F737 HydrophobicContact CG-CD2 3.91Å; P731-L740 HydrophobicContact CB-CD1 4.04Å; P731-L740 HydrophobicContact CG-CD1 4.14Å
732	Q	92.5	Very high	94.1	Very high	155 Å²	155	48.1 Å²	48.1	72%	0.724	26%	0.263	S	S	*	.			trans	-96.1	-22.6	-174.7	-60.1	-58.4	-52.1	0	0	113	R730	R730-Q732 PolarHBondContact O-N 3.12Å; R730-Q732 PolarHBondContact O-NE2 3.49Å
733	D	92.8	Very high	93.7	Very high	71 Å²	71	50.6 Å²	50.6	38%	0.38	28%	0.275	S	S	.	.	S	Bend	trans	-130.7	161.1	-176	66.7	91.6	0	0	0	111.5	D735 T736 F737	D733-D735 PolarHBondContact O-N 3Å; D733-D735 WeakPolarHBondContact OD1-CB 3.37Å; D733-D735 PolarHBondContact OD1-N 3.03Å; D733-D735 VanDerWaalsContact OD1-N 3.14Å; D733-T736 VanDerWaalsContact CG-OG1 3.28Å; D733-T736 PolarHBondContact O-N 3.05Å; D733-T736 PolarHBondContact OD1-N 2.91Å; D733-T736 PolarHBondContact OD1-OG1 3.37Å; D733-T736 VanDerWaalsContact OD1-OG1 3.11Å; D733-T736 VanDerWaalsContact OD2-CB 3.24Å; D733-T736 WeakPolarHBondContact OD2-CB 3.33Å; D733-T736 PolarHBondContact OD2-OG1 3.34Å; D733-F737 WeakPolarHBondContact O-CB 3.41Å; D733-F737 PolarHBondContact O-N 2.85Å
734	N	92.7	Very high	93.4	Very high	65 Å²	65	53.3 Å²	53.3	35%	0.348	29%	0.288	S	S	.	.	H	α-helix	trans	-64	-38.1	-177	-76.2	0.2	0	0	0	113.1	F737 T738 Y762 A976	N734-F737 PolarHBondContact O-N 3.25Å; N734-T738 WeakPolarHBondContact O-CB 3.33Å; N734-T738 WeakPolarHBondContact O-CG2 3.37Å; N734-T738 PolarHBondContact O-N 3.49Å; N734-T738 PolarHBondContact O-OG1 3.37Å; N734-Y762 HydrophobicContact CB-CE2 4.5Å; N734-Y762 WeakPolarHBondContact CB-OH 3.44Å; N734-Y762 PolarHBondContact ND2-OH 3.23Å; N734-A976 PolarHBondContact ND2-O 2.97Å; N734-A976 VanDerWaalsContact ND2-O 3.14Å
735	D	92.9	Very high	92.9	Very high	51 Å²	51	61.8 Å²	61.8	27%	0.273	33%	0.326	S	S	.	.	H	α-helix	trans	-67.3	-40.8	-179.1	-80.3	-2.4	0	0	0	110.5	D733 T738 R739 S946 Q979	D733-D735 PolarHBondContact O-N 3Å; D733-D735 WeakPolarHBondContact OD1-CB 3.37Å; D733-D735 PolarHBondContact OD1-N 3.03Å; D733-D735 VanDerWaalsContact OD1-N 3.14Å; D735-T738 PolarHBondContact O-OG1 3.36Å; D735-R739 WeakPolarHBondContact O-CB 3.49Å; D735-R739 PolarHBondContact O-N 2.87Å; D735-R739 PolarHBondContact O-NH1 3.46Å; D735-S946 WeakPolarHBondContact OD1-CB 3.48Å; D735-S946 PolarHBondContact OD1-OG 3.13Å; D735-S946 PolarHBondContact OD2-OG 3.14Å; D735-Q979 HydrophobicContact CB-CG 3.9Å; D735-Q979 WeakPolarHBondContact O-CB 3.22Å
736	T	95.1	Very high	92.6	Very high	40 Å²	40	68.5 Å²	68.5	25%	0.245	34%	0.342	C	S	.	.	H	α-helix	trans	-67.3	-43.9	173.7	-58.5	0	0	0	0	111.6	P731 D733 R739 L740	P731-T736 HydrophobicContact CB-CG2 3.93Å; D733-T736 VanDerWaalsContact CG-OG1 3.28Å; D733-T736 PolarHBondContact O-N 3.05Å; D733-T736 PolarHBondContact OD1-N 2.91Å; D733-T736 PolarHBondContact OD1-OG1 3.37Å; D733-T736 VanDerWaalsContact OD1-OG1 3.11Å; D733-T736 VanDerWaalsContact OD2-CB 3.24Å; D733-T736 WeakPolarHBondContact OD2-CB 3.33Å; D733-T736 PolarHBondContact OD2-OG1 3.34Å; T736-R739 PolarHBondContact OG1-NH2 2.89Å; T736-L740 HydrophobicContact CG2-CD1 4.43Å; T736-L740 VanDerWaalsContact O-CG 3.28Å; T736-L740 WeakPolarHBondContact O-CG 3.39Å; T736-L740 PolarHBondContact O-N 3.34Å
737	F	96.7	Very high	92.3	Very high	2 Å²	2	68.2 Å²	68.2	1%	0.009	34%	0.34	C	S	.	.	H	α-helix	trans	-61.8	-51.7	177.8	174.7	-112.4	0	0	0	112.4	L714 K718 M721 P731 D733 N734 R739 L740 T741 A758 Y762	L714-F737 HydrophobicContact CD2-CE1 3.89Å; L714-F737 HydrophobicContact CD2-CZ 4.02Å; K718-F737 HydrophobicContact CD-CD2 4.47Å; K718-F737 HydrophobicContact CG-CD2 3.55Å; K718-F737 HydrophobicContact CG-CE2 3.64Å; K718-F737 HydrophobicContact CG-CG 4.34Å; M721-F737 HydrophobicContact CE-CD2 3.85Å; M721-F737 HydrophobicContact CE-CE2 3.5Å; M721-F737 VanDerWaalsContact CE-CE2 3.5Å; M721-F737 HydrophobicContact CE-CZ 4.22Å; M721-F737 HydrophobicContact SD-CD2 3.77Å; M721-F737 HydrophobicContact SD-CE2 3.76Å; P731-F737 HydrophobicContact CB-CB 4.04Å; P731-F737 HydrophobicContact CG-CB 4.16Å; P731-F737 HydrophobicContact CG-CD2 3.91Å; D733-F737 WeakPolarHBondContact O-CB 3.41Å; D733-F737 PolarHBondContact O-N 2.85Å; N734-F737 PolarHBondContact O-N 3.25Å; F737-R739 PolarHBondContact O-N 2.89Å; F737-L740 WeakPolarHBondContact O-CB 3.38Å; F737-L740 PolarHBondContact O-N 2.85Å; F737-L740 VanDerWaalsContact O-N 3.09Å; F737-T741 PolarHBondContact O-N 2.82Å; F737-A758 HydrophobicContact CZ-CB 3.97Å; F737-Y762 AromaticContact CD1-CD2 3.85Å; F737-Y762 HydrophobicContact CD1-CD2 3.85Å; F737-Y762 HydrophobicContact CD1-CE2 4.19Å; F737-Y762 AromaticContact CE1-CD2 3.71Å; F737-Y762 HydrophobicContact CE1-CD2 3.71Å; F737-Y762 HydrophobicContact CE1-CE2 4.47Å; F737-Y762 HydrophobicContact CE1-CG 4.33Å
738	T	95.9	Very high	91.9	Very high	0 Å²	0	70.5 Å²	70.5	0%	0	35%	0.351	C	S	.	.	H	α-helix	trans	-68.4	-33.6	-178.7	54.8	0	0	0	0	112	N734 D735 L740 T741 Y762 W978 Q979 G980	N734-T738 WeakPolarHBondContact O-CB 3.33Å; N734-T738 WeakPolarHBondContact O-CG2 3.37Å; N734-T738 PolarHBondContact O-N 3.49Å; N734-T738 PolarHBondContact O-OG1 3.37Å; D735-T738 PolarHBondContact O-OG1 3.36Å; T738-L740 PolarHBondContact O-N 3.35Å; T738-T741 PolarHBondContact O-N 2.97Å; T738-T741 PolarHBondContact O-OG1 2.96Å; T738-Y762 HydrophobicContact CG2-CD1 3.58Å; T738-Y762 HydrophobicContact CG2-CD2 4.02Å; T738-Y762 HydrophobicContact CG2-CE1 3.38Å; T738-Y762 HydrophobicContact CG2-CE2 3.83Å; T738-Y762 HydrophobicContact CG2-CG 3.89Å; T738-W978 HydrophobicContact CG2-CE3 3.68Å; T738-W978 HydrophobicContact CG2-CZ3 3.88Å; T738-Q979 WeakPolarHBondContact OG1-CA 3.43Å; T738-Q979 WeakPolarHBondContact OG1-CB 3.47Å; T738-Q979 PolarHBondContact OG1-N 3.43Å; T738-G980 WeakPolarHBondContact O-CA 3.38Å; T738-G980 PolarHBondContact O-N 2.99Å
739	R	95.1	Very high	91.7	Very high	102 Å²	102	70.5 Å²	70.5	39%	0.385	34%	0.336	S	S	.	.	H	α-helix	trans	-60.5	-33.8	171.2	-177	168.1	54.6	-105.3	-1.5	112.5	D735 T736 F737 T741 R742 Q979	D735-R739 WeakPolarHBondContact O-CB 3.49Å; D735-R739 PolarHBondContact O-N 2.87Å; D735-R739 PolarHBondContact O-NH1 3.46Å; T736-R739 PolarHBondContact OG1-NH2 2.89Å; F737-R739 PolarHBondContact O-N 2.89Å; R739-T741 PolarHBondContact O-N 3.45Å; R739-R742 WeakPolarHBondContact O-CG 3.26Å; R739-R742 PolarHBondContact O-N 3.22Å; R739-Q979 HydrophobicContact CB-CB 3.92Å
740	L	96.5	Very high	91.7	Very high	30 Å²	30	66.2 Å²	66.2	16%	0.157	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.7	-6.5	175.2	-67.1	169.3	0	0	0	113.4	M721 V726 T727 P731 T736 F737 T738 R755	M721-L740 HydrophobicContact CE-CB 4.07Å; M721-L740 HydrophobicContact SD-CB 3.74Å; M721-L740 HydrophobicContact SD-CD1 4.13Å; V726-L740 HydrophobicContact CG1-CB 4.2Å; V726-L740 HydrophobicContact CG1-CD2 4.21Å; T727-L740 HydrophobicContact CG2-CD1 3.8Å; P731-L740 HydrophobicContact CB-CD1 4.04Å; P731-L740 HydrophobicContact CG-CD1 4.14Å; T736-L740 HydrophobicContact CG2-CD1 4.43Å; T736-L740 VanDerWaalsContact O-CG 3.28Å; T736-L740 WeakPolarHBondContact O-CG 3.39Å; T736-L740 PolarHBondContact O-N 3.34Å; F737-L740 WeakPolarHBondContact O-CB 3.38Å; F737-L740 PolarHBondContact O-N 2.85Å; F737-L740 VanDerWaalsContact O-N 3.09Å; T738-L740 PolarHBondContact O-N 3.35Å; L740-R755 PolarHBondContact O-NH1 3.36Å
741	T	96	Very high	91.8	Very high	3 Å²	3	64.7 Å²	64.7	2%	0.018	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.4	-5.1	174.1	71.2	0	0	0	0	113.6	M721 F737 T738 R739 R755 A758 A759	M721-T741 HydrophobicContact CE-CG2 3.57Å; F737-T741 PolarHBondContact O-N 2.82Å; T738-T741 PolarHBondContact O-N 2.97Å; T738-T741 PolarHBondContact O-OG1 2.96Å; R739-T741 PolarHBondContact O-N 3.45Å; T741-R755 WeakPolarHBondContact O-CB 3.45Å; T741-A758 HydrophobicContact CG2-CB 4.1Å; T741-A759 HydrophobicContact CG2-CB 4.36Å
742	R	93.6	Very high	91.7	Very high	28 Å²	28	70.5 Å²	70.5	11%	0.106	33%	0.327	C	S	.	.	S	Bend	trans	-60.1	138.9	176.6	-67.8	179	-176.6	176.5	-2.5	111.7	R739 R755 E882 Q979 D981	R739-R742 WeakPolarHBondContact O-CG 3.26Å; R739-R742 PolarHBondContact O-N 3.22Å; R742-R755 VanDerWaalsContact O-CD 3.22Å; R742-R755 WeakPolarHBondContact O-CD 3.34Å; R742-R755 PolarHBondContact O-NH1 3.27Å; R742-E882 IonicContact CZ-OE2 2.85Å; R742-E882 VanDerWaalsContact NH1-CG 3.28Å; R742-E882 IonicContact NH1-OE1 3.88Å; R742-E882 PolarHBondContact NH1-OE1 3.45Å; R742-E882 IonicContact NH1-OE2 3.93Å; R742-E882 PolarHBondContact NH1-OE2 3.29Å; R742-E882 IonicContact NH2-OE2 2.69Å; R742-Q979 VanDerWaalsContact CZ-O 3.28Å; R742-Q979 PolarHBondContact NE-O 3.26Å; R742-Q979 PolarHBondContact NH2-O 2.97Å; R742-D981 WeakPolarHBondContact CA-OD1 3.36Å; R742-D981 WeakPolarHBondContact CB-OD1 3.32Å; R742-D981 WeakPolarHBondContact CG-OD1 3.24Å
743	N	88	Confident	91.8	Very high	87 Å²	87	64 Å²	64	47%	0.465	30%	0.301	S	S	.	.			trans	-64	138	177	-73.8	-21.5	0	0	0	111.8	R880 D981	N743-R880 PolarHBondContact ND2-NH2 3.22Å; N743-R880 VanDerWaalsContact ND2-NH2 3.16Å; N743-D981 WeakPolarHBondContact CB-OD2 3.45Å; N743-D981 PolarHBondContact N-OD2 3.43Å
744	D	88.4	Confident	91.9	Very high	66 Å²	66	60.6 Å²	60.6	35%	0.353	28%	0.283	S	S	.	.			trans	-121.2	128.2	171.2	-171.1	-27.5	0	0	0	108.8	K746 D747	D744-K746 PolarHBondContact O-N 2.99Å; D744-K746 WeakPolarHBondContact OD1-CB 3.19Å; D744-K746 PolarHBondContact OD1-N 2.98Å; D744-D747 HydrophobicContact CB-CB 4.26Å; D744-D747 WeakPolarHBondContact O-CB 3.42Å; D744-D747 PolarHBondContact O-N 3.38Å
745	E	82.2	Confident	92.1	Very high	195 Å²	195	58.6 Å²	58.6	91%	0.911	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-24	-178.9	-63.7	-178.7	172.1	0	0	113	D747	E745-D747 VanDerWaalsContact C-N 3.29Å
746	K	85.5	Confident	92.1	Very high	189 Å²	189	58.5 Å²	58.5	82%	0.822	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.2	-8.1	179.3	-61.1	176.3	-175.4	170.9	0	112.7	D744	D744-K746 PolarHBondContact O-N 2.99Å; D744-K746 WeakPolarHBondContact OD1-CB 3.19Å; D744-K746 PolarHBondContact OD1-N 2.98Å
747	D	88.4	Confident	92.1	Very high	13 Å²	13	58.6 Å²	58.6	7%	0.07	27%	0.273	C	S	.	.			trans	-74.1	139.3	-177.5	-85.8	-9.6	0	0	0	112	D744 E745 K751 R752 R755	D744-D747 HydrophobicContact CB-CB 4.26Å; D744-D747 WeakPolarHBondContact O-CB 3.42Å; D744-D747 PolarHBondContact O-N 3.38Å; E745-D747 VanDerWaalsContact C-N 3.29Å; D747-K751 HydrophobicContact CB-CB 3.79Å; D747-K751 HydrophobicContact CB-CD 4.24Å; D747-K751 WeakPolarHBondContact OD1-CD 3.46Å; D747-K751 WeakPolarHBondContact OD2-CB 3.45Å; D747-R752 HydrophobicContact CB-CG 3.82Å; D747-R752 PolarHBondContact O-NE 3.06Å; D747-R752 VanDerWaalsContact O-NE 3.08Å; D747-R755 IonicContact OD2-CZ 3.35Å; D747-R755 VanDerWaalsContact OD2-CZ 3.27Å; D747-R755 IonicContact OD2-NE 2.63Å; D747-R755 PolarHBondContact OD2-NE 2.86Å; D747-R755 IonicContact OD2-NH2 3.31Å; D747-R755 PolarHBondContact OD2-NH2 3.37Å
748	D	86	Confident	92	Very high	70 Å²	70	58.5 Å²	58.5	37%	0.374	27%	0.273	S	S	.	.			trans	-63.5	171.1	166.3	60.7	61.8	0	0	0	111.3	L750 K751 R752	D748-L750 PolarHBondContact O-N 3.12Å; D748-L750 WeakPolarHBondContact OD1-CA 3.37Å; D748-L750 WeakPolarHBondContact OD1-CB 3.37Å; D748-L750 PolarHBondContact OD1-N 3.39Å; D748-K751 PolarHBondContact OD1-N 3.32Å; D748-K751 WeakPolarHBondContact OD2-CE 3.36Å; D748-K751 IonicContact OD2-NZ 3.4Å; D748-R752 WeakPolarHBondContact O-CG 3.46Å; D748-R752 PolarHBondContact O-N 3.16Å; D748-R752 VanDerWaalsContact O-N 3.13Å; D748-R752 PolarHBondContact O-NE 3.21Å
749	W	87.8	Confident	92	Very high	135 Å²	135	59 Å²	59	51%	0.511	28%	0.277	S	S	.	.	H	α-helix	trans	-60.5	-30.5	-178.9	71.6	-88.1	0	0	0	113	M691 M695 G753	M691-W749 HydrophobicContact CE-CZ2 3.55Å; M695-W749 HydrophobicContact CG-CH2 4.45Å; M695-W749 HydrophobicContact SD-CH2 4.12Å; M695-W749 HydrophobicContact SD-CZ2 4.18Å; W749-G753 PolarHBondContact O-N 2.97Å
750	L	92.2	Very high	91.7	Very high	5 Å²	5	56.9 Å²	56.9	3%	0.026	27%	0.273	C	S	.	.	H	α-helix	trans	-75.7	-47.4	-175.7	174.5	59.7	0	0	0	110.4	M691 A694 M695 R698 D748 R752 G753 V754	M691-L750 HydrophobicContact CG-CD2 3.73Å; A694-L750 HydrophobicContact CB-CD2 3.77Å; M695-L750 HydrophobicContact CG-CD1 3.85Å; M695-L750 HydrophobicContact CG-CD2 3.85Å; R698-L750 VanDerWaalsContact NH1-CD1 3.35Å; D748-L750 PolarHBondContact O-N 3.12Å; D748-L750 WeakPolarHBondContact OD1-CA 3.37Å; D748-L750 WeakPolarHBondContact OD1-CB 3.37Å; D748-L750 PolarHBondContact OD1-N 3.39Å; L750-R752 VanDerWaalsContact C-N 3.34Å; L750-R752 PolarHBondContact O-N 3.45Å; L750-G753 PolarHBondContact O-N 2.9Å; L750-V754 HydrophobicContact CD1-CG2 4.29Å; L750-V754 WeakPolarHBondContact O-CG2 3.34Å; L750-V754 PolarHBondContact O-N 3.26Å
751	K	94.2	Very high	91.5	Very high	48 Å²	48	55.9 Å²	55.9	21%	0.209	27%	0.268	C	S	.	.	H	α-helix	trans	-60.5	-44.4	174.4	-68.2	177.1	-173.5	161.8	0	111.3	S724 V726 D747 D748 G753 V754 R755	S724-K751 WeakPolarHBondContact O-CE 3.49Å; V726-K751 HydrophobicContact CG2-CB 3.98Å; V726-K751 HydrophobicContact CG2-CD 4.36Å; V726-K751 HydrophobicContact CG2-CG 3.92Å; D747-K751 HydrophobicContact CB-CB 3.79Å; D747-K751 HydrophobicContact CB-CD 4.24Å; D747-K751 WeakPolarHBondContact OD1-CD 3.46Å; D747-K751 WeakPolarHBondContact OD2-CB 3.45Å; D748-K751 PolarHBondContact OD1-N 3.32Å; D748-K751 WeakPolarHBondContact OD2-CE 3.36Å; D748-K751 IonicContact OD2-NZ 3.4Å; K751-G753 VanDerWaalsContact C-N 3.31Å; K751-G753 PolarHBondContact O-N 3.12Å; K751-V754 PolarHBondContact O-N 3.32Å; K751-R755 WeakPolarHBondContact O-CB 3.33Å; K751-R755 VanDerWaalsContact O-CG 3.24Å; K751-R755 WeakPolarHBondContact O-CG 3.48Å; K751-R755 PolarHBondContact O-N 3.3Å
752	R	93	Very high	91.4	Very high	126 Å²	126	56.3 Å²	56.3	48%	0.475	27%	0.269	S	S	.	.	H	α-helix	trans	-58.5	-42.8	173.5	-75.6	-173.2	-77	175.8	-4.4	112	D747 D748 L750 R755 S756	D747-R752 HydrophobicContact CB-CG 3.82Å; D747-R752 PolarHBondContact O-NE 3.06Å; D747-R752 VanDerWaalsContact O-NE 3.08Å; D748-R752 WeakPolarHBondContact O-CG 3.46Å; D748-R752 PolarHBondContact O-N 3.16Å; D748-R752 VanDerWaalsContact O-N 3.13Å; D748-R752 PolarHBondContact O-NE 3.21Å; L750-R752 VanDerWaalsContact C-N 3.34Å; L750-R752 PolarHBondContact O-N 3.45Å; R752-R755 PolarHBondContact O-N 3.07Å; R752-S756 WeakPolarHBondContact O-CB 3.41Å; R752-S756 PolarHBondContact O-N 3.48Å
753	G	93.6	Very high	91.2	Very high	18 Å²	18	59.2 Å²	59.2	19%	0.186	28%	0.28	C	S	.	.	H	α-helix	trans	-61.6	-49.9	174.8	0	0	0	0	0	112.8	W749 L750 K751 R755 S756 D757	W749-G753 PolarHBondContact O-N 2.97Å; L750-G753 PolarHBondContact O-N 2.9Å; K751-G753 VanDerWaalsContact C-N 3.31Å; K751-G753 PolarHBondContact O-N 3.12Å; G753-R755 VanDerWaalsContact C-N 3.29Å; G753-R755 PolarHBondContact O-N 3.07Å; G753-S756 PolarHBondContact O-N 3.09Å; G753-D757 VanDerWaalsContact O-CB 3.3Å; G753-D757 WeakPolarHBondContact O-CB 3.27Å; G753-D757 VanDerWaalsContact O-CG 3.23Å; G753-D757 PolarHBondContact O-N 2.99Å
754	V	96.6	Very high	91.1	Very high	0 Å²	0	59.5 Å²	59.5	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-57.6	-43.6	177.5	170.4	0	0	0	0	111.2	R698 Y717 A720 M721 L750 K751 A758	R698-V754 HydrophobicContact CB-CG2 3.97Å; R698-V754 HydrophobicContact CG-CG2 3.98Å; Y717-V754 HydrophobicContact CD1-CG1 4.49Å; A720-V754 HydrophobicContact CB-CG1 4.03Å; A720-V754 HydrophobicContact CB-CG2 4.25Å; M721-V754 HydrophobicContact CG-CG1 3.91Å; L750-V754 HydrophobicContact CD1-CG2 4.29Å; L750-V754 WeakPolarHBondContact O-CG2 3.34Å; L750-V754 PolarHBondContact O-N 3.26Å; K751-V754 PolarHBondContact O-N 3.32Å; V754-A758 WeakPolarHBondContact O-CB 3.48Å; V754-A758 PolarHBondContact O-N 2.93Å
755	R	96.5	Very high	91.1	Very high	22 Å²	22	59.3 Å²	59.3	8%	0.083	28%	0.276	C	S	.	.	H	α-helix	trans	-64.1	-51	178.1	-73.1	175.5	-175.1	-92.1	6.6	112.3	L740 T741 R742 D747 K751 R752 G753 A759	L740-R755 PolarHBondContact O-NH1 3.36Å; T741-R755 WeakPolarHBondContact O-CB 3.45Å; R742-R755 VanDerWaalsContact O-CD 3.22Å; R742-R755 WeakPolarHBondContact O-CD 3.34Å; R742-R755 PolarHBondContact O-NH1 3.27Å; D747-R755 IonicContact OD2-CZ 3.35Å; D747-R755 VanDerWaalsContact OD2-CZ 3.27Å; D747-R755 IonicContact OD2-NE 2.63Å; D747-R755 PolarHBondContact OD2-NE 2.86Å; D747-R755 IonicContact OD2-NH2 3.31Å; D747-R755 PolarHBondContact OD2-NH2 3.37Å; K751-R755 WeakPolarHBondContact O-CB 3.33Å; K751-R755 VanDerWaalsContact O-CG 3.24Å; K751-R755 WeakPolarHBondContact O-CG 3.48Å; K751-R755 PolarHBondContact O-N 3.3Å; R752-R755 PolarHBondContact O-N 3.07Å; G753-R755 VanDerWaalsContact C-N 3.29Å; G753-R755 PolarHBondContact O-N 3.07Å; R755-A759 WeakPolarHBondContact O-CB 3.29Å; R755-A759 PolarHBondContact O-N 2.8Å
756	S	93.3	Very high	91.6	Very high	50 Å²	50	50.4 Å²	50.4	35%	0.35	23%	0.234	S	C	.	.	H	α-helix	trans	-63.7	-50.8	-179.1	-166.5	0	0	0	0	111.3	R752 G753 A758 A759 D760	R752-S756 WeakPolarHBondContact O-CB 3.41Å; R752-S756 PolarHBondContact O-N 3.48Å; G753-S756 PolarHBondContact O-N 3.09Å; S756-A758 VanDerWaalsContact C-N 3.31Å; S756-A758 PolarHBondContact O-N 3.32Å; S756-A759 WeakPolarHBondContact O-CB 3.26Å; S756-A759 PolarHBondContact O-N 2.91Å; S756-D760 WeakPolarHBondContact O-CB 3.43Å; S756-D760 PolarHBondContact O-N 2.83Å; S756-D760 PolarHBondContact OG-OD2 2.95Å
757	D	94.1	Very high	91.9	Very high	42 Å²	42	44.7 Å²	44.7	23%	0.225	21%	0.212	C	C	.	.	H	α-helix	trans	-63.3	-39.1	-177.7	-66.2	-26.5	0	0	0	111.2	Y717 G753 L761	Y717-D757 HydrophobicContact CE1-CB 3.89Å; Y717-D757 WeakPolarHBondContact OH-CB 3.23Å; G753-D757 VanDerWaalsContact O-CB 3.3Å; G753-D757 WeakPolarHBondContact O-CB 3.27Å; G753-D757 VanDerWaalsContact O-CG 3.23Å; G753-D757 PolarHBondContact O-N 2.99Å; D757-L761 WeakPolarHBondContact O-CB 3.35Å; D757-L761 PolarHBondContact O-N 3.05Å
758	A	95.9	Very high	92.1	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-68.5	-40.9	174.9	0	0	0	0	0	112.5	Y717 M721 F737 T741 V754 S756 Y762	Y717-A758 HydrophobicContact CD1-CB 4.06Å; Y717-A758 HydrophobicContact CD2-CB 4.14Å; Y717-A758 HydrophobicContact CG-CB 3.79Å; M721-A758 HydrophobicContact CE-CB 4.15Å; F737-A758 HydrophobicContact CZ-CB 3.97Å; T741-A758 HydrophobicContact CG2-CB 4.1Å; V754-A758 WeakPolarHBondContact O-CB 3.48Å; V754-A758 PolarHBondContact O-N 2.93Å; S756-A758 VanDerWaalsContact C-N 3.31Å; S756-A758 PolarHBondContact O-N 3.32Å; A758-Y762 VanDerWaalsContact O-CB 3.23Å; A758-Y762 WeakPolarHBondContact O-CB 3.46Å; A758-Y762 PolarHBondContact O-N 3.27Å
759	A	94.1	Very high	92.6	Very high	10 Å²	10	44.3 Å²	44.3	8%	0.083	21%	0.212	C	C	.	.	H	α-helix	trans	-59.8	-48.5	174.3	0	0	0	0	0	111.4	T741 R755 S756 Y762 R763 W978	T741-A759 HydrophobicContact CG2-CB 4.36Å; R755-A759 WeakPolarHBondContact O-CB 3.29Å; R755-A759 PolarHBondContact O-N 2.8Å; S756-A759 WeakPolarHBondContact O-CB 3.26Å; S756-A759 PolarHBondContact O-N 2.91Å; A759-Y762 PolarHBondContact O-N 2.59Å; A759-R763 WeakPolarHBondContact O-CB 3.34Å; A759-R763 VanDerWaalsContact O-CG 3.32Å; A759-R763 WeakPolarHBondContact O-CG 3.44Å; A759-R763 PolarHBondContact O-N 3.09Å; A759-W978 HydrophobicContact CB-CH2 3.73Å
760	D	90.5	Very high	92.9	Very high	57 Å²	57	38 Å²	38	31%	0.305	19%	0.188	S	C	.	.	H	α-helix	trans	-64	-47.4	-177.7	-67.7	-24.4	0	0	0	110.6	S756 Y762 R763 Q764	S756-D760 WeakPolarHBondContact O-CB 3.43Å; S756-D760 PolarHBondContact O-N 2.83Å; S756-D760 PolarHBondContact OG-OD2 2.95Å; D760-Y762 PolarHBondContact O-N 3.3Å; D760-R763 PolarHBondContact O-N 2.93Å; D760-R763 IonicContact OD1-CZ 3.71Å; D760-R763 IonicContact OD1-NE 2.66Å; D760-R763 IonicContact OD1-NH2 3.68Å; D760-R763 PolarHBondContact OD1-NH2 3.09Å; D760-Q764 WeakPolarHBondContact O-CB 3.46Å; D760-Q764 VanDerWaalsContact O-CG 3.23Å; D760-Q764 WeakPolarHBondContact O-CG 3.43Å; D760-Q764 PolarHBondContact O-N 3.37Å
761	L	92.1	Very high	93.2	Very high	10 Å²	10	42.2 Å²	42.2	5%	0.052	21%	0.21	C	C	.	.	H	α-helix	trans	-62.1	-44	175.9	-176.6	63.2	0	0	0	112	A705 P710 A713 L714 Y717 D757 R763 Q764 Q765	A705-L761 HydrophobicContact CB-CD1 3.91Å; A705-L761 HydrophobicContact CB-CD2 4.03Å; P710-L761 HydrophobicContact CB-CD1 3.89Å; A713-L761 HydrophobicContact CB-CD2 3.52Å; L714-L761 HydrophobicContact CD2-CB 4.28Å; L714-L761 HydrophobicContact CD2-CD2 3.93Å; L714-L761 HydrophobicContact CD2-CG 4.01Å; L714-L761 HydrophobicContact CG-CD2 3.92Å; L714-L761 HydrophobicContact CG-CG 4.19Å; Y717-L761 HydrophobicContact CD2-CD2 3.99Å; Y717-L761 HydrophobicContact CE2-CB 4.43Å; Y717-L761 HydrophobicContact CE2-CD2 3.72Å; D757-L761 WeakPolarHBondContact O-CB 3.35Å; D757-L761 PolarHBondContact O-N 3.05Å; L761-R763 PolarHBondContact O-N 2.87Å; L761-Q764 WeakPolarHBondContact O-CB 3.41Å; L761-Q764 PolarHBondContact O-N 3.5Å; L761-Q765 WeakPolarHBondContact O-CG 3.16Å; L761-Q765 PolarHBondContact O-N 2.93Å; L761-Q765 VanDerWaalsContact O-N 3.11Å
762	Y	93.2	Very high	93.2	Very high	11 Å²	11	40 Å²	40	4%	0.043	20%	0.201	C	C	.	.	H	α-helix	trans	-61.2	-47.5	179.3	-173.2	-85.2	0	0	0	111.3	L714 N734 F737 T738 A758 A759 D760 Q764 Q765 D766 A976 G977 W978	L714-Y762 HydrophobicContact CD1-CD2 4.36Å; L714-Y762 HydrophobicContact CD2-CD2 4.3Å; N734-Y762 HydrophobicContact CB-CE2 4.5Å; N734-Y762 WeakPolarHBondContact CB-OH 3.44Å; N734-Y762 PolarHBondContact ND2-OH 3.23Å; F737-Y762 AromaticContact CD1-CD2 3.85Å; F737-Y762 HydrophobicContact CD1-CD2 3.85Å; F737-Y762 HydrophobicContact CD1-CE2 4.19Å; F737-Y762 AromaticContact CE1-CD2 3.71Å; F737-Y762 HydrophobicContact CE1-CD2 3.71Å; F737-Y762 HydrophobicContact CE1-CE2 4.47Å; F737-Y762 HydrophobicContact CE1-CG 4.33Å; T738-Y762 HydrophobicContact CG2-CD1 3.58Å; T738-Y762 HydrophobicContact CG2-CD2 4.02Å; T738-Y762 HydrophobicContact CG2-CE1 3.38Å; T738-Y762 HydrophobicContact CG2-CE2 3.83Å; T738-Y762 HydrophobicContact CG2-CG 3.89Å; A758-Y762 VanDerWaalsContact O-CB 3.23Å; A758-Y762 WeakPolarHBondContact O-CB 3.46Å; A758-Y762 PolarHBondContact O-N 3.27Å; A759-Y762 PolarHBondContact O-N 2.59Å; D760-Y762 PolarHBondContact O-N 3.3Å; Y762-Q764 VanDerWaalsContact C-N 3.29Å; Y762-Q764 PolarHBondContact O-N 2.99Å; Y762-Q765 PolarHBondContact O-N 2.78Å; Y762-Q765 VanDerWaalsContact O-N 3.12Å; Y762-D766 PolarHBondContact O-N 3.21Å; Y762-D766 VanDerWaalsContact O-N 3.14Å; Y762-A976 HydrophobicContact CE1-CB 4.23Å; Y762-A976 WeakPolarHBondContact OH-CB 3.38Å; Y762-A976 PolarHBondContact OH-O 3.03Å; Y762-G977 WeakPolarHBondContact CE1-O 2.96Å; Y762-G977 PolarHBondContact OH-O 2.85Å; Y762-W978 AromaticContact CD1-CE3 3.62Å; Y762-W978 HydrophobicContact CD1-CE3 3.62Å; Y762-W978 AromaticContact CD1-CZ3 3.68Å; Y762-W978 HydrophobicContact CD1-CZ3 3.68Å; Y762-W978 AromaticContact CE1-CE3 3.98Å; Y762-W978 HydrophobicContact CE1-CE3 3.98Å; Y762-W978 HydrophobicContact CE1-CZ3 4.45Å; Y762-W978 HydrophobicContact CG-CZ3 4.3Å
763	R	89	Confident	93.3	Very high	89 Å²	89	37.3 Å²	37.3	34%	0.336	19%	0.193	S	C	.	.	H	α-helix	trans	-61.9	-37.8	176.9	-71.8	-172.5	-61.4	170.8	1.3	111.7	A759 D760 L761 Q765 D766 R804 W978 D983	A759-R763 WeakPolarHBondContact O-CB 3.34Å; A759-R763 VanDerWaalsContact O-CG 3.32Å; A759-R763 WeakPolarHBondContact O-CG 3.44Å; A759-R763 PolarHBondContact O-N 3.09Å; D760-R763 PolarHBondContact O-N 2.93Å; D760-R763 IonicContact OD1-CZ 3.71Å; D760-R763 IonicContact OD1-NE 2.66Å; D760-R763 IonicContact OD1-NH2 3.68Å; D760-R763 PolarHBondContact OD1-NH2 3.09Å; L761-R763 PolarHBondContact O-N 2.87Å; R763-Q765 VanDerWaalsContact C-N 3.28Å; R763-Q765 PolarHBondContact O-N 3.11Å; R763-D766 PolarHBondContact O-N 2.76Å; R763-R804 PolarHBondContact O-NH1 3.19Å; R763-W978 HydrophobicContact CG-CD2 4.4Å; R763-W978 HydrophobicContact CG-CE3 4.07Å; R763-W978 HydrophobicContact CG-CH2 3.76Å; R763-W978 HydrophobicContact CG-CZ2 4.11Å; R763-W978 HydrophobicContact CG-CZ3 3.74Å; R763-D983 IonicContact NH1-OD1 3.07Å; R763-D983 PolarHBondContact NH1-OD1 3.16Å
764	Q	86.9	Confident	93.3	Very high	94 Å²	94	36.5 Å²	36.5	44%	0.439	19%	0.185	S	C	.	.	H	α-helix	trans	-60.5	-36.7	175	-77	171	3	0	0	112.3	D760 L761 Y762 P799 R804	D760-Q764 WeakPolarHBondContact O-CB 3.46Å; D760-Q764 VanDerWaalsContact O-CG 3.23Å; D760-Q764 WeakPolarHBondContact O-CG 3.43Å; D760-Q764 PolarHBondContact O-N 3.37Å; L761-Q764 WeakPolarHBondContact O-CB 3.41Å; L761-Q764 PolarHBondContact O-N 3.5Å; Y762-Q764 VanDerWaalsContact C-N 3.29Å; Y762-Q764 PolarHBondContact O-N 2.99Å; Q764-P799 WeakPolarHBondContact O-CB 3.46Å; Q764-R804 PolarHBondContact O-NH1 3.48Å
765	Q	88.8	Confident	93	Very high	62 Å²	62	40.3 Å²	40.3	29%	0.29	20%	0.199	S	C	.	.	H	α-helix	trans	-83.1	-13.2	180	-62.6	-53.9	-60.3	0	0	114.5	P710 L714 L761 Y762 R763 P799	P710-Q765 VanDerWaalsContact CB-CD 3.47Å; P710-Q765 HydrophobicContact CB-CG 3.94Å; P710-Q765 HydrophobicContact CG-CG 4.48Å; L714-Q765 HydrophobicContact CD1-CG 4.36Å; L761-Q765 WeakPolarHBondContact O-CG 3.16Å; L761-Q765 PolarHBondContact O-N 2.93Å; L761-Q765 VanDerWaalsContact O-N 3.11Å; Y762-Q765 PolarHBondContact O-N 2.78Å; Y762-Q765 VanDerWaalsContact O-N 3.12Å; R763-Q765 VanDerWaalsContact C-N 3.28Å; R763-Q765 PolarHBondContact O-N 3.11Å; Q765-P799 WeakPolarHBondContact O-CG 3.1Å
766	D	90.9	Very high	92.4	Very high	7 Å²	7	41.9 Å²	41.9	4%	0.037	21%	0.205	C	C	.	.			trans	-78.4	144.9	-176.4	-166.9	16.8	0	0	0	112.4	Y762 R763 N768 R804 S974 A975 A976	Y762-D766 PolarHBondContact O-N 3.21Å; Y762-D766 VanDerWaalsContact O-N 3.14Å; R763-D766 PolarHBondContact O-N 2.76Å; D766-N768 PolarHBondContact OD2-OD1 3.1Å; D766-R804 VanDerWaalsContact O-CZ 3.27Å; D766-R804 PolarHBondContact O-NH1 3.1Å; D766-R804 PolarHBondContact O-NH2 3.34Å; D766-S974 VanDerWaalsContact OD2-CB 3.25Å; D766-S974 WeakPolarHBondContact OD2-CB 3.5Å; D766-S974 PolarHBondContact OD2-OG 3.18Å; D766-A975 PolarHBondContact OD1-N 3.43Å; D766-A976 HydrophobicContact CB-CB 4.49Å; D766-A976 VanDerWaalsContact OD1-CB 3.24Å; D766-A976 WeakPolarHBondContact OD1-CB 3.49Å; D766-A976 PolarHBondContact OD1-N 3.47Å
767	L	93.2	Very high	92	Very high	69 Å²	69	40 Å²	40	36%	0.361	19%	0.194	S	C	.	.			trans	-91.6	122.5	170.1	-179.8	154	0	0	0	108.6	V769 D797 A798 A975	L767-V769 HydrophobicContact CD2-CG2 3.83Å; L767-D797 WeakPolarHBondContact CA-O 3.47Å; L767-A798 HydrophobicContact CD1-CB 4.29Å; L767-A798 HydrophobicContact CG-CB 4.44Å; L767-A975 HydrophobicContact CB-CB 3.92Å; L767-A975 HydrophobicContact CD2-CB 4.12Å; L767-A975 WeakPolarHBondContact O-CB 3.35Å; L767-A975 PolarHBondContact O-N 2.98Å
768	N	92.9	Very high	91.3	Very high	35 Å²	35	39 Å²	39	19%	0.187	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	136.1	-178.4	-71.6	-39.9	0	0	0	110.7	D766 V796 D797 Y973 S974	D766-N768 PolarHBondContact OD2-OD1 3.1Å; N768-V796 CarbonylContact O-C 3.54Å; N768-V796 WeakPolarHBondContact O-CA 3.26Å; N768-D797 HydrophobicContact CB-CB 4.44Å; N768-D797 PolarHBondContact N-O 3.4Å; N768-D797 PolarHBondContact O-N 3.15Å; N768-Y973 CarbonylContact C-O 3.47Å; N768-Y973 VanDerWaalsContact CA-O 3.32Å; N768-Y973 WeakPolarHBondContact CA-O 3.04Å; N768-S974 WeakPolarHBondContact OD1-CA 3.38Å
769	V	95.5	Very high	90.1	Very high	41 Å²	41	42.4 Å²	42.4	25%	0.248	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	121.3	171.4	-175.4	0	0	0	0	108	L767 L794 Q795 V796 R972 Y973	L767-V769 HydrophobicContact CD2-CG2 3.83Å; V769-L794 HydrophobicContact CG1-CD1 3.82Å; V769-Q795 CarbonylContact C-O 3.6Å; V769-Q795 WeakPolarHBondContact CA-O 3.34Å; V769-V796 HydrophobicContact CG1-CG2 4.18Å; V769-V796 HydrophobicContact CG2-CG1 4.31Å; V769-V796 HydrophobicContact CG2-CG2 4.18Å; V769-R972 CarbonylContact O-C 3.57Å; V769-R972 WeakPolarHBondContact O-CA 3.42Å; V769-Y973 PolarHBondContact N-O 3.38Å; V769-Y973 PolarHBondContact O-N 3.21Å
770	T	95.5	Very high	88.5	Confident	2 Å²	2	43.5 Å²	43.5	1%	0.012	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	126.2	175.8	-55	0	0	0	0	109	L794 Q795 Y970 R972 L989	T770-L794 WeakPolarHBondContact O-CA 3.34Å; T770-Q795 PolarHBondContact N-O 2.99Å; T770-Q795 PolarHBondContact O-N 3.3Å; T770-Y970 HydrophobicContact CG2-CD2 4.5Å; T770-R972 HydrophobicContact CG2-CB 4.43Å; T770-R972 PolarHBondContact OG1-NE 3.16Å; T770-L989 HydrophobicContact CG2-CD1 3.98Å; T770-L989 HydrophobicContact CG2-CD2 4.48Å; T770-L989 HydrophobicContact CG2-CG 3.97Å
771	L	96.7	Very high	86.9	Confident	93 Å²	93	44.4 Å²	44.4	49%	0.487	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	121	168.1	178.4	67.3	0	0	0	107.8	T792 M793 L794 Y970 V971	L771-T792 HydrophobicContact CD1-CG2 4.07Å; L771-M793 CarbonylContact C-O 3.54Å; L771-M793 WeakPolarHBondContact CA-O 3.4Å; L771-L794 HydrophobicContact CD1-CB 4.37Å; L771-Y970 CarbonylContact O-C 3.47Å; L771-Y970 VanDerWaalsContact O-CA 3.29Å; L771-Y970 WeakPolarHBondContact O-CA 3.37Å; L771-V971 PolarHBondContact N-O 3.4Å; L771-V971 PolarHBondContact O-N 3.02Å
772	E	95.4	Very high	85.1	Confident	3 Å²	3	47.4 Å²	47.4	1%	0.014	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	144.3	-175.6	-178.8	163.6	150.8	0	0	110.5	T792 M793 L969 L989	E772-T792 CarbonylContact O-C 3.5Å; E772-T792 WeakPolarHBondContact O-CA 3.29Å; E772-M793 HydrophobicContact CB-CB 4.45Å; E772-M793 HydrophobicContact CB-CE 4.17Å; E772-M793 HydrophobicContact CG-CE 3.75Å; E772-M793 PolarHBondContact N-O 3.12Å; E772-M793 PolarHBondContact O-N 3.01Å; E772-L969 WeakPolarHBondContact CA-O 3.26Å; E772-L989 HydrophobicContact CB-CD1 4.18Å; E772-L989 WeakPolarHBondContact OE2-CB 3.48Å; E772-L989 PolarHBondContact OE2-N 3.31Å
773	H	95.2	Very high	83.4	Confident	68 Å²	68	49.4 Å²	49.4	32%	0.315	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	115.7	169.2	-173.7	77.3	0	0	0	108.3	H790 T791 T792 L968 L969	H773-H790 AromaticContact CE1-ND1 3.89Å; H773-H790 AromaticContact NE2-ND1 3.41Å; H773-H790 PolarHBondContact NE2-ND1 3.49Å; H773-T791 WeakPolarHBondContact CA-O 3.24Å; H773-T792 PolarHBondContact ND1-OG1 3.22Å; H773-L968 VanDerWaalsContact O-CA 3.3Å; H773-L968 WeakPolarHBondContact O-CA 3.47Å; H773-L969 PolarHBondContact N-O 3.42Å; H773-L969 PolarHBondContact O-N 3.3Å
774	D	92.4	Very high	82	Confident	2 Å²	2	50.4 Å²	50.4	1%	0.011	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	123.5	174.6	178.3	44.7	0	0	0	109.4	H790 T791 M793 H966 L968	D774-H790 CarbonylContact O-C 3.55Å; D774-H790 WeakPolarHBondContact O-CA 3.43Å; D774-T791 PolarHBondContact N-O 3.25Å; D774-T791 PolarHBondContact O-N 2.95Å; D774-M793 HydrophobicContact CB-CE 3.96Å; D774-H966 IonicContact OD1-ND1 2.89Å; D774-H966 IonicContact OD2-ND1 2.73Å; D774-L968 HydrophobicContact CB-CB 4.47Å
775	Y	91	Very high	81	Confident	79 Å²	79	48 Å²	48	31%	0.31	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	125.4	165	166.3	-102.7	0	0	0	107.8	K788 A789 H790 H966 F967	Y775-K788 HydrophobicContact CE2-CB 4.39Å; Y775-K788 HydrophobicContact CE2-CG 4.5Å; Y775-A789 WeakPolarHBondContact CA-O 3.44Å; Y775-H790 AromaticContact CD2-CE1 3.39Å; Y775-H790 WeakPolarHBondContact CD2-CE1 3.46Å; Y775-H790 AromaticContact CD2-ND1 3.8Å; Y775-H790 AromaticContact CD2-NE2 3.78Å; Y775-H790 AromaticContact CE2-CE1 3.98Å; Y775-H790 AromaticContact CE2-NE2 4Å; Y775-H966 CarbonylContact O-C 3.54Å; Y775-H966 WeakPolarHBondContact O-CA 3.47Å; Y775-F967 HydrophobicContact CD1-CB 4.33Å; Y775-F967 PolarHBondContact N-O 3.37Å; Y775-F967 PolarHBondContact O-N 2.91Å
776	W	85	Confident	80.4	Confident	55 Å²	55	48.3 Å²	48.3	21%	0.208	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	146.7	170.9	84.8	-89.1	0	0	0	111.8	L787 K788 A789 M814 P964 S965 H966	W776-L787 HydrophobicContact CH2-CD2 3.29Å; W776-L787 HydrophobicContact CH2-CG 4.03Å; W776-L787 HydrophobicContact CZ2-CD2 3.54Å; W776-L787 HydrophobicContact CZ2-CG 4.1Å; W776-L787 HydrophobicContact CZ3-CD2 4.2Å; W776-K788 CarbonylContact O-C 3.54Å; W776-K788 WeakPolarHBondContact O-CA 3.22Å; W776-A789 HydrophobicContact CG-CB 4.39Å; W776-A789 PolarHBondContact N-O 3.47Å; W776-A789 PolarHBondContact O-N 2.91Å; W776-M814 HydrophobicContact CZ2-CE 4.48Å; W776-P964 HydrophobicContact CE3-CB 4.37Å; W776-S965 VanDerWaalsContact CA-O 3.3Å; W776-S965 WeakPolarHBondContact CA-O 3.43Å; W776-H966 VanDerWaalsContact CB-CE1 3.47Å; W776-H966 WeakPolarHBondContact CB-CE1 3.13Å; W776-H966 VanDerWaalsContact CB-ND1 3.29Å; W776-H966 WeakPolarHBondContact CB-ND1 3.47Å; W776-H966 AromaticContact CG-CE1 3.87Å
777	G	83.1	Confident	80	Confident	10 Å²	10	49.3 Å²	49.3	10%	0.103	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	147.3	172.6	0	0	0	0	0	111.6	L787 P964 S965	G777-L787 CarbonylContact C-O 3.54Å; G777-L787 WeakPolarHBondContact CA-O 3.44Å; G777-P964 CarbonylContact O-C 3.56Å; G777-P964 WeakPolarHBondContact O-CA 3.4Å; G777-S965 PolarHBondContact N-O 3.39Å; G777-S965 PolarHBondContact O-N 3.24Å
778	S	79.3	Confident	79.8	Confident	23 Å²	23	50 Å²	50	16%	0.161	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	117.7	171	-171.9	0	0	0	0	110	L787	S778-L787 PolarHBondContact N-O 3.45Å; S778-L787 PolarHBondContact O-N 3.47Å
779	S	70.8	Confident	79.6	Confident	70 Å²	70	48.3 Å²	48.3	49%	0.49	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	110.1	166.1	50.4	0	0	0	0	107.3
780	G	61.8	Low	79.5	Confident	34 Å²	34	50 Å²	50	35%	0.351	29%	0.294	S	S	.	.			trans	-69	-158.6	172.2	0	0	0	0	0	111.3	G782 S785	G780-G782 PolarHBondContact O-N 3.13Å; G780-S785 PolarHBondContact N-O 2.98Å; G780-S785 VanDerWaalsContact N-O 3.13Å
781	T	57.1	Low	79.3	Confident	76 Å²	76	50.2 Å²	50.2	47%	0.466	30%	0.295	S	S	.	.	S	Bend	trans	-50.1	133.3	167.8	-58.8	0	0	0	0	109.1	G783 Y784	T781-G783 PolarHBondContact O-N 3.29Å; T781-Y784 HydrophobicContact CG2-CD2 3.61Å; T781-Y784 HydrophobicContact CG2-CE2 3.46Å; T781-Y784 VanDerWaalsContact CG2-CE2 3.46Å; T781-Y784 WeakPolarHBondContact O-CD2 3.37Å; T781-Y784 PolarHBondContact O-N 3.19Å; T781-Y784 VanDerWaalsContact O-N 3.17Å
782	G	53.4	Low	79.2	Confident	73 Å²	73	48.3 Å²	48.3	75%	0.753	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.1	123.3	-176.9	0	0	0	0	0	111.7	G780	G780-G782 PolarHBondContact O-N 3.13Å
783	G	56.7	Low	79.2	Confident	52 Å²	52	48.1 Å²	48.1	54%	0.536	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	104	-12.8	180	0	0	0	0	0	116.1	T781	T781-G783 PolarHBondContact O-N 3.29Å
784	Y	60.5	Low	79.2	Confident	111 Å²	111	48 Å²	48	44%	0.435	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.8	-49.9	-171.4	-64.1	-93.1	0	0	0	114	T781 F819 D829	T781-Y784 HydrophobicContact CG2-CD2 3.61Å; T781-Y784 HydrophobicContact CG2-CE2 3.46Å; T781-Y784 VanDerWaalsContact CG2-CE2 3.46Å; T781-Y784 WeakPolarHBondContact O-CD2 3.37Å; T781-Y784 PolarHBondContact O-N 3.19Å; T781-Y784 VanDerWaalsContact O-N 3.17Å; Y784-F819 WeakPolarHBondContact O-CD1 3.41Å; Y784-F819 WeakPolarHBondContact O-CE1 3.28Å; Y784-D829 WeakPolarHBondContact CE1-OD1 3.48Å
785	S	66.5	Low	79.3	Confident	43 Å²	43	48.6 Å²	48.6	30%	0.301	29%	0.291	S	S	.	.			trans	-157.9	140.6	176.4	179.1	0	0	0	0	110.9	G780 V816	G780-S785 PolarHBondContact N-O 2.98Å; G780-S785 VanDerWaalsContact N-O 3.13Å; S785-V816 PolarHBondContact OG-O 3.44Å
786	D	75.3	Confident	79.4	Confident	68 Å²	68	46.9 Å²	46.9	36%	0.364	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	79.5	168.7	-179.6	22.9	0	0	0	107	K788 V816 G817	D786-K788 PolarHBondContact O-N 2.67Å; D786-K788 WeakPolarHBondContact OD2-CE 3.44Å; D786-K788 IonicContact OD2-NZ 2.76Å; D786-K788 PolarHBondContact OD2-NZ 2.98Å; D786-V816 PolarHBondContact N-O 2.67Å; D786-V816 CarbonylContact O-C 3.57Å; D786-G817 PolarHBondContact O-N 3.09Å
787	L	83.4	Confident	79.8	Confident	28 Å²	28	44.6 Å²	44.6	15%	0.147	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	127.4	-178.6	173.9	57.6	0	0	0	109.1	W776 G777 S778 M814 N815 V816	W776-L787 HydrophobicContact CH2-CD2 3.29Å; W776-L787 HydrophobicContact CH2-CG 4.03Å; W776-L787 HydrophobicContact CZ2-CD2 3.54Å; W776-L787 HydrophobicContact CZ2-CG 4.1Å; W776-L787 HydrophobicContact CZ3-CD2 4.2Å; G777-L787 CarbonylContact C-O 3.54Å; G777-L787 WeakPolarHBondContact CA-O 3.44Å; S778-L787 PolarHBondContact N-O 3.45Å; S778-L787 PolarHBondContact O-N 3.47Å; L787-M814 HydrophobicContact CD1-CB 4.4Å; L787-M814 HydrophobicContact CD1-CE 3.91Å; L787-M814 HydrophobicContact CD2-CE 4.12Å; L787-N815 CarbonylContact C-O 3.53Å; L787-N815 VanDerWaalsContact CA-O 3.31Å; L787-N815 WeakPolarHBondContact CA-O 3.4Å; L787-N815 WeakPolarHBondContact CD1-O 3.16Å; L787-V816 HydrophobicContact CD1-CG1 4.04Å
788	K	88.1	Confident	80.1	Confident	83 Å²	83	44.5 Å²	44.5	36%	0.361	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	133	170.6	-67.4	172.5	-175.9	149.3	0	108.3	Y775 W776 D786 M814 N815	Y775-K788 HydrophobicContact CE2-CB 4.39Å; Y775-K788 HydrophobicContact CE2-CG 4.5Å; W776-K788 CarbonylContact O-C 3.54Å; W776-K788 WeakPolarHBondContact O-CA 3.22Å; D786-K788 PolarHBondContact O-N 2.67Å; D786-K788 WeakPolarHBondContact OD2-CE 3.44Å; D786-K788 IonicContact OD2-NZ 2.76Å; D786-K788 PolarHBondContact OD2-NZ 2.98Å; K788-M814 CarbonylContact O-C 3.58Å; K788-M814 WeakPolarHBondContact O-CA 3.21Å; K788-N815 PolarHBondContact N-O 3.48Å; K788-N815 PolarHBondContact O-N 3.32Å
789	A	89.5	Confident	80.5	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	152.1	169.1	0	0	0	0	0	112.7	Y775 W776 N813 M814	Y775-A789 WeakPolarHBondContact CA-O 3.44Å; W776-A789 HydrophobicContact CG-CB 4.39Å; W776-A789 PolarHBondContact N-O 3.47Å; W776-A789 PolarHBondContact O-N 2.91Å; A789-N813 CarbonylContact C-O 3.51Å; A789-N813 WeakPolarHBondContact CA-O 3.35Å; A789-N813 WeakPolarHBondContact CB-O 3.4Å; A789-M814 HydrophobicContact CB-CB 4.43Å; A789-M814 HydrophobicContact CB-CG 3.78Å
790	H	92.7	Very high	81.1	Confident	76 Å²	76	49.3 Å²	49.3	35%	0.352	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	119.3	172.8	-67.2	-89.4	0	0	0	108	H773 D774 Y775 V812 N813	H773-H790 AromaticContact CE1-ND1 3.89Å; H773-H790 AromaticContact NE2-ND1 3.41Å; H773-H790 PolarHBondContact NE2-ND1 3.49Å; D774-H790 CarbonylContact O-C 3.55Å; D774-H790 WeakPolarHBondContact O-CA 3.43Å; Y775-H790 AromaticContact CD2-CE1 3.39Å; Y775-H790 WeakPolarHBondContact CD2-CE1 3.46Å; Y775-H790 AromaticContact CD2-ND1 3.8Å; Y775-H790 AromaticContact CD2-NE2 3.78Å; Y775-H790 AromaticContact CE2-CE1 3.98Å; Y775-H790 AromaticContact CE2-NE2 4Å; H790-V812 CarbonylContact O-C 3.31Å; H790-V812 WeakPolarHBondContact O-CA 3.42Å; H790-N813 HydrophobicContact CB-CB 4.42Å; H790-N813 PolarHBondContact N-O 2.86Å; H790-N813 PolarHBondContact O-N 3.2Å
791	T	92.3	Very high	81.8	Confident	7 Å²	7	52.4 Å²	52.4	4%	0.043	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	110.9	179.7	-59.8	0	0	0	0	109.5	H773 D774 M793 D810 F811 V812	H773-T791 WeakPolarHBondContact CA-O 3.24Å; D774-T791 PolarHBondContact N-O 3.25Å; D774-T791 PolarHBondContact O-N 2.95Å; T791-M793 HydrophobicContact CG2-CG 3.66Å; T791-M793 HydrophobicContact CG2-SD 4.15Å; T791-D810 HydrophobicContact CG2-CB 4.43Å; T791-F811 CarbonylContact C-O 3.58Å; T791-F811 WeakPolarHBondContact CA-O 3.28Å; T791-V812 HydrophobicContact CG2-CG2 3.96Å
792	T	94.5	Very high	82.5	Confident	53 Å²	53	53.7 Å²	53.7	33%	0.325	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	117.3	171.8	-57.5	0	0	0	0	109.2	L771 E772 H773 F811	L771-T792 HydrophobicContact CD1-CG2 4.07Å; E772-T792 CarbonylContact O-C 3.5Å; E772-T792 WeakPolarHBondContact O-CA 3.29Å; H773-T792 PolarHBondContact ND1-OG1 3.22Å; T792-F811 PolarHBondContact N-O 2.59Å; T792-F811 PolarHBondContact O-N 3.14Å
793	M	94.3	Very high	83.7	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	128.9	-175.4	-56.8	176.2	-83.3	0	0	110.4	L771 E772 D774 T791 R808 D810 L989 P991	L771-M793 CarbonylContact C-O 3.54Å; L771-M793 WeakPolarHBondContact CA-O 3.4Å; E772-M793 HydrophobicContact CB-CB 4.45Å; E772-M793 HydrophobicContact CB-CE 4.17Å; E772-M793 HydrophobicContact CG-CE 3.75Å; E772-M793 PolarHBondContact N-O 3.12Å; E772-M793 PolarHBondContact O-N 3.01Å; D774-M793 HydrophobicContact CB-CE 3.96Å; T791-M793 HydrophobicContact CG2-CG 3.66Å; T791-M793 HydrophobicContact CG2-SD 4.15Å; M793-R808 PolarHBondContact SD-NH2 2.92Å; M793-D810 HydrophobicContact CG-CB 4.39Å; M793-L989 HydrophobicContact CB-CD1 3.81Å; M793-L989 HydrophobicContact CE-CB 4.06Å; M793-L989 HydrophobicContact SD-CB 4.07Å; M793-P991 HydrophobicContact CE-CG 4.15Å; M793-P991 HydrophobicContact SD-CB 4.41Å; M793-P991 HydrophobicContact SD-CG 4.2Å
794	L	94.9	Very high	85.2	Confident	65 Å²	65	49.8 Å²	49.8	34%	0.34	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	120.3	167.4	174.5	65.5	0	0	0	108.3	V769 T770 L771 R808 S809	V769-L794 HydrophobicContact CG1-CD1 3.82Å; T770-L794 WeakPolarHBondContact O-CA 3.34Å; L771-L794 HydrophobicContact CD1-CB 4.37Å; L794-R808 CarbonylContact O-C 3.57Å; L794-R808 VanDerWaalsContact O-CA 3.3Å; L794-R808 WeakPolarHBondContact O-CA 3.11Å; L794-S809 PolarHBondContact N-O 3.29Å; L794-S809 PolarHBondContact O-N 3.03Å
795	Q	94.5	Very high	86.6	Confident	14 Å²	14	48.8 Å²	48.8	7%	0.065	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	131	174.8	-170.7	171.7	-62.4	0	0	110.8	V769 T770 D797 F807 R808 L989	V769-Q795 CarbonylContact C-O 3.6Å; V769-Q795 WeakPolarHBondContact CA-O 3.34Å; T770-Q795 PolarHBondContact N-O 2.99Å; T770-Q795 PolarHBondContact O-N 3.3Å; Q795-D797 WeakPolarHBondContact CG-OD2 3.21Å; Q795-D797 PolarHBondContact NE2-OD1 3.46Å; Q795-D797 PolarHBondContact NE2-OD2 3Å; Q795-F807 CarbonylContact C-O 3.6Å; Q795-F807 WeakPolarHBondContact CA-O 3.41Å; Q795-R808 HydrophobicContact CB-CG 4.5Å; Q795-R808 HydrophobicContact CG-CB 4.32Å; Q795-L989 HydrophobicContact CB-CD1 3.78Å; Q795-L989 HydrophobicContact CB-CD2 4.01Å; Q795-L989 HydrophobicContact CG-CD2 4.4Å
796	V	94.8	Very high	87.8	Confident	43 Å²	43	48.8 Å²	48.8	26%	0.261	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	115	171.9	-178.6	0	0	0	0	107.7	N768 V769 F806 F807	N768-V796 CarbonylContact O-C 3.54Å; N768-V796 WeakPolarHBondContact O-CA 3.26Å; V769-V796 HydrophobicContact CG1-CG2 4.18Å; V769-V796 HydrophobicContact CG2-CG1 4.31Å; V769-V796 HydrophobicContact CG2-CG2 4.18Å; V796-F806 CarbonylContact O-C 3.58Å; V796-F806 VanDerWaalsContact O-CA 3.23Å; V796-F806 WeakPolarHBondContact O-CA 3.09Å; V796-F807 HydrophobicContact CB-CB 4.46Å; V796-F807 PolarHBondContact N-O 2.93Å; V796-F807 PolarHBondContact O-N 2.52Å
797	D	92	Very high	88.7	Confident	7 Å²	7	49.7 Å²	49.7	4%	0.037	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	130.6	175.1	-68.2	-97.2	0	0	0	110	L767 N768 Q795 R804 M805 R857	L767-D797 WeakPolarHBondContact CA-O 3.47Å; N768-D797 HydrophobicContact CB-CB 4.44Å; N768-D797 PolarHBondContact N-O 3.4Å; N768-D797 PolarHBondContact O-N 3.15Å; Q795-D797 WeakPolarHBondContact CG-OD2 3.21Å; Q795-D797 PolarHBondContact NE2-OD1 3.46Å; Q795-D797 PolarHBondContact NE2-OD2 3Å; D797-R804 VanDerWaalsContact CB-NH2 3.28Å; D797-R804 PolarHBondContact O-NH2 3.01Å; D797-M805 WeakPolarHBondContact CA-O 3.33Å; D797-R857 IonicContact OD1-CZ 3.16Å; D797-R857 IonicContact OD1-NE 3.88Å; D797-R857 PolarHBondContact OD1-NE 3.36Å; D797-R857 IonicContact OD1-NH2 3.49Å; D797-R857 PolarHBondContact OD1-NH2 2.85Å; D797-R857 IonicContact OD2-NH2 2.77Å
798	A	90.5	Very high	89.1	Confident	9 Å²	9	49 Å²	49	7%	0.074	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	150.3	177.1	0	0	0	0	0	111.5	L767 Y800 R804 M805	L767-A798 HydrophobicContact CD1-CB 4.29Å; L767-A798 HydrophobicContact CG-CB 4.44Å; A798-Y800 PolarHBondContact O-N 3.21Å; A798-R804 CarbonylContact O-C 3.55Å; A798-R804 VanDerWaalsContact O-CA 3.3Å; A798-R804 WeakPolarHBondContact O-CA 3.27Å; A798-M805 HydrophobicContact CB-CE 3.49Å; A798-M805 VanDerWaalsContact CB-CE 3.49Å; A798-M805 HydrophobicContact CB-CG 3.98Å; A798-M805 PolarHBondContact N-O 2.88Å; A798-M805 WeakPolarHBondContact O-CG 3.34Å; A798-M805 PolarHBondContact O-N 3.48Å
799	P	87.1	Confident	89.4	Confident	44 Å²	44	46.7 Å²	46.7	29%	0.286	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.7	134.4	173.4	25.6	-35.5	0	0	0	111.2	Q764 Q765	Q764-P799 WeakPolarHBondContact O-CB 3.46Å; Q765-P799 WeakPolarHBondContact O-CG 3.1Å
800	Y	83.1	Confident	89.5	Confident	149 Å²	149	46.8 Å²	46.8	58%	0.584	25%	0.247	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-151.8	120.7	169.5	-175.9	-97.7	0	0	0	110.6	A798 D802 G803 W856	A798-Y800 PolarHBondContact O-N 3.21Å; Y800-D802 PolarHBondContact O-N 3.44Å; Y800-G803 CarbonylContact C-O 3.54Å; Y800-G803 PolarHBondContact N-O 3.27Å; Y800-G803 CarbonylContact O-C 3.08Å; Y800-G803 PolarHBondContact O-N 2.95Å; Y800-G803 VanDerWaalsContact O-N 3.13Å; Y800-W856 AromaticContact CD1-CD1 3.81Å; Y800-W856 PolarHBondContact O-NE1 3.49Å
801	S	77.6	Confident	89.5	Confident	100 Å²	100	48.4 Å²	48.4	70%	0.699	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	56	-133.3	-172.3	-169	0	0	0	0	110.8	G803	S801-G803 VanDerWaalsContact C-N 3.28Å
802	D	70.5	Confident	89.5	Confident	102 Å²	102	50 Å²	50	55%	0.545	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.4	8.8	176.1	60.5	-50.5	0	0	0	113.4	Y800 W856 N858	Y800-D802 PolarHBondContact O-N 3.44Å; D802-W856 WeakPolarHBondContact OD1-CZ2 3.3Å; D802-N858 PolarHBondContact OD2-ND2 3.36Å
803	G	79.7	Confident	89.3	Confident	13 Å²	13	50.7 Å²	50.7	13%	0.134	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	-158.3	-177.8	0	0	0	0	0	112.7	Y800 S801 R857	Y800-G803 CarbonylContact C-O 3.54Å; Y800-G803 PolarHBondContact N-O 3.27Å; Y800-G803 CarbonylContact O-C 3.08Å; Y800-G803 PolarHBondContact O-N 2.95Å; Y800-G803 VanDerWaalsContact O-N 3.13Å; S801-G803 VanDerWaalsContact C-N 3.28Å; G803-R857 WeakPolarHBondContact CA-O 3.37Å
804	R	86.9	Confident	89.1	Confident	30 Å²	30	54.2 Å²	54.2	11%	0.113	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	127.1	178	-61	-175	68.1	93.7	-2.5	110	R763 Q764 D766 D797 A798 W856 R857	R763-R804 PolarHBondContact O-NH1 3.19Å; Q764-R804 PolarHBondContact O-NH1 3.48Å; D766-R804 VanDerWaalsContact O-CZ 3.27Å; D766-R804 PolarHBondContact O-NH1 3.1Å; D766-R804 PolarHBondContact O-NH2 3.34Å; D797-R804 VanDerWaalsContact CB-NH2 3.28Å; D797-R804 PolarHBondContact O-NH2 3.01Å; A798-R804 CarbonylContact O-C 3.55Å; A798-R804 VanDerWaalsContact O-CA 3.3Å; A798-R804 WeakPolarHBondContact O-CA 3.27Å; R804-W856 WeakPolarHBondContact O-CA 3.44Å; R804-R857 HydrophobicContact CB-CG 4.35Å; R804-R857 PolarHBondContact N-O 3.32Å; R804-R857 PolarHBondContact O-N 2.94Å
805	M	90.7	Very high	88.7	Confident	90 Å²	90	54.5 Å²	54.5	44%	0.443	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	144.5	161	67.7	176.5	-178.9	0	0	108.7	D797 A798 G855	D797-M805 WeakPolarHBondContact CA-O 3.33Å; A798-M805 HydrophobicContact CB-CE 3.49Å; A798-M805 VanDerWaalsContact CB-CE 3.49Å; A798-M805 HydrophobicContact CB-CG 3.98Å; A798-M805 PolarHBondContact N-O 2.88Å; A798-M805 WeakPolarHBondContact O-CG 3.34Å; A798-M805 PolarHBondContact O-N 3.48Å; M805-G855 CarbonylContact C-O 3.52Å; M805-G855 VanDerWaalsContact CA-O 3.29Å; M805-G855 WeakPolarHBondContact CA-O 3.32Å
806	F	91.6	Very high	88.1	Confident	44 Å²	44	55.9 Å²	55.9	19%	0.193	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	143.6	171.2	69.3	-90.5	0	0	0	110.4	V796 R808 A853 V854 G855 R857	V796-F806 CarbonylContact O-C 3.58Å; V796-F806 VanDerWaalsContact O-CA 3.23Å; V796-F806 WeakPolarHBondContact O-CA 3.09Å; F806-R808 HydrophobicContact CD2-CB 4.12Å; F806-R808 HydrophobicContact CE2-CB 4.44Å; F806-A853 HydrophobicContact CE2-CB 4.22Å; F806-V854 WeakPolarHBondContact O-CA 3.26Å; F806-G855 WeakPolarHBondContact CD1-O 3.5Å; F806-G855 VanDerWaalsContact CE1-C 3.46Å; F806-G855 VanDerWaalsContact CE1-CA 3.41Å; F806-G855 PolarHBondContact N-O 3.34Å; F806-G855 PolarHBondContact O-N 2.89Å; F806-R857 HydrophobicContact CD1-CG 4.48Å
807	F	93.4	Very high	87.3	Confident	86 Å²	86	54.7 Å²	54.7	38%	0.377	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	133.9	160.5	169.6	-89.8	0	0	0	107.3	Q795 V796 V852 A853 V854	Q795-F807 CarbonylContact C-O 3.6Å; Q795-F807 WeakPolarHBondContact CA-O 3.41Å; V796-F807 HydrophobicContact CB-CB 4.46Å; V796-F807 PolarHBondContact N-O 2.93Å; V796-F807 PolarHBondContact O-N 2.52Å; F807-V852 HydrophobicContact CD2-CG1 4.36Å; F807-V852 HydrophobicContact CE2-CG1 3.51Å; F807-V852 HydrophobicContact CZ-CG1 3.97Å; F807-A853 CarbonylContact C-O 3.45Å; F807-A853 WeakPolarHBondContact CA-O 3.36Å; F807-V854 HydrophobicContact CD2-CG2 3.94Å
808	R	92.6	Very high	86.5	Confident	13 Å²	13	58.8 Å²	58.8	5%	0.049	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	141	180	179.4	173.9	173.5	165.3	-5.7	110.8	M793 L794 Q795 F806 D810 V852 A853 I990	M793-R808 PolarHBondContact SD-NH2 2.92Å; L794-R808 CarbonylContact O-C 3.57Å; L794-R808 VanDerWaalsContact O-CA 3.3Å; L794-R808 WeakPolarHBondContact O-CA 3.11Å; Q795-R808 HydrophobicContact CB-CG 4.5Å; Q795-R808 HydrophobicContact CG-CB 4.32Å; F806-R808 HydrophobicContact CD2-CB 4.12Å; F806-R808 HydrophobicContact CE2-CB 4.44Å; R808-D810 VanDerWaalsContact CG-OD1 3.27Å; R808-D810 WeakPolarHBondContact CG-OD1 3.44Å; R808-D810 IonicContact CZ-OD1 2.63Å; R808-D810 IonicContact CZ-OD2 2.74Å; R808-D810 IonicContact NE-OD1 3.57Å; R808-D810 PolarHBondContact NE-OD1 3.47Å; R808-D810 IonicContact NE-OD2 2.71Å; R808-D810 PolarHBondContact NE-OD2 3.47Å; R808-D810 VanDerWaalsContact NE-OD2 3.16Å; R808-D810 IonicContact NH2-OD1 3.61Å; R808-D810 IonicContact NH2-OD2 3.33Å; R808-D810 PolarHBondContact NH2-OD2 3.32Å; R808-V852 CarbonylContact O-C 3.58Å; R808-V852 WeakPolarHBondContact O-CA 3.5Å; R808-A853 HydrophobicContact CB-CB 4.41Å; R808-A853 PolarHBondContact N-O 3.09Å; R808-A853 PolarHBondContact O-N 3.45Å; R808-I990 VanDerWaalsContact CZ-O 3.28Å; R808-I990 PolarHBondContact NH1-O 3.1Å; R808-I990 PolarHBondContact NH2-O 3.01Å
809	S	93.3	Very high	85.5	Confident	35 Å²	35	61.5 Å²	61.5	25%	0.245	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	125.1	171.6	-177.8	0	0	0	0	109.4	L794 S851	L794-S809 PolarHBondContact N-O 3.29Å; L794-S809 PolarHBondContact O-N 3.03Å; S809-S851 CarbonylContact C-O 3.52Å; S809-S851 VanDerWaalsContact CA-O 3.28Å; S809-S851 WeakPolarHBondContact CA-O 3.36Å
810	D	92	Very high	84.8	Confident	3 Å²	3	64 Å²	64	2%	0.016	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	124.9	177.9	-63.4	7.9	0	0	0	108.6	T791 M793 R808 V812 A850 S851	T791-D810 HydrophobicContact CG2-CB 4.43Å; M793-D810 HydrophobicContact CG-CB 4.39Å; R808-D810 VanDerWaalsContact CG-OD1 3.27Å; R808-D810 WeakPolarHBondContact CG-OD1 3.44Å; R808-D810 IonicContact CZ-OD1 2.63Å; R808-D810 IonicContact CZ-OD2 2.74Å; R808-D810 IonicContact NE-OD1 3.57Å; R808-D810 PolarHBondContact NE-OD1 3.47Å; R808-D810 IonicContact NE-OD2 2.71Å; R808-D810 PolarHBondContact NE-OD2 3.47Å; R808-D810 VanDerWaalsContact NE-OD2 3.16Å; R808-D810 IonicContact NH2-OD1 3.61Å; R808-D810 IonicContact NH2-OD2 3.33Å; R808-D810 PolarHBondContact NH2-OD2 3.32Å; D810-V812 HydrophobicContact CB-CG2 4.46Å; D810-A850 CarbonylContact O-C 3.34Å; D810-A850 VanDerWaalsContact O-CA 3.25Å; D810-A850 WeakPolarHBondContact O-CA 3.42Å; D810-S851 PolarHBondContact N-O 3.16Å; D810-S851 PolarHBondContact O-N 3.17Å
811	F	93.2	Very high	84	Confident	110 Å²	110	59.3 Å²	59.3	48%	0.482	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	113.8	171.2	-175.6	-93	0	0	0	108.8	T791 T792 A850	T791-F811 CarbonylContact C-O 3.58Å; T791-F811 WeakPolarHBondContact CA-O 3.28Å; T792-F811 PolarHBondContact N-O 2.59Å; T792-F811 PolarHBondContact O-N 3.14Å; F811-A850 HydrophobicContact CD2-CB 4.26Å
812	V	91.3	Very high	83.8	Confident	39 Å²	39	57.9 Å²	57.9	24%	0.236	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	134.3	-173	-175.3	0	0	0	0	109.2	H790 T791 D810 M814 S848 G849	H790-V812 CarbonylContact O-C 3.31Å; H790-V812 WeakPolarHBondContact O-CA 3.42Å; T791-V812 HydrophobicContact CG2-CG2 3.96Å; D810-V812 HydrophobicContact CB-CG2 4.46Å; V812-M814 HydrophobicContact CG1-CG 3.75Å; V812-M814 HydrophobicContact CG1-SD 4.18Å; V812-S848 CarbonylContact O-C 3.54Å; V812-S848 WeakPolarHBondContact O-CA 3.48Å; V812-S848 WeakPolarHBondContact O-CB 3.42Å; V812-G849 PolarHBondContact N-O 3.36Å; V812-G849 PolarHBondContact O-N 2.96Å
813	N	91.5	Very high	84.1	Confident	69 Å²	69	58.2 Å²	58.2	37%	0.369	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	123	168.4	179.5	-30.8	0	0	0	107.9	A789 H790	A789-N813 CarbonylContact C-O 3.51Å; A789-N813 WeakPolarHBondContact CA-O 3.35Å; A789-N813 WeakPolarHBondContact CB-O 3.4Å; H790-N813 HydrophobicContact CB-CB 4.42Å; H790-N813 PolarHBondContact N-O 2.86Å; H790-N813 PolarHBondContact O-N 3.2Å
814	M	88.9	Confident	83.7	Confident	74 Å²	74	64 Å²	64	37%	0.365	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	145.4	-178.2	-62.7	-179.4	71	0	0	110.9	W776 L787 K788 A789 V812 S846 D847	W776-M814 HydrophobicContact CZ2-CE 4.48Å; L787-M814 HydrophobicContact CD1-CB 4.4Å; L787-M814 HydrophobicContact CD1-CE 3.91Å; L787-M814 HydrophobicContact CD2-CE 4.12Å; K788-M814 CarbonylContact O-C 3.58Å; K788-M814 WeakPolarHBondContact O-CA 3.21Å; A789-M814 HydrophobicContact CB-CB 4.43Å; A789-M814 HydrophobicContact CB-CG 3.78Å; V812-M814 HydrophobicContact CG1-CG 3.75Å; V812-M814 HydrophobicContact CG1-SD 4.18Å; M814-S846 CarbonylContact O-C 3.56Å; M814-S846 WeakPolarHBondContact O-CA 3.37Å; M814-S846 WeakPolarHBondContact O-CB 3.28Å; M814-D847 PolarHBondContact N-O 3.45Å; M814-D847 PolarHBondContact O-N 3.4Å
815	N	87.6	Confident	83.1	Confident	70 Å²	70	63 Å²	63	37%	0.374	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	118.8	175.2	-177.5	-25.2	0	0	0	109.5	L787 K788 G817 Q845	L787-N815 CarbonylContact C-O 3.53Å; L787-N815 VanDerWaalsContact CA-O 3.31Å; L787-N815 WeakPolarHBondContact CA-O 3.4Å; L787-N815 WeakPolarHBondContact CD1-O 3.16Å; K788-N815 PolarHBondContact N-O 3.48Å; K788-N815 PolarHBondContact O-N 3.32Å; N815-G817 VanDerWaalsContact C-N 3.27Å; N815-G817 PolarHBondContact O-N 3.28Å; N815-G817 PolarHBondContact OD1-N 3.43Å; N815-Q845 WeakPolarHBondContact CA-O 3.36Å
816	V	80.9	Confident	82.3	Confident	44 Å²	44	62.6 Å²	62.6	27%	0.267	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	1.7	-177.1	-62.4	0	0	0	0	114.3	S785 D786 L787 Q845	S785-V816 PolarHBondContact OG-O 3.44Å; D786-V816 PolarHBondContact N-O 2.67Å; D786-V816 CarbonylContact O-C 3.57Å; L787-V816 HydrophobicContact CD1-CG1 4.04Å; V816-Q845 HydrophobicContact CG2-CB 3.75Å; V816-Q845 WeakPolarHBondContact CG2-O 3.27Å; V816-Q845 PolarHBondContact N-O 2.97Å
817	G	78.7	Confident	81.2	Confident	18 Å²	18	62.4 Å²	62.4	19%	0.186	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	79.4	-155.1	-174	0	0	0	0	0	112.8	D786 N815 S844	D786-G817 PolarHBondContact O-N 3.09Å; N815-G817 VanDerWaalsContact C-N 3.27Å; N815-G817 PolarHBondContact O-N 3.28Å; N815-G817 PolarHBondContact OD1-N 3.43Å; G817-S844 VanDerWaalsContact O-CA 3.26Å; G817-S844 WeakPolarHBondContact O-CA 3.38Å; G817-S844 WeakPolarHBondContact O-CB 3.3Å
818	S	75.8	Confident	79.8	Confident	93 Å²	93	63.2 Å²	63.2	65%	0.65	37%	0.365	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-137.6	136.6	179.6	61	0	0	0	0	113.1	R843	S818-R843 WeakPolarHBondContact CA-O 3.43Å
819	F	69.7	Low	78.2	Confident	66 Å²	66	64.4 Å²	64.4	29%	0.289	37%	0.372	S	S	.	.			trans	-74.8	147.4	176.5	-56.7	-85.9	0	0	0	112.7	Y784 R843	Y784-F819 WeakPolarHBondContact O-CD1 3.41Å; Y784-F819 WeakPolarHBondContact O-CE1 3.28Å; F819-R843 WeakPolarHBondContact CD2-O 3.27Å; F819-R843 PolarHBondContact N-O 3.35Å
820	S	70.9	Confident	76.7	Confident	95 Å²	95	69.8 Å²	69.8	66%	0.664	40%	0.398	S	S	*	.			trans	-78.8	134.8	165.4	53.7	0	0	0	0	111.1
821	T	68	Low	75	Confident	52 Å²	52	79.7 Å²	79.7	32%	0.319	44%	0.435	S	S	.	.			trans	-107.9	160.9	176.3	58.3	0	0	0	0	111.8	K826 W827	T821-K826 WeakPolarHBondContact CA-O 3.45Å; T821-K826 WeakPolarHBondContact CB-O 3.43Å; T821-W827 HydrophobicContact CG2-CE3 4.45Å
822	N	72.4	Confident	73.5	Confident	70 Å²	70	77.1 Å²	77.1	37%	0.374	44%	0.44	S	S	.	.			trans	-65.8	177.2	162.7	69	15.7	0	0	0	111.2	D824 G825 K826	N822-D824 PolarHBondContact O-N 3.29Å; N822-D824 VanDerWaalsContact O-N 3.1Å; N822-D824 PolarHBondContact OD1-N 2.89Å; N822-D824 VanDerWaalsContact OD1-N 3.1Å; N822-G825 PolarHBondContact O-N 3.47Å; N822-G825 PolarHBondContact OD1-N 3.4Å; N822-K826 PolarHBondContact N-O 2.94Å; N822-K826 PolarHBondContact OD1-N 2.93Å; N822-K826 PolarHBondContact OD1-O 2.93Å
823	A	76.1	Confident	72.3	Confident	109 Å²	109	80.6 Å²	80.6	90%	0.901	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	-25.3	-178.9	0	0	0	0	0	113.9	G825	A823-G825 VanDerWaalsContact C-N 3.32Å
824	D	73.3	Confident	71.1	Confident	133 Å²	133	78.1 Å²	78.1	71%	0.711	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90	5	-179.3	-60.9	-35.9	0	0	0	113	N822 K826	N822-D824 PolarHBondContact O-N 3.29Å; N822-D824 VanDerWaalsContact O-N 3.1Å; N822-D824 PolarHBondContact OD1-N 2.89Å; N822-D824 VanDerWaalsContact OD1-N 3.1Å; D824-K826 PolarHBondContact O-N 3.44Å
825	G	72.5	Confident	69.8	Low	9 Å²	9	77.4 Å²	77.4	9%	0.093	45%	0.449	C	S	.	.	S	Bend	trans	71.8	17.2	-179.5	0	0	0	0	0	114	N822 A823 R843	N822-G825 PolarHBondContact O-N 3.47Å; N822-G825 PolarHBondContact OD1-N 3.4Å; A823-G825 VanDerWaalsContact C-N 3.32Å; G825-R843 PolarHBondContact O-NH2 3.2Å
826	K	73.8	Confident	68.9	Low	82 Å²	82	81.6 Å²	81.6	36%	0.357	47%	0.471	S	S	.	.			trans	-103.2	157	175.1	-62.3	-179.1	177	-176.2	0	110.4	T821 N822 D824 D838 C839	T821-K826 WeakPolarHBondContact CA-O 3.45Å; T821-K826 WeakPolarHBondContact CB-O 3.43Å; N822-K826 PolarHBondContact N-O 2.94Å; N822-K826 PolarHBondContact OD1-N 2.93Å; N822-K826 PolarHBondContact OD1-O 2.93Å; D824-K826 PolarHBondContact O-N 3.44Å; K826-D838 HydrophobicContact CB-CB 4.11Å; K826-D838 HydrophobicContact CD-CB 3.7Å; K826-D838 WeakPolarHBondContact CD-OD2 3.25Å; K826-D838 HydrophobicContact CG-CB 4.4Å; K826-D838 IonicContact NZ-OD2 3.26Å; K826-C839 WeakPolarHBondContact CA-O 3.17Å
827	W	69.9	Low	68.3	Low	40 Å²	40	86.9 Å²	86.9	15%	0.152	49%	0.492	C	S	.	.	B	Isolated β-bridge	trans	-122.1	138.9	166.8	67.8	95.7	0	0	0	109.3	T821 C839 S840 G841 R843	T821-W827 HydrophobicContact CG2-CE3 4.45Å; W827-C839 HydrophobicContact CD2-CB 4.02Å; W827-C839 VanDerWaalsContact CE3-O 3.3Å; W827-C839 HydrophobicContact CH2-CB 3.93Å; W827-C839 HydrophobicContact CZ2-CB 3.27Å; W827-C839 PolarHBondContact N-O 2.79Å; W827-C839 VanDerWaalsContact N-O 3.14Å; W827-C839 PolarHBondContact O-N 2.97Å; W827-S840 VanDerWaalsContact CH2-C 3.41Å; W827-S840 VanDerWaalsContact CZ3-C 3.46Å; W827-G841 WeakPolarHBondContact CH2-O 2.88Å; W827-G841 WeakPolarHBondContact CZ3-O 3.44Å; W827-R843 HydrophobicContact CZ3-CG 4.28Å
828	D	64.6	Low	67.9	Low	104 Å²	104	89.1 Å²	89.1	56%	0.556	50%	0.5	S	S	*	.			trans	-117.6	99	177.4	174.4	17.6	0	0	0	105.7
829	D	59	Low	67.9	Low	38 Å²	38	85.9 Å²	85.9	20%	0.203	48%	0.477	C	S	.	.			trans	-123.1	145.3	-178.8	-81.9	-43.6	0	0	0	110.4	Y784 W831 C834 T835	Y784-D829 WeakPolarHBondContact CE1-OD1 3.48Å; D829-W831 PolarHBondContact O-N 2.95Å; D829-C834 CarbonylContact O-C 3.53Å; D829-T835 WeakPolarHBondContact O-CA 3.19Å; D829-T835 PolarHBondContact O-N 2.9Å; D829-T835 VanDerWaalsContact O-N 3.15Å; D829-T835 PolarHBondContact O-OG1 3.35Å
830	N	59.9	Low	68.2	Low	147 Å²	147	87.1 Å²	87.1	79%	0.786	49%	0.494	S	S	*	.	S	Bend	trans	-71.4	38.7	176.3	-81.4	-27.6	0	0	0	113.2	T835	N830-T835 WeakPolarHBondContact CA-OG1 3.24Å; N830-T835 WeakPolarHBondContact OD1-CG2 3.37Å
831	W	56.2	Low	68.3	Low	211 Å²	211	84.3 Å²	84.3	80%	0.799	48%	0.48	S	S	*	.	S	Bend	trans	-133.5	129.6	-179.4	-164.7	72.8	0	0	0	113.1	D829 C834 T835	D829-W831 PolarHBondContact O-N 2.95Å; W831-C834 PolarHBondContact O-N 3.27Å; W831-T835 PolarHBondContact N-OG1 3.46Å
832	G	62.7	Low	68.4	Low	57 Å²	57	88 Å²	88	59%	0.588	50%	0.498	S	S	*	.	G	3₁₀ helix	trans	61.1	-142.9	177.8	0	0	0	0	0	113.4	C834	G832-C834 PolarHBondContact O-N 3.48Å
833	T	66.2	Low	68.3	Low	111 Å²	111	90 Å²	90	68%	0.681	50%	0.5	S	S	*	.	G	3₁₀ helix	trans	-72.7	-14.5	177.5	50.7	0	0	0	0	113.1	T835 L836 Q837	T833-T835 PolarHBondContact O-N 3.36Å; T833-L836 PolarHBondContact O-N 3.05Å; T833-L836 VanDerWaalsContact O-N 3.14Å; T833-Q837 PolarHBondContact O-N 3.32Å
834	C	66	Low	68.3	Low	17 Å²	17	88.6 Å²	88.6	12%	0.115	48%	0.484	C	S	.	.	G	3₁₀ helix	trans	-68.5	-21.5	-178	-58.3	0	0	0	0	113.1	D829 W831 G832 L836 Q837 C839	D829-C834 CarbonylContact O-C 3.53Å; W831-C834 PolarHBondContact O-N 3.27Å; G832-C834 PolarHBondContact O-N 3.48Å; C834-L836 VanDerWaalsContact C-N 3.29Å; C834-L836 PolarHBondContact O-N 3.24Å; C834-Q837 CarbonylContact C-O 3.39Å; C834-Q837 VanDerWaalsContact CA-O 3.3Å; C834-Q837 WeakPolarHBondContact CA-O 3.39Å; C834-Q837 CarbonylContact O-C 3.33Å; C834-Q837 PolarHBondContact O-N 2.83Å; C834-Q837 VanDerWaalsContact O-O 3.06Å; C834-C839 WeakPolarHBondContact CA-SG 3.34Å; C834-C839 HydrophobicContact CB-CB 3.92Å; C834-C839 WeakPolarHBondContact CB-SG 3.46Å; C834-C839 WeakPolarHBondContact SG-CB 3.36Å; C834-C839 CovalentContact SG-SG 2.04Å; C834-C839 PolarHBondContact SG-SG 3.4Å
835	T	62.6	Low	68.7	Low	60 Å²	60	87.7 Å²	87.7	37%	0.368	48%	0.475	S	S	.	.	G	3₁₀ helix	trans	-70.7	-26.1	173.9	-46.4	0	0	0	0	113.1	D829 N830 W831 T833	D829-T835 WeakPolarHBondContact O-CA 3.19Å; D829-T835 PolarHBondContact O-N 2.9Å; D829-T835 VanDerWaalsContact O-N 3.15Å; D829-T835 PolarHBondContact O-OG1 3.35Å; N830-T835 WeakPolarHBondContact CA-OG1 3.24Å; N830-T835 WeakPolarHBondContact OD1-CG2 3.37Å; W831-T835 PolarHBondContact N-OG1 3.46Å; T833-T835 PolarHBondContact O-N 3.36Å
836	L	67.9	Low	69.4	Low	158 Å²	158	91.4 Å²	91.4	83%	0.827	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.1	-23.5	179.4	-60.7	174.3	0	0	0	111.2	T833 C834	T833-L836 PolarHBondContact O-N 3.05Å; T833-L836 VanDerWaalsContact O-N 3.14Å; C834-L836 VanDerWaalsContact C-N 3.29Å; C834-L836 PolarHBondContact O-N 3.24Å
837	Q	67.9	Low	70.1	Confident	154 Å²	154	93.5 Å²	93.5	72%	0.72	52%	0.515	S	S	*	.	S	Bend	trans	-160.1	127	-176.1	-177.6	174.7	2.6	0	0	110.7	T833 C834 C839	T833-Q837 PolarHBondContact O-N 3.32Å; C834-Q837 CarbonylContact C-O 3.39Å; C834-Q837 VanDerWaalsContact CA-O 3.3Å; C834-Q837 WeakPolarHBondContact CA-O 3.39Å; C834-Q837 CarbonylContact O-C 3.33Å; C834-Q837 PolarHBondContact O-N 2.83Å; C834-Q837 VanDerWaalsContact O-O 3.06Å; Q837-C839 PolarHBondContact O-N 3.4Å
838	D	71.5	Confident	71.2	Confident	66 Å²	66	94.9 Å²	94.9	35%	0.353	53%	0.531	S	S	.	.			trans	-45.9	130.2	175.4	-57.7	-14.3	0	0	0	112.9	K826	K826-D838 HydrophobicContact CB-CB 4.11Å; K826-D838 HydrophobicContact CD-CB 3.7Å; K826-D838 WeakPolarHBondContact CD-OD2 3.25Å; K826-D838 HydrophobicContact CG-CB 4.4Å; K826-D838 IonicContact NZ-OD2 3.26Å
839	C	74.3	Confident	72.4	Confident	25 Å²	25	91.8 Å²	91.8	17%	0.169	52%	0.523	C	S	.	.	B	Isolated β-bridge	trans	-95.6	153.3	179.3	-74	0	0	0	0	112.1	K826 W827 C834 Q837	K826-C839 WeakPolarHBondContact CA-O 3.17Å; W827-C839 HydrophobicContact CD2-CB 4.02Å; W827-C839 VanDerWaalsContact CE3-O 3.3Å; W827-C839 HydrophobicContact CH2-CB 3.93Å; W827-C839 HydrophobicContact CZ2-CB 3.27Å; W827-C839 PolarHBondContact N-O 2.79Å; W827-C839 VanDerWaalsContact N-O 3.14Å; W827-C839 PolarHBondContact O-N 2.97Å; C834-C839 WeakPolarHBondContact CA-SG 3.34Å; C834-C839 HydrophobicContact CB-CB 3.92Å; C834-C839 WeakPolarHBondContact CB-SG 3.46Å; C834-C839 WeakPolarHBondContact SG-CB 3.36Å; C834-C839 CovalentContact SG-SG 2.04Å; C834-C839 PolarHBondContact SG-SG 3.4Å; Q837-C839 PolarHBondContact O-N 3.4Å
840	S	76.2	Confident	73.9	Confident	91 Å²	91	93.5 Å²	93.5	64%	0.636	54%	0.543	S	S	*	.			trans	-144.8	150.4	177.9	71.3	0	0	0	0	111.4	W827	W827-S840 VanDerWaalsContact CH2-C 3.41Å; W827-S840 VanDerWaalsContact CZ3-C 3.46Å
841	G	73.7	Confident	75.4	Confident	36 Å²	36	89.2 Å²	89.2	37%	0.371	53%	0.525	S	S	.	.	S	Bend	trans	95.8	-177.1	-175.8	0	0	0	0	0	114.6	W827 R843	W827-G841 WeakPolarHBondContact CH2-O 2.88Å; W827-G841 WeakPolarHBondContact CZ3-O 3.44Å; G841-R843 PolarHBondContact O-N 3.1Å
842	N	70	Confident	77	Confident	129 Å²	129	83.9 Å²	83.9	69%	0.69	52%	0.515	S	S	*	.			trans	44	36.4	172.4	-62	-27.1	0	0	0	116.9	S844	N842-S844 VanDerWaalsContact C-N 3.26Å; N842-S844 PolarHBondContact O-N 3.34Å
843	R	70	Confident	78.2	Confident	113 Å²	113	82.5 Å²	82.5	43%	0.426	50%	0.498	S	S	.	.			trans	-70.8	-19.8	-170.1	-62.6	-176.2	-175.4	165.2	4.3	114.4	S818 F819 G825 W827 G841	S818-R843 WeakPolarHBondContact CA-O 3.43Å; F819-R843 WeakPolarHBondContact CD2-O 3.27Å; F819-R843 PolarHBondContact N-O 3.35Å; G825-R843 PolarHBondContact O-NH2 3.2Å; W827-R843 HydrophobicContact CZ3-CG 4.28Å; G841-R843 PolarHBondContact O-N 3.1Å
844	S	75.6	Confident	79.3	Confident	80 Å²	80	82.8 Å²	82.8	56%	0.559	50%	0.499	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-144.7	138.4	176.8	59.2	0	0	0	0	108.7	G817 N842	G817-S844 VanDerWaalsContact O-CA 3.26Å; G817-S844 WeakPolarHBondContact O-CA 3.38Å; G817-S844 WeakPolarHBondContact O-CB 3.3Å; N842-S844 VanDerWaalsContact C-N 3.26Å; N842-S844 PolarHBondContact O-N 3.34Å
845	Q	81.5	Confident	80.4	Confident	113 Å²	113	83.1 Å²	83.1	53%	0.528	51%	0.505	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	138.2	175	-63.1	179.9	-24.7	0	0	109.7	N815 V816	N815-Q845 WeakPolarHBondContact CA-O 3.36Å; V816-Q845 HydrophobicContact CG2-CB 3.75Å; V816-Q845 WeakPolarHBondContact CG2-O 3.27Å; V816-Q845 PolarHBondContact N-O 2.97Å
846	S	87.6	Confident	81.4	Confident	87 Å²	87	86 Å²	86	61%	0.608	51%	0.509	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-137.3	143.9	168.3	60.6	0	0	0	0	108.4	M814	M814-S846 CarbonylContact O-C 3.56Å; M814-S846 WeakPolarHBondContact O-CA 3.37Å; M814-S846 WeakPolarHBondContact O-CB 3.28Å
847	D	89.9	Confident	81.9	Confident	126 Å²	126	84.2 Å²	84.2	67%	0.674	49%	0.492	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-140.8	155.8	175.7	-158.7	2.3	0	0	0	110.2	M814	M814-D847 PolarHBondContact N-O 3.45Å; M814-D847 PolarHBondContact O-N 3.4Å
848	S	91.5	Very high	82.1	Confident	69 Å²	69	80.6 Å²	80.6	48%	0.483	48%	0.477	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	139.1	175.2	64.8	0	0	0	0	110.8	V812	V812-S848 CarbonylContact O-C 3.54Å; V812-S848 WeakPolarHBondContact O-CA 3.48Å; V812-S848 WeakPolarHBondContact O-CB 3.42Å
849	G	91.3	Very high	81.5	Confident	39 Å²	39	84.9 Å²	84.9	40%	0.402	50%	0.5	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	161.9	-177.6	0	0	0	0	0	112.3	V812	V812-G849 PolarHBondContact N-O 3.36Å; V812-G849 PolarHBondContact O-N 2.96Å
850	A	90.2	Very high	79.8	Confident	75 Å²	75	87.3 Å²	87.3	62%	0.62	53%	0.53	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.4	132.7	171.2	0	0	0	0	0	109.4	D810 F811	D810-A850 CarbonylContact O-C 3.34Å; D810-A850 VanDerWaalsContact O-CA 3.25Å; D810-A850 WeakPolarHBondContact O-CA 3.42Å; F811-A850 HydrophobicContact CD2-CB 4.26Å
851	S	90	Very high	77.6	Confident	57 Å²	57	86.9 Å²	86.9	40%	0.399	54%	0.54	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	140.9	171.4	64	0	0	0	0	110.4	S809 D810	S809-S851 CarbonylContact C-O 3.52Å; S809-S851 VanDerWaalsContact CA-O 3.28Å; S809-S851 WeakPolarHBondContact CA-O 3.36Å; D810-S851 PolarHBondContact N-O 3.16Å; D810-S851 PolarHBondContact O-N 3.17Å
852	V	90.5	Very high	75.7	Confident	99 Å²	99	95.2 Å²	95.2	60%	0.6	56%	0.561	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-120.8	133.2	174.9	179.2	0	0	0	0	108.7	F807 R808	F807-V852 HydrophobicContact CD2-CG1 4.36Å; F807-V852 HydrophobicContact CE2-CG1 3.51Å; F807-V852 HydrophobicContact CZ-CG1 3.97Å; R808-V852 CarbonylContact O-C 3.58Å; R808-V852 WeakPolarHBondContact O-CA 3.5Å
853	A	88	Confident	73.8	Confident	28 Å²	28	99 Å²	99	23%	0.231	57%	0.567	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-130	142.1	177.2	0	0	0	0	0	110.9	F806 F807 R808	F806-A853 HydrophobicContact CE2-CB 4.22Å; F807-A853 CarbonylContact C-O 3.45Å; F807-A853 WeakPolarHBondContact CA-O 3.36Å; R808-A853 HydrophobicContact CB-CB 4.41Å; R808-A853 PolarHBondContact N-O 3.09Å; R808-A853 PolarHBondContact O-N 3.45Å
854	V	89.9	Confident	72	Confident	117 Å²	117	97.3 Å²	97.3	71%	0.709	57%	0.573	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-126.4	132.7	165.9	-179.2	0	0	0	0	106.7	F806 F807	F806-V854 WeakPolarHBondContact O-CA 3.26Å; F807-V854 HydrophobicContact CD2-CG2 3.94Å
855	G	87.9	Confident	70	Confident	23 Å²	23	98.6 Å²	98.6	24%	0.237	58%	0.579	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-154.8	175.7	178.4	0	0	0	0	0	112.5	M805 F806	M805-G855 CarbonylContact C-O 3.52Å; M805-G855 VanDerWaalsContact CA-O 3.29Å; M805-G855 WeakPolarHBondContact CA-O 3.32Å; F806-G855 WeakPolarHBondContact CD1-O 3.5Å; F806-G855 VanDerWaalsContact CE1-C 3.46Å; F806-G855 VanDerWaalsContact CE1-CA 3.41Å; F806-G855 PolarHBondContact N-O 3.34Å; F806-G855 PolarHBondContact O-N 2.89Å
856	W	84.4	Confident	68.1	Low	120 Å²	120	102.4 Å²	102.4	46%	0.455	60%	0.597	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-126.8	136.5	172.8	176.3	89.2	0	0	0	107.9	Y800 D802 R804 N858	Y800-W856 AromaticContact CD1-CD1 3.81Å; Y800-W856 PolarHBondContact O-NE1 3.49Å; D802-W856 WeakPolarHBondContact OD1-CZ2 3.3Å; R804-W856 WeakPolarHBondContact O-CA 3.44Å; W856-N858 HydrophobicContact CH2-CB 3.4Å; W856-N858 VanDerWaalsContact CH2-CB 3.4Å; W856-N858 HydrophobicContact CZ2-CB 3.83Å; W856-N858 HydrophobicContact CZ3-CB 3.89Å
857	R	78.9	Confident	66.3	Low	122 Å²	122	107.9 Å²	107.9	46%	0.46	61%	0.613	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-130.3	145.9	178.2	63.3	175.4	175.1	157.5	-2.3	111.6	D797 G803 R804 F806	D797-R857 IonicContact OD1-CZ 3.16Å; D797-R857 IonicContact OD1-NE 3.88Å; D797-R857 PolarHBondContact OD1-NE 3.36Å; D797-R857 IonicContact OD1-NH2 3.49Å; D797-R857 PolarHBondContact OD1-NH2 2.85Å; D797-R857 IonicContact OD2-NH2 2.77Å; G803-R857 WeakPolarHBondContact CA-O 3.37Å; R804-R857 HydrophobicContact CB-CG 4.35Å; R804-R857 PolarHBondContact N-O 3.32Å; R804-R857 PolarHBondContact O-N 2.94Å; F806-R857 HydrophobicContact CD1-CG 4.48Å
858	N	71.7	Confident	65.4	Low	77 Å²	77	109.4 Å²	109.4	41%	0.412	61%	0.611	S	S	.	*			trans	-139	164.1	168.1	-165.9	-5.7	0	0	0	107.5	D802 W856 G860	D802-N858 PolarHBondContact OD2-ND2 3.36Å; W856-N858 HydrophobicContact CH2-CB 3.4Å; W856-N858 VanDerWaalsContact CH2-CB 3.4Å; W856-N858 HydrophobicContact CZ2-CB 3.83Å; W856-N858 HydrophobicContact CZ3-CB 3.89Å; N858-G860 PolarHBondContact O-N 3.19Å
859	D	58.6	Low	64.9	Low	157 Å²	157	110.8 Å²	110.8	84%	0.84	61%	0.612	S	S	*	*			trans	-57.2	101.8	-171.9	-66.6	-28.8	0	0	0	111.5
860	G	38.5	Very low	64.5	Low	76 Å²	76	111.5 Å²	111.5	78%	0.784	61%	0.611	S	S	*	*	P	Polyproline II helix	trans	-100.4	135.8	-176.1	0	0	0	0	0	112.6	N858	N858-G860 PolarHBondContact O-N 3.19Å
861	G	29.6	Very low	64.4	Low	82 Å²	82	114 Å²	114	85%	0.845	61%	0.608	S	S	*	*	P	Polyproline II helix	trans	-73.3	156.5	-176	0	0	0	0	0	115.6
862	Y	35.1	Very low	64.2	Low	210 Å²	210	114 Å²	114	82%	0.824	61%	0.611	S	S	*	*	P	Polyproline II helix	trans	-75	131.3	179.8	179	-102.8	0	0	0	112.4
863	Y	30.2	Very low	64.3	Low	209 Å²	209	115.7 Å²	115.7	82%	0.82	62%	0.615	S	S	*	*			trans	-108.4	125.6	174.3	-177	-101	0	0	0	109.8
864	S	31.5	Very low	64.5	Low	78 Å²	78	118.4 Å²	118.4	55%	0.545	63%	0.631	S	S	.	*			trans	-109.9	128.5	-173.7	-173.5	0	0	0	0	111.8
865	P	32.4	Very low	64.7	Low	106 Å²	106	117.8 Å²	117.8	69%	0.688	63%	0.627	S	S	*	*			trans	-88.6	164	-179.5	30.4	-29.8	0	0	0	115.2
866	Q	43.1	Very low	65	Low	193 Å²	193	120.7 Å²	120.7	90%	0.902	64%	0.635	S	S	*	*	S	Bend	trans	-95.1	107.2	-170.4	-65.3	173.6	-2.8	0	0	112.7
867	E	49.3	Very low	65.5	Low	202 Å²	202	121.4 Å²	121.4	94%	0.944	64%	0.638	S	S	*	*			trans	75.3	103.4	162	-57.4	-171	-172.6	0	0	121.3
868	Y	71.9	Confident	66.3	Low	159 Å²	159	121.5 Å²	121.5	62%	0.624	64%	0.638	S	S	*	*			trans	-152.4	140.3	167.8	164.4	-104.2	0	0	0	107.3	S870 S895	Y868-S870 VanDerWaalsContact CE1-CB 3.43Å; Y868-S870 VanDerWaalsContact CE1-OG 3.28Å; Y868-S870 WeakPolarHBondContact CE1-OG 3.29Å; Y868-S895 WeakPolarHBondContact OH-CB 3.37Å
869	L	80.5	Confident	67.3	Low	97 Å²	97	121.8 Å²	121.8	51%	0.508	64%	0.637	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-114.6	113.7	178.1	-174.5	67.1	0	0	0	111.2	F871 H896	L869-F871 HydrophobicContact CD1-CE2 4.07Å; L869-F871 HydrophobicContact CD1-CZ 4.31Å; L869-F871 HydrophobicContact CD2-CE2 4.09Å; L869-F871 HydrophobicContact CG-CE2 4.04Å; L869-H896 PolarHBondContact O-N 3.46Å
870	S	82.1	Confident	69	Low	54 Å²	54	118.1 Å²	118.1	38%	0.378	61%	0.612	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-132.4	146.9	169.1	62.5	0	0	0	0	111.1	Y868 W894	Y868-S870 VanDerWaalsContact CE1-CB 3.43Å; Y868-S870 VanDerWaalsContact CE1-OG 3.28Å; Y868-S870 WeakPolarHBondContact CE1-OG 3.29Å; S870-W894 WeakPolarHBondContact CA-O 3.02Å
871	F	88.1	Confident	71.5	Confident	129 Å²	129	117.3 Å²	117.3	57%	0.566	59%	0.592	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-113.6	126.6	168.7	-68.2	-89.8	0	0	0	107.7	L869 S893 W894	L869-F871 HydrophobicContact CD1-CE2 4.07Å; L869-F871 HydrophobicContact CD1-CZ 4.31Å; L869-F871 HydrophobicContact CD2-CE2 4.09Å; L869-F871 HydrophobicContact CG-CE2 4.04Å; F871-S893 CarbonylContact O-C 3.44Å; F871-S893 VanDerWaalsContact O-CA 3.29Å; F871-S893 WeakPolarHBondContact O-CA 3.29Å; F871-W894 AromaticContact CD2-CE3 3.73Å; F871-W894 HydrophobicContact CD2-CE3 3.73Å; F871-W894 AromaticContact CD2-CZ3 3.73Å; F871-W894 HydrophobicContact CD2-CZ3 3.73Å; F871-W894 HydrophobicContact CE2-CE3 4.49Å; F871-W894 HydrophobicContact CE2-CZ3 4.04Å; F871-W894 PolarHBondContact N-O 3.04Å; F871-W894 PolarHBondContact O-N 3.25Å
872	A	86.8	Confident	74.4	Confident	56 Å²	56	118.9 Å²	118.9	46%	0.463	58%	0.577	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-136	144.3	178.5	0	0	0	0	0	111.2	P874 G892	A872-P874 WeakPolarHBondContact O-CD 3.49Å; A872-G892 CarbonylContact C-O 3.55Å; A872-G892 VanDerWaalsContact CA-O 3.28Å; A872-G892 WeakPolarHBondContact CA-O 3.47Å
873	I	91.6	Very high	77.2	Confident	134 Å²	134	111.9 Å²	111.9	69%	0.687	55%	0.554	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-111.5	100.3	171.4	-57.3	177.1	0	0	0	107.5	S891 G892	I873-S891 WeakPolarHBondContact O-CA 3.32Å; I873-G892 PolarHBondContact N-O 3.21Å; I873-G892 PolarHBondContact O-N 2.99Å
874	P	93.1	Very high	80.3	Confident	86 Å²	86	106.1 Å²	106.1	56%	0.558	53%	0.531	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.2	138.5	172.9	33.4	-32.1	0	0	0	111.4	A872	A872-P874 WeakPolarHBondContact O-CD 3.49Å
875	V	93.7	Very high	83.4	Confident	103 Å²	103	102.4 Å²	102.4	62%	0.624	51%	0.505	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.2	118.5	164.4	-180	0	0	0	0	106.9	G889 A890	V875-G889 CarbonylContact O-C 3.56Å; V875-G889 VanDerWaalsContact O-CA 3.32Å; V875-G889 WeakPolarHBondContact O-CA 3.46Å; V875-A890 PolarHBondContact N-O 2.83Å; V875-A890 PolarHBondContact O-N 3.47Å
876	M	93.5	Very high	86.5	Confident	85 Å²	85	99.6 Å²	99.6	42%	0.419	48%	0.48	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	131.4	-179.9	-60.4	-61.8	-60.7	0	0	109.2	E887 L888 G889	M876-E887 HydrophobicContact CE-CG 3.48Å; M876-E887 VanDerWaalsContact CE-CG 3.48Å; M876-E887 WeakPolarHBondContact CE-OE1 3.22Å; M876-L888 CarbonylContact C-O 3.48Å; M876-G889 WeakPolarHBondContact SD-CA 3.35Å
877	W	95.1	Very high	89	Confident	135 Å²	135	90.4 Å²	90.4	51%	0.511	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	120.5	170.1	176.3	43	0	0	0	108.7	E879 W886 E887 L888	W877-E879 VanDerWaalsContact CZ2-OE2 3.26Å; W877-E879 WeakPolarHBondContact CZ2-OE2 3.48Å; W877-E879 PolarHBondContact NE1-OE2 2.89Å; W877-W886 AromaticContact CE2-NE1 3.8Å; W877-W886 HydrophobicContact CH2-CZ2 4.45Å; W877-W886 AromaticContact CH2-NE1 3.44Å; W877-W886 HydrophobicContact CZ2-CZ2 4.23Å; W877-W886 AromaticContact CZ2-NE1 3.46Å; W877-W886 AromaticContact CZ3-NE1 3.79Å; W877-E887 CarbonylContact O-C 3.57Å; W877-E887 WeakPolarHBondContact O-CA 3.41Å; W877-L888 HydrophobicContact CE3-CB 4.3Å; W877-L888 HydrophobicContact CE3-CD1 3.77Å; W877-L888 HydrophobicContact CE3-CG 4.23Å; W877-L888 HydrophobicContact CZ3-CD1 3.77Å; W877-L888 PolarHBondContact N-O 3.28Å; W877-L888 PolarHBondContact O-N 2.97Å
878	R	95.2	Very high	91.2	Very high	123 Å²	123	84.6 Å²	84.6	46%	0.464	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	130.3	-179.3	-69.2	174.3	178.2	171.5	-4.5	108	W886 E887 L984	R878-W886 WeakPolarHBondContact CA-O 3.01Å; R878-E887 HydrophobicContact CG-CB 4.01Å; R878-E887 HydrophobicContact CG-CG 3.8Å; R878-E887 IonicContact CZ-OE2 3.97Å; R878-E887 IonicContact NE-OE2 3.05Å; R878-E887 PolarHBondContact NE-OE2 3.49Å; R878-E887 IonicContact NH2-OE2 3.31Å; R878-E887 PolarHBondContact NH2-OE2 3.31Å; R878-L984 HydrophobicContact CB-CD1 3.79Å; R878-L984 HydrophobicContact CB-CG 4.19Å
879	E	93.8	Very high	92.3	Very high	83 Å²	83	77.5 Å²	77.5	39%	0.388	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	154.8	175.2	-176.8	173.5	176.9	0	0	110	W877 W886	W877-E879 VanDerWaalsContact CZ2-OE2 3.26Å; W877-E879 WeakPolarHBondContact CZ2-OE2 3.48Å; W877-E879 PolarHBondContact NE1-OE2 2.89Å; E879-W886 HydrophobicContact CB-CD2 4.43Å; E879-W886 HydrophobicContact CB-CH2 4.32Å; E879-W886 HydrophobicContact CB-CZ2 3.55Å; E879-W886 HydrophobicContact CG-CH2 3.99Å; E879-W886 HydrophobicContact CG-CZ2 3.57Å; E879-W886 PolarHBondContact N-O 3.46Å; E879-W886 VanDerWaalsContact N-O 3.1Å; E879-W886 PolarHBondContact O-N 2.91Å; E879-W886 WeakPolarHBondContact OE2-CZ2 3.47Å
880	R	93.4	Very high	92.9	Very high	80 Å²	80	75.2 Å²	75.2	30%	0.302	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	148	174.6	64.3	179.1	-177.8	-176.4	9.4	110.1	N743 W884 D981 M982 L984	N743-R880 PolarHBondContact ND2-NH2 3.22Å; N743-R880 VanDerWaalsContact ND2-NH2 3.16Å; R880-W884 CarbonylContact C-O 3.47Å; R880-W884 VanDerWaalsContact CA-O 3.24Å; R880-W884 WeakPolarHBondContact CA-O 3.21Å; R880-D981 IonicContact CZ-OD2 2.75Å; R880-D981 VanDerWaalsContact NH1-CB 3.34Å; R880-D981 IonicContact NH1-OD2 3.33Å; R880-D981 VanDerWaalsContact NH2-CG 3.33Å; R880-D981 IonicContact NH2-OD2 3.48Å; R880-D981 PolarHBondContact NH2-OD2 2.84Å; R880-M982 HydrophobicContact CB-CB 4.46Å; R880-M982 VanDerWaalsContact CD-O 3.31Å; R880-M982 WeakPolarHBondContact CD-O 3.44Å; R880-M982 PolarHBondContact NH1-O 3.27Å; R880-M982 VanDerWaalsContact NH1-O 3.12Å; R880-L984 HydrophobicContact CB-CD1 4.32Å; R880-L984 HydrophobicContact CG-CD2 4.38Å
881	T	92.2	Very high	93.4	Very high	60 Å²	60	73.8 Å²	73.8	37%	0.368	37%	0.373	S	S	.	.			trans	-117.9	-174.4	166.4	69.5	0	0	0	0	108.7	N883 W884 W886	T881-N883 PolarHBondContact O-N 2.88Å; T881-N883 VanDerWaalsContact O-N 3.17Å; T881-N883 PolarHBondContact OG1-N 2.72Å; T881-W884 PolarHBondContact N-O 2.86Å; T881-W884 WeakPolarHBondContact OG1-CB 3.45Å; T881-W884 PolarHBondContact OG1-N 2.84Å; T881-W884 VanDerWaalsContact OG1-N 3.14Å; T881-W886 HydrophobicContact CG2-CH2 3.85Å; T881-W886 HydrophobicContact CG2-CZ3 3.95Å
882	E	89	Confident	93.6	Very high	114 Å²	114	69.5 Å²	69.5	53%	0.533	37%	0.365	S	S	.	.	S	Bend	trans	-55.7	-33.1	177.1	-55.5	-166	169.8	0	0	113.9	R742 R943	R742-E882 IonicContact CZ-OE2 2.85Å; R742-E882 VanDerWaalsContact NH1-CG 3.28Å; R742-E882 IonicContact NH1-OE1 3.88Å; R742-E882 PolarHBondContact NH1-OE1 3.45Å; R742-E882 IonicContact NH1-OE2 3.93Å; R742-E882 PolarHBondContact NH1-OE2 3.29Å; R742-E882 IonicContact NH2-OE2 2.69Å; E882-R943 PolarHBondContact O-NH1 3.49Å
883	N	94.6	Very high	93.7	Very high	63 Å²	63	68.4 Å²	68.4	34%	0.337	35%	0.354	S	S	.	.	S	Bend	trans	-127.8	1.9	-172.9	-64.8	-48.2	0	0	0	114	T881 R942 R943	T881-N883 PolarHBondContact O-N 2.88Å; T881-N883 VanDerWaalsContact O-N 3.17Å; T881-N883 PolarHBondContact OG1-N 2.72Å; N883-R942 CarbonylContact O-C 3.55Å; N883-R942 VanDerWaalsContact O-CA 3.28Å; N883-R942 WeakPolarHBondContact O-CA 3.39Å; N883-R943 HydrophobicContact CB-CB 4.28Å; N883-R943 PolarHBondContact O-N 3.38Å
884	W	95.8	Very high	93.5	Very high	89 Å²	89	65.5 Å²	65.5	34%	0.337	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	144.2	-179.2	-67.5	95.7	0	0	0	110.5	R880 T881 W886 L940 E941 R942	R880-W884 CarbonylContact C-O 3.47Å; R880-W884 VanDerWaalsContact CA-O 3.24Å; R880-W884 WeakPolarHBondContact CA-O 3.21Å; T881-W884 PolarHBondContact N-O 2.86Å; T881-W884 WeakPolarHBondContact OG1-CB 3.45Å; T881-W884 PolarHBondContact OG1-N 2.84Å; T881-W884 VanDerWaalsContact OG1-N 3.14Å; W884-W886 HydrophobicContact CB-CE3 3.91Å; W884-W886 HydrophobicContact CB-CZ3 3.67Å; W884-L940 HydrophobicContact CE3-CD1 3.55Å; W884-L940 HydrophobicContact CE3-CD2 4.47Å; W884-L940 HydrophobicContact CE3-CG 4.05Å; W884-L940 HydrophobicContact CZ3-CD1 3.76Å; W884-L940 HydrophobicContact CZ3-CD2 3.81Å; W884-L940 HydrophobicContact CZ3-CG 3.8Å; W884-E941 CarbonylContact C-O 3.57Å; W884-E941 VanDerWaalsContact CA-O 3.31Å; W884-E941 WeakPolarHBondContact CA-O 3.32Å; W884-R942 HydrophobicContact CD2-CB 4.11Å; W884-R942 HydrophobicContact CD2-CG 3.86Å; W884-R942 HydrophobicContact CE3-CB 3.67Å; W884-R942 HydrophobicContact CE3-CG 3.93Å; W884-R942 HydrophobicContact CH2-CB 4.05Å; W884-R942 HydrophobicContact CH2-CG 3.97Å; W884-R942 HydrophobicContact CZ2-CB 4.42Å; W884-R942 VanDerWaalsContact CZ2-CD 3.41Å; W884-R942 HydrophobicContact CZ2-CG 3.85Å; W884-R942 HydrophobicContact CZ3-CB 3.64Å; W884-R942 HydrophobicContact CZ3-CG 3.99Å
885	S	96.7	Very high	93.1	Very high	0 Å²	0	62.7 Å²	62.7	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	137	166.2	179.7	0	0	0	0	108.9	L940 E941 D983 P986	S885-L940 WeakPolarHBondContact O-CA 3.37Å; S885-E941 PolarHBondContact N-O 3.33Å; S885-E941 PolarHBondContact O-N 3.16Å; S885-D983 VanDerWaalsContact CB-O 3.3Å; S885-D983 WeakPolarHBondContact CB-O 3.3Å; S885-D983 PolarHBondContact OG-O 3.36Å; S885-P986 WeakPolarHBondContact OG-CD 2.87Å
886	W	96.7	Very high	92.4	Very high	46 Å²	46	60.5 Å²	60.5	17%	0.174	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	154.1	178.8	62.1	88.5	0	0	0	113	W877 R878 E879 T881 W884 L939 L940	W877-W886 AromaticContact CE2-NE1 3.8Å; W877-W886 HydrophobicContact CH2-CZ2 4.45Å; W877-W886 AromaticContact CH2-NE1 3.44Å; W877-W886 HydrophobicContact CZ2-CZ2 4.23Å; W877-W886 AromaticContact CZ2-NE1 3.46Å; W877-W886 AromaticContact CZ3-NE1 3.79Å; R878-W886 WeakPolarHBondContact CA-O 3.01Å; E879-W886 HydrophobicContact CB-CD2 4.43Å; E879-W886 HydrophobicContact CB-CH2 4.32Å; E879-W886 HydrophobicContact CB-CZ2 3.55Å; E879-W886 HydrophobicContact CG-CH2 3.99Å; E879-W886 HydrophobicContact CG-CZ2 3.57Å; E879-W886 PolarHBondContact N-O 3.46Å; E879-W886 VanDerWaalsContact N-O 3.1Å; E879-W886 PolarHBondContact O-N 2.91Å; E879-W886 WeakPolarHBondContact OE2-CZ2 3.47Å; T881-W886 HydrophobicContact CG2-CH2 3.85Å; T881-W886 HydrophobicContact CG2-CZ3 3.95Å; W884-W886 HydrophobicContact CB-CE3 3.91Å; W884-W886 HydrophobicContact CB-CZ3 3.67Å; W886-L939 CarbonylContact C-O 3.55Å; W886-L939 WeakPolarHBondContact CA-O 3.35Å; W886-L939 VanDerWaalsContact CB-O 3.25Å; W886-L939 WeakPolarHBondContact CB-O 3.44Å; W886-L940 HydrophobicContact CB-CD1 3.83Å
887	E	96.3	Very high	91.6	Very high	1 Å²	1	58.6 Å²	58.6	1%	0.005	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	126.3	170.3	174.8	-179.8	114.6	0	0	108.1	M876 W877 R878 R937 A938 L939 P985	M876-E887 HydrophobicContact CE-CG 3.48Å; M876-E887 VanDerWaalsContact CE-CG 3.48Å; M876-E887 WeakPolarHBondContact CE-OE1 3.22Å; W877-E887 CarbonylContact O-C 3.57Å; W877-E887 WeakPolarHBondContact O-CA 3.41Å; R878-E887 HydrophobicContact CG-CB 4.01Å; R878-E887 HydrophobicContact CG-CG 3.8Å; R878-E887 IonicContact CZ-OE2 3.97Å; R878-E887 IonicContact NE-OE2 3.05Å; R878-E887 PolarHBondContact NE-OE2 3.49Å; R878-E887 IonicContact NH2-OE2 3.31Å; R878-E887 PolarHBondContact NH2-OE2 3.31Å; E887-R937 WeakPolarHBondContact OE1-CD 3.25Å; E887-R937 IonicContact OE1-CZ 3.56Å; E887-R937 IonicContact OE1-NE 3.59Å; E887-R937 PolarHBondContact OE1-NE 3.37Å; E887-R937 IonicContact OE1-NH1 3.5Å; E887-A938 CarbonylContact O-C 3.52Å; E887-A938 VanDerWaalsContact O-CA 3.26Å; E887-A938 WeakPolarHBondContact O-CA 3.28Å; E887-L939 HydrophobicContact CB-CB 4.22Å; E887-L939 HydrophobicContact CB-CD1 4.24Å; E887-L939 HydrophobicContact CG-CD1 4.48Å; E887-L939 PolarHBondContact N-O 3.02Å; E887-L939 PolarHBondContact O-N 2.95Å; E887-P985 HydrophobicContact CB-CB 4.02Å; E887-P985 WeakPolarHBondContact OE2-CB 3.32Å; E887-P985 WeakPolarHBondContact OE2-CG 3.17Å
888	L	95.6	Very high	90.3	Very high	80 Å²	80	62.1 Å²	62.1	42%	0.419	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	125.7	166.5	-61.3	-175.1	0	0	0	108.1	M876 W877 R937 A938	M876-L888 CarbonylContact C-O 3.48Å; W877-L888 HydrophobicContact CE3-CB 4.3Å; W877-L888 HydrophobicContact CE3-CD1 3.77Å; W877-L888 HydrophobicContact CE3-CG 4.23Å; W877-L888 HydrophobicContact CZ3-CD1 3.77Å; W877-L888 PolarHBondContact N-O 3.28Å; W877-L888 PolarHBondContact O-N 2.97Å; L888-R937 CarbonylContact C-O 3.54Å; L888-R937 WeakPolarHBondContact CA-O 3.33Å; L888-A938 HydrophobicContact CD2-CB 3.54Å
889	G	93.7	Very high	88.7	Confident	10 Å²	10	60.1 Å²	60.1	10%	0.103	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	142.7	-174.1	0	0	0	0	0	111.6	V875 M876 A936 R937	V875-G889 CarbonylContact O-C 3.56Å; V875-G889 VanDerWaalsContact O-CA 3.32Å; V875-G889 WeakPolarHBondContact O-CA 3.46Å; M876-G889 WeakPolarHBondContact SD-CA 3.35Å; G889-A936 CarbonylContact O-C 3.37Å; G889-A936 WeakPolarHBondContact O-CA 3.42Å; G889-R937 PolarHBondContact N-O 3.37Å; G889-R937 PolarHBondContact O-N 2.86Å
890	A	94.1	Very high	87.4	Confident	48 Å²	48	64.9 Å²	64.9	40%	0.397	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	144.8	164.1	0	0	0	0	0	109.6	V875 T935	V875-A890 PolarHBondContact N-O 2.83Å; V875-A890 PolarHBondContact O-N 3.47Å; A890-T935 CarbonylContact C-O 3.57Å; A890-T935 WeakPolarHBondContact CA-O 3.4Å
891	S	92.4	Very high	86.3	Confident	25 Å²	25	65 Å²	65	18%	0.175	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	149.8	172.2	78	0	0	0	0	111.3	I873 Y934 T935	I873-S891 WeakPolarHBondContact O-CA 3.32Å; S891-Y934 CarbonylContact O-C 3.52Å; S891-Y934 WeakPolarHBondContact O-CA 3.42Å; S891-Y934 WeakPolarHBondContact O-CB 3.28Å; S891-T935 PolarHBondContact N-O 3.46Å; S891-T935 PolarHBondContact N-OG1 2.92Å; S891-T935 PolarHBondContact O-N 2.9Å; S891-T935 PolarHBondContact OG-OG1 3.27Å
892	G	91.9	Very high	85	Confident	39 Å²	39	67.2 Å²	67.2	40%	0.402	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	131.6	164.5	0	0	0	0	0	108.8	A872 I873 G933	A872-G892 CarbonylContact C-O 3.55Å; A872-G892 VanDerWaalsContact CA-O 3.28Å; A872-G892 WeakPolarHBondContact CA-O 3.47Å; I873-G892 PolarHBondContact N-O 3.21Å; I873-G892 PolarHBondContact O-N 2.99Å; G892-G933 CarbonylContact C-O 3.55Å; G892-G933 WeakPolarHBondContact CA-O 3.27Å
893	S	90	Very high	83.8	Confident	33 Å²	33	66.8 Å²	66.8	23%	0.231	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	150.9	179.9	68.3	0	0	0	0	111.9	F871 F932 G933	F871-S893 CarbonylContact O-C 3.44Å; F871-S893 VanDerWaalsContact O-CA 3.29Å; F871-S893 WeakPolarHBondContact O-CA 3.29Å; S893-F932 CarbonylContact O-C 3.44Å; S893-F932 VanDerWaalsContact O-CA 3.28Å; S893-F932 WeakPolarHBondContact O-CA 3.18Å; S893-G933 PolarHBondContact N-O 3.41Å; S893-G933 PolarHBondContact O-N 3.49Å
894	W	87.6	Confident	82.3	Confident	73 Å²	73	70.1 Å²	70.1	28%	0.277	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	128	164.9	174.6	86.1	0	0	0	107.7	S870 F871 H896 G931 F932	S870-W894 WeakPolarHBondContact CA-O 3.02Å; F871-W894 AromaticContact CD2-CE3 3.73Å; F871-W894 HydrophobicContact CD2-CE3 3.73Å; F871-W894 AromaticContact CD2-CZ3 3.73Å; F871-W894 HydrophobicContact CD2-CZ3 3.73Å; F871-W894 HydrophobicContact CE2-CE3 4.49Å; F871-W894 HydrophobicContact CE2-CZ3 4.04Å; F871-W894 PolarHBondContact N-O 3.04Å; F871-W894 PolarHBondContact O-N 3.25Å; W894-H896 HydrophobicContact CH2-CB 3.6Å; W894-H896 HydrophobicContact CZ2-CB 3.95Å; W894-H896 HydrophobicContact CZ3-CB 4.1Å; W894-G931 WeakPolarHBondContact CA-O 3.49Å; W894-F932 HydrophobicContact CB-CD1 4.16Å; W894-F932 HydrophobicContact CB-CE1 4.04Å; W894-F932 AromaticContact CD1-CE1 3.74Å; W894-F932 AromaticContact CD1-CZ 3.7Å; W894-F932 HydrophobicContact CG-CE1 4.24Å
895	S	84.4	Confident	80.4	Confident	27 Å²	27	74.1 Å²	74.1	19%	0.189	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	147	177.4	62.4	0	0	0	0	111	Y868 Q930 G931	Y868-S895 WeakPolarHBondContact OH-CB 3.37Å; S895-Q930 VanDerWaalsContact O-CA 3.29Å; S895-Q930 WeakPolarHBondContact O-CA 3.34Å; S895-G931 PolarHBondContact N-O 2.89Å; S895-G931 PolarHBondContact O-N 2.74Å
896	H	77.5	Confident	78.6	Confident	57 Å²	57	76.3 Å²	76.3	26%	0.264	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	120.9	172.3	178.9	70.3	0	0	0	108.9	L869 W894 S929	L869-H896 PolarHBondContact O-N 3.46Å; W894-H896 HydrophobicContact CH2-CB 3.6Å; W894-H896 HydrophobicContact CZ2-CB 3.95Å; W894-H896 HydrophobicContact CZ3-CB 4.1Å; H896-S929 WeakPolarHBondContact CA-O 3.49Å; H896-S929 PolarHBondContact ND1-O 3.42Å; H896-S929 VanDerWaalsContact ND1-O 3.12Å
897	S	76.8	Confident	76.9	Confident	45 Å²	45	79.4 Å²	79.4	32%	0.315	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	143	174	68.5	0	0	0	0	109.8	S928 S929	S897-S928 CarbonylContact O-C 3.5Å; S897-S928 WeakPolarHBondContact O-CA 3.49Å; S897-S929 PolarHBondContact N-O 2.81Å; S897-S929 VanDerWaalsContact N-O 3.13Å; S897-S929 PolarHBondContact O-N 3.47Å; S897-S929 PolarHBondContact OG-OG 2.97Å
898	R	69.5	Low	75.6	Confident	208 Å²	208	82.5 Å²	82.5	79%	0.785	43%	0.426	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.4	118.1	177.6	-174.8	178.9	-178.8	173.3	1.2	108.7	G927	R898-G927 WeakPolarHBondContact CA-O 3.27Å
899	T	59.9	Low	74.6	Confident	81 Å²	81	84.7 Å²	84.7	50%	0.497	44%	0.438	S	S	.	.	P	Polyproline II helix	trans	-102.3	143	173.8	54.1	0	0	0	0	109.4	G926 G927	T899-G926 CarbonylContact O-C 3.44Å; T899-G926 WeakPolarHBondContact O-CA 3.48Å; T899-G927 PolarHBondContact N-O 3.03Å; T899-G927 PolarHBondContact O-N 2.94Å; T899-G927 PolarHBondContact OG1-O 2.65Å
900	K	66.4	Low	73.5	Confident	183 Å²	183	89 Å²	89	80%	0.796	46%	0.458	S	S	*	.	P	Polyproline II helix	trans	-80.3	149.8	171.7	-66.9	-180	-178.4	174.9	0	109	M902	K900-M902 PolarHBondContact O-N 3.02Å
901	T	71.3	Confident	72.4	Confident	84 Å²	84	87.6 Å²	87.6	52%	0.515	44%	0.444	S	S	.	.	P	Polyproline II helix	trans	-55.5	126	169.4	-57.4	0	0	0	0	108.6	N924 G926	T901-N924 WeakPolarHBondContact CA-O 3.5Å; T901-G926 VanDerWaalsContact CA-N 3.26Å; T901-G926 VanDerWaalsContact N-CA 3.31Å; T901-G926 PolarHBondContact OG1-N 2.9Å
902	M	65.5	Low	71.6	Confident	106 Å²	106	90.4 Å²	90.4	52%	0.522	46%	0.462	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	144.5	-178	44.2	-179.3	68.9	0	0	110.2	K900 R904 S923 N924	K900-M902 PolarHBondContact O-N 3.02Å; M902-R904 PolarHBondContact O-N 2.95Å; M902-S923 WeakPolarHBondContact O-CA 3.34Å; M902-N924 PolarHBondContact N-O 2.98Å; M902-N924 VanDerWaalsContact N-O 3.11Å; M902-N924 PolarHBondContact O-N 3.48Å
903	P	62.6	Low	71	Confident	104 Å²	104	93.6 Å²	93.6	68%	0.675	47%	0.473	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-55.7	138.4	175.5	-21.8	32.1	0	0	0	110.8	Y905	P903-Y905 PolarHBondContact O-N 3.38Å
904	R	64.6	Low	70.4	Confident	133 Å²	133	98.6 Å²	98.6	50%	0.502	50%	0.498	S	S	.	.	P	Polyproline II helix	trans	-69.7	126.4	178.8	-159	174	-162.3	179.9	5.3	108.9	M902 Q922	M902-R904 PolarHBondContact O-N 2.95Å; R904-Q922 HydrophobicContact CB-CB 4.18Å; R904-Q922 WeakPolarHBondContact CB-O 3.22Å; R904-Q922 PolarHBondContact N-O 3.45Å
905	Y	54.5	Low	69.8	Low	173 Å²	173	103.1 Å²	103.1	68%	0.678	52%	0.515	S	S	*	.	S	Bend	trans	-54.2	144.8	172	-176	-88.6	0	0	0	109.6	P903 L907	P903-Y905 PolarHBondContact O-N 3.38Å; Y905-L907 HydrophobicContact CE2-CG 4.25Å
906	P	58.8	Low	69.3	Low	46 Å²	46	104.9 Å²	104.9	30%	0.299	52%	0.52	S	S	.	.	S	Bend	cis	-85.9	164.5	18.1	33	-34.5	0	0	0	117.6	M908 L910 I911	P906-M908 WeakPolarHBondContact O-CE 3.49Å; P906-M908 PolarHBondContact O-N 3.5Å; P906-L910 HydrophobicContact CB-CB 4.11Å; P906-L910 HydrophobicContact CB-CD1 4.04Å; P906-I911 HydrophobicContact CG-CD1 3.82Å; P906-I911 HydrophobicContact CG-CG1 3.6Å
907	L	60.6	Low	69.1	Low	112 Å²	112	108.5 Å²	108.5	59%	0.586	54%	0.537	S	S	*	.	P	Polyproline II helix	trans	-53.1	133.8	169.2	-64.8	171.3	0	0	0	108.9	Y905 N909 L910	Y905-L907 HydrophobicContact CE2-CG 4.25Å; L907-N909 WeakPolarHBondContact CB-OD1 3.26Å; L907-N909 PolarHBondContact O-N 3.05Å; L907-N909 PolarHBondContact O-OD1 3.05Å; L907-L910 HydrophobicContact CB-CD1 4.4Å; L907-L910 WeakPolarHBondContact O-CB 3.42Å; L907-L910 PolarHBondContact O-N 3.1Å
908	M	70.2	Confident	69	Low	65 Å²	65	111.1 Å²	111.1	32%	0.32	54%	0.544	S	S	.	.	G	3₁₀ helix	trans	-54.7	-27.4	-169.4	-71.9	-59.2	107.6	0	0	114.3	P906 L910 I911 Q916 A919 A920	P906-M908 WeakPolarHBondContact O-CE 3.49Å; P906-M908 PolarHBondContact O-N 3.5Å; M908-L910 PolarHBondContact O-N 2.61Å; M908-I911 HydrophobicContact CE-CD1 3.59Å; M908-I911 PolarHBondContact O-N 2.9Å; M908-I911 HydrophobicContact SD-CD1 4.13Å; M908-Q916 PolarHBondContact O-NE2 3.37Å; M908-A919 HydrophobicContact CE-CB 4.27Å; M908-A919 HydrophobicContact SD-CB 4.46Å; M908-A920 HydrophobicContact SD-CB 4.26Å
909	N	73.6	Confident	69.1	Low	126 Å²	126	102.1 Å²	102.1	67%	0.674	51%	0.514	S	S	*	.	G	3₁₀ helix	trans	-67.7	-13.9	176.1	66.5	-42.1	0	0	0	114.4	L907	L907-N909 WeakPolarHBondContact CB-OD1 3.26Å; L907-N909 PolarHBondContact O-N 3.05Å; L907-N909 PolarHBondContact O-OD1 3.05Å
910	L	72	Confident	69.6	Low	100 Å²	100	101.4 Å²	101.4	52%	0.524	52%	0.517	S	S	.	.	G	3₁₀ helix	trans	-93.8	-9.1	176.5	-60.2	174.6	0	0	0	112.8	P906 L907 M908	P906-L910 HydrophobicContact CB-CB 4.11Å; P906-L910 HydrophobicContact CB-CD1 4.04Å; L907-L910 HydrophobicContact CB-CD1 4.4Å; L907-L910 WeakPolarHBondContact O-CB 3.42Å; L907-L910 PolarHBondContact O-N 3.1Å; M908-L910 PolarHBondContact O-N 2.61Å
911	I	70.7	Confident	70	Confident	19 Å²	19	100.4 Å²	100.4	10%	0.097	51%	0.508	C	S	.	.	S	Bend	trans	-96	127.6	-178.2	-55.3	-175.4	0	0	0	108.1	P906 M908 T913 W915 Q916 A919	P906-I911 HydrophobicContact CG-CD1 3.82Å; P906-I911 HydrophobicContact CG-CG1 3.6Å; M908-I911 HydrophobicContact CE-CD1 3.59Å; M908-I911 PolarHBondContact O-N 2.9Å; M908-I911 HydrophobicContact SD-CD1 4.13Å; I911-T913 PolarHBondContact O-N 3.48Å; I911-W915 HydrophobicContact CG2-CB 3.69Å; I911-Q916 HydrophobicContact CB-CG 4Å; I911-Q916 HydrophobicContact CG2-CG 4.09Å; I911-Q916 WeakPolarHBondContact O-CG 3.17Å; I911-Q916 PolarHBondContact O-NE2 2.87Å; I911-A919 HydrophobicContact CD1-CB 3.27Å; I911-A919 HydrophobicContact CG2-CB 4.14Å
912	P	75.3	Confident	69.9	Low	84 Å²	84	100.2 Å²	100.2	55%	0.545	50%	0.501	S	S	.	.			trans	-54.8	138.9	172.9	-22	31.7	0	0	0	110.5	D914 W915 Q916	P912-D914 PolarHBondContact O-N 3.38Å; P912-W915 PolarHBondContact O-N 3.04Å; P912-Q916 PolarHBondContact O-N 3.43Å
913	T	78.5	Confident	69.9	Low	106 Å²	106	97.7 Å²	97.7	65%	0.65	49%	0.494	S	S	*	.	H	α-helix	trans	-47.8	-36.3	-172	10.6	0	0	0	0	114.1	I911 W915 Q916	I911-T913 PolarHBondContact O-N 3.48Å; T913-W915 PolarHBondContact O-N 3.44Å; T913-Q916 PolarHBondContact O-N 3.06Å
914	D	77.6	Confident	69.9	Low	139 Å²	139	96.7 Å²	96.7	74%	0.743	48%	0.483	S	S	*	.	H	α-helix	trans	-64.7	-25.4	-177.8	-44.9	-27.4	0	0	0	113.1	P912	P912-D914 PolarHBondContact O-N 3.38Å
915	W	75	Confident	69.8	Low	167 Å²	167	96.8 Å²	96.8	63%	0.633	49%	0.494	S	S	*	.	H	α-helix	trans	-106	-7.4	-179.3	-60.5	92.6	0	0	0	112.7	I911 P912 T913 E917 E918 A919	I911-W915 HydrophobicContact CG2-CB 3.69Å; P912-W915 PolarHBondContact O-N 3.04Å; T913-W915 PolarHBondContact O-N 3.44Å; W915-E917 VanDerWaalsContact C-N 3.26Å; W915-E917 PolarHBondContact O-N 2.92Å; W915-E918 PolarHBondContact O-N 3.12Å; W915-A919 VanDerWaalsContact O-CB 3.22Å; W915-A919 WeakPolarHBondContact O-CB 3.46Å; W915-A919 PolarHBondContact O-N 3.48Å
916	Q	75.2	Confident	70.2	Confident	64 Å²	64	90 Å²	90	30%	0.299	48%	0.476	S	S	.	.	H	α-helix	trans	-61.9	-35.3	-177.2	-76.4	179.8	-0.4	0	0	112	M908 I911 P912 T913 A920	M908-Q916 PolarHBondContact O-NE2 3.37Å; I911-Q916 HydrophobicContact CB-CG 4Å; I911-Q916 HydrophobicContact CG2-CG 4.09Å; I911-Q916 WeakPolarHBondContact O-CG 3.17Å; I911-Q916 PolarHBondContact O-NE2 2.87Å; P912-Q916 PolarHBondContact O-N 3.43Å; T913-Q916 PolarHBondContact O-N 3.06Å; Q916-A920 WeakPolarHBondContact O-CB 3.44Å; Q916-A920 PolarHBondContact O-N 3.48Å
917	E	73.5	Confident	70.5	Confident	134 Å²	134	89.7 Å²	89.7	63%	0.626	48%	0.481	S	S	*	.	H	α-helix	trans	-70.8	-40.3	-178.8	-143.8	-168.6	153.3	0	0	112.3	W915 R921	W915-E917 VanDerWaalsContact C-N 3.26Å; W915-E917 PolarHBondContact O-N 2.92Å; E917-R921 WeakPolarHBondContact O-CG 3.32Å; E917-R921 PolarHBondContact O-N 2.95Å; E917-R921 IonicContact OE1-NH2 3.73Å; E917-R921 PolarHBondContact OE1-NH2 3Å
918	E	73.1	Confident	71.1	Confident	99 Å²	99	88.1 Å²	88.1	46%	0.463	48%	0.479	S	S	.	.	H	α-helix	trans	-70.6	-44.2	175.1	-177.3	59.1	-160.6	0	0	110.7	W915 A920 R921 Q922	W915-E918 PolarHBondContact O-N 3.12Å; E918-A920 VanDerWaalsContact C-N 3.35Å; E918-A920 PolarHBondContact O-N 2.89Å; E918-R921 WeakPolarHBondContact O-CB 3.48Å; E918-R921 PolarHBondContact O-N 3.29Å; E918-R921 VanDerWaalsContact O-N 3.13Å; E918-Q922 PolarHBondContact O-N 3.18Å
919	A	72	Confident	71.1	Confident	19 Å²	19	87.8 Å²	87.8	16%	0.157	48%	0.484	C	S	.	.	H	α-helix	trans	-65.3	-35.7	177.6	0	0	0	0	0	113	M908 I911 W915 R921 Q922	M908-A919 HydrophobicContact CE-CB 4.27Å; M908-A919 HydrophobicContact SD-CB 4.46Å; I911-A919 HydrophobicContact CD1-CB 3.27Å; I911-A919 HydrophobicContact CG2-CB 4.14Å; W915-A919 VanDerWaalsContact O-CB 3.22Å; W915-A919 WeakPolarHBondContact O-CB 3.46Å; W915-A919 PolarHBondContact O-N 3.48Å; A919-R921 PolarHBondContact O-N 2.92Å; A919-Q922 PolarHBondContact O-N 3.27Å; A919-Q922 VanDerWaalsContact O-N 3.07Å
920	A	71.4	Confident	71.4	Confident	66 Å²	66	87.5 Å²	87.5	55%	0.545	48%	0.478	S	S	.	.	H	α-helix	trans	-64.6	-24.5	174.8	0	0	0	0	0	112.8	M908 Q916 E918	M908-A920 HydrophobicContact SD-CB 4.26Å; Q916-A920 WeakPolarHBondContact O-CB 3.44Å; Q916-A920 PolarHBondContact O-N 3.48Å; E918-A920 VanDerWaalsContact C-N 3.35Å; E918-A920 PolarHBondContact O-N 2.89Å
921	R	73.6	Confident	71.8	Confident	163 Å²	163	83.4 Å²	83.4	62%	0.615	46%	0.46	S	S	*	.	H	α-helix	trans	-83.7	-15.6	174.5	-64.8	172.1	-160.8	-176.8	5.4	112.7	E917 E918 A919 S923	E917-R921 WeakPolarHBondContact O-CG 3.32Å; E917-R921 PolarHBondContact O-N 2.95Å; E917-R921 IonicContact OE1-NH2 3.73Å; E917-R921 PolarHBondContact OE1-NH2 3Å; E918-R921 WeakPolarHBondContact O-CB 3.48Å; E918-R921 PolarHBondContact O-N 3.29Å; E918-R921 VanDerWaalsContact O-N 3.13Å; A919-R921 PolarHBondContact O-N 2.92Å; R921-S923 PolarHBondContact O-N 3.07Å
922	Q	69.3	Low	72.7	Confident	79 Å²	79	90.5 Å²	90.5	37%	0.369	49%	0.491	S	S	.	.			trans	-82.5	106.7	177.3	-64.2	-161.1	12.2	0	0	110.8	R904 E918 A919	R904-Q922 HydrophobicContact CB-CB 4.18Å; R904-Q922 WeakPolarHBondContact CB-O 3.22Å; R904-Q922 PolarHBondContact N-O 3.45Å; E918-Q922 PolarHBondContact O-N 3.18Å; A919-Q922 PolarHBondContact O-N 3.27Å; A919-Q922 VanDerWaalsContact O-N 3.07Å
923	S	66.2	Low	73.3	Confident	54 Å²	54	86.9 Å²	86.9	38%	0.378	47%	0.469	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	147.1	168.2	52.4	0	0	0	0	111.1	M902 R921 D925	M902-S923 WeakPolarHBondContact O-CA 3.34Å; R921-S923 PolarHBondContact O-N 3.07Å; S923-D925 PolarHBondContact O-N 2.9Å
924	N	62.5	Low	73.8	Confident	83 Å²	83	88.2 Å²	88.2	44%	0.444	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	112.3	154.6	-74.5	-20.2	0	0	0	106.7	T901 M902 G926	T901-N924 WeakPolarHBondContact CA-O 3.5Å; M902-N924 PolarHBondContact N-O 2.98Å; M902-N924 VanDerWaalsContact N-O 3.11Å; M902-N924 PolarHBondContact O-N 3.48Å; N924-G926 PolarHBondContact O-N 3.21Å
925	D	61.9	Low	74.5	Confident	135 Å²	135	83.7 Å²	83.7	72%	0.722	44%	0.44	S	S	*	.			trans	-58.6	128	176.8	-73	-25	0	0	0	110.6	S923	S923-D925 PolarHBondContact O-N 2.9Å
926	G	62.7	Low	75.4	Confident	29 Å²	29	77.5 Å²	77.5	30%	0.299	43%	0.425	S	S	.	.			trans	-69.6	136.8	175.3	0	0	0	0	0	109.8	T899 T901 N924	T899-G926 CarbonylContact O-C 3.44Å; T899-G926 WeakPolarHBondContact O-CA 3.48Å; T901-G926 VanDerWaalsContact CA-N 3.26Å; T901-G926 VanDerWaalsContact N-CA 3.31Å; T901-G926 PolarHBondContact OG1-N 2.9Å; N924-G926 PolarHBondContact O-N 3.21Å
927	G	65.2	Low	76.3	Confident	40 Å²	40	79 Å²	79	41%	0.412	43%	0.428	S	S	.	.			trans	-138.7	159.6	-177.3	0	0	0	0	0	111.7	R898 T899	R898-G927 WeakPolarHBondContact CA-O 3.27Å; T899-G927 PolarHBondContact N-O 3.03Å; T899-G927 PolarHBondContact O-N 2.94Å; T899-G927 PolarHBondContact OG1-O 2.65Å
928	S	72.9	Confident	77.3	Confident	79 Å²	79	74 Å²	74	55%	0.552	41%	0.41	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.6	129.5	165.1	58.2	0	0	0	0	109.8	S897	S897-S928 CarbonylContact O-C 3.5Å; S897-S928 WeakPolarHBondContact O-CA 3.49Å
929	S	71.4	Confident	78.4	Confident	59 Å²	59	69.6 Å²	69.6	41%	0.413	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	149.3	170.4	77.9	0	0	0	0	110.4	H896 S897	H896-S929 WeakPolarHBondContact CA-O 3.49Å; H896-S929 PolarHBondContact ND1-O 3.42Å; H896-S929 VanDerWaalsContact ND1-O 3.12Å; S897-S929 PolarHBondContact N-O 2.81Å; S897-S929 VanDerWaalsContact N-O 3.13Å; S897-S929 PolarHBondContact O-N 3.47Å; S897-S929 PolarHBondContact OG-OG 2.97Å
930	Q	79.7	Confident	79.5	Confident	120 Å²	120	71.8 Å²	71.8	56%	0.561	40%	0.398	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-131.5	137	171	-39	-171.4	20.4	0	0	107	S895	S895-Q930 VanDerWaalsContact O-CA 3.29Å; S895-Q930 WeakPolarHBondContact O-CA 3.34Å
931	G	81.1	Confident	80.8	Confident	14 Å²	14	68.9 Å²	68.9	14%	0.144	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	141.2	-178.1	0	0	0	0	0	111.2	W894 S895	W894-G931 WeakPolarHBondContact CA-O 3.49Å; S895-G931 PolarHBondContact N-O 2.89Å; S895-G931 PolarHBondContact O-N 2.74Å
932	F	87.9	Confident	81.9	Confident	167 Å²	167	66.9 Å²	66.9	73%	0.732	37%	0.366	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.2	135.4	162.9	-70.3	-82.6	0	0	0	108.4	S893 W894	S893-F932 CarbonylContact O-C 3.44Å; S893-F932 VanDerWaalsContact O-CA 3.28Å; S893-F932 WeakPolarHBondContact O-CA 3.18Å; W894-F932 HydrophobicContact CB-CD1 4.16Å; W894-F932 HydrophobicContact CB-CE1 4.04Å; W894-F932 AromaticContact CD1-CE1 3.74Å; W894-F932 AromaticContact CD1-CZ 3.7Å; W894-F932 HydrophobicContact CG-CE1 4.24Å
933	G	87.7	Confident	83.2	Confident	8 Å²	8	63.4 Å²	63.4	8%	0.082	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	155.6	171	0	0	0	0	0	110.9	G892 S893 Q958	G892-G933 CarbonylContact C-O 3.55Å; G892-G933 WeakPolarHBondContact CA-O 3.27Å; S893-G933 PolarHBondContact N-O 3.41Å; S893-G933 PolarHBondContact O-N 3.49Å; G933-Q958 CarbonylContact C-O 3.58Å; G933-Q958 WeakPolarHBondContact CA-O 3.3Å
934	Y	90.8	Very high	84.6	Confident	134 Å²	134	65 Å²	65	53%	0.525	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	151.4	166.3	63.6	-91	0	0	0	110.7	S891 Q958	S891-Y934 CarbonylContact O-C 3.52Å; S891-Y934 WeakPolarHBondContact O-CA 3.42Å; S891-Y934 WeakPolarHBondContact O-CB 3.28Å; Y934-Q958 HydrophobicContact CD1-CB 3.76Å; Y934-Q958 HydrophobicContact CD2-CB 3.93Å; Y934-Q958 HydrophobicContact CD2-CG 4.28Å; Y934-Q958 HydrophobicContact CE1-CB 3.36Å; Y934-Q958 HydrophobicContact CE1-CG 4.04Å; Y934-Q958 HydrophobicContact CE2-CB 3.54Å; Y934-Q958 HydrophobicContact CE2-CG 3.51Å; Y934-Q958 HydrophobicContact CG-CB 4.04Å; Y934-Q958 PolarHBondContact N-O 3.13Å; Y934-Q958 PolarHBondContact O-N 2.66Å; Y934-Q958 WeakPolarHBondContact OH-CG 3.35Å
935	T	92.4	Very high	86.2	Confident	44 Å²	44	63.9 Å²	63.9	27%	0.27	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	147.8	170.5	68.5	0	0	0	0	110.2	A890 S891 I956 Q957	A890-T935 CarbonylContact C-O 3.57Å; A890-T935 WeakPolarHBondContact CA-O 3.4Å; S891-T935 PolarHBondContact N-O 3.46Å; S891-T935 PolarHBondContact N-OG1 2.92Å; S891-T935 PolarHBondContact O-N 2.9Å; S891-T935 PolarHBondContact OG-OG1 3.27Å; T935-I956 CarbonylContact C-O 3.58Å; T935-I956 WeakPolarHBondContact CA-O 3.44Å; T935-Q957 HydrophobicContact CG2-CB 4.17Å; T935-Q957 HydrophobicContact CG2-CG 4.04Å
936	A	92.9	Very high	87.6	Confident	38 Å²	38	58.2 Å²	58.2	31%	0.314	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	125.5	169.9	0	0	0	0	0	108.3	G889 I956	G889-A936 CarbonylContact O-C 3.37Å; G889-A936 WeakPolarHBondContact O-CA 3.42Å; A936-I956 HydrophobicContact CB-CB 4.37Å; A936-I956 PolarHBondContact N-O 3.34Å; A936-I956 PolarHBondContact O-N 3.06Å
937	R	93.3	Very high	89.2	Confident	94 Å²	94	58.8 Å²	58.8	36%	0.355	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	134.7	-172.5	-176.9	170.9	180	-178.3	-8.4	110	E887 L888 G889 L939 I954 D955	E887-R937 WeakPolarHBondContact OE1-CD 3.25Å; E887-R937 IonicContact OE1-CZ 3.56Å; E887-R937 IonicContact OE1-NE 3.59Å; E887-R937 PolarHBondContact OE1-NE 3.37Å; E887-R937 IonicContact OE1-NH1 3.5Å; L888-R937 CarbonylContact C-O 3.54Å; L888-R937 WeakPolarHBondContact CA-O 3.33Å; G889-R937 PolarHBondContact N-O 3.37Å; G889-R937 PolarHBondContact O-N 2.86Å; R937-L939 HydrophobicContact CG-CD1 3.36Å; R937-I954 CarbonylContact C-O 3.58Å; R937-I954 VanDerWaalsContact CA-O 3.29Å; R937-I954 WeakPolarHBondContact CA-O 3.39Å; R937-D955 WeakPolarHBondContact CD-OD1 3.34Å
938	A	95.1	Very high	90.7	Very high	31 Å²	31	62.7 Å²	62.7	26%	0.256	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	127.4	173.3	0	0	0	0	0	109.1	E887 L888 A953 I954	E887-A938 CarbonylContact O-C 3.52Å; E887-A938 VanDerWaalsContact O-CA 3.26Å; E887-A938 WeakPolarHBondContact O-CA 3.28Å; L888-A938 HydrophobicContact CD2-CB 3.54Å; A938-A953 CarbonylContact O-C 3.47Å; A938-A953 WeakPolarHBondContact O-CA 3.34Å; A938-A953 WeakPolarHBondContact O-CB 3.25Å; A938-I954 PolarHBondContact N-O 2.91Å; A938-I954 PolarHBondContact O-N 3.43Å
939	L	95.9	Very high	91.9	Very high	5 Å²	5	59.4 Å²	59.4	3%	0.026	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	137.6	174.4	-70.9	81.3	0	0	0	107.7	W886 E887 R937 A953 P986 P988	W886-L939 CarbonylContact C-O 3.55Å; W886-L939 WeakPolarHBondContact CA-O 3.35Å; W886-L939 VanDerWaalsContact CB-O 3.25Å; W886-L939 WeakPolarHBondContact CB-O 3.44Å; E887-L939 HydrophobicContact CB-CB 4.22Å; E887-L939 HydrophobicContact CB-CD1 4.24Å; E887-L939 HydrophobicContact CG-CD1 4.48Å; E887-L939 PolarHBondContact N-O 3.02Å; E887-L939 PolarHBondContact O-N 2.95Å; R937-L939 HydrophobicContact CG-CD1 3.36Å; L939-A953 HydrophobicContact CB-CB 4.41Å; L939-A953 HydrophobicContact CD1-CB 4.41Å; L939-A953 HydrophobicContact CD2-CB 4.31Å; L939-A953 HydrophobicContact CG-CB 3.67Å; L939-P986 HydrophobicContact CB-CB 4.46Å; L939-P986 HydrophobicContact CB-CG 4.19Å; L939-P986 HydrophobicContact CD2-CB 4.44Å; L939-P988 HydrophobicContact CD2-CG 4.08Å
940	L	96.4	Very high	93.1	Very high	66 Å²	66	59.7 Å²	59.7	35%	0.346	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	126.7	176.9	-177.8	65.1	0	0	0	108.8	W884 S885 W886 G951 T952	W884-L940 HydrophobicContact CE3-CD1 3.55Å; W884-L940 HydrophobicContact CE3-CD2 4.47Å; W884-L940 HydrophobicContact CE3-CG 4.05Å; W884-L940 HydrophobicContact CZ3-CD1 3.76Å; W884-L940 HydrophobicContact CZ3-CD2 3.81Å; W884-L940 HydrophobicContact CZ3-CG 3.8Å; S885-L940 WeakPolarHBondContact O-CA 3.37Å; W886-L940 HydrophobicContact CB-CD1 3.83Å; L940-G951 CarbonylContact O-C 3.52Å; L940-G951 WeakPolarHBondContact O-CA 3.28Å; L940-T952 HydrophobicContact CB-CG2 4.21Å; L940-T952 PolarHBondContact N-O 3Å; L940-T952 PolarHBondContact O-N 3.12Å
941	E	97.7	Very high	93.9	Very high	4 Å²	4	54.2 Å²	54.2	2%	0.019	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	139.5	173.4	-169.6	178.5	81.2	0	0	110	W884 S885 V950 Y970 R972 M982 P986	W884-E941 CarbonylContact C-O 3.57Å; W884-E941 VanDerWaalsContact CA-O 3.31Å; W884-E941 WeakPolarHBondContact CA-O 3.32Å; S885-E941 PolarHBondContact N-O 3.33Å; S885-E941 PolarHBondContact O-N 3.16Å; E941-V950 CarbonylContact C-O 3.55Å; E941-V950 WeakPolarHBondContact CA-O 3.37Å; E941-Y970 WeakPolarHBondContact CB-OH 3.43Å; E941-Y970 VanDerWaalsContact CD-OH 3.31Å; E941-Y970 HydrophobicContact CG-CE2 4.23Å; E941-Y970 WeakPolarHBondContact CG-OH 3.45Å; E941-Y970 WeakPolarHBondContact OE2-CE2 3.2Å; E941-Y970 VanDerWaalsContact OE2-CZ 3.31Å; E941-Y970 PolarHBondContact OE2-OH 3.36Å; E941-R972 IonicContact OE2-NH1 2.69Å; E941-M982 HydrophobicContact CB-CE 4.1Å; E941-M982 HydrophobicContact CG-CE 3.76Å; E941-M982 WeakPolarHBondContact OE1-CE 3.45Å; E941-P986 HydrophobicContact CB-CB 3.9Å; E941-P986 HydrophobicContact CB-CG 3.89Å
942	R	96.8	Very high	94.7	Very high	122 Å²	122	55.5 Å²	55.5	46%	0.46	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	130.1	176.2	-169.5	-172.6	179.2	162.1	-4.1	111	N883 W884 F949 V950	N883-R942 CarbonylContact O-C 3.55Å; N883-R942 VanDerWaalsContact O-CA 3.28Å; N883-R942 WeakPolarHBondContact O-CA 3.39Å; W884-R942 HydrophobicContact CD2-CB 4.11Å; W884-R942 HydrophobicContact CD2-CG 3.86Å; W884-R942 HydrophobicContact CE3-CB 3.67Å; W884-R942 HydrophobicContact CE3-CG 3.93Å; W884-R942 HydrophobicContact CH2-CB 4.05Å; W884-R942 HydrophobicContact CH2-CG 3.97Å; W884-R942 HydrophobicContact CZ2-CB 4.42Å; W884-R942 VanDerWaalsContact CZ2-CD 3.41Å; W884-R942 HydrophobicContact CZ2-CG 3.85Å; W884-R942 HydrophobicContact CZ3-CB 3.64Å; W884-R942 HydrophobicContact CZ3-CG 3.99Å; R942-F949 CarbonylContact O-C 3.51Å; R942-F949 VanDerWaalsContact O-CA 3.3Å; R942-F949 WeakPolarHBondContact O-CA 3.46Å; R942-V950 PolarHBondContact N-O 2.97Å; R942-V950 PolarHBondContact O-N 3.48Å
943	R	96.7	Very high	95	Very high	6 Å²	6	47.9 Å²	47.9	2%	0.023	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	117.3	162.5	-170.7	179.1	-50.6	168.7	1.3	109.9	E882 N883 T945 F949 W978 Q979 G980 M982	E882-R943 PolarHBondContact O-NH1 3.49Å; N883-R943 HydrophobicContact CB-CB 4.28Å; N883-R943 PolarHBondContact O-N 3.38Å; R943-T945 WeakPolarHBondContact CG-O 3.49Å; R943-F949 HydrophobicContact CB-CD1 3.92Å; R943-F949 HydrophobicContact CB-CE1 3.78Å; R943-F949 HydrophobicContact CG-CD1 4.09Å; R943-F949 HydrophobicContact CG-CE1 3.59Å; R943-F949 HydrophobicContact CG-CZ 3.89Å; R943-W978 WeakPolarHBondContact CD-O 3.49Å; R943-W978 PolarHBondContact NE-O 2.93Å; R943-W978 PolarHBondContact NH1-O 3.32Å; R943-Q979 PolarHBondContact NH1-O 3.03Å; R943-G980 VanDerWaalsContact CZ-O 3.27Å; R943-G980 PolarHBondContact NH1-O 3.04Å; R943-G980 PolarHBondContact NH2-O 3.24Å; R943-M982 HydrophobicContact CB-CE 4.41Å; R943-M982 HydrophobicContact CB-SD 3.89Å; R943-M982 PolarHBondContact NE-SD 3.31Å; R943-M982 PolarHBondContact NH2-SD 3.01Å
944	V	96.1	Very high	95.3	Very high	87 Å²	87	51.1 Å²	51.1	53%	0.527	26%	0.261	S	S	.	.	S	Bend	trans	-92.4	-42.9	179.6	-177.6	0	0	0	0	110.6	W948 V950	V944-W948 HydrophobicContact CB-CB 4.37Å; V944-W948 PolarHBondContact N-O 3.32Å; V944-V950 HydrophobicContact CG2-CB 4.38Å; V944-V950 HydrophobicContact CG2-CG2 3.81Å
945	T	95.3	Very high	95.3	Very high	60 Å²	60	46.2 Å²	46.2	37%	0.368	24%	0.243	S	C	.	.	S	Bend	trans	-137.2	178.9	169	72.8	0	0	0	0	108.8	R943 N947 W948	R943-T945 WeakPolarHBondContact CG-O 3.49Å; T945-N947 PolarHBondContact O-N 3.3Å; T945-N947 PolarHBondContact OG1-N 2.86Å; T945-N947 VanDerWaalsContact OG1-N 3.16Å; T945-W948 PolarHBondContact N-O 3.3Å; T945-W948 PolarHBondContact O-N 3.11Å; T945-W948 PolarHBondContact OG1-N 3.05Å
946	S	92.7	Very high	95.1	Very high	16 Å²	16	46.7 Å²	46.7	11%	0.112	24%	0.244	C	C	.	.	S	Bend	trans	-55.9	-31.2	170.3	27.3	0	0	0	0	112.3	D735 G977 W978	D735-S946 WeakPolarHBondContact OD1-CB 3.48Å; D735-S946 PolarHBondContact OD1-OG 3.13Å; D735-S946 PolarHBondContact OD2-OG 3.14Å; S946-G977 CarbonylContact O-C 3.52Å; S946-G977 WeakPolarHBondContact O-CA 3.43Å; S946-W978 PolarHBondContact O-N 2.74Å
947	N	96.1	Very high	94.8	Very high	41 Å²	41	47.7 Å²	47.7	22%	0.219	24%	0.242	C	C	.	.	S	Bend	trans	-94.7	-31.2	-178.2	-55.1	92.4	0	0	0	113.7	T945 Y973 S974	T945-N947 PolarHBondContact O-N 3.3Å; T945-N947 PolarHBondContact OG1-N 2.86Å; T945-N947 VanDerWaalsContact OG1-N 3.16Å; N947-Y973 HydrophobicContact CB-CD2 3.97Å; N947-Y973 HydrophobicContact CB-CE2 3.61Å; N947-Y973 CarbonylContact O-C 3.59Å; N947-Y973 VanDerWaalsContact O-CA 3.23Å; N947-Y973 WeakPolarHBondContact O-CA 3.17Å; N947-S974 WeakPolarHBondContact CB-O 3.21Å; N947-S974 PolarHBondContact ND2-O 3.39Å; N947-S974 PolarHBondContact O-N 2.94Å
948	W	96.8	Very high	94.4	Very high	121 Å²	121	45.5 Å²	45.5	46%	0.458	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	131.6	-169.2	-70.7	99.8	0	0	0	113.1	V944 T945 V971 Y973	V944-W948 HydrophobicContact CB-CB 4.37Å; V944-W948 PolarHBondContact N-O 3.32Å; T945-W948 PolarHBondContact N-O 3.3Å; T945-W948 PolarHBondContact O-N 3.11Å; T945-W948 PolarHBondContact OG1-N 3.05Å; W948-V971 HydrophobicContact CE3-CG1 3.51Å; W948-V971 HydrophobicContact CZ3-CG1 3.57Å; W948-Y973 AromaticContact CD2-CD2 3.87Å; W948-Y973 HydrophobicContact CD2-CD2 3.87Å; W948-Y973 AromaticContact CE2-CD2 3.52Å; W948-Y973 HydrophobicContact CE3-CD2 4.26Å; W948-Y973 HydrophobicContact CG-CD2 4.42Å; W948-Y973 HydrophobicContact CH2-CD2 4.07Å; W948-Y973 HydrophobicContact CH2-CG 4.44Å; W948-Y973 AromaticContact CZ2-CD2 3.63Å; W948-Y973 HydrophobicContact CZ2-CD2 3.63Å; W948-Y973 HydrophobicContact CZ2-CE2 4.15Å; W948-Y973 HydrophobicContact CZ2-CG 4.42Å; W948-Y973 HydrophobicContact CZ3-CD2 4.35Å; W948-Y973 AromaticContact NE1-CD2 3.85Å; W948-Y973 AromaticContact NE1-CE2 3.95Å
949	F	96.9	Very high	93.7	Very high	10 Å²	10	46.1 Å²	46.1	4%	0.044	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	143.2	178.1	-57.6	-104.8	0	0	0	109.3	R942 R943 V971 R972 W978 M982	R942-F949 CarbonylContact O-C 3.51Å; R942-F949 VanDerWaalsContact O-CA 3.3Å; R942-F949 WeakPolarHBondContact O-CA 3.46Å; R943-F949 HydrophobicContact CB-CD1 3.92Å; R943-F949 HydrophobicContact CB-CE1 3.78Å; R943-F949 HydrophobicContact CG-CD1 4.09Å; R943-F949 HydrophobicContact CG-CE1 3.59Å; R943-F949 HydrophobicContact CG-CZ 3.89Å; F949-V971 CarbonylContact O-C 3.59Å; F949-V971 VanDerWaalsContact O-CA 3.32Å; F949-V971 WeakPolarHBondContact O-CA 3.27Å; F949-R972 HydrophobicContact CB-CB 4.16Å; F949-R972 PolarHBondContact N-O 2.96Å; F949-R972 PolarHBondContact O-N 2.84Å; F949-W978 HydrophobicContact CZ-CB 4.02Å; F949-W978 HydrophobicContact CZ-CG 4.45Å; F949-M982 HydrophobicContact CD1-CE 4.02Å; F949-M982 HydrophobicContact CD1-SD 4.06Å; F949-M982 HydrophobicContact CE1-CE 4.33Å; F949-M982 HydrophobicContact CE1-SD 3.75Å
950	V	97.2	Very high	92.5	Very high	65 Å²	65	53.2 Å²	53.2	39%	0.394	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	133.5	177.4	179.8	0	0	0	0	108.2	E941 R942 V944 Y970 V971	E941-V950 CarbonylContact C-O 3.55Å; E941-V950 WeakPolarHBondContact CA-O 3.37Å; R942-V950 PolarHBondContact N-O 2.97Å; R942-V950 PolarHBondContact O-N 3.48Å; V944-V950 HydrophobicContact CG2-CB 4.38Å; V944-V950 HydrophobicContact CG2-CG2 3.81Å; V950-Y970 WeakPolarHBondContact CA-O 3.46Å; V950-V971 HydrophobicContact CG2-CG2 4.36Å
951	G	96.9	Very high	91	Very high	5 Å²	5	55.8 Å²	55.8	5%	0.052	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	166.1	176.7	0	0	0	0	0	114.2	L940 L969 Y970	L940-G951 CarbonylContact O-C 3.52Å; L940-G951 WeakPolarHBondContact O-CA 3.28Å; G951-L969 WeakPolarHBondContact O-CA 3.39Å; G951-Y970 VanDerWaalsContact CA-CE1 3.49Å; G951-Y970 PolarHBondContact N-O 2.89Å; G951-Y970 PolarHBondContact O-N 3.43Å
952	T	96.7	Very high	89.7	Confident	42 Å²	42	61.7 Å²	61.7	26%	0.258	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	149	175.3	-174.6	0	0	0	0	109.5	L940 F967 L968	L940-T952 HydrophobicContact CB-CG2 4.21Å; L940-T952 PolarHBondContact N-O 3Å; L940-T952 PolarHBondContact O-N 3.12Å; T952-F967 WeakPolarHBondContact OG1-CE2 3.26Å; T952-L968 CarbonylContact C-O 3.45Å; T952-L968 WeakPolarHBondContact CA-O 3.3Å; T952-L968 WeakPolarHBondContact CB-O 3.48Å; T952-L968 PolarHBondContact OG1-O 2.77Å
953	A	94.5	Very high	89	Confident	7 Å²	7	56.3 Å²	56.3	6%	0.058	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	155.7	168.4	0	0	0	0	0	112.4	A938 L939 F967 L968	A938-A953 CarbonylContact O-C 3.47Å; A938-A953 WeakPolarHBondContact O-CA 3.34Å; A938-A953 WeakPolarHBondContact O-CB 3.25Å; L939-A953 HydrophobicContact CB-CB 4.41Å; L939-A953 HydrophobicContact CD1-CB 4.41Å; L939-A953 HydrophobicContact CD2-CB 4.31Å; L939-A953 HydrophobicContact CG-CB 3.67Å; A953-F967 WeakPolarHBondContact O-CA 3.25Å; A953-F967 WeakPolarHBondContact O-CD2 3.45Å; A953-L968 HydrophobicContact CB-CD1 3.65Å; A953-L968 HydrophobicContact CB-CD2 3.68Å; A953-L968 HydrophobicContact CB-CG 3.52Å; A953-L968 VanDerWaalsContact N-CD1 3.35Å; A953-L968 PolarHBondContact N-O 3.48Å; A953-L968 PolarHBondContact O-N 3.27Å
954	I	93.5	Very high	88.3	Confident	76 Å²	76	56.1 Å²	56.1	39%	0.39	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	129.9	167.1	-65.4	165.7	0	0	0	106.3	R937 A938 I956 H966 F967	R937-I954 CarbonylContact C-O 3.58Å; R937-I954 VanDerWaalsContact CA-O 3.29Å; R937-I954 WeakPolarHBondContact CA-O 3.39Å; A938-I954 PolarHBondContact N-O 2.91Å; A938-I954 PolarHBondContact O-N 3.43Å; I954-I956 HydrophobicContact CG2-CD1 4.04Å; I954-I956 HydrophobicContact CG2-CG1 3.91Å; I954-H966 VanDerWaalsContact CA-O 3.32Å; I954-H966 WeakPolarHBondContact CA-O 3.47Å; I954-F967 HydrophobicContact CD1-CD2 4.47Å; I954-F967 HydrophobicContact CG1-CD2 3.74Å; I954-F967 HydrophobicContact CG1-CE2 4.4Å
955	D	90.7	Very high	87.9	Confident	30 Å²	30	54 Å²	54	16%	0.16	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	117.3	171.1	-174.1	71.8	0	0	0	109	R937 Q957 S965 H966	R937-D955 WeakPolarHBondContact CD-OD1 3.34Å; D955-Q957 WeakPolarHBondContact OD2-CG 3.4Å; D955-Q957 PolarHBondContact OD2-NE2 2.93Å; D955-S965 CarbonylContact O-C 3.58Å; D955-S965 WeakPolarHBondContact O-CA 3.41Å; D955-H966 HydrophobicContact CB-CB 4.26Å; D955-H966 PolarHBondContact N-O 2.84Å; D955-H966 PolarHBondContact O-N 3.43Å
956	I	89.5	Confident	87.6	Confident	54 Å²	54	52.4 Å²	52.4	28%	0.277	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	124.1	-179.9	-61.3	171.8	0	0	0	106.5	T935 A936 I954 Q958	T935-I956 CarbonylContact C-O 3.58Å; T935-I956 WeakPolarHBondContact CA-O 3.44Å; A936-I956 HydrophobicContact CB-CB 4.37Å; A936-I956 PolarHBondContact N-O 3.34Å; A936-I956 PolarHBondContact O-N 3.06Å; I954-I956 HydrophobicContact CG2-CD1 4.04Å; I954-I956 HydrophobicContact CG2-CG1 3.91Å; I956-Q958 HydrophobicContact CG2-CG 3.94Å
957	Q	86.5	Confident	87.6	Confident	60 Å²	60	55.5 Å²	55.5	28%	0.28	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	133.2	172.7	-46.7	178.9	29.5	0	0	108.4	T935 D955 Y962 A963 P964	T935-Q957 HydrophobicContact CG2-CB 4.17Å; T935-Q957 HydrophobicContact CG2-CG 4.04Å; D955-Q957 WeakPolarHBondContact OD2-CG 3.4Å; D955-Q957 PolarHBondContact OD2-NE2 2.93Å; Q957-Y962 HydrophobicContact CB-CE1 4.33Å; Q957-A963 CarbonylContact O-C 3.59Å; Q957-A963 VanDerWaalsContact O-C 3.31Å; Q957-A963 VanDerWaalsContact O-CA 3.23Å; Q957-A963 WeakPolarHBondContact O-CA 3.28Å; Q957-P964 HydrophobicContact CB-CG 3.91Å; Q957-P964 HydrophobicContact CG-CG 4.36Å; Q957-P964 PolarHBondContact N-O 3.34Å; Q957-P964 WeakPolarHBondContact O-CD 3.43Å; Q957-P964 VanDerWaalsContact O-O 3.11Å
958	Q	84.6	Confident	87.4	Confident	47 Å²	47	54.4 Å²	54.4	22%	0.22	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	116.9	-173.7	-71.5	-71.8	-16.1	0	0	108.3	G933 Y934 I956 Y962	G933-Q958 CarbonylContact C-O 3.58Å; G933-Q958 WeakPolarHBondContact CA-O 3.3Å; Y934-Q958 HydrophobicContact CD1-CB 3.76Å; Y934-Q958 HydrophobicContact CD2-CB 3.93Å; Y934-Q958 HydrophobicContact CD2-CG 4.28Å; Y934-Q958 HydrophobicContact CE1-CB 3.36Å; Y934-Q958 HydrophobicContact CE1-CG 4.04Å; Y934-Q958 HydrophobicContact CE2-CB 3.54Å; Y934-Q958 HydrophobicContact CE2-CG 3.51Å; Y934-Q958 HydrophobicContact CG-CB 4.04Å; Y934-Q958 PolarHBondContact N-O 3.13Å; Y934-Q958 PolarHBondContact O-N 2.66Å; Y934-Q958 WeakPolarHBondContact OH-CG 3.35Å; I956-Q958 HydrophobicContact CG2-CG 3.94Å; Q958-Y962 CarbonylContact C-O 3.45Å
959	A	80.1	Confident	87.4	Confident	45 Å²	45	52.9 Å²	52.9	37%	0.372	27%	0.273	S	S	.	.	B	Isolated β-bridge	trans	-144.7	170.7	172.7	0	0	0	0	0	108.2	D961 Y962	A959-D961 PolarHBondContact O-N 2.66Å; A959-D961 VanDerWaalsContact O-N 3.12Å; A959-Y962 PolarHBondContact N-O 2.73Å; A959-Y962 PolarHBondContact O-N 3.4Å; A959-Y962 VanDerWaalsContact O-N 3.12Å; A959-Y962 VanDerWaalsContact O-O 3.06Å
960	K	70.6	Confident	87.3	Confident	153 Å²	153	52.8 Å²	52.8	67%	0.665	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	122	175	-169.1	-179.6	176.3	-177.6	0	109.5	Y962	K960-Y962 PolarHBondContact O-N 2.98Å
961	D	64.9	Low	87.3	Confident	120 Å²	120	52.3 Å²	52.3	64%	0.642	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.3	9.9	-179.4	-47	-43.3	0	0	0	115.8	A959	A959-D961 PolarHBondContact O-N 2.66Å; A959-D961 VanDerWaalsContact O-N 3.12Å
962	Y	71.6	Confident	87.2	Confident	129 Å²	129	53.7 Å²	53.7	51%	0.506	27%	0.273	S	S	.	.	B	Isolated β-bridge	trans	-142.6	107.8	179.4	-175.4	-102.5	0	0	0	111	Q957 Q958 A959 K960 P964	Q957-Y962 HydrophobicContact CB-CE1 4.33Å; Q958-Y962 CarbonylContact C-O 3.45Å; A959-Y962 PolarHBondContact N-O 2.73Å; A959-Y962 PolarHBondContact O-N 3.4Å; A959-Y962 VanDerWaalsContact O-N 3.12Å; A959-Y962 VanDerWaalsContact O-O 3.06Å; K960-Y962 PolarHBondContact O-N 2.98Å; Y962-P964 HydrophobicContact CD1-CG 4.24Å; Y962-P964 HydrophobicContact CE1-CG 3.61Å; Y962-P964 HydrophobicContact CE2-CG 4.26Å
963	A	80.6	Confident	87.2	Confident	8 Å²	8	55.6 Å²	55.6	7%	0.066	28%	0.276	C	S	.	.			trans	-139.8	49.8	-168.1	0	0	0	0	0	113.9	Q957	Q957-A963 CarbonylContact O-C 3.59Å; Q957-A963 VanDerWaalsContact O-C 3.31Å; Q957-A963 VanDerWaalsContact O-CA 3.23Å; Q957-A963 WeakPolarHBondContact O-CA 3.28Å
964	P	82.5	Confident	87.2	Confident	3 Å²	3	55.4 Å²	55.4	2%	0.019	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	145.4	178.8	32.8	-36.6	0	0	0	111.5	W776 G777 Q957 Y962	W776-P964 HydrophobicContact CE3-CB 4.37Å; G777-P964 CarbonylContact O-C 3.56Å; G777-P964 WeakPolarHBondContact O-CA 3.4Å; Q957-P964 HydrophobicContact CB-CG 3.91Å; Q957-P964 HydrophobicContact CG-CG 4.36Å; Q957-P964 PolarHBondContact N-O 3.34Å; Q957-P964 WeakPolarHBondContact O-CD 3.43Å; Q957-P964 VanDerWaalsContact O-O 3.11Å; Y962-P964 HydrophobicContact CD1-CG 4.24Å; Y962-P964 HydrophobicContact CE1-CG 3.61Å; Y962-P964 HydrophobicContact CE2-CG 4.26Å
965	S	87.2	Confident	87.1	Confident	41 Å²	41	53.9 Å²	53.9	29%	0.287	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	118.5	170.2	-63.8	0	0	0	0	109	W776 G777 D955	W776-S965 VanDerWaalsContact CA-O 3.3Å; W776-S965 WeakPolarHBondContact CA-O 3.43Å; G777-S965 PolarHBondContact N-O 3.39Å; G777-S965 PolarHBondContact O-N 3.24Å; D955-S965 CarbonylContact O-C 3.58Å; D955-S965 WeakPolarHBondContact O-CA 3.41Å
966	H	88.9	Confident	87.1	Confident	28 Å²	28	54.2 Å²	54.2	13%	0.13	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	141.8	179.4	-62.3	-103.9	0	0	0	110.1	D774 Y775 W776 I954 D955	D774-H966 IonicContact OD1-ND1 2.89Å; D774-H966 IonicContact OD2-ND1 2.73Å; Y775-H966 CarbonylContact O-C 3.54Å; Y775-H966 WeakPolarHBondContact O-CA 3.47Å; W776-H966 VanDerWaalsContact CB-CE1 3.47Å; W776-H966 WeakPolarHBondContact CB-CE1 3.13Å; W776-H966 VanDerWaalsContact CB-ND1 3.29Å; W776-H966 WeakPolarHBondContact CB-ND1 3.47Å; W776-H966 AromaticContact CG-CE1 3.87Å; I954-H966 VanDerWaalsContact CA-O 3.32Å; I954-H966 WeakPolarHBondContact CA-O 3.47Å; D955-H966 HydrophobicContact CB-CB 4.26Å; D955-H966 PolarHBondContact N-O 2.84Å; D955-H966 PolarHBondContact O-N 3.43Å
967	F	93	Very high	87.3	Confident	81 Å²	81	51.7 Å²	51.7	36%	0.355	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	120.7	165.1	172.8	-109.2	0	0	0	108.4	Y775 T952 A953 I954 L969	Y775-F967 HydrophobicContact CD1-CB 4.33Å; Y775-F967 PolarHBondContact N-O 3.37Å; Y775-F967 PolarHBondContact O-N 2.91Å; T952-F967 WeakPolarHBondContact OG1-CE2 3.26Å; A953-F967 WeakPolarHBondContact O-CA 3.25Å; A953-F967 WeakPolarHBondContact O-CD2 3.45Å; I954-F967 HydrophobicContact CD1-CD2 4.47Å; I954-F967 HydrophobicContact CG1-CD2 3.74Å; I954-F967 HydrophobicContact CG1-CE2 4.4Å; F967-L969 HydrophobicContact CD1-CD1 4.28Å; F967-L969 HydrophobicContact CE1-CD1 3.28Å; F967-L969 HydrophobicContact CE1-CG 4.13Å; F967-L969 HydrophobicContact CZ-CD1 3.54Å; F967-L969 HydrophobicContact CZ-CG 3.96Å
968	L	93.2	Very high	87.6	Confident	17 Å²	17	49.7 Å²	49.7	9%	0.089	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	148.9	-178.8	65.1	88.5	0	0	0	112	H773 D774 T952 A953 Y970 P988	H773-L968 VanDerWaalsContact O-CA 3.3Å; H773-L968 WeakPolarHBondContact O-CA 3.47Å; D774-L968 HydrophobicContact CB-CB 4.47Å; T952-L968 CarbonylContact C-O 3.45Å; T952-L968 WeakPolarHBondContact CA-O 3.3Å; T952-L968 WeakPolarHBondContact CB-O 3.48Å; T952-L968 PolarHBondContact OG1-O 2.77Å; A953-L968 HydrophobicContact CB-CD1 3.65Å; A953-L968 HydrophobicContact CB-CD2 3.68Å; A953-L968 HydrophobicContact CB-CG 3.52Å; A953-L968 VanDerWaalsContact N-CD1 3.35Å; A953-L968 PolarHBondContact N-O 3.48Å; A953-L968 PolarHBondContact O-N 3.27Å; L968-Y970 HydrophobicContact CD1-CD1 3.46Å; L968-Y970 VanDerWaalsContact CD1-CD1 3.46Å; L968-Y970 HydrophobicContact CD1-CE1 3.79Å; L968-P988 HydrophobicContact CD1-CB 4.04Å; L968-P988 HydrophobicContact CD2-CB 4.03Å; L968-P988 HydrophobicContact CD2-CG 4.16Å
969	L	95.6	Very high	88.1	Confident	90 Å²	90	49 Å²	49	47%	0.471	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	135.5	167.4	-75.5	126.8	0	0	0	108.4	E772 H773 G951 F967	E772-L969 WeakPolarHBondContact CA-O 3.26Å; H773-L969 PolarHBondContact N-O 3.42Å; H773-L969 PolarHBondContact O-N 3.3Å; G951-L969 WeakPolarHBondContact O-CA 3.39Å; F967-L969 HydrophobicContact CD1-CD1 4.28Å; F967-L969 HydrophobicContact CE1-CD1 3.28Å; F967-L969 HydrophobicContact CE1-CG 4.13Å; F967-L969 HydrophobicContact CZ-CD1 3.54Å; F967-L969 HydrophobicContact CZ-CG 3.96Å
970	Y	96	Very high	88.8	Confident	7 Å²	7	46.8 Å²	46.8	3%	0.027	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	155.5	176.5	66.3	-87.2	0	0	0	113.1	T770 L771 E941 V950 G951 L968 P988	T770-Y970 HydrophobicContact CG2-CD2 4.5Å; L771-Y970 CarbonylContact O-C 3.47Å; L771-Y970 VanDerWaalsContact O-CA 3.29Å; L771-Y970 WeakPolarHBondContact O-CA 3.37Å; E941-Y970 WeakPolarHBondContact CB-OH 3.43Å; E941-Y970 VanDerWaalsContact CD-OH 3.31Å; E941-Y970 HydrophobicContact CG-CE2 4.23Å; E941-Y970 WeakPolarHBondContact CG-OH 3.45Å; E941-Y970 WeakPolarHBondContact OE2-CE2 3.2Å; E941-Y970 VanDerWaalsContact OE2-CZ 3.31Å; E941-Y970 PolarHBondContact OE2-OH 3.36Å; V950-Y970 WeakPolarHBondContact CA-O 3.46Å; G951-Y970 VanDerWaalsContact CA-CE1 3.49Å; G951-Y970 PolarHBondContact N-O 2.89Å; G951-Y970 PolarHBondContact O-N 3.43Å; L968-Y970 HydrophobicContact CD1-CD1 3.46Å; L968-Y970 VanDerWaalsContact CD1-CD1 3.46Å; L968-Y970 HydrophobicContact CD1-CE1 3.79Å; Y970-P988 HydrophobicContact CD1-CB 4.38Å; Y970-P988 HydrophobicContact CE1-CB 4.16Å
971	V	96.8	Very high	89.8	Confident	56 Å²	56	41 Å²	41	34%	0.339	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	132	170.2	-176.8	0	0	0	0	107.9	L771 W948 F949 V950	L771-V971 PolarHBondContact N-O 3.4Å; L771-V971 PolarHBondContact O-N 3.02Å; W948-V971 HydrophobicContact CE3-CG1 3.51Å; W948-V971 HydrophobicContact CZ3-CG1 3.57Å; F949-V971 CarbonylContact O-C 3.59Å; F949-V971 VanDerWaalsContact O-CA 3.32Å; F949-V971 WeakPolarHBondContact O-CA 3.27Å; V950-V971 HydrophobicContact CG2-CG2 4.36Å
972	R	95.4	Very high	91.1	Very high	34 Å²	34	35.4 Å²	35.4	13%	0.128	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	137.6	177.7	173.9	-177.6	-62.5	165	4	110.7	V769 T770 E941 F949 D983 Q987	V769-R972 CarbonylContact O-C 3.57Å; V769-R972 WeakPolarHBondContact O-CA 3.42Å; T770-R972 HydrophobicContact CG2-CB 4.43Å; T770-R972 PolarHBondContact OG1-NE 3.16Å; E941-R972 IonicContact OE2-NH1 2.69Å; F949-R972 HydrophobicContact CB-CB 4.16Å; F949-R972 PolarHBondContact N-O 2.96Å; F949-R972 PolarHBondContact O-N 2.84Å; R972-D983 IonicContact NH1-OD2 2.77Å; R972-Q987 PolarHBondContact NH2-O 2.79Å
973	Y	95.5	Very high	91.9	Very high	81 Å²	81	30.8 Å²	30.8	32%	0.318	17%	0.166	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	122.8	176.5	179.2	-99.5	0	0	0	110.3	N768 V769 N947 W948 A975	N768-Y973 CarbonylContact C-O 3.47Å; N768-Y973 VanDerWaalsContact CA-O 3.32Å; N768-Y973 WeakPolarHBondContact CA-O 3.04Å; V769-Y973 PolarHBondContact N-O 3.38Å; V769-Y973 PolarHBondContact O-N 3.21Å; N947-Y973 HydrophobicContact CB-CD2 3.97Å; N947-Y973 HydrophobicContact CB-CE2 3.61Å; N947-Y973 CarbonylContact O-C 3.59Å; N947-Y973 VanDerWaalsContact O-CA 3.23Å; N947-Y973 WeakPolarHBondContact O-CA 3.17Å; W948-Y973 AromaticContact CD2-CD2 3.87Å; W948-Y973 HydrophobicContact CD2-CD2 3.87Å; W948-Y973 AromaticContact CE2-CD2 3.52Å; W948-Y973 HydrophobicContact CE3-CD2 4.26Å; W948-Y973 HydrophobicContact CG-CD2 4.42Å; W948-Y973 HydrophobicContact CH2-CD2 4.07Å; W948-Y973 HydrophobicContact CH2-CG 4.44Å; W948-Y973 AromaticContact CZ2-CD2 3.63Å; W948-Y973 HydrophobicContact CZ2-CD2 3.63Å; W948-Y973 HydrophobicContact CZ2-CE2 4.15Å; W948-Y973 HydrophobicContact CZ2-CG 4.42Å; W948-Y973 HydrophobicContact CZ3-CD2 4.35Å; W948-Y973 AromaticContact NE1-CD2 3.85Å; W948-Y973 AromaticContact NE1-CE2 3.95Å; Y973-A975 HydrophobicContact CE1-CB 4.08Å
974	S	93.9	Very high	92.3	Very high	3 Å²	3	34 Å²	34	2%	0.021	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	121.5	170.5	155.9	0	0	0	0	108.8	D766 N768 N947 G977	D766-S974 VanDerWaalsContact OD2-CB 3.25Å; D766-S974 WeakPolarHBondContact OD2-CB 3.5Å; D766-S974 PolarHBondContact OD2-OG 3.18Å; N768-S974 WeakPolarHBondContact OD1-CA 3.38Å; N947-S974 WeakPolarHBondContact CB-O 3.21Å; N947-S974 PolarHBondContact ND2-O 3.39Å; N947-S974 PolarHBondContact O-N 2.94Å; S974-G977 WeakPolarHBondContact OG-CA 3.43Å; S974-G977 PolarHBondContact OG-N 2.98Å; S974-G977 VanDerWaalsContact OG-N 3.12Å
975	A	93.1	Very high	92.7	Very high	44 Å²	44	35.2 Å²	35.2	36%	0.364	19%	0.19	S	C	.	.	S	Bend	trans	-70.9	-39.2	-175.2	0	0	0	0	0	112.5	D766 L767 Y973	D766-A975 PolarHBondContact OD1-N 3.43Å; L767-A975 HydrophobicContact CB-CB 3.92Å; L767-A975 HydrophobicContact CD2-CB 4.12Å; L767-A975 WeakPolarHBondContact O-CB 3.35Å; L767-A975 PolarHBondContact O-N 2.98Å; Y973-A975 HydrophobicContact CE1-CB 4.08Å
976	A	90.8	Very high	92.9	Very high	37 Å²	37	33.3 Å²	33.3	31%	0.306	18%	0.177	S	C	.	.	S	Bend	trans	-84.1	-16.2	-178.3	0	0	0	0	0	113.5	N734 Y762 D766	N734-A976 PolarHBondContact ND2-O 2.97Å; N734-A976 VanDerWaalsContact ND2-O 3.14Å; Y762-A976 HydrophobicContact CE1-CB 4.23Å; Y762-A976 WeakPolarHBondContact OH-CB 3.38Å; Y762-A976 PolarHBondContact OH-O 3.03Å; D766-A976 HydrophobicContact CB-CB 4.49Å; D766-A976 VanDerWaalsContact OD1-CB 3.24Å; D766-A976 WeakPolarHBondContact OD1-CB 3.49Å; D766-A976 PolarHBondContact OD1-N 3.47Å
977	G	92	Very high	92.9	Very high	1 Å²	1	37.8 Å²	37.8	1%	0.01	20%	0.198	C	C	.	.			trans	83.7	136.8	-175.7	0	0	0	0	0	112	Y762 S946 S974	Y762-G977 WeakPolarHBondContact CE1-O 2.96Å; Y762-G977 PolarHBondContact OH-O 2.85Å; S946-G977 CarbonylContact O-C 3.52Å; S946-G977 WeakPolarHBondContact O-CA 3.43Å; S974-G977 WeakPolarHBondContact OG-CA 3.43Å; S974-G977 PolarHBondContact OG-N 2.98Å; S974-G977 VanDerWaalsContact OG-N 3.12Å
978	W	94.3	Very high	92.8	Very high	19 Å²	19	35.2 Å²	35.2	7%	0.072	19%	0.189	C	C	.	.			trans	-128.9	112.5	-178.3	178.8	-109.7	0	0	0	111.9	T738 A759 Y762 R763 R943 S946 F949 D981	T738-W978 HydrophobicContact CG2-CE3 3.68Å; T738-W978 HydrophobicContact CG2-CZ3 3.88Å; A759-W978 HydrophobicContact CB-CH2 3.73Å; Y762-W978 AromaticContact CD1-CE3 3.62Å; Y762-W978 HydrophobicContact CD1-CE3 3.62Å; Y762-W978 AromaticContact CD1-CZ3 3.68Å; Y762-W978 HydrophobicContact CD1-CZ3 3.68Å; Y762-W978 AromaticContact CE1-CE3 3.98Å; Y762-W978 HydrophobicContact CE1-CE3 3.98Å; Y762-W978 HydrophobicContact CE1-CZ3 4.45Å; Y762-W978 HydrophobicContact CG-CZ3 4.3Å; R763-W978 HydrophobicContact CG-CD2 4.4Å; R763-W978 HydrophobicContact CG-CE3 4.07Å; R763-W978 HydrophobicContact CG-CH2 3.76Å; R763-W978 HydrophobicContact CG-CZ2 4.11Å; R763-W978 HydrophobicContact CG-CZ3 3.74Å; R943-W978 WeakPolarHBondContact CD-O 3.49Å; R943-W978 PolarHBondContact NE-O 2.93Å; R943-W978 PolarHBondContact NH1-O 3.32Å; S946-W978 PolarHBondContact O-N 2.74Å; F949-W978 HydrophobicContact CZ-CB 4.02Å; F949-W978 HydrophobicContact CZ-CG 4.45Å; W978-D981 PolarHBondContact NE1-O 3.04Å
979	Q	94.6	Very high	92.6	Very high	31 Å²	31	35.2 Å²	35.2	15%	0.145	19%	0.189	C	C	.	.			trans	-107.3	3	172.4	-69.8	-68.8	-17.8	0	0	114	D735 T738 R739 R742 R943	D735-Q979 HydrophobicContact CB-CG 3.9Å; D735-Q979 WeakPolarHBondContact O-CB 3.22Å; T738-Q979 WeakPolarHBondContact OG1-CA 3.43Å; T738-Q979 WeakPolarHBondContact OG1-CB 3.47Å; T738-Q979 PolarHBondContact OG1-N 3.43Å; R739-Q979 HydrophobicContact CB-CB 3.92Å; R742-Q979 VanDerWaalsContact CZ-O 3.28Å; R742-Q979 PolarHBondContact NE-O 3.26Å; R742-Q979 PolarHBondContact NH2-O 2.97Å; R943-Q979 PolarHBondContact NH1-O 3.03Å
980	G	93.9	Very high	91.9	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	19%	0.188	C	C	.	.	S	Bend	trans	-70.8	-161.8	178.8	0	0	0	0	0	113.7	T738 R943	T738-G980 WeakPolarHBondContact O-CA 3.38Å; T738-G980 PolarHBondContact O-N 2.99Å; R943-G980 VanDerWaalsContact CZ-O 3.27Å; R943-G980 PolarHBondContact NH1-O 3.04Å; R943-G980 PolarHBondContact NH2-O 3.24Å
981	D	92.6	Very high	91	Very high	30 Å²	30	35.4 Å²	35.4	16%	0.16	19%	0.191	C	C	.	.	P	Polyproline II helix	trans	-67.9	145.6	176.3	-75.5	-23.3	0	0	0	111.5	R742 N743 R880 W978	R742-D981 WeakPolarHBondContact CA-OD1 3.36Å; R742-D981 WeakPolarHBondContact CB-OD1 3.32Å; R742-D981 WeakPolarHBondContact CG-OD1 3.24Å; N743-D981 WeakPolarHBondContact CB-OD2 3.45Å; N743-D981 PolarHBondContact N-OD2 3.43Å; R880-D981 IonicContact CZ-OD2 2.75Å; R880-D981 VanDerWaalsContact NH1-CB 3.34Å; R880-D981 IonicContact NH1-OD2 3.33Å; R880-D981 VanDerWaalsContact NH2-CG 3.33Å; R880-D981 IonicContact NH2-OD2 3.48Å; R880-D981 PolarHBondContact NH2-OD2 2.84Å; W978-D981 PolarHBondContact NE1-O 3.04Å
982	M	92	Very high	89.7	Confident	3 Å²	3	39.9 Å²	39.9	2%	0.015	20%	0.203	C	C	.	.	P	Polyproline II helix	trans	-70	150.3	168	-61.6	-72.5	-72.4	0	0	110.4	R880 E941 R943 F949	R880-M982 HydrophobicContact CB-CB 4.46Å; R880-M982 VanDerWaalsContact CD-O 3.31Å; R880-M982 WeakPolarHBondContact CD-O 3.44Å; R880-M982 PolarHBondContact NH1-O 3.27Å; R880-M982 VanDerWaalsContact NH1-O 3.12Å; E941-M982 HydrophobicContact CB-CE 4.1Å; E941-M982 HydrophobicContact CG-CE 3.76Å; E941-M982 WeakPolarHBondContact OE1-CE 3.45Å; R943-M982 HydrophobicContact CB-CE 4.41Å; R943-M982 HydrophobicContact CB-SD 3.89Å; R943-M982 PolarHBondContact NE-SD 3.31Å; R943-M982 PolarHBondContact NH2-SD 3.01Å; F949-M982 HydrophobicContact CD1-CE 4.02Å; F949-M982 HydrophobicContact CD1-SD 4.06Å; F949-M982 HydrophobicContact CE1-CE 4.33Å; F949-M982 HydrophobicContact CE1-SD 3.75Å
983	D	89.2	Confident	88.1	Confident	32 Å²	32	42.8 Å²	42.8	17%	0.171	23%	0.234	C	C	.	.	P	Polyproline II helix	trans	-60.8	140.9	172.8	-68.8	-32.2	0	0	0	110.3	R763 S885 R972 P985 Q987	R763-D983 IonicContact NH1-OD1 3.07Å; R763-D983 PolarHBondContact NH1-OD1 3.16Å; S885-D983 VanDerWaalsContact CB-O 3.3Å; S885-D983 WeakPolarHBondContact CB-O 3.3Å; S885-D983 PolarHBondContact OG-O 3.36Å; R972-D983 IonicContact NH1-OD2 2.77Å; D983-P985 CarbonylContact C-O 3.47Å; D983-P985 CarbonylContact O-C 3.56Å; D983-Q987 HydrophobicContact CB-CG 4.5Å
984	L	89.1	Confident	86.7	Confident	76 Å²	76	43 Å²	43	40%	0.398	24%	0.241	S	C	.	.	S	Bend	trans	-132.2	104.3	179.8	-170.2	65.1	0	0	0	110.5	R878 R880	R878-L984 HydrophobicContact CB-CD1 3.79Å; R878-L984 HydrophobicContact CB-CG 4.19Å; R880-L984 HydrophobicContact CB-CD1 4.32Å; R880-L984 HydrophobicContact CG-CD2 4.38Å
985	P	90.2	Very high	85	Confident	28 Å²	28	53.9 Å²	53.9	18%	0.182	28%	0.281	C	S	.	.	S	Bend	cis	-75	170.1	-1	34.5	-37.1	0	0	0	112.9	E887 D983	E887-P985 HydrophobicContact CB-CB 4.02Å; E887-P985 WeakPolarHBondContact OE2-CB 3.32Å; E887-P985 WeakPolarHBondContact OE2-CG 3.17Å; D983-P985 CarbonylContact C-O 3.47Å; D983-P985 CarbonylContact O-C 3.56Å
986	P	91.6	Very high	84.6	Confident	2 Å²	2	54.4 Å²	54.4	1%	0.013	28%	0.277	C	S	.	.			trans	-51.9	142.4	165.2	-23.9	34.3	0	0	0	111.4	S885 L939 E941 P988	S885-P986 WeakPolarHBondContact OG-CD 2.87Å; L939-P986 HydrophobicContact CB-CB 4.46Å; L939-P986 HydrophobicContact CB-CG 4.19Å; L939-P986 HydrophobicContact CD2-CB 4.44Å; E941-P986 HydrophobicContact CB-CB 3.9Å; E941-P986 HydrophobicContact CB-CG 3.89Å; P986-P988 WeakPolarHBondContact O-CD 3.16Å
987	Q	88.5	Confident	84.3	Confident	122 Å²	122	55.3 Å²	55.3	57%	0.57	28%	0.276	S	S	*	.			trans	-113.8	83.9	-176.6	-62.9	-170.8	-4.8	0	0	110.7	R972 D983	R972-Q987 PolarHBondContact NH2-O 2.79Å; D983-Q987 HydrophobicContact CB-CG 4.5Å
988	P	90.5	Very high	83.8	Confident	27 Å²	27	58.3 Å²	58.3	18%	0.175	29%	0.29	C	S	.	.	P	Polyproline II helix	trans	-66.7	167.6	171.7	29.9	-34.6	0	0	0	111.3	L939 L968 Y970 P986	L939-P988 HydrophobicContact CD2-CG 4.08Å; L968-P988 HydrophobicContact CD1-CB 4.04Å; L968-P988 HydrophobicContact CD2-CB 4.03Å; L968-P988 HydrophobicContact CD2-CG 4.16Å; Y970-P988 HydrophobicContact CD1-CB 4.38Å; Y970-P988 HydrophobicContact CE1-CB 4.16Å; P986-P988 WeakPolarHBondContact O-CD 3.16Å
989	L	88.5	Confident	83.2	Confident	16 Å²	16	60.6 Å²	60.6	8%	0.084	30%	0.303	C	S	.	.	P	Polyproline II helix	trans	-68	147	170.4	-60	-179.3	0	0	0	109.6	T770 E772 M793 Q795	T770-L989 HydrophobicContact CG2-CD1 3.98Å; T770-L989 HydrophobicContact CG2-CD2 4.48Å; T770-L989 HydrophobicContact CG2-CG 3.97Å; E772-L989 HydrophobicContact CB-CD1 4.18Å; E772-L989 WeakPolarHBondContact OE2-CB 3.48Å; E772-L989 PolarHBondContact OE2-N 3.31Å; M793-L989 HydrophobicContact CB-CD1 3.81Å; M793-L989 HydrophobicContact CE-CB 4.06Å; M793-L989 HydrophobicContact SD-CB 4.07Å; Q795-L989 HydrophobicContact CB-CD1 3.78Å; Q795-L989 HydrophobicContact CB-CD2 4.01Å; Q795-L989 HydrophobicContact CG-CD2 4.4Å
990	I	82.4	Confident	82.5	Confident	89 Å²	89	62.4 Å²	62.4	46%	0.456	31%	0.313	S	S	.	.	P	Polyproline II helix	trans	-103.5	124.8	172.3	-59.3	174.1	0	0	0	106.8	R808 D994	R808-I990 VanDerWaalsContact CZ-O 3.28Å; R808-I990 PolarHBondContact NH1-O 3.1Å; R808-I990 PolarHBondContact NH2-O 3.01Å; I990-D994 HydrophobicContact CG2-CB 3.77Å
991	P	77	Confident	81.7	Confident	13 Å²	13	66.6 Å²	66.6	8%	0.084	33%	0.334	C	S	.	.	P	Polyproline II helix	trans	-50	141.4	173.1	-27.1	35.1	0	0	0	111.7	M793 A993 D994 W995	M793-P991 HydrophobicContact CE-CG 4.15Å; M793-P991 HydrophobicContact SD-CB 4.41Å; M793-P991 HydrophobicContact SD-CG 4.2Å; P991-A993 PolarHBondContact O-N 3.37Å; P991-A993 VanDerWaalsContact O-N 3.15Å; P991-D994 WeakPolarHBondContact CD-OD2 3.37Å; P991-D994 WeakPolarHBondContact CG-OD2 3.5Å; P991-D994 PolarHBondContact O-N 3.26Å; P991-W995 PolarHBondContact O-N 3.17Å
992	Y	68.3	Low	81	Confident	150 Å²	150	69.2 Å²	69.2	59%	0.588	35%	0.347	S	S	*	.	G	3₁₀ helix	trans	-63	-23.6	-178.9	-153.8	-85.6	0	0	0	112.7	D994 W995	Y992-D994 PolarHBondContact O-N 3.06Å; Y992-W995 PolarHBondContact O-N 2.84Å
993	A	62.5	Low	80.1	Confident	95 Å²	95	74.3 Å²	74.3	79%	0.785	37%	0.372	S	S	*	.	G	3₁₀ helix	trans	-69	-19.1	174.4	0	0	0	0	0	113.7	P991	P991-A993 PolarHBondContact O-N 3.37Å; P991-A993 VanDerWaalsContact O-N 3.15Å
994	D	66.1	Low	79.4	Confident	85 Å²	85	77.8 Å²	77.8	46%	0.455	39%	0.389	S	S	.	.	G	3₁₀ helix	trans	-100.3	-8.3	-179.5	-60.7	-31.4	0	0	0	113	I990 P991 Y992	I990-D994 HydrophobicContact CG2-CB 3.77Å; P991-D994 WeakPolarHBondContact CD-OD2 3.37Å; P991-D994 WeakPolarHBondContact CG-OD2 3.5Å; P991-D994 PolarHBondContact O-N 3.26Å; Y992-D994 PolarHBondContact O-N 3.06Å
995	W	57.8	Low	78.5	Confident	231 Å²	231	78 Å²	78	88%	0.875	39%	0.388	S	S	*	.			trans	-76.7	0	169.8	-95.1	76	0	0	0	110.6	P991 Y992	P991-W995 PolarHBondContact O-N 3.17Å; Y992-W995 PolarHBondContact O-N 2.84Å

Retrieved 995 of 995 residues in 639.5 ms (Link to these results)

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