A0A5K4F181_SCHMA Loading...

Bromodomain and PHD finger-containing protein 3

AlphaFold DB , UniProt , Accession A0A5K4F181, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,446 aa.

						>A0A5K4F181_SCHMA|A0A5K4F181
MVYHPVDFDIDDFLSRIQGNKPPFVCPSETCQKVCRSYNYMQKHMLLHRPPAPIDIPGPLVNGEVSSNFKCASALENGSDQIEKAPIVVGHPTENLCRHQSKTPMTFTDAHTSVVFEASPATKGHTFRCNICVPLTICFQNMSNKVDHDSCTSTQELSKSEGIPINKKQPSSRSKMPHHKNKGRIKNNKSGQISDKQQSDLGGKGSLYTNGTEVNNVIEIPKAVYSIDPEFSIRKSIHLKEGSSYIRFIEKTSDELDEVVEYDLDEEDLFWLKRINAKRNSLSLPPVSESTLEWIMDRFEKKARFRLFTSNGCETTDVLPDIGGNHSGIDEDAVCAVCQDGTCENTNVILFCDVCNLAVHQECYGVPYVPEGPWLCRKCLHSPSEPVSCVLCPNRGGAFKKTTDDRWAHVICGLWVPEVMFANLTFLEPLEGIDRIAAARWRLQCFICKQRNVGACIQCHKSSCYRAFHVTCAQHAGLYMKIEHTDDPGDLGIRKSAFCDQHCPPDHFSSSNKGMYAHSDSDGPQSPERAARIHLRKARKILAERRNSKPSVCVPIVSKAKIDLILSKLSGVSGDKMEFLKQTYAFWKLKREFRRGVPLLKRLQACSLHRSAANFAVAATTGDAESHQMRAHLKFWQQLRQDLERGRLLSELIRKRERIKRDIFRLFVTEIDFKIKPLVVFQLRFIDQLQALDTNQFFAEPVEPSLAPDYSLIIKKPMDFSTMRKKIENFEYCTINELLSDFNLMLENCFEYNRETSIYYTAAMKLRERSKPIISEALTIAKQINFCPKTGLLLENVQTKTETNEQSSHQDNIENSSKTNENCVQSVNTSNTNYNYSKNPTNSSVLLHLSTTRKPSKCSLTTDEQRVHSPLKELINCDRNSSVPSSIRSRLRSFHSPTKPNQSPISFTTNRNFEFTSPNSATTSNTTNIVMDSSVLPRKRRLSSTNGDRELHLSPTLLNGDCRKPAKLARLQSHFPGNTFAQAYTNSANCFENLIKLPGNNDSTNCKWNPSNLLAANDSNCLQIRQLARSTNEMNELISLSNGPAFTRYRIGRLSRGDDEDDEDDSEDTDEDESDDGCITYPNTNSSTPNPSHDSDRSLSRHYQQQRSKQDPEVEINKKSTIVSRTTTLVGTSRMAFANKRSPVSRLKSTYRFKTKQTSVNIRKYKHKRRPSSRCEFAANNKLHNTELNIPSPILVPFNDSHMTSDFDTLFTKFLPKTGIIKSNNIQREHDVVNINFESVKRSDHIDLPLDNEFDTKANCVIDPLSVSSNIETSYTSNSKPIRSPLSRVSSRGSVGEDIFPEHQFSPLDIVWAKCLGSPWYPAIIVDPDANEGYSHNGVPIPLPPESVLKWGKRIAFNKSTDDSELLLVLFFDTKRTWQWLSPQKLQPLGINKELDYERLREGRKSKMKHSVTKAYRRAVEHICKVHGRPYPYTDGKSTDIAVFTL
					

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	31.7	Very low	48.9	Very low	134 Å²	134	97.1 Å²	97.1	66%	0.66	50%	0.498	S	S	*	.				0	104.2	0	-61.1	173.6	90.5	0	0	107.8	F116	M1-F116 HydrophobicContact CE-CB 3.47Å; M1-F116 VanDerWaalsContact CE-CB 3.47Å; M1-F116 HydrophobicContact CE-CD1 4.07Å; M1-F116 HydrophobicContact CE-CD2 3.92Å; M1-F116 HydrophobicContact CE-CG 3.56Å; M1-F116 HydrophobicContact CG-CB 4.46Å
2	V	31.2	Very low	50.9	Low	92 Å²	92	93.5 Å²	93.5	56%	0.558	48%	0.48	S	S	*	.			trans	-87	142.8	163.1	-177	0	0	0	0	107
3	Y	35.9	Very low	53	Low	166 Å²	166	89.2 Å²	89.2	65%	0.651	46%	0.456	S	S	*	.			trans	-100.3	107.1	172.1	-89.1	-93.1	0	0	0	108.3	V114	Y3-V114 HydrophobicContact CE1-CG1 4.22Å
4	H	38.1	Very low	55.1	Low	105 Å²	105	83.2 Å²	83.2	49%	0.486	43%	0.426	S	S	.	.			trans	-84.9	125.7	176.2	-119.1	-43	0	0	0	110.7	V6 E29	H4-V6 HydrophobicContact CB-CG2 4.38Å; H4-V6 PolarHBondContact O-N 3.16Å; H4-V6 VanDerWaalsContact O-N 3.16Å; H4-E29 IonicContact CE1-OE2 2.75Å; H4-E29 PolarHBondContact CE1-OE2 3Å; H4-E29 IonicContact ND1-OE2 2.66Å; H4-E29 PolarHBondContact ND1-OE2 3.45Å
5	P	38.9	Very low	56.7	Low	99 Å²	99	81.9 Å²	81.9	64%	0.643	43%	0.427	S	S	*	.			trans	-90.4	61.9	-176.1	36.5	-36	0	0	0	112.2
6	V	43.3	Very low	58.2	Low	42 Å²	42	87.8 Å²	87.8	26%	0.255	44%	0.441	S	S	.	.			trans	-130.7	35.4	-171.6	-150.6	0	0	0	0	114.4	H4 F8	H4-V6 HydrophobicContact CB-CG2 4.38Å; H4-V6 PolarHBondContact O-N 3.16Å; H4-V6 VanDerWaalsContact O-N 3.16Å; V6-F8 HydrophobicContact CG1-CD1 3.92Å; V6-F8 HydrophobicContact CG1-CE1 3.75Å
7	D	51.5	Low	59.5	Low	126 Å²	126	83.6 Å²	83.6	67%	0.674	42%	0.421	S	S	*	.			trans	-93.9	75.6	159.2	-84.2	-45.4	0	0	0	109.1	M105	D7-M105 VanDerWaalsContact OD2-CE 3.27Å; D7-M105 WeakPolarHBondContact OD2-CE 3.38Å
8	F	58	Low	60.3	Low	74 Å²	74	86.7 Å²	86.7	33%	0.325	43%	0.433	S	S	.	.			trans	-119.3	143.4	170.5	78	-94.5	0	0	0	110.7	V6 I10 F13 P27 M45	V6-F8 HydrophobicContact CG1-CD1 3.92Å; V6-F8 HydrophobicContact CG1-CE1 3.75Å; F8-I10 HydrophobicContact CE2-CG1 4.24Å; F8-F13 HydrophobicContact CD2-CB 3.78Å; F8-F13 HydrophobicContact CD2-CG 4.29Å; F8-F13 HydrophobicContact CE2-CB 3.73Å; F8-F13 HydrophobicContact CE2-CD1 4.16Å; F8-F13 HydrophobicContact CE2-CD2 4.44Å; F8-F13 AromaticContact CE2-CG 3.86Å; F8-F13 HydrophobicContact CE2-CG 3.86Å; F8-P27 HydrophobicContact CE1-CB 4.35Å; F8-P27 HydrophobicContact CE1-CG 3.69Å; F8-P27 HydrophobicContact CE2-CG 4.03Å; F8-P27 HydrophobicContact CZ-CB 4.39Å; F8-P27 HydrophobicContact CZ-CG 3.33Å; F8-M45 HydrophobicContact CZ-SD 4.28Å
9	D	66.4	Low	61.2	Low	86 Å²	86	86.1 Å²	86.1	46%	0.46	45%	0.452	S	S	.	.			trans	-77	125.5	177.4	179.4	-10.1	0	0	0	109.6	D11 D12 F13	D9-D11 PolarHBondContact OD1-N 2.97Å; D9-D12 HydrophobicContact CB-CB 3.76Å; D9-D12 PolarHBondContact OD1-N 3.44Å; D9-F13 WeakPolarHBondContact O-CB 3.3Å; D9-F13 PolarHBondContact O-N 3.13Å
10	I	70.3	Confident	62.2	Low	27 Å²	27	86.6 Å²	86.6	14%	0.138	46%	0.455	C	S	.	.	H	α-helix	trans	-69.5	-36.1	-176.7	-64.2	174.5	0	0	0	110.6	F8 F13 L14 M45	F8-I10 HydrophobicContact CE2-CG1 4.24Å; I10-F13 PolarHBondContact O-N 2.92Å; I10-L14 HydrophobicContact CG2-CD1 3.9Å; I10-L14 HydrophobicContact CG2-CG 4.31Å; I10-L14 WeakPolarHBondContact O-CB 3.46Å; I10-L14 WeakPolarHBondContact O-CG 3.46Å; I10-L14 PolarHBondContact O-N 3.31Å; I10-M45 HydrophobicContact CG2-CB 3.86Å
11	D	72.4	Confident	63.1	Low	117 Å²	117	88.3 Å²	88.3	63%	0.626	46%	0.459	S	S	*	.	H	α-helix	trans	-74.6	-38.2	-179.3	-66.8	-41.5	0	0	0	110.6	D9 L14 S15	D9-D11 PolarHBondContact OD1-N 2.97Å; D11-L14 PolarHBondContact O-N 3.48Å; D11-S15 WeakPolarHBondContact O-CB 3.46Å; D11-S15 PolarHBondContact O-N 3.41Å
12	D	72.8	Confident	65.5	Low	54 Å²	54	84.7 Å²	84.7	29%	0.289	45%	0.445	S	S	.	.	H	α-helix	trans	-60.2	-48.7	168.5	175.6	51	0	0	0	111.5	D9 L14 S15 R16	D9-D12 HydrophobicContact CB-CB 3.76Å; D9-D12 PolarHBondContact OD1-N 3.44Å; D12-L14 PolarHBondContact O-N 3.31Å; D12-S15 PolarHBondContact O-N 2.68Å; D12-S15 PolarHBondContact O-OG 3Å; D12-R16 VanDerWaalsContact CG-CZ 3.42Å; D12-R16 VanDerWaalsContact CG-NE 3.29Å; D12-R16 VanDerWaalsContact O-CG 3.28Å; D12-R16 WeakPolarHBondContact O-CG 3.41Å; D12-R16 PolarHBondContact O-N 3.28Å; D12-R16 IonicContact OD1-CZ 2.85Å; D12-R16 IonicContact OD1-NE 3.22Å; D12-R16 PolarHBondContact OD1-NE 3.08Å; D12-R16 IonicContact OD1-NH2 2.66Å; D12-R16 PolarHBondContact OD1-NH2 2.81Å; D12-R16 IonicContact OD2-CZ 3.58Å; D12-R16 IonicContact OD2-NE 2.75Å; D12-R16 PolarHBondContact OD2-NE 3.31Å; D12-R16 IonicContact OD2-NH1 3.76Å; D12-R16 IonicContact OD2-NH2 2.86Å; D12-R16 PolarHBondContact OD2-NH2 2.8Å
13	F	78.2	Confident	67.7	Low	37 Å²	37	82 Å²	82	16%	0.162	43%	0.429	C	S	.	.	H	α-helix	trans	-59.1	-46.2	175.6	171.4	-103.5	0	0	0	112.7	F8 D9 I10 R16 I17 P27 M41 M45	F8-F13 HydrophobicContact CD2-CB 3.78Å; F8-F13 HydrophobicContact CD2-CG 4.29Å; F8-F13 HydrophobicContact CE2-CB 3.73Å; F8-F13 HydrophobicContact CE2-CD1 4.16Å; F8-F13 HydrophobicContact CE2-CD2 4.44Å; F8-F13 AromaticContact CE2-CG 3.86Å; F8-F13 HydrophobicContact CE2-CG 3.86Å; D9-F13 WeakPolarHBondContact O-CB 3.3Å; D9-F13 PolarHBondContact O-N 3.13Å; I10-F13 PolarHBondContact O-N 2.92Å; F13-R16 PolarHBondContact O-N 2.89Å; F13-I17 HydrophobicContact CE1-CD1 3.91Å; F13-I17 HydrophobicContact CE2-CG2 4.09Å; F13-I17 HydrophobicContact CZ-CD1 4.12Å; F13-I17 HydrophobicContact CZ-CG2 4.22Å; F13-I17 PolarHBondContact O-N 2.77Å; F13-I17 VanDerWaalsContact O-N 3.17Å; F13-P27 HydrophobicContact CD2-CG 4.39Å; F13-P27 HydrophobicContact CE1-CG 4.26Å; F13-P27 HydrophobicContact CE2-CB 4.33Å; F13-P27 HydrophobicContact CE2-CG 3.95Å; F13-P27 HydrophobicContact CZ-CG 3.88Å; F13-M41 HydrophobicContact CE1-CG 4.4Å; F13-M41 HydrophobicContact CE1-SD 4.49Å; F13-M45 HydrophobicContact CD1-SD 4.24Å; F13-M45 HydrophobicContact CE1-CG 4.33Å; F13-M45 HydrophobicContact CE1-SD 3.94Å
14	L	82.2	Confident	70	Confident	6 Å²	6	75 Å²	75	3%	0.031	40%	0.402	C	S	.	.	H	α-helix	trans	-61.7	-45.5	177.4	-73.9	171.8	0	0	0	111.1	I10 D11 D12 R16 I17 Q18 Y38 M41 Q42	I10-L14 HydrophobicContact CG2-CD1 3.9Å; I10-L14 HydrophobicContact CG2-CG 4.31Å; I10-L14 WeakPolarHBondContact O-CB 3.46Å; I10-L14 WeakPolarHBondContact O-CG 3.46Å; I10-L14 PolarHBondContact O-N 3.31Å; D11-L14 PolarHBondContact O-N 3.48Å; D12-L14 PolarHBondContact O-N 3.31Å; L14-R16 VanDerWaalsContact C-N 3.3Å; L14-R16 PolarHBondContact O-N 2.9Å; L14-I17 HydrophobicContact CD2-CD1 4.27Å; L14-I17 WeakPolarHBondContact O-CG1 3.23Å; L14-I17 PolarHBondContact O-N 2.84Å; L14-I17 VanDerWaalsContact O-N 3.16Å; L14-Q18 PolarHBondContact O-N 3.15Å; L14-Q18 VanDerWaalsContact O-N 3.07Å; L14-Y38 HydrophobicContact CD2-CE2 4.48Å; L14-M41 HydrophobicContact CD2-CG 4.5Å; L14-Q42 HydrophobicContact CD1-CB 4.41Å; L14-Q42 HydrophobicContact CD1-CG 3.96Å; L14-Q42 HydrophobicContact CD2-CB 4.13Å
15	S	80	Confident	72.3	Confident	63 Å²	63	72.9 Å²	72.9	44%	0.441	40%	0.397	S	S	.	.	H	α-helix	trans	-59.7	-38	176.2	78.9	0	0	0	0	112.7	D11 D12 I17 Q18	D11-S15 WeakPolarHBondContact O-CB 3.46Å; D11-S15 PolarHBondContact O-N 3.41Å; D12-S15 PolarHBondContact O-N 2.68Å; D12-S15 PolarHBondContact O-OG 3Å; S15-I17 VanDerWaalsContact C-N 3.34Å; S15-I17 PolarHBondContact O-N 3.33Å; S15-Q18 WeakPolarHBondContact O-CB 3.46Å; S15-Q18 PolarHBondContact O-N 3.06Å
16	R	79.8	Confident	74.4	Confident	176 Å²	176	68.3 Å²	68.3	66%	0.664	37%	0.367	S	S	*	.	H	α-helix	trans	-71.8	-22.9	178.5	-71	172.3	-169.2	-167.2	5	114.1	D12 F13 L14	D12-R16 VanDerWaalsContact CG-CZ 3.42Å; D12-R16 VanDerWaalsContact CG-NE 3.29Å; D12-R16 VanDerWaalsContact O-CG 3.28Å; D12-R16 WeakPolarHBondContact O-CG 3.41Å; D12-R16 PolarHBondContact O-N 3.28Å; D12-R16 IonicContact OD1-CZ 2.85Å; D12-R16 IonicContact OD1-NE 3.22Å; D12-R16 PolarHBondContact OD1-NE 3.08Å; D12-R16 IonicContact OD1-NH2 2.66Å; D12-R16 PolarHBondContact OD1-NH2 2.81Å; D12-R16 IonicContact OD2-CZ 3.58Å; D12-R16 IonicContact OD2-NE 2.75Å; D12-R16 PolarHBondContact OD2-NE 3.31Å; D12-R16 IonicContact OD2-NH1 3.76Å; D12-R16 IonicContact OD2-NH2 2.86Å; D12-R16 PolarHBondContact OD2-NH2 2.8Å; F13-R16 PolarHBondContact O-N 2.89Å; L14-R16 VanDerWaalsContact C-N 3.3Å; L14-R16 PolarHBondContact O-N 2.9Å
17	I	81.7	Confident	75.8	Confident	18 Å²	18	69.1 Å²	69.1	9%	0.092	37%	0.373	C	S	.	.	H	α-helix	trans	-96.3	-4.9	173.7	70.4	174.3	0	0	0	113.3	F13 L14 S15 G19 N20 F24 Y38 M41	F13-I17 HydrophobicContact CE1-CD1 3.91Å; F13-I17 HydrophobicContact CE2-CG2 4.09Å; F13-I17 HydrophobicContact CZ-CD1 4.12Å; F13-I17 HydrophobicContact CZ-CG2 4.22Å; F13-I17 PolarHBondContact O-N 2.77Å; F13-I17 VanDerWaalsContact O-N 3.17Å; L14-I17 HydrophobicContact CD2-CD1 4.27Å; L14-I17 WeakPolarHBondContact O-CG1 3.23Å; L14-I17 PolarHBondContact O-N 2.84Å; L14-I17 VanDerWaalsContact O-N 3.16Å; S15-I17 VanDerWaalsContact C-N 3.34Å; S15-I17 PolarHBondContact O-N 3.33Å; I17-G19 PolarHBondContact O-N 3.42Å; I17-N20 PolarHBondContact O-N 3.16Å; I17-F24 HydrophobicContact CB-CD1 4.26Å; I17-F24 HydrophobicContact CB-CE1 4.39Å; I17-F24 HydrophobicContact CD1-CD1 3.95Å; I17-F24 HydrophobicContact CD1-CE1 4.5Å; I17-F24 HydrophobicContact CG1-CD1 4.43Å; I17-Y38 HydrophobicContact CD1-CD2 4.4Å; I17-Y38 HydrophobicContact CD1-CE2 4.45Å; I17-Y38 HydrophobicContact CG1-CD2 4.11Å; I17-Y38 HydrophobicContact CG1-CE2 3.9Å; I17-M41 HydrophobicContact CD1-CG 3.79Å
18	Q	74	Confident	76.4	Confident	138 Å²	138	64.2 Å²	64.2	65%	0.645	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.3	86.2	178.6	-166	173.8	3.3	0	0	111	L14 S15 Y38	L14-Q18 PolarHBondContact O-N 3.15Å; L14-Q18 VanDerWaalsContact O-N 3.07Å; S15-Q18 WeakPolarHBondContact O-CB 3.46Å; S15-Q18 PolarHBondContact O-N 3.06Å; Q18-Y38 HydrophobicContact CB-CE2 3.97Å; Q18-Y38 HydrophobicContact CG-CE2 4.3Å
19	G	75.8	Confident	76.6	Confident	76 Å²	76	66.3 Å²	66.3	78%	0.784	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	136.3	-15.7	-174.3	0	0	0	0	0	113.4	I17	I17-G19 PolarHBondContact O-N 3.42Å
20	N	82	Confident	76.3	Confident	95 Å²	95	67.7 Å²	67.7	51%	0.508	37%	0.371	S	S	.	.	P	Polyproline II helix	trans	-69.4	140.5	171.9	-74.4	-30.2	0	0	0	111	I17 F24	I17-N20 PolarHBondContact O-N 3.16Å; N20-F24 HydrophobicContact CB-CE1 4.03Å; N20-F24 WeakPolarHBondContact O-CE1 3.5Å; N20-F24 VanDerWaalsContact O-CZ 3.25Å; N20-F24 WeakPolarHBondContact O-CZ 3.38Å
21	K	81.1	Confident	76.5	Confident	124 Å²	124	68.7 Å²	68.7	54%	0.539	38%	0.38	S	S	.	.	P	Polyproline II helix	trans	-79.8	141.4	171.9	-62.5	-163.8	176.6	-165.1	0	109.7
22	P	81.8	Confident	76.6	Confident	58 Å²	58	67.3 Å²	67.3	38%	0.377	37%	0.37	S	S	.	.	S	Bend	trans	-60.9	163.1	178.5	25.7	-35.6	0	0	0	111.9	F24 R36	P22-F24 HydrophobicContact CB-CD2 4.07Å; P22-F24 HydrophobicContact CB-CE2 3.84Å; P22-R36 WeakPolarHBondContact CB-O 3.29Å
23	P	78.6	Confident	76.9	Confident	34 Å²	34	69 Å²	69	22%	0.221	38%	0.375	C	S	.	.	P	Polyproline II helix	cis	-76.6	143.7	1.5	30.5	-34.6	0	0	0	114.1	V34 V1289	P23-V34 HydrophobicContact CB-CG1 3.59Å; P23-V34 HydrophobicContact CG-CG1 4.42Å; P23-V1289 HydrophobicContact CG-CG1 4.48Å
24	F	83.9	Confident	77.2	Confident	19 Å²	19	71.6 Å²	71.6	8%	0.083	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	147.4	169.6	-51.6	-88.9	0	0	0	109.1	I17 N20 P22 V34 C35 M41	I17-F24 HydrophobicContact CB-CD1 4.26Å; I17-F24 HydrophobicContact CB-CE1 4.39Å; I17-F24 HydrophobicContact CD1-CD1 3.95Å; I17-F24 HydrophobicContact CD1-CE1 4.5Å; I17-F24 HydrophobicContact CG1-CD1 4.43Å; N20-F24 HydrophobicContact CB-CE1 4.03Å; N20-F24 WeakPolarHBondContact O-CE1 3.5Å; N20-F24 VanDerWaalsContact O-CZ 3.25Å; N20-F24 WeakPolarHBondContact O-CZ 3.38Å; P22-F24 HydrophobicContact CB-CD2 4.07Å; P22-F24 HydrophobicContact CB-CE2 3.84Å; F24-V34 CarbonylContact O-C 3.55Å; F24-V34 WeakPolarHBondContact O-CA 3.34Å; F24-C35 HydrophobicContact CB-CB 4.29Å; F24-C35 WeakPolarHBondContact CD2-O 3.47Å; F24-C35 PolarHBondContact N-O 3.27Å; F24-C35 PolarHBondContact O-N 3.42Å; F24-M41 HydrophobicContact CB-CB 4.44Å; F24-M41 HydrophobicContact CB-CE 3.66Å; F24-M41 HydrophobicContact CB-CG 4.46Å
25	V	85.1	Confident	77.3	Confident	62 Å²	62	71.3 Å²	71.3	38%	0.376	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	134	-179.4	-176.4	0	0	0	0	109.7
26	C	82.7	Confident	77.4	Confident	3 Å²	3	79.3 Å²	79.3	2%	0.02	41%	0.412	C	S	.	.			trans	-65.4	128.7	176.6	-179.1	0	0	0	0	110.2	S28 K33 M41 H44 M45	C26-S28 VanDerWaalsContact C-N 3.3Å; C26-S28 PolarHBondContact O-N 2.93Å; C26-K33 HydrophobicContact CB-CB 4.27Å; C26-K33 PolarHBondContact N-O 2.89Å; C26-M41 HydrophobicContact CB-CE 4.49Å; C26-H44 PolarHBondContact SG-NE2 3.02Å; C26-M45 VanDerWaalsContact SG-CE 3.5Å
27	P	73.5	Confident	77.7	Confident	59 Å²	59	73.6 Å²	73.6	38%	0.383	40%	0.4	S	S	.	.			trans	-78	-9.3	-175.5	32.2	-37.4	0	0	0	114.1	F8 F13 E29 M45	F8-P27 HydrophobicContact CE1-CB 4.35Å; F8-P27 HydrophobicContact CE1-CG 3.69Å; F8-P27 HydrophobicContact CE2-CG 4.03Å; F8-P27 HydrophobicContact CZ-CB 4.39Å; F8-P27 HydrophobicContact CZ-CG 3.33Å; F13-P27 HydrophobicContact CD2-CG 4.39Å; F13-P27 HydrophobicContact CE1-CG 4.26Å; F13-P27 HydrophobicContact CE2-CB 4.33Å; F13-P27 HydrophobicContact CE2-CG 3.95Å; F13-P27 HydrophobicContact CZ-CG 3.88Å; P27-E29 PolarHBondContact O-N 3.44Å; P27-M45 HydrophobicContact CG-SD 4.24Å
28	S	65	Low	78	Confident	23 Å²	23	75.6 Å²	75.6	16%	0.161	41%	0.406	C	S	.	.			trans	-73.6	122.5	174.5	-169.5	0	0	0	0	110.7	C26 T30 C31 Q32	C26-S28 VanDerWaalsContact C-N 3.3Å; C26-S28 PolarHBondContact O-N 2.93Å; S28-T30 PolarHBondContact O-N 3.13Å; S28-T30 PolarHBondContact OG-OG1 3.43Å; S28-C31 PolarHBondContact O-N 2.85Å; S28-Q32 PolarHBondContact O-N 3.37Å
29	E	61.4	Low	78.5	Confident	117 Å²	117	73.5 Å²	73.5	55%	0.547	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.2	-34.4	179.8	-64.8	176.8	134.8	0	0	112.5	H4 P27 C31 Q32	H4-E29 IonicContact CE1-OE2 2.75Å; H4-E29 PolarHBondContact CE1-OE2 3Å; H4-E29 IonicContact ND1-OE2 2.66Å; H4-E29 PolarHBondContact ND1-OE2 3.45Å; P27-E29 PolarHBondContact O-N 3.44Å; E29-C31 VanDerWaalsContact C-N 3.3Å; E29-C31 PolarHBondContact O-N 2.88Å; E29-Q32 PolarHBondContact O-NE2 3.31Å; E29-Q32 VanDerWaalsContact O-NE2 3.1Å
30	T	59.5	Low	79	Confident	116 Å²	116	75.2 Å²	75.2	71%	0.712	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.8	-9	178	55.2	0	0	0	0	114.8	S28	S28-T30 PolarHBondContact O-N 3.13Å; S28-T30 PolarHBondContact OG-OG1 3.43Å
31	C	74.6	Confident	79.2	Confident	47 Å²	47	70.7 Å²	70.7	32%	0.318	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-124.7	-52	-173.2	-170.3	0	0	0	0	113.3	S28 E29 K33 H44	S28-C31 PolarHBondContact O-N 2.85Å; E29-C31 VanDerWaalsContact C-N 3.3Å; E29-C31 PolarHBondContact O-N 2.88Å; C31-K33 PolarHBondContact O-N 2.73Å; C31-H44 PolarHBondContact SG-CE1 3.1Å
32	Q	74.6	Confident	79.4	Confident	89 Å²	89	68.1 Å²	68.1	42%	0.416	35%	0.349	S	S	.	.			trans	46	17.2	178.2	-61	-169.8	55.6	0	0	117	S28 E29 V34 R1292	S28-Q32 PolarHBondContact O-N 3.37Å; E29-Q32 PolarHBondContact O-NE2 3.31Å; E29-Q32 VanDerWaalsContact O-NE2 3.1Å; Q32-V34 PolarHBondContact O-N 2.72Å; Q32-R1292 VanDerWaalsContact OE1-NH1 3.1Å
33	K	80.2	Confident	79.4	Confident	89 Å²	89	71.4 Å²	71.4	39%	0.387	36%	0.357	S	S	.	.			trans	-58.9	133.7	-172.3	-164.1	171.6	-166.6	176.4	0	111.8	C26 C31 Y40	C26-K33 HydrophobicContact CB-CB 4.27Å; C26-K33 PolarHBondContact N-O 2.89Å; C31-K33 PolarHBondContact O-N 2.73Å; K33-Y40 HydrophobicContact CD-CE1 4.48Å; K33-Y40 WeakPolarHBondContact CE-OH 3.24Å; K33-Y40 PolarHBondContact NZ-OH 3.38Å
34	V	84.5	Confident	79.8	Confident	91 Å²	91	70.2 Å²	70.2	55%	0.552	35%	0.349	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.2	113.6	-177.1	-172.7	0	0	0	0	109.7	P23 F24 Q32	P23-V34 HydrophobicContact CB-CG1 3.59Å; P23-V34 HydrophobicContact CG-CG1 4.42Å; F24-V34 CarbonylContact O-C 3.55Å; F24-V34 WeakPolarHBondContact O-CA 3.34Å; Q32-V34 PolarHBondContact O-N 2.72Å
35	C	83.9	Confident	79.5	Confident	1 Å²	1	69.7 Å²	69.7	1%	0.007	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	125.6	-173.5	-57.6	0	0	0	0	110.3	F24 Y40 M41	F24-C35 HydrophobicContact CB-CB 4.29Å; F24-C35 WeakPolarHBondContact CD2-O 3.47Å; F24-C35 PolarHBondContact N-O 3.27Å; F24-C35 PolarHBondContact O-N 3.42Å; C35-Y40 HydrophobicContact CB-CD1 3.91Å; C35-M41 HydrophobicContact CB-CB 4.06Å; C35-M41 HydrophobicContact CB-CE 3.87Å; C35-M41 WeakPolarHBondContact SG-CE 3.34Å
36	R	81.5	Confident	78.8	Confident	230 Å²	230	72.2 Å²	72.2	87%	0.868	36%	0.357	S	S	*	.	S	Bend	trans	-79.9	-13.7	179.4	-67.1	-174.4	-179.5	-179.6	1.2	114.2	P22	P22-R36 WeakPolarHBondContact CB-O 3.29Å
37	S	86	Confident	78.1	Confident	57 Å²	57	78.8 Å²	78.8	40%	0.399	39%	0.391	S	S	.	.	S	Bend	trans	-136.8	152.9	175.7	77.1	0	0	0	0	112.7	Y40 M41	S37-Y40 PolarHBondContact O-N 2.79Å; S37-Y40 WeakPolarHBondContact OG-CB 2.98Å; S37-Y40 PolarHBondContact OG-N 3.06Å; S37-M41 PolarHBondContact O-N 3.26Å; S37-M41 VanDerWaalsContact O-N 3.09Å
38	Y	88.5	Confident	77.5	Confident	60 Å²	60	81.2 Å²	81.2	24%	0.235	40%	0.397	C	S	.	.	H	α-helix	trans	-62	-43.1	176.7	176.2	-88.7	0	0	0	111.6	L14 I17 Q18 Y40 M41 Q42	L14-Y38 HydrophobicContact CD2-CE2 4.48Å; I17-Y38 HydrophobicContact CD1-CD2 4.4Å; I17-Y38 HydrophobicContact CD1-CE2 4.45Å; I17-Y38 HydrophobicContact CG1-CD2 4.11Å; I17-Y38 HydrophobicContact CG1-CE2 3.9Å; Q18-Y38 HydrophobicContact CB-CE2 3.97Å; Q18-Y38 HydrophobicContact CG-CE2 4.3Å; Y38-Y40 VanDerWaalsContact C-N 3.3Å; Y38-Y40 PolarHBondContact O-N 3.5Å; Y38-M41 WeakPolarHBondContact O-CB 3.45Å; Y38-M41 PolarHBondContact O-N 2.84Å; Y38-M41 VanDerWaalsContact O-N 3.07Å; Y38-Q42 PolarHBondContact O-N 3.24Å
39	N	85.2	Confident	77.1	Confident	93 Å²	93	88.4 Å²	88.4	50%	0.497	42%	0.421	S	S	.	.	H	α-helix	trans	-62	-37.1	178.8	-163.9	-55.3	0	0	0	111.7	Q42 K43	N39-Q42 PolarHBondContact O-N 3.38Å; N39-K43 WeakPolarHBondContact O-CG 3.43Å; N39-K43 PolarHBondContact O-N 3.49Å; N39-K43 WeakPolarHBondContact OD1-CE 2.93Å
40	Y	85.7	Confident	76.5	Confident	112 Å²	112	86.5 Å²	86.5	44%	0.439	42%	0.419	S	S	.	.	H	α-helix	trans	-68.1	-39.8	172.2	-169.9	-83	0	0	0	112.1	K33 C35 S37 Y38 K43 H44	K33-Y40 HydrophobicContact CD-CE1 4.48Å; K33-Y40 WeakPolarHBondContact CE-OH 3.24Å; K33-Y40 PolarHBondContact NZ-OH 3.38Å; C35-Y40 HydrophobicContact CB-CD1 3.91Å; S37-Y40 PolarHBondContact O-N 2.79Å; S37-Y40 WeakPolarHBondContact OG-CB 2.98Å; S37-Y40 PolarHBondContact OG-N 3.06Å; Y38-Y40 VanDerWaalsContact C-N 3.3Å; Y38-Y40 PolarHBondContact O-N 3.5Å; Y40-K43 PolarHBondContact O-N 3.41Å; Y40-H44 HydrophobicContact CE1-CB 4.47Å; Y40-H44 WeakPolarHBondContact O-CB 3.31Å; Y40-H44 PolarHBondContact O-N 2.98Å
41	M	86.7	Confident	76.2	Confident	0 Å²	0	86.1 Å²	86.1	0%	0	42%	0.418	C	S	.	.	H	α-helix	trans	-62.3	-42.4	174.1	-177.7	56.8	82.8	0	0	111.9	F13 L14 I17 F24 C26 C35 S37 Y38 H44 M45	F13-M41 HydrophobicContact CE1-CG 4.4Å; F13-M41 HydrophobicContact CE1-SD 4.49Å; L14-M41 HydrophobicContact CD2-CG 4.5Å; I17-M41 HydrophobicContact CD1-CG 3.79Å; F24-M41 HydrophobicContact CB-CB 4.44Å; F24-M41 HydrophobicContact CB-CE 3.66Å; F24-M41 HydrophobicContact CB-CG 4.46Å; C26-M41 HydrophobicContact CB-CE 4.49Å; C35-M41 HydrophobicContact CB-CB 4.06Å; C35-M41 HydrophobicContact CB-CE 3.87Å; C35-M41 WeakPolarHBondContact SG-CE 3.34Å; S37-M41 PolarHBondContact O-N 3.26Å; S37-M41 VanDerWaalsContact O-N 3.09Å; Y38-M41 WeakPolarHBondContact O-CB 3.45Å; Y38-M41 PolarHBondContact O-N 2.84Å; Y38-M41 VanDerWaalsContact O-N 3.07Å; M41-H44 PolarHBondContact O-N 3.48Å; M41-M45 HydrophobicContact CG-CG 4.32Å; M41-M45 VanDerWaalsContact O-CG 3.29Å; M41-M45 WeakPolarHBondContact O-CG 3.29Å; M41-M45 PolarHBondContact O-N 3.44Å; M41-M45 HydrophobicContact SD-CG 3.8Å; M41-M45 HydrophobicContact SD-SD 4.34Å
42	Q	85	Confident	75.4	Confident	71 Å²	71	87.8 Å²	87.8	33%	0.332	44%	0.436	S	S	.	.	H	α-helix	trans	-59.5	-49.9	175.6	-175.6	170.9	21.8	0	0	111.6	L14 Y38 N39 H44 M45 L46	L14-Q42 HydrophobicContact CD1-CB 4.41Å; L14-Q42 HydrophobicContact CD1-CG 3.96Å; L14-Q42 HydrophobicContact CD2-CB 4.13Å; Y38-Q42 PolarHBondContact O-N 3.24Å; N39-Q42 PolarHBondContact O-N 3.38Å; Q42-H44 PolarHBondContact O-N 2.89Å; Q42-M45 PolarHBondContact O-N 3.31Å; Q42-L46 HydrophobicContact CG-CD1 4.14Å; Q42-L46 WeakPolarHBondContact O-CB 3.28Å; Q42-L46 WeakPolarHBondContact O-CD1 3.25Å; Q42-L46 VanDerWaalsContact O-CG 3.3Å; Q42-L46 WeakPolarHBondContact O-CG 3.37Å; Q42-L46 PolarHBondContact O-N 2.86Å
43	K	82	Confident	74.9	Confident	127 Å²	127	85.6 Å²	85.6	55%	0.552	43%	0.429	S	S	*	.	H	α-helix	trans	-61.5	-41.4	174.3	-71.4	-175.9	-179.9	-173.1	0	112.5	N39 Y40 L46 L47	N39-K43 WeakPolarHBondContact O-CG 3.43Å; N39-K43 PolarHBondContact O-N 3.49Å; N39-K43 WeakPolarHBondContact OD1-CE 2.93Å; Y40-K43 PolarHBondContact O-N 3.41Å; K43-L46 PolarHBondContact O-N 2.69Å; K43-L47 WeakPolarHBondContact O-CB 3.39Å; K43-L47 WeakPolarHBondContact O-CG 3.26Å; K43-L47 PolarHBondContact O-N 3.22Å; K43-L47 VanDerWaalsContact O-N 3.09Å
44	H	85.5	Confident	74.3	Confident	8 Å²	8	84.2 Å²	84.2	4%	0.037	43%	0.425	C	S	.	.	H	α-helix	trans	-62	-44.5	178.9	175.4	57.2	0	0	0	112.1	C26 C31 Y40 M41 Q42 L47 H48	C26-H44 PolarHBondContact SG-NE2 3.02Å; C31-H44 PolarHBondContact SG-CE1 3.1Å; Y40-H44 HydrophobicContact CE1-CB 4.47Å; Y40-H44 WeakPolarHBondContact O-CB 3.31Å; Y40-H44 PolarHBondContact O-N 2.98Å; M41-H44 PolarHBondContact O-N 3.48Å; Q42-H44 PolarHBondContact O-N 2.89Å; H44-L47 PolarHBondContact O-N 3.03Å; H44-H48 AromaticContact CE1-CD2 3.37Å; H44-H48 PolarHBondContact CE1-CD2 3.16Å; H44-H48 AromaticContact CE1-CG 3.72Å; H44-H48 AromaticContact CE1-NE2 3.76Å; H44-H48 AromaticContact ND1-CD2 3.09Å; H44-H48 PolarHBondContact ND1-CD2 3.25Å; H44-H48 AromaticContact ND1-CG 3.87Å; H44-H48 AromaticContact ND1-NE2 3.53Å; H44-H48 WeakPolarHBondContact O-CB 3.26Å; H44-H48 PolarHBondContact O-CD2 2.85Å; H44-H48 PolarHBondContact O-N 3.49Å
45	M	77.7	Confident	73.5	Confident	8 Å²	8	83.2 Å²	83.2	4%	0.039	42%	0.417	C	S	.	.	H	α-helix	trans	-73.4	-29.9	179.2	-62.3	-88.8	65	0	0	113.2	F8 I10 F13 C26 P27 M41 Q42 L47	F8-M45 HydrophobicContact CZ-SD 4.28Å; I10-M45 HydrophobicContact CG2-CB 3.86Å; F13-M45 HydrophobicContact CD1-SD 4.24Å; F13-M45 HydrophobicContact CE1-CG 4.33Å; F13-M45 HydrophobicContact CE1-SD 3.94Å; C26-M45 VanDerWaalsContact SG-CE 3.5Å; P27-M45 HydrophobicContact CG-SD 4.24Å; M41-M45 HydrophobicContact CG-CG 4.32Å; M41-M45 VanDerWaalsContact O-CG 3.29Å; M41-M45 WeakPolarHBondContact O-CG 3.29Å; M41-M45 PolarHBondContact O-N 3.44Å; M41-M45 HydrophobicContact SD-CG 3.8Å; M41-M45 HydrophobicContact SD-SD 4.34Å; Q42-M45 PolarHBondContact O-N 3.31Å; M45-L47 VanDerWaalsContact C-N 3.33Å
46	L	70.1	Confident	72.6	Confident	115 Å²	115	85.6 Å²	85.6	60%	0.602	43%	0.429	S	S	*	.	H	α-helix	trans	-68.3	-30.8	171.7	-74.8	166	0	0	0	112.9	Q42 K43	Q42-L46 HydrophobicContact CG-CD1 4.14Å; Q42-L46 WeakPolarHBondContact O-CB 3.28Å; Q42-L46 WeakPolarHBondContact O-CD1 3.25Å; Q42-L46 VanDerWaalsContact O-CG 3.3Å; Q42-L46 WeakPolarHBondContact O-CG 3.37Å; Q42-L46 PolarHBondContact O-N 2.86Å; K43-L46 PolarHBondContact O-N 2.69Å
47	L	68.5	Low	71.1	Confident	141 Å²	141	80.2 Å²	80.2	74%	0.738	42%	0.424	S	S	*	.	H	α-helix	trans	-90.4	-39.8	-178.6	-70.4	167.6	0	0	0	113.5	K43 H44 M45 R49	K43-L47 WeakPolarHBondContact O-CB 3.39Å; K43-L47 WeakPolarHBondContact O-CG 3.26Å; K43-L47 PolarHBondContact O-N 3.22Å; K43-L47 VanDerWaalsContact O-N 3.09Å; H44-L47 PolarHBondContact O-N 3.03Å; M45-L47 VanDerWaalsContact C-N 3.33Å; L47-R49 PolarHBondContact O-N 3.32Å
48	H	60.7	Low	69.1	Low	110 Å²	110	78.9 Å²	78.9	51%	0.509	42%	0.42	S	S	.	.			trans	-94.1	57.6	-177.9	-68.6	-97.7	0	0	0	112.5	H44	H44-H48 AromaticContact CE1-CD2 3.37Å; H44-H48 PolarHBondContact CE1-CD2 3.16Å; H44-H48 AromaticContact CE1-CG 3.72Å; H44-H48 AromaticContact CE1-NE2 3.76Å; H44-H48 AromaticContact ND1-CD2 3.09Å; H44-H48 PolarHBondContact ND1-CD2 3.25Å; H44-H48 AromaticContact ND1-CG 3.87Å; H44-H48 AromaticContact ND1-NE2 3.53Å; H44-H48 WeakPolarHBondContact O-CB 3.26Å; H44-H48 PolarHBondContact O-CD2 2.85Å; H44-H48 PolarHBondContact O-N 3.49Å
49	R	56.8	Low	66.6	Low	174 Å²	174	80.2 Å²	80.2	66%	0.657	44%	0.435	S	S	*	.	P	Polyproline II helix	trans	-77.6	126.6	171.1	-164.4	-178.5	-169.7	94.3	1.4	109.6	L47	L47-R49 PolarHBondContact O-N 3.32Å
50	P	49.8	Very low	64	Low	77 Å²	77	82 Å²	82	50%	0.5	44%	0.444	S	S	.	.	P	Polyproline II helix	trans	-63.6	150.7	172.9	26.8	-33.8	0	0	0	110.9
51	P	53	Low	61.4	Low	108 Å²	108	83.1 Å²	83.1	70%	0.701	46%	0.463	S	S	*	.	P	Polyproline II helix	trans	-62.3	140.5	179.1	26.2	-34.2	0	0	0	111.1
52	A	57	Low	58.7	Low	83 Å²	83	90.2 Å²	90.2	69%	0.686	50%	0.5	S	S	*	.	P	Polyproline II helix	trans	-68.6	140	-180	0	0	0	0	0	111.1
53	P	64.2	Low	56	Low	43 Å²	43	90.2 Å²	90.2	28%	0.279	52%	0.52	S	S	.	.	P	Polyproline II helix	trans	-57.9	144.2	178.6	-27	35.1	0	0	0	114	D55 V115 T126 R128	P53-D55 PolarHBondContact O-N 3.07Å; P53-V115 HydrophobicContact CB-CG1 4.11Å; P53-V115 HydrophobicContact CB-CG2 4.47Å; P53-V115 HydrophobicContact CG-CG1 3.74Å; P53-V115 HydrophobicContact CG-CG2 4.04Å; P53-T126 WeakPolarHBondContact CA-O 3.34Å; P53-T126 WeakPolarHBondContact CA-OG1 3.2Å; P53-R128 HydrophobicContact CB-CB 3.83Å
54	I	67.2	Low	53.3	Low	59 Å²	59	92.2 Å²	92.2	30%	0.303	53%	0.531	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	118	172.3	-61.2	177.3	0	0	0	109	I56 H125 T126 F127 R128	I54-I56 PolarHBondContact O-N 3.17Å; I54-H125 HydrophobicContact CD1-CB 4.4Å; I54-T126 PolarHBondContact N-O 3.19Å; I54-F127 HydrophobicContact CB-CD1 3.95Å; I54-F127 HydrophobicContact CB-CE1 4.3Å; I54-F127 HydrophobicContact CD1-CE1 4.08Å; I54-F127 HydrophobicContact CG2-CD1 4.16Å; I54-F127 HydrophobicContact CG2-CE1 4.36Å; I54-F127 CarbonylContact O-C 3.58Å; I54-F127 WeakPolarHBondContact O-CA 3.48Å; I54-R128 PolarHBondContact O-N 2.7Å
55	D	69.4	Low	50.5	Low	70 Å²	70	98.4 Å²	98.4	37%	0.374	57%	0.569	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-69.8	116.3	178.6	-71.3	-42.6	0	0	0	111.5	P53 P57 K102 R128	P53-D55 PolarHBondContact O-N 3.07Å; D55-P57 WeakPolarHBondContact O-CD 3.25Å; D55-K102 IonicContact OD2-NZ 3.25Å; D55-R128 IonicContact OD1-CZ 2.71Å; D55-R128 IonicContact OD1-NE 2.7Å; D55-R128 PolarHBondContact OD1-NE 2.84Å; D55-R128 IonicContact OD1-NH2 3.49Å; D55-R128 PolarHBondContact OD1-NH2 3.01Å; D55-R128 IonicContact OD2-NH2 2.9Å; D55-R128 PolarHBondContact OD2-NH2 3.39Å
56	I	64.3	Low	48.1	Very low	52 Å²	52	103.8 Å²	103.8	27%	0.267	61%	0.608	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-86	114.5	167.5	-65.5	175.4	0	0	0	107.5	I54 G58 F116 F127 R128 C129	I54-I56 PolarHBondContact O-N 3.17Å; I56-G58 PolarHBondContact O-N 3.24Å; I56-F116 HydrophobicContact CD1-CE1 3.96Å; I56-F116 HydrophobicContact CD1-CZ 3.6Å; I56-F127 HydrophobicContact CD1-CB 3.77Å; I56-F127 HydrophobicContact CD1-CD1 4.2Å; I56-F127 HydrophobicContact CD1-CG 4.31Å; I56-F127 HydrophobicContact CG1-CB 4.27Å; I56-F127 HydrophobicContact CG1-CD1 4.3Å; I56-R128 PolarHBondContact N-O 3.05Å; I56-C129 HydrophobicContact CB-CB 3.82Å; I56-C129 HydrophobicContact CD1-CB 4.16Å; I56-C129 HydrophobicContact CG2-CB 4Å
57	P	49.8	Very low	46	Very low	116 Å²	116	103 Å²	103	75%	0.753	61%	0.611	S	S	*	*	P	Polyproline II helix	trans	-58.9	125.8	-178	-25.4	35.4	0	0	0	112.3	D55	D55-P57 WeakPolarHBondContact O-CD 3.25Å
58	G	44.5	Very low	44.1	Very low	30 Å²	30	103.5 Å²	103.5	31%	0.309	62%	0.615	S	S	.	*	P	Polyproline II helix	trans	-75.9	154.2	170.2	0	0	0	0	0	111.8	I56 L60	I56-G58 PolarHBondContact O-N 3.24Å; G58-L60 PolarHBondContact O-N 3.16Å
59	P	35.7	Very low	42.4	Very low	87 Å²	87	108.6 Å²	108.6	57%	0.565	64%	0.636	S	S	*	*	P	Polyproline II helix	trans	-62.5	122.3	168.3	27.5	-33.2	0	0	0	109.2	V61	P59-V61 PolarHBondContact O-N 3.29Å
60	L	30.9	Very low	41.1	Very low	132 Å²	132	109.7 Å²	109.7	69%	0.691	65%	0.646	S	S	*	*	P	Polyproline II helix	trans	-63	122.1	-179.6	-69.4	169.9	0	0	0	110.6	G58 N62	G58-L60 PolarHBondContact O-N 3.16Å; L60-N62 WeakPolarHBondContact CB-O 3.41Å
61	V	31.5	Very low	39.9	Very low	135 Å²	135	111.7 Å²	111.7	82%	0.818	66%	0.66	S	S	*	*	S	Bend	trans	-79.9	121.2	164.9	179.5	0	0	0	0	106.7	P59	P59-V61 PolarHBondContact O-N 3.29Å
62	N	29.4	Very low	38.8	Very low	148 Å²	148	111.1 Å²	111.1	79%	0.791	66%	0.664	S	S	*	*	S	Bend	trans	74.1	119.7	-154.1	-47.2	-30.5	0	0	0	110.6	L60	L60-N62 WeakPolarHBondContact CB-O 3.41Å
63	G	26.8	Very low	37.2	Very low	72 Å²	72	112.9 Å²	112.9	74%	0.742	67%	0.672	S	S	*	*			trans	-100.4	136.5	-161	0	0	0	0	0	114.8
64	E	26.7	Very low	35.5	Very low	169 Å²	169	115 Å²	115	79%	0.79	69%	0.693	S	S	*	*			trans	-151.1	140.4	134.3	-115.2	173.9	-157.4	0	0	108.6
65	V	26	Very low	33.7	Very low	137 Å²	137	119.4 Å²	119.4	83%	0.83	72%	0.716	S	S	*	*			trans	-100.9	95.1	-173.8	-179.2	0	0	0	0	110.1
66	S	27.4	Very low	31.6	Very low	122 Å²	122	122.6 Å²	122.6	85%	0.853	73%	0.729	S	S	*	*			trans	-95.2	89.2	165.7	-83.8	0	0	0	0	110.4	N68	S66-N68 PolarHBondContact O-N 2.65Å
67	S	27.1	Very low	29.9	Very low	97 Å²	97	127.9 Å²	127.9	68%	0.678	76%	0.758	S	S	*	*			trans	-76.8	96.7	175.1	56.6	0	0	0	0	111.5
68	N	27.7	Very low	28.9	Very low	153 Å²	153	125.7 Å²	125.7	82%	0.818	76%	0.756	S	S	*	*			trans	-172.6	100.5	157.3	-97.8	-30.7	0	0	0	111.7	S66	S66-N68 PolarHBondContact O-N 2.65Å
69	F	26.2	Very low	28.1	Very low	216 Å²	216	129.5 Å²	129.5	95%	0.947	78%	0.778	S	S	*	*			trans	-163.5	109.9	145.9	-103.5	-66.3	0	0	0	109.7
70	K	29.3	Very low	27.9	Very low	198 Å²	198	131.6 Å²	131.6	86%	0.861	79%	0.785	S	S	*	*			trans	-87.8	124.9	161.8	-76.9	-176.2	174.1	-177.4	0	107.7
71	C	23.7	Very low	27.9	Very low	118 Å²	118	132.4 Å²	132.4	80%	0.797	79%	0.785	S	S	*	*			trans	-67.6	131.5	157.7	-89.1	0	0	0	0	108.6
72	A	29.2	Very low	27.7	Very low	96 Å²	96	132.1 Å²	132.1	79%	0.793	78%	0.778	S	S	*	*			trans	-138.4	126.3	172.9	0	0	0	0	0	108.4
73	S	25.1	Very low	27.5	Very low	121 Å²	121	131.6 Å²	131.6	85%	0.846	77%	0.77	S	S	*	*			trans	-85.2	133.9	-179.7	50.1	0	0	0	0	111.9
74	A	28.6	Very low	27.6	Very low	88 Å²	88	136.2 Å²	136.2	73%	0.727	77%	0.77	S	S	*	*			trans	-140.7	116.6	159.7	0	0	0	0	0	106.9
75	L	27.8	Very low	27.7	Very low	151 Å²	151	132.5 Å²	132.5	79%	0.791	77%	0.768	S	S	*	*				59.8	117.5	103.7	-80.9	77	0	0	0	112.5
76	E	25.1	Very low	28	Very low	137 Å²	137	131.4 Å²	131.4	64%	0.64	76%	0.764	S	S	*	*				58.8	87.3	50.9	-60.9	176.4	165.7	0	0	112.7	K123	E76-K123 IonicContact OE1-NZ 3.99Å; E76-K123 IonicContact OE2-NZ 2.59Å
77	N	29.1	Very low	27.9	Very low	162 Å²	162	133.2 Å²	133.2	87%	0.866	76%	0.762	S	S	*	*				156.2	150.8	125.1	-75.4	-23	0	0	0	114.4
78	G	30.3	Very low	27.8	Very low	70 Å²	70	134.7 Å²	134.7	72%	0.722	77%	0.767	S	S	*	*			trans	86.1	116.7	175.8	0	0	0	0	0	113.8
79	S	27.6	Very low	27.7	Very low	111 Å²	111	134.2 Å²	134.2	78%	0.776	77%	0.769	S	S	*	*			cis	93.8	125.1	35.1	77.5	0	0	0	0	114.7
80	D	30.3	Very low	27.8	Very low	130 Å²	130	126.9 Å²	126.9	70%	0.695	76%	0.755	S	S	*	*			trans	84.8	120.4	150.6	-78	40	0	0	0	123.7
81	Q	30.5	Very low	27.7	Very low	150 Å²	150	126.3 Å²	126.3	70%	0.701	75%	0.754	S	S	*	*			trans	91.4	116.6	130.9	-71	178.7	53.6	0	0	123.5
82	I	27.8	Very low	28.1	Very low	129 Å²	129	126 Å²	126	66%	0.662	75%	0.751	S	S	*	*				87.6	99.8	127	-65.7	172.8	0	0	0	121.1
83	E	26.2	Very low	28	Very low	136 Å²	136	127.4 Å²	127.4	64%	0.636	75%	0.75	S	S	*	*				62.9	141.8	127.1	-61.5	-160.3	119.2	0	0	126.2
84	K	28.7	Very low	28	Very low	170 Å²	170	130.9 Å²	130.9	74%	0.739	75%	0.753	S	S	*	*			trans	60.7	149.5	145.6	-67.2	157.2	-172.3	156	0	118.4
85	A	27.5	Very low	27.9	Very low	91 Å²	91	134 Å²	134	75%	0.752	76%	0.758	S	S	*	*			cis	-164.7	169.6	-18.2	0	0	0	0	0	107.7
86	P	33.4	Very low	27.8	Very low	114 Å²	114	134.7 Å²	134.7	74%	0.74	76%	0.761	S	S	*	*			trans	-106.4	161	-159.9	38.9	-35.1	0	0	0	117.2
87	I	23.9	Very low	27.8	Very low	160 Å²	160	134 Å²	134	82%	0.821	77%	0.77	S	S	*	*				178.5	123.9	125	-89.9	154.5	0	0	0	114.8
88	V	26.1	Very low	27.7	Very low	128 Å²	128	137.4 Å²	137.4	78%	0.776	77%	0.77	S	S	*	*			trans	9.8	153.2	151.2	-150.6	0	0	0	0	124.5
89	V	26	Very low	27.5	Very low	143 Å²	143	143.1 Å²	143.1	87%	0.867	78%	0.778	S	S	*	*			trans	90.3	126.2	163.8	-166.5	0	0	0	0	116.4
90	G	27	Very low	27.4	Very low	62 Å²	62	145.9 Å²	145.9	64%	0.639	78%	0.779	S	S	*	*			cis	169.6	135.3	-12.7	0	0	0	0	0	116.1
91	H	29	Very low	27.4	Very low	185 Å²	185	145 Å²	145	86%	0.856	78%	0.783	S	S	*	*			trans	66	158.8	169.2	-78.2	-87.7	0	0	0	119.5
92	P	30.9	Very low	27.7	Very low	111 Å²	111	144.9 Å²	144.9	72%	0.721	78%	0.78	S	S	*	*			cis	-120.9	165.1	-1.6	40.5	-27.2	0	0	0	116.6
93	T	26.5	Very low	28.2	Very low	127 Å²	127	143.8 Å²	143.8	78%	0.779	78%	0.779	S	S	*	*			trans	-4.7	116.7	164.5	53.1	0	0	0	0	121.3
94	E	26.7	Very low	29.1	Very low	194 Å²	194	142 Å²	142	91%	0.907	78%	0.78	S	S	*	*				-153.8	166.4	116.3	-125.8	177.3	-157	0	0	111.3
95	N	26.1	Very low	30.1	Very low	154 Å²	154	136.2 Å²	136.2	82%	0.824	76%	0.756	S	S	*	*			trans	-100.6	122.7	-166.6	-65.1	-79.5	0	0	0	113.3
96	L	25.5	Very low	31.5	Very low	164 Å²	164	134.3 Å²	134.3	86%	0.859	74%	0.735	S	S	*	*			trans	-169.1	-176.7	138.6	-127.6	67.4	0	0	0	112.1	R98	L96-R98 VanDerWaalsContact C-N 3.35Å; L96-R98 PolarHBondContact O-N 2.91Å
97	C	25.8	Very low	32.3	Very low	123 Å²	123	133.7 Å²	133.7	83%	0.831	72%	0.721	S	S	*	*			trans	61.3	20.1	169	-63.3	0	0	0	0	119	H99	C97-H99 PolarHBondContact O-N 3.35Å
98	R	25.3	Very low	33.9	Very low	233 Å²	233	130.7 Å²	130.7	88%	0.879	71%	0.71	S	S	*	*	S	Bend	trans	-65.1	119.6	149.7	-163	177.2	-162.1	162.4	5.5	107.2	L96 Q100	L96-R98 VanDerWaalsContact C-N 3.35Å; L96-R98 PolarHBondContact O-N 2.91Å; R98-Q100 PolarHBondContact O-N 3.25Å
99	H	26.7	Very low	35.3	Very low	191 Å²	191	127.3 Å²	127.3	88%	0.884	69%	0.688	S	S	*	*			trans	-51.5	109.3	177.3	-87.5	-81.5	0	0	0	109.5	C97 S101	C97-H99 PolarHBondContact O-N 3.35Å; H99-S101 PolarHBondContact O-N 3.26Å
100	Q	26.6	Very low	37	Very low	169 Å²	169	122.9 Å²	122.9	79%	0.79	67%	0.666	S	S	*	*			trans	-69.2	111.9	-178.3	-72.3	-176.2	-5.3	0	0	108.4	R98 K102	R98-Q100 PolarHBondContact O-N 3.25Å; Q100-K102 PolarHBondContact O-N 2.91Å
101	S	28.6	Very low	38.8	Very low	112 Å²	112	124.4 Å²	124.4	78%	0.783	66%	0.656	S	S	*	*			trans	-62.9	79	159.4	54.1	0	0	0	0	108	H99 T103	H99-S101 PolarHBondContact O-N 3.26Å; S101-T103 PolarHBondContact O-N 2.74Å
102	K	37	Very low	40.5	Very low	147 Å²	147	118.2 Å²	118.2	64%	0.639	63%	0.632	S	S	*	*	P	Polyproline II helix	trans	-52.2	116.8	175.5	-79.3	-168.9	172.4	-170.7	0	106.6	D55 Q100	D55-K102 IonicContact OD2-NZ 3.25Å; Q100-K102 PolarHBondContact O-N 2.91Å
103	T	39.6	Very low	42.3	Very low	105 Å²	105	114.1 Å²	114.1	64%	0.644	61%	0.606	S	S	*	*	P	Polyproline II helix	trans	-55.6	144.1	-168.7	43.6	0	0	0	0	110.5	S101 M105	S101-T103 PolarHBondContact O-N 2.74Å; T103-M105 PolarHBondContact O-N 3.26Å
104	P	45	Very low	44.3	Very low	100 Å²	100	109.8 Å²	109.8	65%	0.649	58%	0.579	S	S	*	*	P	Polyproline II helix	trans	-51.4	139.4	167.8	25.3	-34.1	0	0	0	108.6	T106	P104-T106 PolarHBondContact O-N 3.15Å
105	M	48.8	Very low	46.3	Very low	47 Å²	47	102.5 Å²	102.5	23%	0.232	55%	0.548	C	S	.	.			trans	-53	115.2	-171	-173.5	165.3	57.8	0	0	109.3	D7 T103 D109 A110	D7-M105 VanDerWaalsContact OD2-CE 3.27Å; D7-M105 WeakPolarHBondContact OD2-CE 3.38Å; T103-M105 PolarHBondContact O-N 3.26Å; M105-D109 HydrophobicContact CG-CB 3.41Å; M105-D109 VanDerWaalsContact CG-CB 3.41Å; M105-D109 HydrophobicContact SD-CB 4.37Å; M105-A110 HydrophobicContact CE-CB 4Å; M105-A110 HydrophobicContact CG-CB 4.36Å
106	T	56.3	Low	48.2	Very low	52 Å²	52	96.4 Å²	96.4	32%	0.319	51%	0.514	S	S	.	.			trans	-65.1	159.6	-172.5	69.9	0	0	0	0	109.6	P104 T108 D109 A110	P104-T106 PolarHBondContact O-N 3.15Å; T106-T108 PolarHBondContact O-N 2.81Å; T106-T108 PolarHBondContact OG1-OG1 3.1Å; T106-D109 VanDerWaalsContact CB-OD2 3.27Å; T106-D109 WeakPolarHBondContact CB-OD2 3.21Å; T106-D109 WeakPolarHBondContact CG2-OD2 3.48Å; T106-D109 PolarHBondContact N-OD2 2.6Å; T106-D109 PolarHBondContact O-N 3.15Å; T106-D109 PolarHBondContact OG1-N 3.25Å; T106-D109 PolarHBondContact OG1-OD1 3.07Å; T106-D109 PolarHBondContact OG1-OD2 3.34Å; T106-A110 PolarHBondContact O-N 3.25Å
107	F	50.6	Low	50	Low	100 Å²	100	91.3 Å²	91.3	44%	0.439	49%	0.486	S	S	.	.	H	α-helix	trans	-52.7	-34	176.7	173.7	-108.4	0	0	0	112.7	H111 R645	F107-H111 AromaticContact CD2-CD2 3.98Å; F107-H111 AromaticContact CE2-CD2 3.13Å; F107-H111 WeakPolarHBondContact CE2-CD2 2.83Å; F107-H111 AromaticContact CE2-NE2 3.18Å; F107-H111 WeakPolarHBondContact CE2-NE2 3.44Å; F107-H111 AromaticContact CZ-CD2 3.33Å; F107-H111 WeakPolarHBondContact CZ-CD2 3.32Å; F107-H111 AromaticContact CZ-CE1 3.95Å; F107-H111 AromaticContact CZ-NE2 3.28Å; F107-H111 VanDerWaalsContact CZ-NE2 3.28Å; F107-H111 WeakPolarHBondContact CZ-NE2 3.21Å; F107-H111 PolarHBondContact O-N 2.84Å; F107-R645 VanDerWaalsContact CD1-NH2 3.31Å; F107-R645 HydrophobicContact CE2-CG 4.09Å; F107-R645 HydrophobicContact CZ-CG 4.12Å
108	T	57.3	Low	51.5	Low	98 Å²	98	87.3 Å²	87.3	60%	0.601	46%	0.461	S	S	*	.	H	α-helix	trans	-66.6	-41.8	172.1	13.6	0	0	0	0	113.8	T106 H111 T112	T106-T108 PolarHBondContact O-N 2.81Å; T106-T108 PolarHBondContact OG1-OG1 3.1Å; T108-H111 PolarHBondContact O-N 2.79Å; T108-T112 PolarHBondContact O-N 2.83Å; T108-T112 PolarHBondContact O-OG1 3.08Å
109	D	56.3	Low	53	Low	57 Å²	57	79.9 Å²	79.9	31%	0.305	45%	0.445	S	S	.	.	H	α-helix	trans	-70.2	-40	180	-55.7	-40.5	0	0	0	111.1	M105 T106 H111 T112 S113	M105-D109 HydrophobicContact CG-CB 3.41Å; M105-D109 VanDerWaalsContact CG-CB 3.41Å; M105-D109 HydrophobicContact SD-CB 4.37Å; T106-D109 VanDerWaalsContact CB-OD2 3.27Å; T106-D109 WeakPolarHBondContact CB-OD2 3.21Å; T106-D109 WeakPolarHBondContact CG2-OD2 3.48Å; T106-D109 PolarHBondContact N-OD2 2.6Å; T106-D109 PolarHBondContact O-N 3.15Å; T106-D109 PolarHBondContact OG1-N 3.25Å; T106-D109 PolarHBondContact OG1-OD1 3.07Å; T106-D109 PolarHBondContact OG1-OD2 3.34Å; D109-H111 PolarHBondContact O-N 3.15Å; D109-T112 WeakPolarHBondContact CA-OG1 3.41Å; D109-T112 CarbonylContact O-C 3.52Å; D109-T112 PolarHBondContact O-N 2.82Å; D109-T112 PolarHBondContact O-OG1 3.09Å; D109-S113 VanDerWaalsContact O-CB 3.31Å; D109-S113 WeakPolarHBondContact O-CB 3.36Å; D109-S113 PolarHBondContact O-N 3.01Å; D109-S113 PolarHBondContact O-OG 2.89Å
110	A	62.4	Low	53.9	Low	49 Å²	49	76.7 Å²	76.7	41%	0.405	44%	0.442	S	S	.	.	H	α-helix	trans	-63.8	-27	175.3	0	0	0	0	0	112.7	M105 T106	M105-A110 HydrophobicContact CE-CB 4Å; M105-A110 HydrophobicContact CG-CB 4.36Å; T106-A110 PolarHBondContact O-N 3.25Å
111	H	64.5	Low	54.9	Low	94 Å²	94	72.9 Å²	72.9	44%	0.435	44%	0.439	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-7.1	173.5	-95.5	-105.3	0	0	0	114.3	F107 T108 D109	F107-H111 AromaticContact CD2-CD2 3.98Å; F107-H111 AromaticContact CE2-CD2 3.13Å; F107-H111 WeakPolarHBondContact CE2-CD2 2.83Å; F107-H111 AromaticContact CE2-NE2 3.18Å; F107-H111 WeakPolarHBondContact CE2-NE2 3.44Å; F107-H111 AromaticContact CZ-CD2 3.33Å; F107-H111 WeakPolarHBondContact CZ-CD2 3.32Å; F107-H111 AromaticContact CZ-CE1 3.95Å; F107-H111 AromaticContact CZ-NE2 3.28Å; F107-H111 VanDerWaalsContact CZ-NE2 3.28Å; F107-H111 WeakPolarHBondContact CZ-NE2 3.21Å; F107-H111 PolarHBondContact O-N 2.84Å; T108-H111 PolarHBondContact O-N 2.79Å; D109-H111 PolarHBondContact O-N 3.15Å
112	T	64.9	Low	56.2	Low	56 Å²	56	69.5 Å²	69.5	34%	0.344	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	-122.9	-5.8	-177.2	52.7	0	0	0	0	113.9	T108 D109 N130 I131	T108-T112 PolarHBondContact O-N 2.83Å; T108-T112 PolarHBondContact O-OG1 3.08Å; D109-T112 WeakPolarHBondContact CA-OG1 3.41Å; D109-T112 CarbonylContact O-C 3.52Å; D109-T112 PolarHBondContact O-N 2.82Å; D109-T112 PolarHBondContact O-OG1 3.09Å; T112-N130 CarbonylContact O-C 3.59Å; T112-N130 WeakPolarHBondContact O-CA 3.45Å; T112-N130 PolarHBondContact O-ND2 3.49Å; T112-I131 PolarHBondContact O-N 3.09Å
113	S	68.7	Low	57	Low	25 Å²	25	70.1 Å²	70.1	18%	0.175	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	156.6	-174.2	-51	0	0	0	0	113.6	D109 C129	D109-S113 VanDerWaalsContact O-CB 3.31Å; D109-S113 WeakPolarHBondContact O-CB 3.36Å; D109-S113 PolarHBondContact O-N 3.01Å; D109-S113 PolarHBondContact O-OG 2.89Å; S113-C129 CarbonylContact C-O 3.6Å; S113-C129 VanDerWaalsContact CA-O 3.25Å; S113-C129 WeakPolarHBondContact CA-O 3.33Å
114	V	67.3	Low	57.8	Low	36 Å²	36	67.2 Å²	67.2	22%	0.218	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	132.2	175.3	-173.6	0	0	0	0	109.2	Y3 R128 C129 I131	Y3-V114 HydrophobicContact CE1-CG1 4.22Å; V114-R128 CarbonylContact O-C 3.59Å; V114-R128 VanDerWaalsContact O-CA 3.3Å; V114-R128 WeakPolarHBondContact O-CA 3.27Å; V114-C129 PolarHBondContact N-O 3.44Å; V114-C129 PolarHBondContact O-N 3.39Å; V114-I131 HydrophobicContact CG2-CG2 3.62Å
115	V	69.1	Low	58.4	Low	41 Å²	41	67.1 Å²	67.1	25%	0.248	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	134.4	171.9	-175.9	0	0	0	0	110	P53 T126 F127 R128	P53-V115 HydrophobicContact CB-CG1 4.11Å; P53-V115 HydrophobicContact CB-CG2 4.47Å; P53-V115 HydrophobicContact CG-CG1 3.74Å; P53-V115 HydrophobicContact CG-CG2 4.04Å; V115-T126 HydrophobicContact CG1-CG2 4.47Å; V115-F127 CarbonylContact C-O 3.54Å; V115-F127 VanDerWaalsContact CA-O 3.24Å; V115-F127 WeakPolarHBondContact CA-O 3.14Å; V115-R128 HydrophobicContact CG2-CB 4.17Å; V115-R128 HydrophobicContact CG2-CG 4.14Å
116	F	66.3	Low	59.3	Low	26 Å²	26	66.8 Å²	66.8	11%	0.114	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	158.6	179.5	67.2	-87.9	0	0	0	113.6	M1 I56 A118 F127 C129	M1-F116 HydrophobicContact CE-CB 3.47Å; M1-F116 VanDerWaalsContact CE-CB 3.47Å; M1-F116 HydrophobicContact CE-CD1 4.07Å; M1-F116 HydrophobicContact CE-CD2 3.92Å; M1-F116 HydrophobicContact CE-CG 3.56Å; M1-F116 HydrophobicContact CG-CB 4.46Å; I56-F116 HydrophobicContact CD1-CE1 3.96Å; I56-F116 HydrophobicContact CD1-CZ 3.6Å; F116-A118 HydrophobicContact CD2-CB 4.48Å; F116-A118 HydrophobicContact CE2-CB 4.19Å; F116-F127 HydrophobicContact CD1-CB 4.49Å; F116-F127 HydrophobicContact CE1-CB 4.15Å; F116-F127 HydrophobicContact CE2-CB 4.19Å; F116-F127 HydrophobicContact CZ-CB 4Å; F116-F127 PolarHBondContact N-O 3.25Å; F116-F127 PolarHBondContact O-N 2.91Å; F116-C129 HydrophobicContact CE1-CB 4.18Å
117	E	62.4	Low	60	Low	56 Å²	56	66.3 Å²	66.3	26%	0.262	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	141.9	170.6	-174.3	-175.7	-157	0	0	111.4	G124	E117-G124 WeakPolarHBondContact OE1-CA 3.37Å
118	A	57	Low	61.1	Low	39 Å²	39	64.4 Å²	64.4	32%	0.322	38%	0.382	S	S	.	.			trans	-115.5	73.7	-166.9	0	0	0	0	0	113.9	F116 T122 F127	F116-A118 HydrophobicContact CD2-CB 4.48Å; F116-A118 HydrophobicContact CE2-CB 4.19Å; A118-T122 WeakPolarHBondContact O-CG2 3.37Å; A118-T122 PolarHBondContact O-OG1 2.89Å; A118-F127 HydrophobicContact CB-CD2 3.89Å; A118-F127 HydrophobicContact CB-CE2 3.69Å
119	S	56.8	Low	62	Low	77 Å²	77	60 Å²	60	54%	0.538	36%	0.355	S	S	.	.			trans	78.5	146.2	-178.2	-162.7	0	0	0	0	114	A121 T122	S119-A121 PolarHBondContact O-N 2.96Å; S119-T122 PolarHBondContact O-N 3.05Å; S119-T122 PolarHBondContact O-OG1 2.98Å; S119-T122 VanDerWaalsContact O-OG1 3.09Å
120	P	47	Very low	62.7	Low	125 Å²	125	59.7 Å²	59.7	81%	0.812	35%	0.353	S	S	*	.	G	3₁₀ helix	trans	-55.9	-19.4	176.2	-26.9	36.1	0	0	0	114.7	T122	P120-T122 VanDerWaalsContact C-N 3.26Å; P120-T122 PolarHBondContact O-N 3.3Å
121	A	48	Very low	63	Low	88 Å²	88	62.3 Å²	62.3	73%	0.727	36%	0.36	S	S	*	.	G	3₁₀ helix	trans	-68.1	-15.2	178.8	0	0	0	0	0	114.8	S119 K123	S119-A121 PolarHBondContact O-N 2.96Å; A121-K123 PolarHBondContact O-N 3.11Å
122	T	54.2	Low	62.9	Low	42 Å²	42	62.3 Å²	62.3	26%	0.258	37%	0.369	S	S	.	.	G	3₁₀ helix	trans	-90.3	22.6	-173.3	55.8	0	0	0	0	115.6	A118 S119 P120 G124 H125	A118-T122 WeakPolarHBondContact O-CG2 3.37Å; A118-T122 PolarHBondContact O-OG1 2.89Å; S119-T122 PolarHBondContact O-N 3.05Å; S119-T122 PolarHBondContact O-OG1 2.98Å; S119-T122 VanDerWaalsContact O-OG1 3.09Å; P120-T122 VanDerWaalsContact C-N 3.26Å; P120-T122 PolarHBondContact O-N 3.3Å; T122-G124 VanDerWaalsContact C-N 3.26Å; T122-G124 PolarHBondContact O-N 3.07Å; T122-G124 VanDerWaalsContact O-N 3.1Å; T122-H125 PolarHBondContact O-N 3.09Å; T122-H125 VanDerWaalsContact O-N 3.08Å; T122-H125 PolarHBondContact O-ND1 3.49Å
123	K	55	Low	62.7	Low	160 Å²	160	60.9 Å²	60.9	70%	0.696	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	45.2	42.9	178.8	-70.9	-169.8	172.5	-173	0	113.7	E76 A121 H125	E76-K123 IonicContact OE1-NZ 3.99Å; E76-K123 IonicContact OE2-NZ 2.59Å; A121-K123 PolarHBondContact O-N 3.11Å; K123-H125 PolarHBondContact O-N 3.13Å
124	G	54.9	Low	61.6	Low	44 Å²	44	65 Å²	65	45%	0.454	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.7	10.7	177	0	0	0	0	0	117	E117 T122 T126	E117-G124 WeakPolarHBondContact OE1-CA 3.37Å; T122-G124 VanDerWaalsContact C-N 3.26Å; T122-G124 PolarHBondContact O-N 3.07Å; T122-G124 VanDerWaalsContact O-N 3.1Å; G124-T126 PolarHBondContact O-N 3.5Å
125	H	59.1	Low	60.9	Low	98 Å²	98	67.4 Å²	67.4	45%	0.454	40%	0.398	S	S	.	.			trans	-67.8	125.9	177.6	-72.8	85.8	0	0	0	112.4	I54 T122 K123 F127	I54-H125 HydrophobicContact CD1-CB 4.4Å; T122-H125 PolarHBondContact O-N 3.09Å; T122-H125 VanDerWaalsContact O-N 3.08Å; T122-H125 PolarHBondContact O-ND1 3.49Å; K123-H125 PolarHBondContact O-N 3.13Å; H125-F127 HydrophobicContact CB-CE2 4.1Å; H125-F127 HydrophobicContact CB-CZ 4.26Å; H125-F127 WeakPolarHBondContact O-CD2 3.44Å; H125-F127 WeakPolarHBondContact O-CE2 3.46Å
126	T	66.8	Low	59.8	Low	39 Å²	39	71.4 Å²	71.4	24%	0.239	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	144	171.8	56.3	0	0	0	0	110.9	P53 I54 V115 G124	P53-T126 WeakPolarHBondContact CA-O 3.34Å; P53-T126 WeakPolarHBondContact CA-OG1 3.2Å; I54-T126 PolarHBondContact N-O 3.19Å; V115-T126 HydrophobicContact CG1-CG2 4.47Å; G124-T126 PolarHBondContact O-N 3.5Å
127	F	70.8	Confident	58.6	Low	42 Å²	42	76 Å²	76	18%	0.184	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	136.8	-177.6	-62.7	-92.2	0	0	0	110.1	I54 I56 V115 F116 A118 H125	I54-F127 HydrophobicContact CB-CD1 3.95Å; I54-F127 HydrophobicContact CB-CE1 4.3Å; I54-F127 HydrophobicContact CD1-CE1 4.08Å; I54-F127 HydrophobicContact CG2-CD1 4.16Å; I54-F127 HydrophobicContact CG2-CE1 4.36Å; I54-F127 CarbonylContact O-C 3.58Å; I54-F127 WeakPolarHBondContact O-CA 3.48Å; I56-F127 HydrophobicContact CD1-CB 3.77Å; I56-F127 HydrophobicContact CD1-CD1 4.2Å; I56-F127 HydrophobicContact CD1-CG 4.31Å; I56-F127 HydrophobicContact CG1-CB 4.27Å; I56-F127 HydrophobicContact CG1-CD1 4.3Å; V115-F127 CarbonylContact C-O 3.54Å; V115-F127 VanDerWaalsContact CA-O 3.24Å; V115-F127 WeakPolarHBondContact CA-O 3.14Å; F116-F127 HydrophobicContact CD1-CB 4.49Å; F116-F127 HydrophobicContact CE1-CB 4.15Å; F116-F127 HydrophobicContact CE2-CB 4.19Å; F116-F127 HydrophobicContact CZ-CB 4Å; F116-F127 PolarHBondContact N-O 3.25Å; F116-F127 PolarHBondContact O-N 2.91Å; A118-F127 HydrophobicContact CB-CD2 3.89Å; A118-F127 HydrophobicContact CB-CE2 3.69Å; H125-F127 HydrophobicContact CB-CE2 4.1Å; H125-F127 HydrophobicContact CB-CZ 4.26Å; H125-F127 WeakPolarHBondContact O-CD2 3.44Å; H125-F127 WeakPolarHBondContact O-CE2 3.46Å
128	R	74.3	Confident	57.4	Low	60 Å²	60	78.4 Å²	78.4	23%	0.226	47%	0.468	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	114.8	177.6	-177.1	170.5	65.9	155.7	0.8	110.6	P53 I54 D55 I56 V114 V115	P53-R128 HydrophobicContact CB-CB 3.83Å; I54-R128 PolarHBondContact O-N 2.7Å; D55-R128 IonicContact OD1-CZ 2.71Å; D55-R128 IonicContact OD1-NE 2.7Å; D55-R128 PolarHBondContact OD1-NE 2.84Å; D55-R128 IonicContact OD1-NH2 3.49Å; D55-R128 PolarHBondContact OD1-NH2 3.01Å; D55-R128 IonicContact OD2-NH2 2.9Å; D55-R128 PolarHBondContact OD2-NH2 3.39Å; I56-R128 PolarHBondContact N-O 3.05Å; V114-R128 CarbonylContact O-C 3.59Å; V114-R128 VanDerWaalsContact O-CA 3.3Å; V114-R128 WeakPolarHBondContact O-CA 3.27Å; V115-R128 HydrophobicContact CG2-CB 4.17Å; V115-R128 HydrophobicContact CG2-CG 4.14Å
129	C	76.1	Confident	56.2	Low	5 Å²	5	85.1 Å²	85.1	3%	0.034	49%	0.49	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	154.4	175	77.9	0	0	0	0	112	I56 S113 V114 F116 V133	I56-C129 HydrophobicContact CB-CB 3.82Å; I56-C129 HydrophobicContact CD1-CB 4.16Å; I56-C129 HydrophobicContact CG2-CB 4Å; S113-C129 CarbonylContact C-O 3.6Å; S113-C129 VanDerWaalsContact CA-O 3.25Å; S113-C129 WeakPolarHBondContact CA-O 3.33Å; V114-C129 PolarHBondContact N-O 3.44Å; V114-C129 PolarHBondContact O-N 3.39Å; F116-C129 HydrophobicContact CE1-CB 4.18Å; C129-V133 HydrophobicContact CB-CB 4.5Å; C129-V133 HydrophobicContact CB-CG2 4.37Å
130	N	72.1	Confident	55	Low	52 Å²	52	88.8 Å²	88.8	28%	0.278	50%	0.499	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	144.6	172.2	-176	-71.7	0	0	0	111	T112 C132 V133	T112-N130 CarbonylContact O-C 3.59Å; T112-N130 WeakPolarHBondContact O-CA 3.45Å; T112-N130 PolarHBondContact O-ND2 3.49Å; N130-C132 PolarHBondContact O-N 2.7Å; N130-C132 VanDerWaalsContact O-N 3.07Å; N130-C132 VanDerWaalsContact OD1-CB 3.31Å; N130-C132 WeakPolarHBondContact OD1-CB 3.32Å; N130-C132 PolarHBondContact OD1-N 2.94Å; N130-V133 HydrophobicContact CB-CG2 4.09Å; N130-V133 WeakPolarHBondContact O-CB 3.46Å; N130-V133 WeakPolarHBondContact O-CG2 3.42Å; N130-V133 PolarHBondContact O-N 3.46Å
131	I	67.4	Low	54.2	Low	104 Å²	104	90 Å²	90	53%	0.533	50%	0.499	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-19.1	-179.9	58.6	169.4	0	0	0	114.1	T112 V114	T112-I131 PolarHBondContact O-N 3.09Å; V114-I131 HydrophobicContact CG2-CG2 3.62Å
132	C	62	Low	53.2	Low	93 Å²	93	92.4 Å²	92.4	63%	0.628	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.7	0.1	177.3	-63.3	0	0	0	0	113.7	N130 P134	N130-C132 PolarHBondContact O-N 2.7Å; N130-C132 VanDerWaalsContact O-N 3.07Å; N130-C132 VanDerWaalsContact OD1-CB 3.31Å; N130-C132 WeakPolarHBondContact OD1-CB 3.32Å; N130-C132 PolarHBondContact OD1-N 2.94Å; C132-P134 WeakPolarHBondContact O-CD 3.47Å
133	V	61	Low	52	Low	27 Å²	27	95.7 Å²	95.7	16%	0.164	52%	0.521	C	S	.	.	S	Bend	trans	-73.4	120.9	175.5	177	0	0	0	0	109.9	C129 N130 L135	C129-V133 HydrophobicContact CB-CB 4.5Å; C129-V133 HydrophobicContact CB-CG2 4.37Å; N130-V133 HydrophobicContact CB-CG2 4.09Å; N130-V133 WeakPolarHBondContact O-CB 3.46Å; N130-V133 WeakPolarHBondContact O-CG2 3.42Å; N130-V133 PolarHBondContact O-N 3.46Å; V133-L135 HydrophobicContact CG1-CD2 4.05Å; V133-L135 PolarHBondContact O-N 2.94Å; V133-L135 VanDerWaalsContact O-N 3.11Å
134	P	47.2	Very low	50.8	Low	111 Å²	111	94.5 Å²	94.5	72%	0.721	52%	0.522	S	S	*	.			trans	-73.8	102.6	174	29.8	-32.7	0	0	0	110.3	C132 T136	C132-P134 WeakPolarHBondContact O-CD 3.47Å; P134-T136 PolarHBondContact O-N 3.46Å
135	L	51.4	Low	49.6	Very low	87 Å²	87	100.9 Å²	100.9	46%	0.455	54%	0.538	S	S	.	.			trans	-81.6	108.8	175.8	-63.5	176.3	0	0	0	110.9	V133 I137	V133-L135 HydrophobicContact CG1-CD2 4.05Å; V133-L135 PolarHBondContact O-N 2.94Å; V133-L135 VanDerWaalsContact O-N 3.11Å; L135-I137 PolarHBondContact O-N 3.07Å
136	T	45.4	Very low	48.1	Very low	124 Å²	124	101 Å²	101	76%	0.761	55%	0.545	S	S	*	.			trans	-78.9	104.5	174	-52.8	0	0	0	0	110.3	P134 C138	P134-T136 PolarHBondContact O-N 3.46Å; T136-C138 PolarHBondContact O-N 3.11Å
137	I	42.8	Very low	46.4	Very low	124 Å²	124	105.3 Å²	105.3	64%	0.636	57%	0.567	S	S	*	*			trans	-84.8	94.4	176.7	-56.2	175.5	0	0	0	109.2	L135 F139	L135-I137 PolarHBondContact O-N 3.07Å; I137-F139 HydrophobicContact CG2-CD2 4.32Å; I137-F139 HydrophobicContact CG2-CE2 3.9Å; I137-F139 HydrophobicContact CG2-CZ 4.03Å; I137-F139 PolarHBondContact O-N 3.13Å
138	C	35.3	Very low	44.4	Very low	105 Å²	105	111.4 Å²	111.4	71%	0.709	60%	0.595	S	S	*	*			trans	-80.5	111.5	169.9	-67.2	0	0	0	0	110.1	T136 Q140	T136-C138 PolarHBondContact O-N 3.11Å; C138-Q140 PolarHBondContact O-N 3.24Å
139	F	32.8	Very low	42.4	Very low	180 Å²	180	115.9 Å²	115.9	79%	0.789	62%	0.624	S	S	*	*			trans	-76.8	96.8	165.6	-66.5	-86	0	0	0	108.9	I137 N141	I137-F139 HydrophobicContact CG2-CD2 4.32Å; I137-F139 HydrophobicContact CG2-CE2 3.9Å; I137-F139 HydrophobicContact CG2-CZ 4.03Å; I137-F139 PolarHBondContact O-N 3.13Å; F139-N141 PolarHBondContact O-N 3.06Å
140	Q	32.6	Very low	40.3	Very low	155 Å²	155	120.4 Å²	120.4	72%	0.724	66%	0.655	S	S	*	*			trans	-68.5	117.7	160	-84.4	-179.1	-44.8	0	0	108.2	C138 M142	C138-Q140 PolarHBondContact O-N 3.24Å; Q140-M142 VanDerWaalsContact C-N 3.34Å; Q140-M142 HydrophobicContact CB-CE 4.3Å; Q140-M142 PolarHBondContact O-N 3.17Å
141	N	29.2	Very low	37.9	Very low	150 Å²	150	123.8 Å²	123.8	80%	0.802	68%	0.682	S	S	*	*			trans	-64.9	98.1	165.5	-78.5	-8.5	0	0	0	107.9	F139 S143	F139-N141 PolarHBondContact O-N 3.06Å; N141-S143 PolarHBondContact O-N 2.98Å
142	M	27.3	Very low	36	Very low	139 Å²	139	125.5 Å²	125.5	69%	0.685	70%	0.697	S	S	*	*			trans	-73.2	76.9	167.7	-67.5	-64.2	179.2	0	0	108.4	Q140 N144	Q140-M142 VanDerWaalsContact C-N 3.34Å; Q140-M142 HydrophobicContact CB-CE 4.3Å; Q140-M142 PolarHBondContact O-N 3.17Å; M142-N144 PolarHBondContact O-N 3Å; M142-N144 PolarHBondContact O-OD1 2.98Å
143	S	29.5	Very low	34.3	Very low	111 Å²	111	125.4 Å²	125.4	78%	0.776	70%	0.698	S	S	*	*			trans	-67.7	102.6	162.4	49.4	0	0	0	0	107.5	N141 K145	N141-S143 PolarHBondContact O-N 2.98Å; S143-K145 PolarHBondContact O-N 3.27Å
144	N	29.3	Very low	32.6	Very low	134 Å²	134	130.1 Å²	130.1	72%	0.717	73%	0.727	S	S	*	*			trans	-58.8	119.8	-177.8	-65.4	-9.2	0	0	0	110.4	M142 V146	M142-N144 PolarHBondContact O-N 3Å; M142-N144 PolarHBondContact O-OD1 2.98Å; N144-V146 HydrophobicContact CB-CG2 3.98Å; N144-V146 PolarHBondContact O-N 3.26Å
145	K	29.3	Very low	31.7	Very low	179 Å²	179	132.7 Å²	132.7	78%	0.778	73%	0.729	S	S	*	*			trans	-74.7	107.4	144.7	-82.3	-166	159.1	-142.1	0	107.2	S143	S143-K145 PolarHBondContact O-N 3.27Å
146	V	27.8	Very low	30.4	Very low	101 Å²	101	136.4 Å²	136.4	61%	0.612	74%	0.744	S	S	*	*			trans	-97.8	90.5	160.5	-177.7	0	0	0	0	105.4	N144	N144-V146 HydrophobicContact CB-CG2 3.98Å; N144-V146 PolarHBondContact O-N 3.26Å
147	D	31.6	Very low	29.6	Very low	129 Å²	129	137.3 Å²	137.3	69%	0.69	74%	0.744	S	S	*	*			trans	-83.3	118.1	166.3	-65	-46.2	0	0	0	106.2
148	H	28.4	Very low	28.8	Very low	169 Å²	169	135.6 Å²	135.6	78%	0.782	74%	0.743	S	S	*	*			trans	-74.8	135.7	179	-91.2	-109	0	0	0	110.7
149	D	32.1	Very low	28.5	Very low	154 Å²	154	139.8 Å²	139.8	82%	0.824	75%	0.749	S	S	*	*			trans	176.2	153.9	140.2	-99.1	-35.8	0	0	0	110
150	S	31.3	Very low	28.2	Very low	100 Å²	100	135.5 Å²	135.5	70%	0.699	74%	0.741	S	S	*	*			cis	-161.2	163.7	-46.3	35.3	0	0	0	0	107
151	C	23.2	Very low	27.9	Very low	123 Å²	123	137.2 Å²	137.2	83%	0.831	75%	0.749	S	S	*	*			trans	-73	132.7	-169	-174.3	0	0	0	0	113.1
152	T	27.5	Very low	27.9	Very low	140 Å²	140	133.2 Å²	133.2	86%	0.859	74%	0.744	S	S	*	*			trans	-160	166.4	132.5	2.7	0	0	0	0	114
153	S	25.9	Very low	28	Very low	92 Å²	92	134.2 Å²	134.2	64%	0.643	75%	0.75	S	S	*	*			trans	-91.6	148.2	-165.6	49.3	0	0	0	0	115.4
154	T	25	Very low	28.3	Very low	126 Å²	126	133.6 Å²	133.6	77%	0.773	74%	0.743	S	S	*	*			trans	68.6	147.5	143.4	49.2	0	0	0	0	122.1
155	Q	28.5	Very low	28.3	Very low	164 Å²	164	134 Å²	134	77%	0.766	74%	0.744	S	S	*	*			trans	78.6	93.9	157.9	-75.6	172.6	-13	0	0	120.7
156	E	24.4	Very low	28.3	Very low	165 Å²	165	131.2 Å²	131.2	77%	0.771	74%	0.738	S	S	*	*				75.7	158.3	119.2	-72.1	-174.4	-168.3	0	0	123.7
157	L	28	Very low	28.6	Very low	144 Å²	144	134.6 Å²	134.6	75%	0.754	74%	0.744	S	S	*	*			trans	70.5	72.8	154.4	-71.8	155.7	0	0	0	121.5
158	S	26.5	Very low	28.5	Very low	87 Å²	87	137.5 Å²	137.5	61%	0.608	75%	0.751	S	S	*	*				66.5	135.8	115.1	73.7	0	0	0	0	123.9
159	K	27.7	Very low	28.9	Very low	194 Å²	194	133.9 Å²	133.9	84%	0.843	73%	0.734	S	S	*	*			trans	69.6	152.7	148.7	-68.4	169.1	-178.9	178.4	0	117.9
160	S	26.6	Very low	29.1	Very low	90 Å²	90	130.3 Å²	130.3	63%	0.629	72%	0.719	S	S	*	*			cis	-171.4	157.8	-16.8	48.2	0	0	0	0	112.6
161	E	27.3	Very low	29.3	Very low	190 Å²	190	129.2 Å²	129.2	89%	0.888	71%	0.712	S	S	*	*			trans	70.8	155.5	152.4	-70.3	165.4	-171.2	0	0	123.1
162	G	29.2	Very low	29.9	Very low	67 Å²	67	128 Å²	128	69%	0.691	71%	0.705	S	S	*	*			trans	91.6	118.6	168.9	0	0	0	0	0	118.6
163	I	29.7	Very low	30.3	Very low	159 Å²	159	132.1 Å²	132.1	82%	0.815	70%	0.704	S	S	*	*			cis	87.1	129.6	-11.4	-59.3	174.1	0	0	0	116.9
164	P	34.6	Very low	30.8	Very low	98 Å²	98	132.1 Å²	132.1	64%	0.636	70%	0.704	S	S	*	*			cis	-153.1	-170.2	-28.7	44	-22.4	0	0	0	118.3
165	I	30.4	Very low	31.4	Very low	142 Å²	142	135.9 Å²	135.9	73%	0.728	71%	0.71	S	S	*	*			trans	86.4	141.5	138.4	-86.6	169.2	0	0	0	125.9
166	N	29.7	Very low	31.7	Very low	121 Å²	121	136.5 Å²	136.5	65%	0.647	72%	0.715	S	S	*	*			trans	75.3	156.6	157.4	-78.9	-17.7	0	0	0	122.4
167	K	32.4	Very low	32.6	Very low	173 Å²	173	133.5 Å²	133.5	75%	0.752	71%	0.71	S	S	*	*			cis	167.4	133.8	-37.4	-106.1	-167.8	-156.4	108.4	0	111.4
168	K	29.9	Very low	33	Very low	189 Å²	189	134 Å²	134	82%	0.822	71%	0.708	S	S	*	*			trans	158.9	179.7	133.7	-89.2	173.7	177.2	177.5	0	117.9
169	Q	36.5	Very low	33.7	Very low	93 Å²	93	135.9 Å²	135.9	44%	0.435	71%	0.707	S	S	.	*			trans	-151.1	-164.4	-163.3	-53	-173.7	-51.7	0	0	111.3	N833 Y834 N835	Q169-N833 PolarHBondContact NE2-OD1 3.25Å; Q169-Y834 VanDerWaalsContact CA-CE1 3.48Å; Q169-Y834 HydrophobicContact CB-CD1 3.95Å; Q169-Y834 HydrophobicContact CB-CE1 3.38Å; Q169-Y834 HydrophobicContact CG-CD1 4.16Å; Q169-Y834 HydrophobicContact CG-CE1 3.74Å; Q169-N835 VanDerWaalsContact CD-ND2 3.28Å; Q169-N835 PolarHBondContact NE2-ND2 3.39Å; Q169-N835 PolarHBondContact NE2-OD1 3.08Å; Q169-N835 PolarHBondContact OE1-ND2 2.86Å; Q169-N835 PolarHBondContact OE1-OD1 3.34Å
170	P	36.9	Very low	34.1	Very low	79 Å²	79	133.9 Å²	133.9	51%	0.513	70%	0.698	S	S	.	*			cis	-149.6	153.6	-2.9	40.8	-17.9	0	0	0	121.8	Y834 N835	P170-Y834 HydrophobicContact CB-CD1 4.5Å; P170-N835 WeakPolarHBondContact CB-ND2 3.47Å
171	S	34.8	Very low	34.5	Very low	78 Å²	78	135.5 Å²	135.5	55%	0.545	70%	0.7	S	S	.	*			trans	66	-178.3	145	72.9	0	0	0	0	120.4
172	S	36.4	Very low	34.9	Very low	97 Å²	97	135.5 Å²	135.5	68%	0.678	70%	0.697	S	S	*	*			cis	-163.9	168.1	6.6	78.1	0	0	0	0	116.6
173	R	36.5	Very low	35.2	Very low	226 Å²	226	136.1 Å²	136.1	85%	0.853	70%	0.703	S	S	*	*			trans	89.6	105.9	140.2	-93.3	-170.5	163.7	174.5	-3.2	128.2
174	S	36	Very low	35.2	Very low	92 Å²	92	139.4 Å²	139.4	64%	0.643	71%	0.706	S	S	*	*				69.2	133.3	110.9	72.8	0	0	0	0	128.1
175	K	36.9	Very low	35.2	Very low	206 Å²	206	140.5 Å²	140.5	90%	0.896	71%	0.705	S	S	*	*				170.8	-176.8	107.7	-103.7	176.6	175.8	178.9	0	117.7
176	M	36.1	Very low	35.4	Very low	177 Å²	177	141.7 Å²	141.7	87%	0.872	71%	0.705	S	S	*	*			trans	-145.4	-161.6	-162.1	-54.6	156.2	70.9	0	0	111.7
177	P	42.9	Very low	35.4	Very low	101 Å²	101	142.6 Å²	142.6	66%	0.656	71%	0.71	S	S	*	*			cis	-150.5	-173.2	-1.2	44.8	-22.3	0	0	0	120.9
178	H	37	Very low	35.3	Very low	155 Å²	155	141.3 Å²	141.3	72%	0.718	71%	0.711	S	S	*	*			trans	104.3	139	132.4	-90.9	-30.6	0	0	0	130.7
179	H	40.1	Very low	35.4	Very low	127 Å²	127	141 Å²	141	59%	0.588	71%	0.709	S	S	*	*			trans	87.2	159.7	141.7	-72.5	-1.1	0	0	0	122.6
180	K	36.2	Very low	35.1	Very low	151 Å²	151	142.4 Å²	142.4	66%	0.657	73%	0.73	S	S	*	*			cis	-171	141.2	-20.4	-108	171.8	178.1	156.3	0	115.4
181	N	35.2	Very low	34.7	Very low	125 Å²	125	142.2 Å²	142.2	67%	0.668	74%	0.742	S	S	*	*			trans	60	162.4	144.4	-72.1	-18.1	0	0	0	123.7
182	K	35	Very low	34.5	Very low	189 Å²	189	147.4 Å²	147.4	82%	0.822	76%	0.757	S	S	*	*			cis	-170.2	146.6	-14.3	-110	174.4	-177.5	-178.2	0	115.6
183	G	35.9	Very low	34.2	Very low	80 Å²	80	149.9 Å²	149.9	83%	0.825	76%	0.761	S	S	*	*			trans	88.6	166.3	145.1	0	0	0	0	0	121.5
184	R	31	Very low	33.7	Very low	229 Å²	229	143.6 Å²	143.6	86%	0.864	75%	0.752	S	S	*	*			cis	-171.3	131.5	-22.9	-155.7	-160.8	178.3	-173.8	-2.4	114.8
185	I	32.8	Very low	33.5	Very low	120 Å²	120	144.9 Å²	144.9	62%	0.615	75%	0.752	S	S	*	*			trans	95.1	141.1	140.1	-113.9	178.1	0	0	0	126.7
186	K	34.7	Very low	33.2	Very low	168 Å²	168	143.2 Å²	143.2	73%	0.73	75%	0.745	S	S	*	*			trans	73.1	118.5	153.4	-75.6	173.6	-173.6	178.1	0	125.6
187	N	30.6	Very low	32.8	Very low	140 Å²	140	143 Å²	143	75%	0.749	74%	0.742	S	S	*	*				35.8	151.2	116.3	-51.5	8.8	0	0	0	121.2
188	N	30.9	Very low	32.2	Very low	146 Å²	146	145.4 Å²	145.4	78%	0.781	74%	0.744	S	S	*	*			cis	-160.6	-175.4	31.1	-142	-5.6	0	0	0	116.1
189	K	32	Very low	31.7	Very low	182 Å²	182	142.7 Å²	142.7	79%	0.791	74%	0.743	S	S	*	*			trans	-68.7	164.7	-167.4	-61	167.7	168.8	178	0	121
190	S	28.6	Very low	31.2	Very low	123 Å²	123	143.4 Å²	143.4	86%	0.86	75%	0.751	S	S	*	*			trans	99.3	151.1	131.3	68.1	0	0	0	0	123.1
191	G	30.3	Very low	30.9	Very low	74 Å²	74	144 Å²	144	76%	0.763	76%	0.76	S	S	*	*			trans	79.9	113.3	177.5	0	0	0	0	0	114.1
192	Q	29.9	Very low	30.6	Very low	187 Å²	187	142.1 Å²	142.1	87%	0.874	77%	0.77	S	S	*	*			cis	87.4	135.8	30.5	-152.2	-173.3	27.9	0	0	114.8
193	I	30	Very low	30.4	Very low	149 Å²	149	137 Å²	137	76%	0.764	77%	0.772	S	S	*	*			trans	106	106.5	166	-56.7	179.2	0	0	0	118.1
194	S	26.8	Very low	30.3	Very low	95 Å²	95	143.8 Å²	143.8	66%	0.664	78%	0.779	S	S	*	*			trans	28	139.3	149.5	67.3	0	0	0	0	127.3
195	D	30.2	Very low	30.2	Very low	119 Å²	119	136.1 Å²	136.1	64%	0.636	77%	0.77	S	S	*	*			trans	79.7	103.8	132.6	-83.2	-55.2	0	0	0	123.6
196	K	30.1	Very low	30	Very low	171 Å²	171	135.9 Å²	135.9	74%	0.743	78%	0.78	S	S	*	*				70.8	146.1	125.9	-74.5	179.8	-171.4	109.9	0	122.9
197	Q	28.6	Very low	29.6	Very low	172 Å²	172	133.8 Å²	133.8	80%	0.804	78%	0.776	S	S	*	*			trans	67.2	153.9	166.1	-69.4	175.3	-39	0	0	116.2
198	Q	30.4	Very low	29.3	Very low	151 Å²	151	136.1 Å²	136.1	71%	0.706	78%	0.775	S	S	*	*			cis	-170.4	149.1	-29	-176.9	163.1	-20.3	0	0	107.1
199	S	27.1	Very low	29.1	Very low	99 Å²	99	134.5 Å²	134.5	69%	0.692	77%	0.771	S	S	*	*			trans	63.8	162	175.2	17.6	0	0	0	0	115.2
200	D	30	Very low	28.8	Very low	142 Å²	142	133.4 Å²	133.4	76%	0.759	77%	0.774	S	S	*	*			cis	-151.4	172.7	-11.2	-122.7	-33.2	0	0	0	114.5
201	L	28.9	Very low	28.7	Very low	162 Å²	162	131 Å²	131	85%	0.848	77%	0.768	S	S	*	*			trans	-24.1	140.3	172.8	-62.5	155.9	0	0	0	122
202	G	28.3	Very low	28.6	Very low	86 Å²	86	133.5 Å²	133.5	89%	0.887	77%	0.769	S	S	*	*				119.5	135.1	127.9	0	0	0	0	0	120.4
203	G	32	Very low	28.4	Very low	83 Å²	83	131.3 Å²	131.3	86%	0.856	76%	0.758	S	S	*	*			trans	146.3	112	159.1	0	0	0	0	0	119
204	K	32.4	Very low	28.4	Very low	222 Å²	222	129.6 Å²	129.6	97%	0.965	76%	0.755	S	S	*	*			trans	-52.2	157.7	172.8	-55.9	155.2	-179	176.4	0	114.1
205	G	29.9	Very low	28.5	Very low	67 Å²	67	130.9 Å²	130.9	69%	0.691	75%	0.754	S	S	*	*			cis	163.2	178.8	-0.3	0	0	0	0	0	112
206	S	28.1	Very low	28.4	Very low	116 Å²	116	132 Å²	132	81%	0.811	76%	0.76	S	S	*	*			trans	69.6	142.6	172.7	-77.2	0	0	0	0	118.3
207	L	25.6	Very low	28.4	Very low	123 Å²	123	130 Å²	130	64%	0.644	76%	0.762	S	S	*	*			cis	-160.6	157.2	-8.8	-149.6	51.4	0	0	0	112.6
208	Y	25.5	Very low	28.4	Very low	189 Å²	189	128.9 Å²	128.9	74%	0.741	76%	0.76	S	S	*	*			trans	64.3	113.4	162.7	-59.7	-46.6	0	0	0	124
209	T	26.4	Very low	28.5	Very low	113 Å²	113	128.2 Å²	128.2	69%	0.693	76%	0.757	S	S	*	*			trans	62.4	143.4	134.1	63.2	0	0	0	0	121.4
210	N	26	Very low	28.9	Very low	159 Å²	159	130.2 Å²	130.2	85%	0.85	76%	0.758	S	S	*	*			cis	-162.1	162.3	-11.8	-100.1	-12.3	0	0	0	108.1
211	G	26.6	Very low	28.9	Very low	71 Å²	71	129.3 Å²	129.3	73%	0.732	76%	0.76	S	S	*	*			trans	115.6	78.5	161.7	0	0	0	0	0	118
212	T	26.9	Very low	29.2	Very low	128 Å²	128	129.1 Å²	129.1	79%	0.785	75%	0.753	S	S	*	*			trans	-59.7	127.5	-176	-44.8	0	0	0	0	117.2	V214	T212-V214 HydrophobicContact CG2-CG2 3.89Å
213	E	27.4	Very low	29.3	Very low	140 Å²	140	128.9 Å²	128.9	65%	0.654	74%	0.742	S	S	*	*			trans	-139.4	81	155.2	-84.4	-160.9	144.1	0	0	111.8	N215 K857	E213-N215 PolarHBondContact O-N 3.34Å; E213-N215 PolarHBondContact O-ND2 3.21Å; E213-K857 IonicContact OE2-NZ 2.76Å; E213-K857 PolarHBondContact OE2-NZ 2.92Å
214	V	29	Very low	29.6	Very low	113 Å²	113	131.9 Å²	131.9	69%	0.685	74%	0.744	S	S	*	*			trans	-78.9	108.7	179.8	-177.8	0	0	0	0	110.9	T212 N216	T212-V214 HydrophobicContact CG2-CG2 3.89Å; V214-N216 PolarHBondContact O-N 2.63Å
215	N	28.6	Very low	30.5	Very low	122 Å²	122	130 Å²	130	65%	0.652	73%	0.732	S	S	*	*			trans	-82.5	93.8	175.1	-74.6	-91.3	0	0	0	110.3	E213 V217	E213-N215 PolarHBondContact O-N 3.34Å; E213-N215 PolarHBondContact O-ND2 3.21Å; N215-V217 VanDerWaalsContact C-N 3.32Å; N215-V217 PolarHBondContact O-N 2.87Å
216	N	29.4	Very low	31.3	Very low	144 Å²	144	132.2 Å²	132.2	77%	0.77	74%	0.736	S	S	*	*			trans	-69.6	89.9	168.6	-80.8	-1.5	0	0	0	110.2	V214 I218	V214-N216 PolarHBondContact O-N 2.63Å; N216-I218 PolarHBondContact O-N 2.85Å
217	V	30.2	Very low	32.2	Very low	128 Å²	128	133 Å²	133	78%	0.776	73%	0.73	S	S	*	*			trans	-71	93.9	173.3	-178.9	0	0	0	0	109	N215 E219	N215-V217 VanDerWaalsContact C-N 3.32Å; N215-V217 PolarHBondContact O-N 2.87Å; V217-E219 PolarHBondContact O-N 3.15Å
218	I	28.7	Very low	33.1	Very low	149 Å²	149	131.3 Å²	131.3	76%	0.764	72%	0.722	S	S	*	*			trans	-73.8	105.5	167.3	-59.1	176.3	0	0	0	107.1	N216 I220	N216-I218 PolarHBondContact O-N 2.85Å; I218-I220 PolarHBondContact O-N 3.15Å
219	E	32.2	Very low	34.4	Very low	136 Å²	136	128.3 Å²	128.3	64%	0.636	73%	0.725	S	S	*	*			trans	-66.4	117.4	179.3	-158.3	-177	177	0	0	109.9	V217 K222	V217-E219 PolarHBondContact O-N 3.15Å; E219-K222 IonicContact OE1-NZ 3.02Å; E219-K222 PolarHBondContact OE1-NZ 3.47Å
220	I	33.9	Very low	35.5	Very low	142 Å²	142	131 Å²	131	73%	0.728	73%	0.73	S	S	*	*			trans	-72.2	133.7	-176.7	-57.3	174.8	0	0	0	108.6	I218 K222	I218-I220 PolarHBondContact O-N 3.15Å; I220-K222 PolarHBondContact O-N 3.07Å
221	P	31.9	Very low	36.1	Very low	122 Å²	122	130.1 Å²	130.1	79%	0.792	72%	0.719	S	S	*	*			trans	-52.6	113.9	177.1	-28.5	35.6	0	0	0	111.9	A223	P221-A223 PolarHBondContact O-N 3.17Å
222	K	35	Very low	36.9	Very low	159 Å²	159	131.8 Å²	131.8	69%	0.691	72%	0.72	S	S	*	*			trans	-60.5	125.3	173.6	-73.3	161.7	177.5	141.2	0	108	E219 I220 V224	E219-K222 IonicContact OE1-NZ 3.02Å; E219-K222 PolarHBondContact OE1-NZ 3.47Å; I220-K222 PolarHBondContact O-N 3.07Å; K222-V224 PolarHBondContact O-N 3.5Å
223	A	28.7	Very low	37.6	Very low	81 Å²	81	131.4 Å²	131.4	67%	0.669	71%	0.712	S	S	*	*			trans	-65.4	103.8	178.9	0	0	0	0	0	109.4	P221 Y225	P221-A223 PolarHBondContact O-N 3.17Å; A223-Y225 HydrophobicContact CB-CD1 4.37Å; A223-Y225 VanDerWaalsContact O-CD1 3.24Å; A223-Y225 WeakPolarHBondContact O-CD1 3.39Å; A223-Y225 PolarHBondContact O-N 2.83Å
224	V	38.1	Very low	38.4	Very low	146 Å²	146	136.3 Å²	136.3	89%	0.885	72%	0.724	S	S	*	*			trans	-80.5	105.8	171.1	-179.1	0	0	0	0	107.4	K222	K222-V224 PolarHBondContact O-N 3.5Å
225	Y	51.8	Low	38.8	Very low	182 Å²	182	139.3 Å²	139.3	71%	0.714	73%	0.728	S	S	*	*			trans	-121.6	126.6	171.5	58.8	-86.3	0	0	0	109.1	A223 I227	A223-Y225 HydrophobicContact CB-CD1 4.37Å; A223-Y225 VanDerWaalsContact O-CD1 3.24Å; A223-Y225 WeakPolarHBondContact O-CD1 3.39Å; A223-Y225 PolarHBondContact O-N 2.83Å; Y225-I227 HydrophobicContact CD2-CG1 4.23Å; Y225-I227 HydrophobicContact CE2-CG1 4.23Å
226	S	46.3	Very low	39.2	Very low	113 Å²	113	138.3 Å²	138.3	79%	0.79	73%	0.731	S	S	*	*	P	Polyproline II helix	trans	-78.2	127.9	156.6	49.2	0	0	0	0	107.7	D228	S226-D228 PolarHBondContact O-N 3.27Å
227	I	47.7	Very low	39.9	Very low	134 Å²	134	138.8 Å²	138.8	69%	0.687	73%	0.731	S	S	*	*	P	Polyproline II helix	trans	-67.3	119.5	160.6	-59.5	175.4	0	0	0	105.7	Y225 P229	Y225-I227 HydrophobicContact CD2-CG1 4.23Å; Y225-I227 HydrophobicContact CE2-CG1 4.23Å; I227-P229 WeakPolarHBondContact O-CD 3.23Å
228	D	45.7	Very low	40.5	Very low	86 Å²	86	140.7 Å²	140.7	46%	0.46	73%	0.732	S	S	.	*	P	Polyproline II helix	trans	-62	118.9	170.6	175.2	-7.2	0	0	0	108.2	S226 E230 F231	S226-D228 PolarHBondContact O-N 3.27Å; D228-E230 PolarHBondContact O-N 3.31Å; D228-E230 PolarHBondContact OD1-N 3.2Å; D228-F231 HydrophobicContact CB-CB 3.79Å; D228-F231 PolarHBondContact O-N 3.02Å
229	P	52.4	Low	41.3	Very low	126 Å²	126	139.3 Å²	139.3	82%	0.818	73%	0.725	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.6	-15	-176.1	29	-35.8	0	0	0	113.3	I227	I227-P229 WeakPolarHBondContact O-CD 3.23Å
230	E	50	Low	42	Very low	171 Å²	171	141.5 Å²	141.5	80%	0.799	73%	0.733	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.3	-14.4	174.4	-59.8	-172.7	175.2	0	0	112.3	D228 S232	D228-E230 PolarHBondContact O-N 3.31Å; D228-E230 PolarHBondContact OD1-N 3.2Å; E230-S232 VanDerWaalsContact C-N 3.3Å; E230-S232 PolarHBondContact O-N 3.5Å
231	F	37.6	Very low	42.1	Very low	139 Å²	139	144.5 Å²	144.5	61%	0.61	74%	0.743	S	S	*	*			trans	-76.5	75.3	-178.7	-171.5	-107.5	0	0	0	113.1	D228 I233	D228-F231 HydrophobicContact CB-CB 3.79Å; D228-F231 PolarHBondContact O-N 3.02Å; F231-I233 HydrophobicContact CD1-CG1 3.92Å; F231-I233 HydrophobicContact CE1-CD1 4.08Å; F231-I233 HydrophobicContact CE1-CG1 3.42Å; F231-I233 VanDerWaalsContact CE1-CG1 3.42Å; F231-I233 HydrophobicContact CZ-CG1 4.23Å; F231-I233 PolarHBondContact O-N 2.74Å
232	S	42.7	Very low	42.9	Very low	107 Å²	107	142.3 Å²	142.3	75%	0.748	74%	0.743	S	S	*	*			trans	-70.6	93.1	170.5	-69.7	0	0	0	0	111.3	E230 R234	E230-S232 VanDerWaalsContact C-N 3.3Å; E230-S232 PolarHBondContact O-N 3.5Å; S232-R234 PolarHBondContact O-N 3.46Å; S232-R234 VanDerWaalsContact O-N 3.08Å
233	I	42.4	Very low	43.2	Very low	120 Å²	120	138.1 Å²	138.1	62%	0.615	73%	0.734	S	S	*	*			trans	-51.7	117.8	160.2	-65.3	176.3	0	0	0	107.6	F231 K235	F231-I233 HydrophobicContact CD1-CG1 3.92Å; F231-I233 HydrophobicContact CE1-CD1 4.08Å; F231-I233 HydrophobicContact CE1-CG1 3.42Å; F231-I233 VanDerWaalsContact CE1-CG1 3.42Å; F231-I233 HydrophobicContact CZ-CG1 4.23Å; F231-I233 PolarHBondContact O-N 2.74Å; I233-K235 PolarHBondContact O-N 2.98Å
234	R	43.3	Very low	44.1	Very low	243 Å²	243	139.8 Å²	139.8	92%	0.917	74%	0.741	S	S	*	*			trans	-56.6	105.7	165.7	-76.3	-170.1	178.8	-166.5	1.2	106.8	S232 S236	S232-R234 PolarHBondContact O-N 3.46Å; S232-R234 VanDerWaalsContact O-N 3.08Å; R234-S236 PolarHBondContact O-N 3.49Å
235	K	38.9	Very low	44.2	Very low	175 Å²	175	142.7 Å²	142.7	76%	0.761	74%	0.737	S	S	*	*			trans	-49.2	132.5	-172.7	-77.2	-176.5	175.9	179.7	0	109.8	I233 I237	I233-K235 PolarHBondContact O-N 2.98Å; K235-I237 PolarHBondContact O-N 3.46Å
236	S	36.4	Very low	44.3	Very low	102 Å²	102	141.3 Å²	141.3	71%	0.713	74%	0.741	S	S	*	*			trans	-44.5	126.9	163.3	-45.1	0	0	0	0	108.2	R234 H238	R234-S236 PolarHBondContact O-N 3.49Å; S236-H238 PolarHBondContact O-N 2.87Å
237	I	43.8	Very low	44.5	Very low	153 Å²	153	145.9 Å²	145.9	79%	0.785	74%	0.74	S	S	*	*			trans	-54.6	121.6	178	-63.1	170.9	0	0	0	107	K235 L239	K235-I237 PolarHBondContact O-N 3.46Å; I237-L239 PolarHBondContact O-N 2.87Å
238	H	42.7	Very low	44.5	Very low	169 Å²	169	147.2 Å²	147.2	78%	0.782	74%	0.742	S	S	*	*			trans	-68.5	86.4	177.5	-94.2	-87.3	0	0	0	108.8	S236 K240	S236-H238 PolarHBondContact O-N 2.87Å; H238-K240 PolarHBondContact O-N 3.47Å; H238-K240 VanDerWaalsContact O-N 3.14Å
239	L	45.3	Very low	45.4	Very low	120 Å²	120	149.1 Å²	149.1	63%	0.628	75%	0.751	S	S	*	*			trans	-57	115.1	164.3	-73.7	163.3	0	0	0	107.4	I237 E241	I237-L239 PolarHBondContact O-N 2.87Å; L239-E241 PolarHBondContact O-N 3.46Å; L239-E241 VanDerWaalsContact O-N 3.17Å
240	K	46.5	Very low	45.6	Very low	182 Å²	182	150.5 Å²	150.5	79%	0.791	75%	0.746	S	S	*	*			trans	-62.4	116.9	170	-80.7	-176.2	172.9	-179.1	0	108.1	H238 G242 S243	H238-K240 PolarHBondContact O-N 3.47Å; H238-K240 VanDerWaalsContact O-N 3.14Å; K240-G242 PolarHBondContact O-N 3.44Å; K240-G242 VanDerWaalsContact O-N 3.1Å; K240-S243 PolarHBondContact O-N 3.27Å; K240-S243 VanDerWaalsContact O-N 3.11Å; K240-S243 PolarHBondContact O-OG 2.96Å
241	E	37	Very low	46.7	Very low	204 Å²	204	147.3 Å²	147.3	95%	0.953	73%	0.729	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.4	114.5	169.7	-65	-177	125	0	0	108.1	L239	L239-E241 PolarHBondContact O-N 3.46Å; L239-E241 VanDerWaalsContact O-N 3.17Å
242	G	47.8	Very low	48.4	Very low	77 Å²	77	144.1 Å²	144.1	79%	0.794	72%	0.722	S	S	*	*	T	Hydrogen-bonded Turn	trans	129.1	-19.6	-169.3	0	0	0	0	0	114.7	K240 S244	K240-G242 PolarHBondContact O-N 3.44Å; K240-G242 VanDerWaalsContact O-N 3.1Å; G242-S244 PolarHBondContact O-N 3.36Å
243	S	41.5	Very low	49.5	Very low	70 Å²	70	142.8 Å²	142.8	49%	0.49	71%	0.712	S	S	.	*			trans	-75.2	91.3	172.6	49.6	0	0	0	0	111.7	K240 Y245	K240-S243 PolarHBondContact O-N 3.27Å; K240-S243 VanDerWaalsContact O-N 3.11Å; K240-S243 PolarHBondContact O-OG 2.96Å; S243-Y245 VanDerWaalsContact C-N 3.29Å; S243-Y245 PolarHBondContact O-N 3.05Å
244	S	47.3	Very low	50.9	Low	116 Å²	116	142.8 Å²	142.8	81%	0.811	71%	0.713	S	S	*	*			trans	-74.2	-8.7	-173	55.3	0	0	0	0	115.6	G242	G242-S244 PolarHBondContact O-N 3.36Å
245	Y	40.9	Very low	52.4	Low	208 Å²	208	135.5 Å²	135.5	82%	0.816	69%	0.69	S	S	*	*			trans	-132.1	122.6	175	-98.4	-94.4	0	0	0	111.6	S243 R247	S243-Y245 VanDerWaalsContact C-N 3.29Å; S243-Y245 PolarHBondContact O-N 3.05Å; Y245-R247 PolarHBondContact O-N 2.84Å
246	I	53.4	Low	54.1	Low	153 Å²	153	129.4 Å²	129.4	79%	0.785	67%	0.665	S	S	*	*			trans	-82.3	89.5	164.8	-58.7	174.9	0	0	0	107.1	F248	I246-F248 PolarHBondContact O-N 2.78Å
247	R	50.3	Low	56	Low	208 Å²	208	126.2 Å²	126.2	79%	0.785	64%	0.64	S	S	*	*			trans	-72.3	110.8	171.1	-179.1	173.7	174.4	168.5	-3.2	108.8	Y245 I249	Y245-R247 PolarHBondContact O-N 2.84Å; R247-I249 HydrophobicContact CG-CG1 4.12Å; R247-I249 PolarHBondContact O-N 3.01Å
248	F	49.2	Very low	57.8	Low	162 Å²	162	126.3 Å²	126.3	71%	0.711	64%	0.637	S	S	*	*			trans	-64.6	124.2	163.2	-179	-119.9	0	0	0	108.1	I246 E250	I246-F248 PolarHBondContact O-N 2.78Å; F248-E250 HydrophobicContact CD1-CG 4.04Å; F248-E250 HydrophobicContact CE1-CG 3.32Å; F248-E250 HydrophobicContact CZ-CG 3.84Å
249	I	63.9	Low	59.8	Low	127 Å²	127	121.6 Å²	121.6	65%	0.651	62%	0.62	S	S	*	*			trans	-111.4	119.2	170.1	-59.9	176.9	0	0	0	104.6	R247 K251	R247-I249 HydrophobicContact CG-CG1 4.12Å; R247-I249 PolarHBondContact O-N 3.01Å; I249-K251 PolarHBondContact O-N 3.26Å
250	E	56.8	Low	61.8	Low	154 Å²	154	118.2 Å²	118.2	72%	0.72	61%	0.605	S	S	*	*	P	Polyproline II helix	trans	-67.5	131.7	171	-71.9	-171.4	159.4	0	0	108.7	F248	F248-E250 HydrophobicContact CD1-CG 4.04Å; F248-E250 HydrophobicContact CE1-CG 3.32Å; F248-E250 HydrophobicContact CZ-CG 3.84Å
251	K	72.1	Confident	63.8	Low	104 Å²	104	112 Å²	112	45%	0.452	58%	0.578	S	S	.	*	P	Polyproline II helix	trans	-61.1	144	173	-74.8	-165.8	155.1	-144.8	0	110.1	I249 E255 L256	I249-K251 PolarHBondContact O-N 3.26Å; K251-E255 WeakPolarHBondContact CA-OE2 3.4Å; K251-E255 HydrophobicContact CB-CB 4.04Å; K251-E255 VanDerWaalsContact CB-OE2 3.26Å; K251-E255 WeakPolarHBondContact CB-OE2 3.4Å; K251-E255 HydrophobicContact CD-CB 4.23Å; K251-E255 HydrophobicContact CG-CB 4.42Å; K251-E255 WeakPolarHBondContact CG-OE2 3.44Å; K251-L256 HydrophobicContact CB-CD1 4.13Å; K251-L256 HydrophobicContact CB-CD2 3.87Å; K251-L256 HydrophobicContact CB-CG 3.66Å; K251-L256 HydrophobicContact CD-CD2 4.02Å; K251-L256 HydrophobicContact CD-CG 4.47Å; K251-L256 HydrophobicContact CG-CD2 4.5Å; K251-L256 WeakPolarHBondContact O-CD1 3.18Å
252	T	73.3	Confident	66.4	Low	73 Å²	73	103 Å²	103	45%	0.448	54%	0.536	S	S	.	.	P	Polyproline II helix	trans	-64.4	163	174.9	72.3	0	0	0	0	110.8	D254 E255 L256	T252-D254 PolarHBondContact O-N 3.41Å; T252-D254 PolarHBondContact OG1-N 3.28Å; T252-E255 PolarHBondContact N-OE2 3.14Å; T252-E255 PolarHBondContact O-N 3.16Å; T252-E255 WeakPolarHBondContact OG1-CG 3.22Å; T252-E255 PolarHBondContact OG1-N 3.34Å; T252-L256 WeakPolarHBondContact O-CD1 3.31Å; T252-L256 VanDerWaalsContact O-CG 3.3Å; T252-L256 WeakPolarHBondContact O-CG 3.45Å; T252-L256 PolarHBondContact O-N 2.86Å; T252-L256 VanDerWaalsContact O-N 3.09Å
253	S	65.8	Low	68.5	Low	78 Å²	78	104.4 Å²	104.4	55%	0.545	53%	0.525	S	S	.	.	H	α-helix	trans	-58.5	-31.7	176.4	-168.8	0	0	0	0	111.8	D257	S253-D257 PolarHBondContact O-N 3.41Å
254	D	72.2	Confident	70.9	Confident	120 Å²	120	102.9 Å²	102.9	64%	0.642	51%	0.511	S	S	*	.	H	α-helix	trans	-75	-46.3	-179.1	-45.9	-67.5	0	0	0	111.6	T252 L256 D257 E258	T252-D254 PolarHBondContact O-N 3.41Å; T252-D254 PolarHBondContact OG1-N 3.28Å; D254-L256 PolarHBondContact O-N 3.03Å; D254-D257 PolarHBondContact O-N 2.87Å; D254-E258 PolarHBondContact O-N 2.82Å
255	E	74.9	Confident	72.9	Confident	90 Å²	90	99 Å²	99	42%	0.421	48%	0.482	S	S	.	.	H	α-helix	trans	-59.2	-27.2	172.6	-73.7	-176.8	157.7	0	0	113.1	K251 T252 V259	K251-E255 WeakPolarHBondContact CA-OE2 3.4Å; K251-E255 HydrophobicContact CB-CB 4.04Å; K251-E255 VanDerWaalsContact CB-OE2 3.26Å; K251-E255 WeakPolarHBondContact CB-OE2 3.4Å; K251-E255 HydrophobicContact CD-CB 4.23Å; K251-E255 HydrophobicContact CG-CB 4.42Å; K251-E255 WeakPolarHBondContact CG-OE2 3.44Å; T252-E255 PolarHBondContact N-OE2 3.14Å; T252-E255 PolarHBondContact O-N 3.16Å; T252-E255 WeakPolarHBondContact OG1-CG 3.22Å; T252-E255 PolarHBondContact OG1-N 3.34Å; E255-V259 WeakPolarHBondContact O-CG2 3.25Å
256	L	73.9	Confident	75.2	Confident	47 Å²	47	93.2 Å²	93.2	25%	0.246	46%	0.462	C	S	.	.	H	α-helix	trans	-83.9	-31.1	174.7	-69.3	166.1	0	0	0	112.4	K251 T252 D254 K301 R602	K251-L256 HydrophobicContact CB-CD1 4.13Å; K251-L256 HydrophobicContact CB-CD2 3.87Å; K251-L256 HydrophobicContact CB-CG 3.66Å; K251-L256 HydrophobicContact CD-CD2 4.02Å; K251-L256 HydrophobicContact CD-CG 4.47Å; K251-L256 HydrophobicContact CG-CD2 4.5Å; K251-L256 WeakPolarHBondContact O-CD1 3.18Å; T252-L256 WeakPolarHBondContact O-CD1 3.31Å; T252-L256 VanDerWaalsContact O-CG 3.3Å; T252-L256 WeakPolarHBondContact O-CG 3.45Å; T252-L256 PolarHBondContact O-N 2.86Å; T252-L256 VanDerWaalsContact O-N 3.09Å; D254-L256 PolarHBondContact O-N 3.03Å; L256-K301 PolarHBondContact O-NZ 3.13Å; L256-R602 PolarHBondContact O-NH2 2.87Å
257	D	77.3	Confident	77	Confident	36 Å²	36	90 Å²	90	19%	0.193	44%	0.444	C	S	.	.	H	α-helix	trans	-72.5	-32	174.2	-114.9	42.2	0	0	0	111.7	S253 D254 R298 K301 K302 R602	S253-D257 PolarHBondContact O-N 3.41Å; D254-D257 PolarHBondContact O-N 2.87Å; D257-R298 VanDerWaalsContact O-CZ 3.3Å; D257-R298 PolarHBondContact O-NH1 2.81Å; D257-R298 PolarHBondContact O-NH2 2.8Å; D257-K301 PolarHBondContact O-NZ 3.32Å; D257-K302 IonicContact OD2-NZ 3.82Å; D257-K302 PolarHBondContact OD2-NZ 2.98Å; D257-R602 IonicContact OD1-NH2 3.24Å; D257-R602 PolarHBondContact OD1-NH2 3.38Å
258	E	81.6	Confident	79	Confident	155 Å²	155	80.1 Å²	80.1	72%	0.724	41%	0.406	S	S	*	.	H	α-helix	trans	-63.1	-54.6	172.3	-71.6	-164.3	156.7	0	0	113	D254 V260 R298	D254-E258 PolarHBondContact O-N 2.82Å; E258-V260 PolarHBondContact O-N 2.92Å; E258-R298 PolarHBondContact O-NH2 3.4Å
259	V	84.3	Confident	81.1	Confident	69 Å²	69	74.5 Å²	74.5	42%	0.418	38%	0.384	S	S	.	.	S	Bend	trans	-65.6	126.3	-175.1	172.6	0	0	0	0	111.7	E255 E261 K301	E255-V259 WeakPolarHBondContact O-CG2 3.25Å; V259-E261 PolarHBondContact O-N 2.99Å; V259-K301 PolarHBondContact O-NZ 3.45Å
260	V	88	Confident	82.4	Confident	50 Å²	50	73.7 Å²	73.7	30%	0.303	38%	0.375	S	S	.	.			trans	-65.1	127.3	172.4	177.5	0	0	0	0	110.1	E258 E293 D297	E258-V260 PolarHBondContact O-N 2.92Å; V260-E293 HydrophobicContact CG1-CG 4.02Å; V260-E293 WeakPolarHBondContact CG1-OE1 3.1Å; V260-D297 HydrophobicContact CG1-CB 3.94Å
261	E	88.4	Confident	84.2	Confident	51 Å²	51	68.3 Å²	68.3	24%	0.238	35%	0.349	C	S	.	.			trans	-114.6	-2.4	-175.3	-68.6	178.1	88.7	0	0	113.8	V259 D297 K301 L600 R602	V259-E261 PolarHBondContact O-N 2.99Å; E261-D297 PolarHBondContact N-OD1 3.21Å; E261-K301 WeakPolarHBondContact OE2-CE 3.4Å; E261-K301 IonicContact OE2-NZ 2.97Å; E261-L600 HydrophobicContact CB-CD1 3.99Å; E261-L600 HydrophobicContact CB-CD2 3.51Å; E261-L600 HydrophobicContact CB-CG 4.29Å; E261-L600 VanDerWaalsContact O-CD2 3.31Å; E261-L600 WeakPolarHBondContact O-CD2 3.39Å; E261-R602 VanDerWaalsContact CD-NE 3.32Å; E261-R602 WeakPolarHBondContact OE1-CB 3.46Å; E261-R602 WeakPolarHBondContact OE1-CD 3.44Å; E261-R602 IonicContact OE1-NE 2.66Å; E261-R602 PolarHBondContact OE1-NE 2.91Å; E261-R602 IonicContact OE2-CZ 2.7Å; E261-R602 VanDerWaalsContact OE2-CZ 3.22Å; E261-R602 IonicContact OE2-NE 2.66Å; E261-R602 PolarHBondContact OE2-NE 2.92Å; E261-R602 IonicContact OE2-NH2 2.81Å; E261-R602 PolarHBondContact OE2-NH2 2.85Å
262	Y	92.2	Very high	85.2	Confident	14 Å²	14	63.6 Å²	63.6	6%	0.055	33%	0.328	C	S	.	.	P	Polyproline II helix	trans	-88.2	124.3	-172.8	-164.7	-77.3	0	0	0	111.1	L264 D268 E293 M296 L599 L600	Y262-L264 HydrophobicContact CD1-CD2 4Å; Y262-L264 HydrophobicContact CE1-CD2 3.87Å; Y262-D268 WeakPolarHBondContact CE1-OD2 3.25Å; Y262-D268 PolarHBondContact OH-OD2 2.72Å; Y262-E293 WeakPolarHBondContact O-CG 3.29Å; Y262-M296 HydrophobicContact CD1-CB 3.99Å; Y262-M296 HydrophobicContact CD2-CB 3.76Å; Y262-M296 HydrophobicContact CE1-CB 4.03Å; Y262-M296 HydrophobicContact CE1-CG 4.38Å; Y262-M296 HydrophobicContact CE2-CB 3.78Å; Y262-M296 HydrophobicContact CE2-CE 4.13Å; Y262-M296 HydrophobicContact CG-CB 3.88Å; Y262-M296 VanDerWaalsContact OH-CE 3.3Å; Y262-M296 WeakPolarHBondContact OH-CE 3.43Å; Y262-L599 HydrophobicContact CD2-CB 4.39Å; Y262-L599 HydrophobicContact CE2-CB 3.75Å; Y262-L599 HydrophobicContact CE2-CD1 3.81Å; Y262-L599 HydrophobicContact CE2-CG 4.42Å; Y262-L600 HydrophobicContact CD2-CD2 4.21Å
263	D	90.2	Very high	86.2	Confident	108 Å²	108	65.9 Å²	65.9	58%	0.578	33%	0.332	S	S	*	.	P	Polyproline II helix	trans	-93.7	124.7	168.5	-52.6	-63.7	0	0	0	109	K601	D263-K601 IonicContact OD2-NZ 3.19Å; D263-K601 PolarHBondContact OD2-NZ 3.33Å
264	L	91.9	Very high	87.5	Confident	37 Å²	37	71.8 Å²	71.8	19%	0.194	34%	0.342	C	S	.	.	P	Polyproline II helix	trans	-66.8	136.5	171.6	-63.9	-171.1	0	0	0	111.4	Y262 D268 L269 E289 L292 E293	Y262-L264 HydrophobicContact CD1-CD2 4Å; Y262-L264 HydrophobicContact CE1-CD2 3.87Å; L264-D268 HydrophobicContact CB-CB 4.21Å; L264-D268 HydrophobicContact CD2-CB 3.99Å; L264-L269 HydrophobicContact CD1-CD2 4.26Å; L264-E289 HydrophobicContact CD1-CB 3.87Å; L264-E289 HydrophobicContact CD1-CG 4.33Å; L264-L292 HydrophobicContact CD1-CD2 4.48Å; L264-L292 HydrophobicContact CD2-CD2 4.27Å; L264-L292 HydrophobicContact CD2-CG 4.07Å; L264-E293 HydrophobicContact CD2-CB 4.16Å; L264-E293 HydrophobicContact CG-CB 4.13Å; L264-E293 HydrophobicContact CG-CG 4.41Å
265	D	90.6	Very high	88.4	Confident	36 Å²	36	67 Å²	67	19%	0.193	32%	0.316	C	S	.	.			trans	-103.3	178.5	174.1	67.7	34.6	0	0	0	113.7	E267 D268 L269 K590 F1137	D265-E267 PolarHBondContact O-N 3.5Å; D265-E267 WeakPolarHBondContact OD1-CA 3.32Å; D265-E267 VanDerWaalsContact OD1-CB 3.29Å; D265-E267 WeakPolarHBondContact OD1-CB 3.33Å; D265-E267 PolarHBondContact OD1-N 3.36Å; D265-D268 PolarHBondContact N-OD2 3.5Å; D265-D268 PolarHBondContact O-N 3.31Å; D265-D268 PolarHBondContact OD1-N 3.2Å; D265-L269 WeakPolarHBondContact O-CG 3.48Å; D265-L269 PolarHBondContact O-N 3.36Å; D265-K590 IonicContact OD1-NZ 3.83Å; D265-K590 PolarHBondContact OD1-NZ 2.98Å; D265-K590 IonicContact OD2-NZ 2.96Å; D265-K590 PolarHBondContact OD2-NZ 3.37Å; D265-F1137 HydrophobicContact CB-CE2 4.26Å; D265-F1137 HydrophobicContact CB-CZ 3.87Å
266	E	88.7	Confident	89.2	Confident	85 Å²	85	63.7 Å²	63.7	40%	0.397	30%	0.302	S	S	.	.	H	α-helix	trans	-61.5	-31.2	-178.4	-59	-174.8	117.5	0	0	112.1	F270 M1135	E266-F270 WeakPolarHBondContact O-CD2 3.36Å; E266-F270 PolarHBondContact O-N 3.23Å; E266-M1135 HydrophobicContact CB-CB 4.12Å; E266-M1135 HydrophobicContact CB-CE 4.46Å; E266-M1135 HydrophobicContact CB-CG 4.35Å; E266-M1135 HydrophobicContact CB-SD 3.66Å; E266-M1135 HydrophobicContact CG-SD 4.37Å; E266-M1135 WeakPolarHBondContact OE2-CB 3.21Å; E266-M1135 WeakPolarHBondContact OE2-CG 3.37Å
267	E	90.3	Very high	90	Very high	87 Å²	87	64.3 Å²	64.3	41%	0.407	31%	0.314	S	S	.	.	H	α-helix	trans	-70.1	-43.4	176.5	-174.7	179.3	-152.2	0	0	111	D265 L269 F270 W271 F586 K590	D265-E267 PolarHBondContact O-N 3.5Å; D265-E267 WeakPolarHBondContact OD1-CA 3.32Å; D265-E267 VanDerWaalsContact OD1-CB 3.29Å; D265-E267 WeakPolarHBondContact OD1-CB 3.33Å; D265-E267 PolarHBondContact OD1-N 3.36Å; E267-L269 VanDerWaalsContact C-N 3.32Å; E267-L269 PolarHBondContact O-N 3.48Å; E267-F270 PolarHBondContact O-N 2.95Å; E267-W271 WeakPolarHBondContact O-CB 3.34Å; E267-W271 PolarHBondContact O-N 3.04Å; E267-F586 HydrophobicContact CG-CE2 4.27Å; E267-F586 HydrophobicContact CG-CZ 4.25Å; E267-K590 IonicContact OE2-NZ 3.35Å
268	D	93.7	Very high	90.6	Very high	0 Å²	0	68 Å²	68	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-59	-43.6	174.1	-61.5	-41.3	0	0	0	111.3	Y262 L264 D265 W271 L272 L292 F586 K590	Y262-D268 WeakPolarHBondContact CE1-OD2 3.25Å; Y262-D268 PolarHBondContact OH-OD2 2.72Å; L264-D268 HydrophobicContact CB-CB 4.21Å; L264-D268 HydrophobicContact CD2-CB 3.99Å; D265-D268 PolarHBondContact N-OD2 3.5Å; D265-D268 PolarHBondContact O-N 3.31Å; D265-D268 PolarHBondContact OD1-N 3.2Å; D268-W271 PolarHBondContact O-N 3.3Å; D268-L272 WeakPolarHBondContact O-CB 3.35Å; D268-L272 PolarHBondContact O-N 3.07Å; D268-L292 HydrophobicContact CB-CD2 4.36Å; D268-F586 WeakPolarHBondContact OD1-CE1 3.4Å; D268-F586 WeakPolarHBondContact OD1-CZ 3.48Å; D268-K590 WeakPolarHBondContact OD1-CD 3.27Å; D268-K590 IonicContact OD1-NZ 2.93Å; D268-K590 PolarHBondContact OD1-NZ 3.16Å; D268-K590 IonicContact OD2-NZ 3.94Å; D268-K590 PolarHBondContact OD2-NZ 3.41Å
269	L	92.8	Very high	91	Very high	44 Å²	44	61.4 Å²	61.4	23%	0.23	30%	0.296	C	S	.	.	H	α-helix	trans	-67.3	-35	177.9	-67.2	174.9	0	0	0	112.7	L264 D265 E267 K273 E289	L264-L269 HydrophobicContact CD1-CD2 4.26Å; D265-L269 WeakPolarHBondContact O-CG 3.48Å; D265-L269 PolarHBondContact O-N 3.36Å; E267-L269 VanDerWaalsContact C-N 3.32Å; E267-L269 PolarHBondContact O-N 3.48Å; L269-K273 WeakPolarHBondContact O-CB 3.46Å; L269-K273 VanDerWaalsContact O-CD 3.27Å; L269-K273 WeakPolarHBondContact O-CD 3.28Å; L269-K273 WeakPolarHBondContact O-CG 3.47Å; L269-K273 PolarHBondContact O-N 3.11Å; L269-E289 HydrophobicContact CD2-CG 3.82Å
270	F	91.8	Very high	91.2	Very high	110 Å²	110	62.8 Å²	62.8	48%	0.482	30%	0.301	S	S	.	.	H	α-helix	trans	-72	-38.1	173.3	-87.7	-67.8	0	0	0	112.4	E266 E267 K273 R274 M1135	E266-F270 WeakPolarHBondContact O-CD2 3.36Å; E266-F270 PolarHBondContact O-N 3.23Å; E267-F270 PolarHBondContact O-N 2.95Å; F270-K273 PolarHBondContact O-N 2.79Å; F270-R274 PolarHBondContact O-N 3.03Å; F270-M1135 HydrophobicContact CD2-SD 4.01Å; F270-M1135 HydrophobicContact CE2-CE 3.92Å; F270-M1135 HydrophobicContact CE2-SD 3.6Å; F270-M1135 VanDerWaalsContact CE2-SD 3.6Å
271	W	94.7	Very high	91.3	Very high	41 Å²	41	64.8 Å²	64.8	16%	0.155	32%	0.318	C	S	.	.	H	α-helix	trans	-62.5	-49.6	173.4	-175.1	92.4	0	0	0	111	E267 D268 K273 R274 I275 L292 F579 Q582 T583 F586	E267-W271 WeakPolarHBondContact O-CB 3.34Å; E267-W271 PolarHBondContact O-N 3.04Å; D268-W271 PolarHBondContact O-N 3.3Å; W271-K273 VanDerWaalsContact C-N 3.34Å; W271-K273 PolarHBondContact O-N 3.06Å; W271-R274 WeakPolarHBondContact O-CB 3.44Å; W271-R274 PolarHBondContact O-N 2.84Å; W271-R274 VanDerWaalsContact O-N 3.08Å; W271-I275 HydrophobicContact CD2-CG1 3.88Å; W271-I275 HydrophobicContact CE3-CG1 4.01Å; W271-I275 HydrophobicContact CH2-CG1 3.83Å; W271-I275 HydrophobicContact CZ2-CD1 4.1Å; W271-I275 HydrophobicContact CZ2-CG1 3.69Å; W271-I275 HydrophobicContact CZ3-CG1 3.99Å; W271-I275 WeakPolarHBondContact O-CG1 3.34Å; W271-I275 PolarHBondContact O-N 2.88Å; W271-L292 HydrophobicContact CE3-CD1 4.4Å; W271-L292 HydrophobicContact CE3-CD2 4.13Å; W271-L292 HydrophobicContact CZ3-CD1 3.93Å; W271-L292 HydrophobicContact CZ3-CD2 4.34Å; W271-F579 HydrophobicContact CH2-CE2 4.07Å; W271-F579 HydrophobicContact CZ3-CE2 4.16Å; W271-F579 HydrophobicContact CZ3-CZ 4.48Å; W271-Q582 HydrophobicContact CZ2-CB 4.24Å; W271-T583 HydrophobicContact CH2-CG2 4.27Å; W271-T583 WeakPolarHBondContact CH2-OG1 3.38Å; W271-F586 HydrophobicContact CB-CD1 4.48Å; W271-F586 HydrophobicContact CB-CE1 3.91Å; W271-F586 HydrophobicContact CB-CE2 3.97Å; W271-F586 HydrophobicContact CB-CZ 3.62Å; W271-F586 AromaticContact CD1-CD2 3.48Å; W271-F586 VanDerWaalsContact CD1-CD2 3.48Å; W271-F586 AromaticContact CD1-CE2 3.73Å; W271-F586 AromaticContact CD1-CG 3.69Å; W271-F586 HydrophobicContact CD2-CB 4.47Å; W271-F586 AromaticContact CD2-CD1 3.72Å; W271-F586 HydrophobicContact CD2-CD1 3.72Å; W271-F586 HydrophobicContact CD2-CD2 4.46Å; W271-F586 AromaticContact CD2-CE1 3.98Å; W271-F586 HydrophobicContact CD2-CE1 3.98Å; W271-F586 AromaticContact CD2-CG 3.98Å; W271-F586 HydrophobicContact CD2-CG 3.98Å; W271-F586 HydrophobicContact CD2-CZ 4.46Å; W271-F586 AromaticContact CE2-CD1 3.94Å; W271-F586 AromaticContact CE2-CG 3.8Å; W271-F586 HydrophobicContact CE3-CD1 4.1Å; W271-F586 HydrophobicContact CE3-CE1 4.28Å; W271-F586 AromaticContact CG-CD1 3.88Å; W271-F586 HydrophobicContact CG-CD1 3.88Å; W271-F586 AromaticContact CG-CD2 3.95Å; W271-F586 HydrophobicContact CG-CD2 3.95Å; W271-F586 AromaticContact CG-CE1 3.81Å; W271-F586 HydrophobicContact CG-CE1 3.81Å; W271-F586 AromaticContact CG-CE2 3.89Å; W271-F586 HydrophobicContact CG-CE2 3.89Å; W271-F586 AromaticContact CG-CG 3.94Å; W271-F586 HydrophobicContact CG-CG 3.94Å; W271-F586 AromaticContact CG-CZ 3.81Å; W271-F586 HydrophobicContact CG-CZ 3.81Å; W271-F586 HydrophobicContact CZ2-CB 4.04Å; W271-F586 HydrophobicContact CZ2-CD1 4.5Å; W271-F586 HydrophobicContact CZ2-CG 4.44Å; W271-F586 AromaticContact NE1-CD2 3.78Å; W271-F586 AromaticContact NE1-CG 3.6Å
272	L	93.3	Very high	91.3	Very high	5 Å²	5	67.4 Å²	67.4	3%	0.026	33%	0.333	C	S	.	.	H	α-helix	trans	-60.3	-41.1	178.1	-174.3	58.1	0	0	0	112.1	D268 R274 I275 N276 V287 E289 L292	D268-L272 WeakPolarHBondContact O-CB 3.35Å; D268-L272 PolarHBondContact O-N 3.07Å; L272-R274 PolarHBondContact O-N 2.95Å; L272-I275 PolarHBondContact O-N 3.07Å; L272-N276 VanDerWaalsContact O-CB 3.26Å; L272-N276 WeakPolarHBondContact O-CB 3.42Å; L272-N276 PolarHBondContact O-N 2.62Å; L272-V287 HydrophobicContact CD1-CB 4.22Å; L272-E289 HydrophobicContact CD2-CB 4.39Å; L272-E289 HydrophobicContact CD2-CG 3.76Å; L272-L292 HydrophobicContact CB-CD2 3.9Å; L272-L292 HydrophobicContact CD1-CD2 4.31Å; L272-L292 HydrophobicContact CD2-CB 4.4Å; L272-L292 HydrophobicContact CD2-CD2 4.15Å; L272-L292 HydrophobicContact CG-CD2 4.34Å
273	K	92.7	Very high	91	Very high	120 Å²	120	72.3 Å²	72.3	52%	0.522	37%	0.369	S	S	.	.	H	α-helix	trans	-61.1	-41.8	173.6	-75.1	164.2	-165.7	169.3	0	112.1	L269 F270 W271 A277	L269-K273 WeakPolarHBondContact O-CB 3.46Å; L269-K273 VanDerWaalsContact O-CD 3.27Å; L269-K273 WeakPolarHBondContact O-CD 3.28Å; L269-K273 WeakPolarHBondContact O-CG 3.47Å; L269-K273 PolarHBondContact O-N 3.11Å; F270-K273 PolarHBondContact O-N 2.79Å; W271-K273 VanDerWaalsContact C-N 3.34Å; W271-K273 PolarHBondContact O-N 3.06Å; K273-A277 WeakPolarHBondContact O-CB 3.28Å; K273-A277 PolarHBondContact O-N 2.92Å
274	R	92.8	Very high	90.8	Very high	202 Å²	202	69.5 Å²	69.5	76%	0.762	35%	0.354	S	S	*	.	H	α-helix	trans	-65.9	-42.6	176.7	-176.5	-179.9	174.3	107	-2.3	112	F270 W271 L272 K278	F270-R274 PolarHBondContact O-N 3.03Å; W271-R274 WeakPolarHBondContact O-CB 3.44Å; W271-R274 PolarHBondContact O-N 2.84Å; W271-R274 VanDerWaalsContact O-N 3.08Å; L272-R274 PolarHBondContact O-N 2.95Å; R274-K278 PolarHBondContact O-N 3.04Å
275	I	92	Very high	90.6	Very high	19 Å²	19	71 Å²	71	10%	0.097	37%	0.366	C	S	.	.	H	α-helix	trans	-69.8	-42.2	177.6	-61.7	-58.9	0	0	0	111.3	W271 L272 A277 K278 R279 F579	W271-I275 HydrophobicContact CD2-CG1 3.88Å; W271-I275 HydrophobicContact CE3-CG1 4.01Å; W271-I275 HydrophobicContact CH2-CG1 3.83Å; W271-I275 HydrophobicContact CZ2-CD1 4.1Å; W271-I275 HydrophobicContact CZ2-CG1 3.69Å; W271-I275 HydrophobicContact CZ3-CG1 3.99Å; W271-I275 WeakPolarHBondContact O-CG1 3.34Å; W271-I275 PolarHBondContact O-N 2.88Å; L272-I275 PolarHBondContact O-N 3.07Å; I275-A277 VanDerWaalsContact C-N 3.33Å; I275-A277 PolarHBondContact O-N 3.3Å; I275-K278 CarbonylContact O-C 3.59Å; I275-K278 WeakPolarHBondContact O-CB 3.36Å; I275-K278 PolarHBondContact O-N 3.31Å; I275-K278 VanDerWaalsContact O-N 3.11Å; I275-R279 HydrophobicContact CG2-CG 4.39Å; I275-R279 WeakPolarHBondContact O-CG 3.46Å; I275-R279 PolarHBondContact O-N 3.04Å; I275-F579 HydrophobicContact CG2-CD2 3.97Å; I275-F579 HydrophobicContact CG2-CE2 3.84Å
276	N	91.9	Very high	90.5	Very high	22 Å²	22	73 Å²	73	12%	0.118	38%	0.381	C	S	.	.	H	α-helix	trans	-65.4	-34.3	175.7	-76.6	-16.5	0	0	0	112.3	L272 R279 N280 P286 V287	L272-N276 VanDerWaalsContact O-CB 3.26Å; L272-N276 WeakPolarHBondContact O-CB 3.42Å; L272-N276 PolarHBondContact O-N 2.62Å; N276-R279 PolarHBondContact O-N 3.24Å; N276-N280 WeakPolarHBondContact O-CB 3.28Å; N276-N280 PolarHBondContact O-N 3.31Å; N276-N280 PolarHBondContact O-OD1 3Å; N276-P286 HydrophobicContact CB-CB 4.04Å; N276-P286 WeakPolarHBondContact OD1-CA 3.12Å; N276-V287 PolarHBondContact ND2-O 2.89Å; N276-V287 PolarHBondContact OD1-N 2.95Å
277	A	91	Very high	90.6	Very high	60 Å²	60	69.1 Å²	69.1	50%	0.496	36%	0.363	S	S	.	.	H	α-helix	trans	-60.9	-43.1	169.5	0	0	0	0	0	112.1	K273 I275 N280 S281	K273-A277 WeakPolarHBondContact O-CB 3.28Å; K273-A277 PolarHBondContact O-N 2.92Å; I275-A277 VanDerWaalsContact C-N 3.33Å; I275-A277 PolarHBondContact O-N 3.3Å; A277-N280 PolarHBondContact O-N 2.84Å; A277-S281 PolarHBondContact O-N 3.43Å; A277-S281 VanDerWaalsContact O-N 3.07Å; A277-S281 PolarHBondContact O-OG 2.87Å
278	K	89.7	Confident	90.7	Very high	112 Å²	112	67.5 Å²	67.5	49%	0.487	36%	0.361	S	S	.	.	H	α-helix	trans	-64.9	-39.8	174.2	-172.2	-178.6	176.4	-173.4	0	112.2	R274 I275 S281 L282	R274-K278 PolarHBondContact O-N 3.04Å; I275-K278 CarbonylContact O-C 3.59Å; I275-K278 WeakPolarHBondContact O-CB 3.36Å; I275-K278 PolarHBondContact O-N 3.31Å; I275-K278 VanDerWaalsContact O-N 3.11Å; K278-S281 WeakPolarHBondContact CA-OG 2.91Å; K278-S281 PolarHBondContact O-N 2.83Å; K278-S281 PolarHBondContact O-OG 3.37Å; K278-L282 HydrophobicContact CG-CD1 4.39Å; K278-L282 WeakPolarHBondContact O-CG 3.14Å; K278-L282 PolarHBondContact O-N 3.44Å
279	R	90	Very high	90.7	Very high	17 Å²	17	72.8 Å²	72.8	6%	0.064	39%	0.386	C	S	.	.	H	α-helix	trans	-63.9	-43.7	175.6	-72.5	178.7	62.2	85.8	2.3	111.6	I275 N276 S281 L282 S283 L284 P285 S573	I275-R279 HydrophobicContact CG2-CG 4.39Å; I275-R279 WeakPolarHBondContact O-CG 3.46Å; I275-R279 PolarHBondContact O-N 3.04Å; N276-R279 PolarHBondContact O-N 3.24Å; R279-S281 VanDerWaalsContact C-N 3.33Å; R279-S281 PolarHBondContact O-N 3.23Å; R279-L282 CarbonylContact O-C 3.58Å; R279-L282 WeakPolarHBondContact O-CA 3.31Å; R279-L282 PolarHBondContact O-N 2.98Å; R279-S283 PolarHBondContact O-N 3.22Å; R279-L284 CarbonylContact C-O 3.55Å; R279-L284 HydrophobicContact CB-CB 4.06Å; R279-L284 HydrophobicContact CG-CB 4.5Å; R279-L284 PolarHBondContact O-N 2.91Å; R279-P285 VanDerWaalsContact CZ-O 3.26Å; R279-P285 PolarHBondContact NE-O 3.24Å; R279-P285 PolarHBondContact NH2-O 3.09Å; R279-S573 PolarHBondContact NH1-O 3.06Å; R279-S573 PolarHBondContact NH2-O 3.3Å
280	N	89.4	Confident	90.6	Very high	98 Å²	98	74.1 Å²	74.1	52%	0.524	40%	0.399	S	S	.	.	H	α-helix	trans	-60	-40.4	174.3	-68.4	-2.5	0	0	0	111.9	N276 A277 L282 S283	N276-N280 WeakPolarHBondContact O-CB 3.28Å; N276-N280 PolarHBondContact O-N 3.31Å; N276-N280 PolarHBondContact O-OD1 3Å; A277-N280 PolarHBondContact O-N 2.84Å; N280-L282 PolarHBondContact O-N 2.9Å; N280-S283 PolarHBondContact O-N 3.2Å; N280-S283 VanDerWaalsContact O-N 3.11Å
281	S	89.7	Confident	90.6	Very high	92 Å²	92	69.7 Å²	69.7	64%	0.643	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.7	-9.7	173.7	60.4	0	0	0	0	114.7	A277 K278 R279	A277-S281 PolarHBondContact O-N 3.43Å; A277-S281 VanDerWaalsContact O-N 3.07Å; A277-S281 PolarHBondContact O-OG 2.87Å; K278-S281 WeakPolarHBondContact CA-OG 2.91Å; K278-S281 PolarHBondContact O-N 2.83Å; K278-S281 PolarHBondContact O-OG 3.37Å; R279-S281 VanDerWaalsContact C-N 3.33Å; R279-S281 PolarHBondContact O-N 3.23Å
282	L	87.4	Confident	90.5	Very high	107 Å²	107	67.8 Å²	67.8	56%	0.56	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.1	14.9	174.1	-64.3	170.9	0	0	0	111.7	K278 R279 N280 L284	K278-L282 HydrophobicContact CG-CD1 4.39Å; K278-L282 WeakPolarHBondContact O-CG 3.14Å; K278-L282 PolarHBondContact O-N 3.44Å; R279-L282 CarbonylContact O-C 3.58Å; R279-L282 WeakPolarHBondContact O-CA 3.31Å; R279-L282 PolarHBondContact O-N 2.98Å; N280-L282 PolarHBondContact O-N 2.9Å; L282-L284 HydrophobicContact CB-CD1 4.49Å; L282-L284 HydrophobicContact CB-CG 4.4Å; L282-L284 PolarHBondContact O-N 3.2Å; L282-L284 VanDerWaalsContact O-N 3.08Å
283	S	85.6	Confident	90.5	Very high	117 Å²	117	70.8 Å²	70.8	82%	0.818	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.5	21	-176.4	-58.3	0	0	0	0	115.2	R279 N280	R279-S283 PolarHBondContact O-N 3.22Å; N280-S283 PolarHBondContact O-N 3.2Å; N280-S283 VanDerWaalsContact O-N 3.11Å
284	L	87.1	Confident	90.6	Very high	49 Å²	49	68 Å²	68	26%	0.257	37%	0.374	S	S	.	.	P	Polyproline II helix	trans	-92	138.9	174.8	-65.2	177.6	0	0	0	110.4	R279 L282	R279-L284 CarbonylContact C-O 3.55Å; R279-L284 HydrophobicContact CB-CB 4.06Å; R279-L284 HydrophobicContact CG-CB 4.5Å; R279-L284 PolarHBondContact O-N 2.91Å; L282-L284 HydrophobicContact CB-CD1 4.49Å; L282-L284 HydrophobicContact CB-CG 4.4Å; L282-L284 PolarHBondContact O-N 3.2Å; L282-L284 VanDerWaalsContact O-N 3.08Å
285	P	87.4	Confident	90.6	Very high	68 Å²	68	58.4 Å²	58.4	44%	0.442	34%	0.338	S	S	.	.	P	Polyproline II helix	trans	-65.6	151	-179.7	27.7	-35.1	0	0	0	111.6	R279 S573	R279-P285 VanDerWaalsContact CZ-O 3.26Å; R279-P285 PolarHBondContact NE-O 3.24Å; R279-P285 PolarHBondContact NH2-O 3.09Å; P285-S573 WeakPolarHBondContact CD-OG 3.36Å; P285-S573 WeakPolarHBondContact CG-OG 3.49Å
286	P	89.4	Confident	90.6	Very high	78 Å²	78	57.5 Å²	57.5	51%	0.506	33%	0.333	S	S	.	.	P	Polyproline II helix	trans	-66.6	144.3	179.7	28.5	-35.7	0	0	0	111.7	N276	N276-P286 HydrophobicContact CB-CB 4.04Å; N276-P286 WeakPolarHBondContact OD1-CA 3.12Å
287	V	90.5	Very high	90.6	Very high	4 Å²	4	56.5 Å²	56.5	2%	0.024	33%	0.328	C	S	.	.	P	Polyproline II helix	trans	-80.4	137.5	170.7	-177.6	0	0	0	0	109	L272 N276 T291 V572 F579	L272-V287 HydrophobicContact CD1-CB 4.22Å; N276-V287 PolarHBondContact ND2-O 2.89Å; N276-V287 PolarHBondContact OD1-N 2.95Å; V287-T291 HydrophobicContact CG1-CG2 3.66Å; V287-V572 HydrophobicContact CG1-CG2 4.1Å; V287-V572 HydrophobicContact CG2-CG1 4.19Å; V287-V572 HydrophobicContact CG2-CG2 4.05Å; V287-F579 HydrophobicContact CB-CZ 4.09Å; V287-F579 HydrophobicContact CG1-CE1 4.02Å; V287-F579 HydrophobicContact CG1-CZ 3.83Å; V287-F579 HydrophobicContact CG2-CE1 4.1Å; V287-F579 HydrophobicContact CG2-CE2 4.1Å; V287-F579 HydrophobicContact CG2-CZ 3.87Å
288	S	91.9	Very high	90.6	Very high	53 Å²	53	55.3 Å²	55.3	37%	0.371	31%	0.31	S	S	.	.	P	Polyproline II helix	trans	-75.8	157.3	178.4	63.6	0	0	0	0	112.6	S290 T291 L292	S288-S290 VanDerWaalsContact C-N 3.31Å; S288-S290 PolarHBondContact O-N 3.17Å; S288-S290 PolarHBondContact OG-OG 2.82Å; S288-T291 PolarHBondContact O-N 3.48Å; S288-T291 VanDerWaalsContact O-N 3.17Å; S288-T291 PolarHBondContact OG-N 3.36Å; S288-T291 PolarHBondContact OG-OG1 3.18Å; S288-L292 PolarHBondContact O-N 3.03Å
289	E	92.6	Very high	90.7	Very high	110 Å²	110	50 Å²	50	51%	0.514	29%	0.287	S	S	.	.	H	α-helix	trans	-55.9	-46.3	174.2	-70.2	170.1	-173.6	0	0	110.9	L264 L269 L272 T291 L292 E293	L264-E289 HydrophobicContact CD1-CB 3.87Å; L264-E289 HydrophobicContact CD1-CG 4.33Å; L269-E289 HydrophobicContact CD2-CG 3.82Å; L272-E289 HydrophobicContact CD2-CB 4.39Å; L272-E289 HydrophobicContact CD2-CG 3.76Å; E289-T291 VanDerWaalsContact C-N 3.28Å; E289-T291 PolarHBondContact O-N 2.91Å; E289-L292 PolarHBondContact O-N 3.04Å; E289-L292 VanDerWaalsContact O-N 3.1Å; E289-E293 WeakPolarHBondContact O-CB 3.27Å; E289-E293 PolarHBondContact O-N 2.81Å
290	S	91.1	Very high	90.6	Very high	73 Å²	73	49.2 Å²	49.2	51%	0.51	28%	0.284	S	S	.	.	H	α-helix	trans	-57.8	-31.5	176.5	53.6	0	0	0	0	115	S288 W294	S288-S290 VanDerWaalsContact C-N 3.31Å; S288-S290 PolarHBondContact O-N 3.17Å; S288-S290 PolarHBondContact OG-OG 2.82Å; S290-W294 WeakPolarHBondContact O-CB 3.43Å; S290-W294 PolarHBondContact O-N 2.88Å; S290-W294 VanDerWaalsContact O-N 3.16Å
291	T	92	Very high	90.4	Very high	17 Å²	17	45.7 Å²	45.7	10%	0.104	26%	0.264	C	S	.	.	H	α-helix	trans	-75.9	-38.1	176.7	-65.5	0	0	0	0	111.3	V287 S288 E289 I295 L569 V572	V287-T291 HydrophobicContact CG1-CG2 3.66Å; S288-T291 PolarHBondContact O-N 3.48Å; S288-T291 VanDerWaalsContact O-N 3.17Å; S288-T291 PolarHBondContact OG-N 3.36Å; S288-T291 PolarHBondContact OG-OG1 3.18Å; E289-T291 VanDerWaalsContact C-N 3.28Å; E289-T291 PolarHBondContact O-N 2.91Å; T291-I295 HydrophobicContact CG2-CD1 4.13Å; T291-I295 VanDerWaalsContact O-CG1 3.27Å; T291-I295 WeakPolarHBondContact O-CG1 3.34Å; T291-I295 PolarHBondContact O-N 3.48Å; T291-I295 VanDerWaalsContact O-N 3.1Å; T291-L569 HydrophobicContact CG2-CD1 3.74Å; T291-V572 HydrophobicContact CG2-CG2 3.73Å
292	L	93.4	Very high	90.1	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-65.7	-44.6	173	178.6	59.4	0	0	0	111.1	L264 D268 W271 L272 S288 E289 W294 I295 M296 T583	L264-L292 HydrophobicContact CD1-CD2 4.48Å; L264-L292 HydrophobicContact CD2-CD2 4.27Å; L264-L292 HydrophobicContact CD2-CG 4.07Å; D268-L292 HydrophobicContact CB-CD2 4.36Å; W271-L292 HydrophobicContact CE3-CD1 4.4Å; W271-L292 HydrophobicContact CE3-CD2 4.13Å; W271-L292 HydrophobicContact CZ3-CD1 3.93Å; W271-L292 HydrophobicContact CZ3-CD2 4.34Å; L272-L292 HydrophobicContact CB-CD2 3.9Å; L272-L292 HydrophobicContact CD1-CD2 4.31Å; L272-L292 HydrophobicContact CD2-CB 4.4Å; L272-L292 HydrophobicContact CD2-CD2 4.15Å; L272-L292 HydrophobicContact CG-CD2 4.34Å; S288-L292 PolarHBondContact O-N 3.03Å; E289-L292 PolarHBondContact O-N 3.04Å; E289-L292 VanDerWaalsContact O-N 3.1Å; L292-W294 VanDerWaalsContact C-N 3.34Å; L292-W294 PolarHBondContact O-N 2.73Å; L292-I295 PolarHBondContact O-N 2.88Å; L292-M296 HydrophobicContact CD1-CG 3.94Å; L292-M296 HydrophobicContact CD1-SD 4.45Å; L292-M296 HydrophobicContact CG-CG 4.27Å; L292-M296 VanDerWaalsContact O-CG 3.27Å; L292-M296 WeakPolarHBondContact O-CG 3.23Å; L292-M296 PolarHBondContact O-N 2.86Å; L292-T583 HydrophobicContact CD1-CG2 3.57Å
293	E	93.4	Very high	89.7	Confident	69 Å²	69	40.1 Å²	40.1	32%	0.322	23%	0.227	S	C	.	.	H	α-helix	trans	-52.8	-49.7	176.7	-167.1	-169.6	116.2	0	0	111.7	V260 Y262 L264 E289 M296 D297	V260-E293 HydrophobicContact CG1-CG 4.02Å; V260-E293 WeakPolarHBondContact CG1-OE1 3.1Å; Y262-E293 WeakPolarHBondContact O-CG 3.29Å; L264-E293 HydrophobicContact CD2-CB 4.16Å; L264-E293 HydrophobicContact CG-CB 4.13Å; L264-E293 HydrophobicContact CG-CG 4.41Å; E289-E293 WeakPolarHBondContact O-CB 3.27Å; E289-E293 PolarHBondContact O-N 2.81Å; E293-M296 PolarHBondContact O-N 3.34Å; E293-D297 WeakPolarHBondContact O-CB 3.32Å; E293-D297 PolarHBondContact O-N 2.82Å
294	W	93.3	Very high	88.6	Confident	62 Å²	62	42.6 Å²	42.6	24%	0.235	22%	0.218	C	C	.	.	H	α-helix	trans	-64.1	-43.5	176.6	-177.3	93.5	0	0	0	112.8	S290 L292 M296 D297 R298 I565 K568 L569	S290-W294 WeakPolarHBondContact O-CB 3.43Å; S290-W294 PolarHBondContact O-N 2.88Å; S290-W294 VanDerWaalsContact O-N 3.16Å; L292-W294 VanDerWaalsContact C-N 3.34Å; L292-W294 PolarHBondContact O-N 2.73Å; W294-M296 VanDerWaalsContact C-N 3.33Å; W294-M296 PolarHBondContact O-N 2.85Å; W294-D297 PolarHBondContact O-N 3.15Å; W294-R298 HydrophobicContact CD2-CG 3.77Å; W294-R298 HydrophobicContact CE3-CG 4.01Å; W294-R298 HydrophobicContact CG-CG 4.44Å; W294-R298 HydrophobicContact CH2-CG 3.86Å; W294-R298 HydrophobicContact CZ2-CG 3.61Å; W294-R298 HydrophobicContact CZ3-CG 4.05Å; W294-R298 VanDerWaalsContact O-CG 3.31Å; W294-R298 WeakPolarHBondContact O-CG 3.05Å; W294-R298 PolarHBondContact O-N 3.44Å; W294-I565 HydrophobicContact CH2-CG2 4.23Å; W294-I565 HydrophobicContact CZ3-CG2 3.86Å; W294-K568 HydrophobicContact CH2-CB 3.74Å; W294-K568 HydrophobicContact CZ2-CB 3.97Å; W294-L569 HydrophobicContact CE3-CD1 4.38Å; W294-L569 HydrophobicContact CZ3-CB 4.44Å; W294-L569 HydrophobicContact CZ3-CD1 4.19Å
295	I	92.8	Very high	87	Confident	0 Å²	0	44 Å²	44	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-61.2	-43.9	177.9	-68.2	165.3	0	0	0	110.7	T291 L292 R298 F299 L569 F579 L580 T583	T291-I295 HydrophobicContact CG2-CD1 4.13Å; T291-I295 VanDerWaalsContact O-CG1 3.27Å; T291-I295 WeakPolarHBondContact O-CG1 3.34Å; T291-I295 PolarHBondContact O-N 3.48Å; T291-I295 VanDerWaalsContact O-N 3.1Å; L292-I295 PolarHBondContact O-N 2.88Å; I295-R298 PolarHBondContact O-N 3.18Å; I295-F299 HydrophobicContact CG2-CD2 3.71Å; I295-F299 HydrophobicContact CG2-CE2 3.34Å; I295-F299 HydrophobicContact CG2-CZ 3.89Å; I295-F299 PolarHBondContact O-N 3.46Å; I295-L569 HydrophobicContact CD1-CD1 3.82Å; I295-L569 HydrophobicContact CD1-CD2 4.2Å; I295-L569 HydrophobicContact CG1-CD1 3.93Å; I295-F579 HydrophobicContact CD1-CD1 4.33Å; I295-F579 HydrophobicContact CD1-CE1 3.64Å; I295-L580 HydrophobicContact CG2-CD1 3.81Å; I295-T583 HydrophobicContact CB-CG2 4.43Å; I295-T583 HydrophobicContact CG2-CG2 3.63Å
296	M	93	Very high	85.2	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-64.5	-43.5	179.4	-66.2	-67.5	-81.4	0	0	111.5	Y262 L292 E293 W294 E300 T583 F586 W587 K590 L599	Y262-M296 HydrophobicContact CD1-CB 3.99Å; Y262-M296 HydrophobicContact CD2-CB 3.76Å; Y262-M296 HydrophobicContact CE1-CB 4.03Å; Y262-M296 HydrophobicContact CE1-CG 4.38Å; Y262-M296 HydrophobicContact CE2-CB 3.78Å; Y262-M296 HydrophobicContact CE2-CE 4.13Å; Y262-M296 HydrophobicContact CG-CB 3.88Å; Y262-M296 VanDerWaalsContact OH-CE 3.3Å; Y262-M296 WeakPolarHBondContact OH-CE 3.43Å; L292-M296 HydrophobicContact CD1-CG 3.94Å; L292-M296 HydrophobicContact CD1-SD 4.45Å; L292-M296 HydrophobicContact CG-CG 4.27Å; L292-M296 VanDerWaalsContact O-CG 3.27Å; L292-M296 WeakPolarHBondContact O-CG 3.23Å; L292-M296 PolarHBondContact O-N 2.86Å; E293-M296 PolarHBondContact O-N 3.34Å; W294-M296 VanDerWaalsContact C-N 3.33Å; W294-M296 PolarHBondContact O-N 2.85Å; M296-E300 WeakPolarHBondContact O-CB 3.41Å; M296-E300 PolarHBondContact O-N 2.74Å; M296-T583 HydrophobicContact SD-CG2 4.2Å; M296-F586 HydrophobicContact CE-CD1 4.43Å; M296-F586 HydrophobicContact CE-CE1 4.43Å; M296-W587 HydrophobicContact CE-CB 4.22Å; M296-W587 HydrophobicContact SD-CB 3.88Å; M296-K590 HydrophobicContact CE-CD 4.11Å; M296-L599 HydrophobicContact CE-CD1 4.31Å
297	D	91.9	Very high	82.9	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-58.1	-45.8	172	177.5	81.2	0	0	0	112.5	V260 E261 E293 W294 E300 K301	V260-D297 HydrophobicContact CG1-CB 3.94Å; E261-D297 PolarHBondContact N-OD1 3.21Å; E293-D297 WeakPolarHBondContact O-CB 3.32Å; E293-D297 PolarHBondContact O-N 2.82Å; W294-D297 PolarHBondContact O-N 3.15Å; D297-E300 PolarHBondContact O-N 3.5Å; D297-K301 VanDerWaalsContact CG-NZ 3.32Å; D297-K301 WeakPolarHBondContact O-CG 3.31Å; D297-K301 PolarHBondContact O-N 3.43Å; D297-K301 WeakPolarHBondContact OD1-CE 3.4Å; D297-K301 IonicContact OD1-NZ 3.21Å; D297-K301 PolarHBondContact OD1-NZ 3.03Å; D297-K301 IonicContact OD2-NZ 2.69Å; D297-K301 PolarHBondContact OD2-NZ 3.13Å
298	R	91.1	Very high	80.3	Confident	36 Å²	36	56 Å²	56	14%	0.136	26%	0.26	C	S	.	.	H	α-helix	trans	-69.5	-42.8	-179	-65.8	-56.3	117.5	166.5	7	112.9	D257 E258 W294 I295 E300 K302 I565	D257-R298 VanDerWaalsContact O-CZ 3.3Å; D257-R298 PolarHBondContact O-NH1 2.81Å; D257-R298 PolarHBondContact O-NH2 2.8Å; E258-R298 PolarHBondContact O-NH2 3.4Å; W294-R298 HydrophobicContact CD2-CG 3.77Å; W294-R298 HydrophobicContact CE3-CG 4.01Å; W294-R298 HydrophobicContact CG-CG 4.44Å; W294-R298 HydrophobicContact CH2-CG 3.86Å; W294-R298 HydrophobicContact CZ2-CG 3.61Å; W294-R298 HydrophobicContact CZ3-CG 4.05Å; W294-R298 VanDerWaalsContact O-CG 3.31Å; W294-R298 WeakPolarHBondContact O-CG 3.05Å; W294-R298 PolarHBondContact O-N 3.44Å; I295-R298 PolarHBondContact O-N 3.18Å; R298-E300 VanDerWaalsContact C-N 3.27Å; R298-E300 PolarHBondContact O-N 3.3Å; R298-K302 VanDerWaalsContact O-CB 3.26Å; R298-K302 WeakPolarHBondContact O-CB 3.42Å; R298-K302 WeakPolarHBondContact O-CG 3.43Å; R298-K302 PolarHBondContact O-N 2.93Å; R298-I565 HydrophobicContact CB-CD1 3.8Å; R298-I565 HydrophobicContact CB-CG1 3.87Å; R298-I565 HydrophobicContact CB-CG2 4.39Å
299	F	91.7	Very high	77.4	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-58.4	-45.1	171.7	-73.9	-36.2	0	0	0	110.6	I295 K301 K302 A303 V557 I562 I565 L580 T583 Y584 W587	I295-F299 HydrophobicContact CG2-CD2 3.71Å; I295-F299 HydrophobicContact CG2-CE2 3.34Å; I295-F299 HydrophobicContact CG2-CZ 3.89Å; I295-F299 PolarHBondContact O-N 3.46Å; F299-K301 PolarHBondContact O-N 3.34Å; F299-K302 PolarHBondContact O-N 3.44Å; F299-A303 WeakPolarHBondContact O-CB 3.24Å; F299-A303 PolarHBondContact O-N 3.45Å; F299-V557 HydrophobicContact CB-CG2 4.21Å; F299-V557 HydrophobicContact CD1-CG1 4.42Å; F299-V557 HydrophobicContact CD1-CG2 4.01Å; F299-V557 HydrophobicContact CG-CG2 4.49Å; F299-I562 HydrophobicContact CE1-CG1 4.45Å; F299-I565 HydrophobicContact CD1-CD1 3.66Å; F299-I565 HydrophobicContact CE1-CD1 4.09Å; F299-L580 HydrophobicContact CE1-CD1 4.02Å; F299-L580 HydrophobicContact CE1-CG 4.39Å; F299-L580 HydrophobicContact CE2-CD1 4.21Å; F299-L580 HydrophobicContact CZ-CD1 3.43Å; F299-L580 VanDerWaalsContact CZ-CD1 3.43Å; F299-L580 HydrophobicContact CZ-CG 3.9Å; F299-T583 HydrophobicContact CE2-CG2 4.06Å; F299-Y584 HydrophobicContact CD1-CD2 4.18Å; F299-Y584 AromaticContact CE1-CD2 3.98Å; F299-Y584 HydrophobicContact CE1-CD2 3.98Å; F299-Y584 HydrophobicContact CE2-CD2 4.44Å; F299-Y584 HydrophobicContact CZ-CD2 4.12Å; F299-Y584 HydrophobicContact CZ-CG 4.36Å; F299-W587 HydrophobicContact CB-CD2 3.96Å; F299-W587 HydrophobicContact CB-CG 4.01Å; F299-W587 HydrophobicContact CD2-CB 4.04Å; F299-W587 HydrophobicContact CD2-CG 4.14Å; F299-W587 HydrophobicContact CG-CG 4.46Å
300	E	88.2	Confident	74.3	Confident	1 Å²	1	57.7 Å²	57.7	1%	0.005	28%	0.279	C	S	.	.	H	α-helix	trans	-68	-36.2	-173.2	-174.2	54.4	-162.8	0	0	113.7	M296 D297 R298 W587 R591 P598 L599 L600 L603	M296-E300 WeakPolarHBondContact O-CB 3.41Å; M296-E300 PolarHBondContact O-N 2.74Å; D297-E300 PolarHBondContact O-N 3.5Å; R298-E300 VanDerWaalsContact C-N 3.27Å; R298-E300 PolarHBondContact O-N 3.3Å; E300-W587 PolarHBondContact OE2-NE1 3.17Å; E300-R591 IonicContact OE1-CZ 3.2Å; E300-R591 IonicContact OE1-NE 3.2Å; E300-R591 PolarHBondContact OE1-NE 2.96Å; E300-R591 IonicContact OE1-NH2 3.85Å; E300-R591 PolarHBondContact OE1-NH2 3.12Å; E300-R591 IonicContact OE2-CZ 3.89Å; E300-R591 VanDerWaalsContact OE2-CZ 3.24Å; E300-R591 IonicContact OE2-NE 2.64Å; E300-R591 PolarHBondContact OE2-NE 2.8Å; E300-R591 IonicContact OE2-NH2 2.75Å; E300-R591 PolarHBondContact OE2-NH2 3.49Å; E300-P598 WeakPolarHBondContact OE1-CA 3.37Å; E300-P598 VanDerWaalsContact OE1-CB 3.23Å; E300-P598 WeakPolarHBondContact OE1-CB 3.24Å; E300-L599 HydrophobicContact CG-CB 4.05Å; E300-L599 PolarHBondContact OE1-N 3.31Å; E300-L600 HydrophobicContact CB-CD1 4.49Å; E300-L600 HydrophobicContact CB-CG 4.36Å; E300-L600 HydrophobicContact CG-CB 4.17Å; E300-L600 HydrophobicContact CG-CD1 4.07Å; E300-L600 HydrophobicContact CG-CG 3.63Å; E300-L603 HydrophobicContact CG-CD1 4.23Å; E300-L603 WeakPolarHBondContact O-CD1 3.37Å
301	K	85.6	Confident	71.3	Confident	23 Å²	23	61.8 Å²	61.8	10%	0.1	30%	0.296	C	S	.	.	H	α-helix	trans	-78.8	-34.9	172.6	-71.1	168.8	175.1	163.9	0	114	L256 D257 V259 E261 D297 F299 L600	L256-K301 PolarHBondContact O-NZ 3.13Å; D257-K301 PolarHBondContact O-NZ 3.32Å; V259-K301 PolarHBondContact O-NZ 3.45Å; E261-K301 WeakPolarHBondContact OE2-CE 3.4Å; E261-K301 IonicContact OE2-NZ 2.97Å; D297-K301 VanDerWaalsContact CG-NZ 3.32Å; D297-K301 WeakPolarHBondContact O-CG 3.31Å; D297-K301 PolarHBondContact O-N 3.43Å; D297-K301 WeakPolarHBondContact OD1-CE 3.4Å; D297-K301 IonicContact OD1-NZ 3.21Å; D297-K301 PolarHBondContact OD1-NZ 3.03Å; D297-K301 IonicContact OD2-NZ 2.69Å; D297-K301 PolarHBondContact OD2-NZ 3.13Å; F299-K301 PolarHBondContact O-N 3.34Å; K301-L600 HydrophobicContact CD-CD1 4.43Å; K301-L600 HydrophobicContact CG-CD1 3.83Å
302	K	83.5	Confident	68.2	Low	67 Å²	67	64.9 Å²	64.9	29%	0.291	33%	0.33	S	S	.	.	H	α-helix	trans	-87.2	-15.2	-177.3	-62.2	-48.9	-176.3	-157.9	0	113.5	D257 R298 F299 K561	D257-K302 IonicContact OD2-NZ 3.82Å; D257-K302 PolarHBondContact OD2-NZ 2.98Å; R298-K302 VanDerWaalsContact O-CB 3.26Å; R298-K302 WeakPolarHBondContact O-CB 3.42Å; R298-K302 WeakPolarHBondContact O-CG 3.43Å; R298-K302 PolarHBondContact O-N 2.93Å; F299-K302 PolarHBondContact O-N 3.44Å; K302-K561 HydrophobicContact CB-CB 4.5Å; K302-K561 HydrophobicContact CB-CD 4.2Å; K302-K561 VanDerWaalsContact O-CD 3.32Å; K302-K561 WeakPolarHBondContact O-CD 3.21Å; K302-K561 PolarHBondContact O-NZ 2.99Å
303	A	77.4	Confident	65	Low	15 Å²	15	71.1 Å²	71.1	12%	0.124	37%	0.372	C	S	.	.			trans	-60	134.4	170.8	0	0	0	0	0	111.9	F299 P555 V557 W587	F299-A303 WeakPolarHBondContact O-CB 3.24Å; F299-A303 PolarHBondContact O-N 3.45Å; A303-P555 HydrophobicContact CB-CB 3.84Å; A303-V557 HydrophobicContact CB-CG2 3.91Å; A303-W587 HydrophobicContact CB-CH2 3.54Å; A303-W587 HydrophobicContact CB-CZ2 3.54Å
304	R	62.7	Low	61.7	Low	169 Å²	169	75.1 Å²	75.1	64%	0.638	39%	0.391	S	S	*	.	B	Isolated β-bridge	trans	-123.8	158.1	166.9	-68.9	-178.6	-179.5	156.6	-5.9	107.7	P555 I556	R304-P555 CarbonylContact O-C 3.44Å; R304-P555 VanDerWaalsContact O-CA 3.26Å; R304-P555 WeakPolarHBondContact O-CA 3.21Å; R304-P555 WeakPolarHBondContact O-CB 3.41Å; R304-I556 PolarHBondContact N-O 3Å; R304-I556 VanDerWaalsContact N-O 3.13Å; R304-I556 PolarHBondContact O-N 2.86Å; R304-I556 VanDerWaalsContact O-O 3.1Å
305	F	54.7	Low	58.6	Low	78 Å²	78	77.9 Å²	77.9	34%	0.342	42%	0.415	S	S	.	.			trans	-59.5	155.5	163.6	-70.1	-84.4	0	0	0	109	L307 C553 P555	F305-L307 VanDerWaalsContact C-N 3.26Å; F305-L307 PolarHBondContact O-N 3.24Å; F305-C553 HydrophobicContact CD1-CB 4.38Å; F305-C553 HydrophobicContact CE1-CB 4.49Å; F305-P555 HydrophobicContact CD1-CG 3.8Å; F305-P555 HydrophobicContact CD2-CG 4.14Å; F305-P555 HydrophobicContact CE1-CG 3.6Å; F305-P555 HydrophobicContact CE2-CG 3.94Å; F305-P555 HydrophobicContact CG-CG 4.07Å; F305-P555 HydrophobicContact CZ-CG 3.67Å
306	R	48.6	Very low	55.6	Low	145 Å²	145	83.6 Å²	83.6	55%	0.547	45%	0.45	S	S	.	.			trans	-67.5	92.4	169.2	-86.5	-174	177.6	170.4	-0.7	108.5	F308 I556	R306-F308 HydrophobicContact CB-CD2 4.04Å; R306-F308 HydrophobicContact CB-CE2 3.9Å; R306-F308 PolarHBondContact O-N 3.38Å; R306-I556 HydrophobicContact CG-CD1 4.12Å
307	L	41.6	Very low	52.5	Low	109 Å²	109	91.1 Å²	91.1	57%	0.571	49%	0.491	S	S	*	.			trans	-55.6	117	145.6	-72.5	161.6	0	0	0	105.9	F305 T309	F305-L307 VanDerWaalsContact C-N 3.26Å; F305-L307 PolarHBondContact O-N 3.24Å; L307-T309 PolarHBondContact O-N 3.19Å; L307-T309 VanDerWaalsContact O-N 3.16Å
308	F	35.4	Very low	49.7	Very low	150 Å²	150	98.1 Å²	98.1	66%	0.658	53%	0.533	S	S	*	.			trans	-84	45.5	172.4	-86	-92	0	0	0	110.2	R306 S310	R306-F308 HydrophobicContact CB-CD2 4.04Å; R306-F308 HydrophobicContact CB-CE2 3.9Å; R306-F308 PolarHBondContact O-N 3.38Å; F308-S310 PolarHBondContact O-N 3.24Å
309	T	30.8	Very low	46.9	Very low	117 Å²	117	104 Å²	104	72%	0.718	57%	0.566	S	S	*	*			trans	-76.3	118.1	160.3	29.2	0	0	0	0	108.2	L307	L307-T309 PolarHBondContact O-N 3.19Å; L307-T309 VanDerWaalsContact O-N 3.16Å
310	S	29.1	Very low	44.1	Very low	80 Å²	80	109.2 Å²	109.2	56%	0.559	60%	0.6	S	S	*	*			trans	-63.5	141	-179.4	50.2	0	0	0	0	112.4	F308	F308-S310 PolarHBondContact O-N 3.24Å
311	N	27.3	Very low	41.1	Very low	160 Å²	160	116.4 Å²	116.4	86%	0.856	64%	0.638	S	S	*	*	S	Bend	trans	50.1	74.2	153.3	-59.1	-12.3	0	0	0	117.5
312	G	26.3	Very low	38.4	Very low	81 Å²	81	123 Å²	123	84%	0.835	67%	0.673	S	S	*	*			trans	42.7	100.7	137.1	0	0	0	0	0	119.4
313	C	25.9	Very low	35.6	Very low	131 Å²	131	123.7 Å²	123.7	89%	0.885	70%	0.7	S	S	*	*			trans	-132.6	149.2	139.5	-150.3	0	0	0	0	109.8
314	E	25.8	Very low	33.1	Very low	153 Å²	153	126.1 Å²	126.1	72%	0.715	73%	0.726	S	S	*	*			trans	-86.4	145.2	159.8	-58.9	176.1	151	0	0	105.3
315	T	27.3	Very low	31.3	Very low	121 Å²	121	125.1 Å²	125.1	74%	0.742	73%	0.733	S	S	*	*				-167.4	167	68.7	46.4	0	0	0	0	112.2
316	T	29.2	Very low	30.2	Very low	120 Å²	120	130.2 Å²	130.2	74%	0.736	76%	0.758	S	S	*	*			trans	24.6	129.2	150.1	55	0	0	0	0	122.1
317	D	27.7	Very low	29.3	Very low	158 Å²	158	128.9 Å²	128.9	85%	0.845	77%	0.77	S	S	*	*			trans	-46.1	126.9	162.8	-38.4	-95.8	0	0	0	114.3
318	V	34.8	Very low	29	Very low	146 Å²	146	125.8 Å²	125.8	89%	0.885	77%	0.765	S	S	*	*			trans	177.9	142.1	147.8	144.9	0	0	0	0	109.3
319	L	30.6	Very low	28.9	Very low	160 Å²	160	124.3 Å²	124.3	84%	0.838	76%	0.763	S	S	*	*			trans	-104.1	163.9	170.6	-77.5	165.4	0	0	0	109.1
320	P	33.4	Very low	29.7	Very low	109 Å²	109	124.4 Å²	124.4	71%	0.708	76%	0.759	S	S	*	*			cis	-139.3	-175.2	15.2	42.2	-23.8	0	0	0	116.4
321	D	26.2	Very low	30.7	Very low	152 Å²	152	129.3 Å²	129.3	81%	0.813	77%	0.773	S	S	*	*			trans	75.2	165.4	145.8	-132.4	-26.4	0	0	0	120.6
322	I	28.4	Very low	32.3	Very low	162 Å²	162	127.1 Å²	127.1	83%	0.831	76%	0.761	S	S	*	*			trans	69.9	118	-178.2	-50	176.9	0	0	0	114.4
323	G	24.4	Very low	34.5	Very low	82 Å²	82	124.2 Å²	124.2	85%	0.845	73%	0.729	S	S	*	*			trans	-87.7	150.1	-174.4	0	0	0	0	0	115.5
324	G	24.7	Very low	37.3	Very low	65 Å²	65	120.4 Å²	120.4	67%	0.67	70%	0.702	S	S	*	*			trans	176.8	123.5	170.1	0	0	0	0	0	113.3
325	N	25.6	Very low	40.4	Very low	149 Å²	149	113.1 Å²	113.1	80%	0.797	67%	0.668	S	S	*	*			trans	22.4	104.3	166.9	-65.6	-5.2	0	0	0	119.1
326	H	31.7	Very low	43.4	Very low	185 Å²	185	108.6 Å²	108.6	86%	0.856	64%	0.642	S	S	*	*			trans	-115.8	69.5	157.3	-79.1	-7.1	0	0	0	111.3	G328	H326-G328 VanDerWaalsContact C-N 3.34Å; H326-G328 PolarHBondContact O-N 3.38Å
327	S	30.1	Very low	46.3	Very low	116 Å²	116	103.2 Å²	103.2	81%	0.811	61%	0.61	S	S	*	*			trans	-68.2	84.6	173.7	-52.8	0	0	0	0	111.1
328	G	33.5	Very low	49.2	Very low	45 Å²	45	98.6 Å²	98.6	46%	0.464	59%	0.589	S	S	.	*			trans	-152.6	16.6	178.2	0	0	0	0	0	113.9	H326	H326-G328 VanDerWaalsContact C-N 3.34Å; H326-G328 PolarHBondContact O-N 3.38Å
329	I	35.1	Very low	51.5	Low	118 Å²	118	94.9 Å²	94.9	61%	0.605	56%	0.562	S	S	*	*	S	Bend	trans	-77.2	139.1	169.3	-57.9	173.1	0	0	0	107.3	E331 F351	I329-E331 PolarHBondContact O-N 2.76Å; I329-E331 VanDerWaalsContact O-N 3.11Å; I329-F351 HydrophobicContact CG2-CE2 4.43Å; I329-F351 HydrophobicContact CG2-CZ 4.39Å
330	D	46.7	Very low	54.1	Low	119 Å²	119	91 Å²	91	64%	0.636	54%	0.542	S	S	*	.			trans	-68.2	101.8	170.6	-165.7	10.9	0	0	0	107.9	D332 A333	D330-D332 PolarHBondContact O-N 2.8Å; D330-D332 VanDerWaalsContact O-N 3.07Å; D330-A333 HydrophobicContact CB-CB 4.38Å; D330-A333 WeakPolarHBondContact O-CB 3.48Å; D330-A333 PolarHBondContact O-N 3.21Å
331	E	49.2	Very low	56.4	Low	184 Å²	184	87.4 Å²	87.4	86%	0.86	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-15.9	-170.4	-65.3	-170.4	166.3	0	0	113.2	I329 A333	I329-E331 PolarHBondContact O-N 2.76Å; I329-E331 VanDerWaalsContact O-N 3.11Å; E331-A333 VanDerWaalsContact C-N 3.29Å; E331-A333 PolarHBondContact O-N 3.34Å
332	D	61.1	Low	59.1	Low	114 Å²	114	84 Å²	84	61%	0.61	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.1	4.1	172.1	-75.4	-28.9	0	0	0	113.7	D330 V334	D330-D332 PolarHBondContact O-N 2.8Å; D330-D332 VanDerWaalsContact O-N 3.07Å; D332-V334 PolarHBondContact O-N 3Å
333	A	72.2	Confident	61.5	Low	19 Å²	19	79.8 Å²	79.8	16%	0.157	49%	0.494	C	S	.	.			trans	-77.6	77.3	-170.1	0	0	0	0	0	115.7	D330 E331 F351	D330-A333 HydrophobicContact CB-CB 4.38Å; D330-A333 WeakPolarHBondContact O-CB 3.48Å; D330-A333 PolarHBondContact O-N 3.21Å; E331-A333 VanDerWaalsContact C-N 3.29Å; E331-A333 PolarHBondContact O-N 3.34Å; A333-F351 HydrophobicContact CB-CE1 3.93Å; A333-F351 HydrophobicContact CB-CZ 3.65Å
334	V	85.3	Confident	64.1	Low	51 Å²	51	81.3 Å²	81.3	31%	0.309	48%	0.479	S	S	.	.			trans	-64.6	143.5	177.7	-62.4	0	0	0	0	115.3	D332	D332-V334 PolarHBondContact O-N 3Å
335	C	91.7	Very high	66.5	Low	1 Å²	1	86 Å²	86	1%	0.007	49%	0.489	C	S	.	.			trans	-67.2	129.3	175.4	165.8	0	0	0	0	112.9	V337 Q339 D340 H360	C335-V337 PolarHBondContact O-N 2.97Å; C335-V337 PolarHBondContact SG-N 3.26Å; C335-V337 VanDerWaalsContact SG-N 3.44Å; C335-Q339 VanDerWaalsContact O-CA 3.25Å; C335-Q339 WeakPolarHBondContact O-CA 3.27Å; C335-Q339 PolarHBondContact O-N 2.99Å; C335-D340 WeakPolarHBondContact CB-O 3.42Å; C335-D340 PolarHBondContact N-O 2.77Å; C335-H360 WeakPolarHBondContact CB-CE1 3.46Å; C335-H360 WeakPolarHBondContact CB-ND1 3.49Å; C335-H360 PolarHBondContact SG-N 3.04Å; C335-H360 VanDerWaalsContact SG-N 3.38Å; C335-H360 PolarHBondContact SG-ND1 3.22Å
336	A	89.2	Confident	69.2	Low	25 Å²	25	83.8 Å²	83.8	21%	0.207	48%	0.481	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.9	1.9	-176.9	0	0	0	0	0	115.8	L357 A358 V359 Q474	A336-L357 HydrophobicContact CB-CD1 3.66Å; A336-A358 WeakPolarHBondContact CB-O 3.14Å; A336-A358 PolarHBondContact N-O 3.39Å; A336-V359 HydrophobicContact CB-CG1 4.27Å; A336-Q474 PolarHBondContact O-NE2 2.99Å
337	V	90.3	Very high	71.8	Confident	8 Å²	8	75.9 Å²	75.9	5%	0.048	45%	0.445	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.6	-54.9	178.7	177.7	0	0	0	0	111.8	C335 V359 C363 A398 V410 I411 L414	C335-V337 PolarHBondContact O-N 2.97Å; C335-V337 PolarHBondContact SG-N 3.26Å; C335-V337 VanDerWaalsContact SG-N 3.44Å; V337-V359 HydrophobicContact CG2-CG1 3.87Å; V337-C363 HydrophobicContact CB-CB 3.95Å; V337-C363 HydrophobicContact CG1-CB 4.12Å; V337-C363 HydrophobicContact CG2-CB 4.41Å; V337-A398 HydrophobicContact CG2-CB 3.56Å; V337-V410 HydrophobicContact CG1-CG1 4.44Å; V337-V410 HydrophobicContact CG2-CB 4.29Å; V337-I411 HydrophobicContact CG1-CB 4.48Å; V337-I411 WeakPolarHBondContact O-CD1 3.38Å; V337-L414 HydrophobicContact CG1-CD1 3.82Å
338	C	89.1	Confident	74.6	Confident	60 Å²	60	72.3 Å²	72.3	41%	0.405	42%	0.418	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.9	-20.6	-179.8	60.7	0	0	0	0	114	D340 H360	C338-D340 VanDerWaalsContact C-N 3.26Å; C338-D340 PolarHBondContact SG-N 3.25Å; C338-D340 VanDerWaalsContact SG-N 3.39Å; C338-H360 PolarHBondContact SG-CE1 3.29Å; C338-H360 PolarHBondContact SG-ND1 2.87Å
339	Q	83.1	Confident	77.3	Confident	68 Å²	68	71.3 Å²	71.3	32%	0.318	40%	0.402	S	S	.	.			trans	70	8.6	-169.5	-48.4	179.9	109.7	0	0	115.8	C335 Q474	C335-Q339 VanDerWaalsContact O-CA 3.25Å; C335-Q339 WeakPolarHBondContact O-CA 3.27Å; C335-Q339 PolarHBondContact O-N 2.99Å; Q339-Q474 VanDerWaalsContact CD-CG 3.4Å; Q339-Q474 HydrophobicContact CG-CG 3.83Å; Q339-Q474 VanDerWaalsContact OE1-CG 3.3Å; Q339-Q474 PolarHBondContact OE1-O 2.8Å; Q339-Q474 VanDerWaalsContact OE1-O 3.13Å
340	D	84.6	Confident	79.9	Confident	78 Å²	78	66.3 Å²	66.3	42%	0.417	38%	0.376	S	S	.	.			trans	-84.4	149.2	171.7	-161.7	-5.3	0	0	0	111.2	C335 C338 T342 H360	C335-D340 WeakPolarHBondContact CB-O 3.42Å; C335-D340 PolarHBondContact N-O 2.77Å; C338-D340 VanDerWaalsContact C-N 3.26Å; C338-D340 PolarHBondContact SG-N 3.25Å; C338-D340 VanDerWaalsContact SG-N 3.39Å; D340-T342 WeakPolarHBondContact OD1-CG2 3.22Å; D340-T342 PolarHBondContact OD1-N 3.1Å; D340-T342 PolarHBondContact OD1-OG1 3.16Å; D340-T342 WeakPolarHBondContact OD2-CG2 3.23Å; D340-T342 PolarHBondContact OD2-OG1 2.75Å; D340-H360 PolarHBondContact O-CE1 3.5Å
341	G	82.7	Confident	81.9	Confident	34 Å²	34	63.9 Å²	63.9	35%	0.351	36%	0.36	S	S	.	.			trans	-107.2	-3.4	173.7	0	0	0	0	0	113.9	C343	G341-C343 PolarHBondContact O-N 2.87Å
342	T	83.3	Confident	83.7	Confident	80 Å²	80	55.1 Å²	55.1	49%	0.491	32%	0.319	S	S	.	.			trans	-51.2	137.7	169.6	53.4	0	0	0	0	110.9	D340 H360	D340-T342 WeakPolarHBondContact OD1-CG2 3.22Å; D340-T342 PolarHBondContact OD1-N 3.1Å; D340-T342 PolarHBondContact OD1-OG1 3.16Å; D340-T342 WeakPolarHBondContact OD2-CG2 3.23Å; D340-T342 PolarHBondContact OD2-OG1 2.75Å; T342-H360 PolarHBondContact O-CD2 2.78Å; T342-H360 PolarHBondContact O-NE2 3.1Å
343	C	78.4	Confident	84.5	Confident	75 Å²	75	52 Å²	52	51%	0.507	30%	0.302	S	S	.	.			trans	-134.9	104.1	-180	-174.2	0	0	0	0	109.8	G341 I349	G341-C343 PolarHBondContact O-N 2.87Å; C343-I349 HydrophobicContact CB-CD1 4.4Å; C343-I349 HydrophobicContact CB-CG1 4.36Å
344	E	77.7	Confident	84.3	Confident	114 Å²	114	52.2 Å²	52.2	53%	0.533	30%	0.302	S	S	.	.	B	Isolated β-bridge	trans	-91.2	148.8	177.4	-60.5	-180	165.7	0	0	110.9	T346 N347 V348	E344-T346 PolarHBondContact O-N 2.81Å; E344-T346 VanDerWaalsContact O-N 3.1Å; E344-N347 HydrophobicContact CB-CB 4.31Å; E344-N347 CarbonylContact O-C 3.57Å; E344-N347 PolarHBondContact O-N 2.87Å; E344-V348 WeakPolarHBondContact O-CG1 3.36Å; E344-V348 PolarHBondContact O-N 3.11Å
345	N	76.6	Confident	83.7	Confident	163 Å²	163	52.2 Å²	52.2	87%	0.872	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-26.4	177.6	-62.3	64.9	0	0	0	113.4
346	T	81.7	Confident	83.3	Confident	103 Å²	103	56.8 Å²	56.8	63%	0.632	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.6	-20.3	177.2	36.5	0	0	0	0	114.1	E344	E344-T346 PolarHBondContact O-N 2.81Å; E344-T346 VanDerWaalsContact O-N 3.1Å
347	N	87.1	Confident	83.1	Confident	19 Å²	19	56.4 Å²	56.4	10%	0.102	32%	0.322	C	S	.	.	B	Isolated β-bridge	trans	-138.8	52.3	-168.9	-161.4	7	0	0	0	110.9	E344 H360 E362	E344-N347 HydrophobicContact CB-CB 4.31Å; E344-N347 CarbonylContact O-C 3.57Å; E344-N347 PolarHBondContact O-N 2.87Å; N347-H360 PolarHBondContact O-CD2 3.42Å; N347-E362 VanDerWaalsContact ND2-CD 3.29Å; N347-E362 PolarHBondContact ND2-OE2 2.92Å; N347-E362 WeakPolarHBondContact OD1-CB 3.49Å; N347-E362 VanDerWaalsContact OD1-CG 3.3Å; N347-E362 WeakPolarHBondContact OD1-CG 3.41Å; N347-E362 PolarHBondContact OD1-N 2.99Å
348	V	89	Confident	83.1	Confident	41 Å²	41	56.6 Å²	56.6	25%	0.248	32%	0.324	C	S	.	.			trans	-64	150.8	-170.5	-64.5	0	0	0	0	113.3	E344 L350 H360 Q361 V369	E344-V348 WeakPolarHBondContact O-CG1 3.36Å; E344-V348 PolarHBondContact O-N 3.11Å; V348-L350 HydrophobicContact CG2-CD2 3.77Å; V348-L350 HydrophobicContact CG2-CG 4.38Å; V348-L350 PolarHBondContact O-N 2.88Å; V348-H360 WeakPolarHBondContact O-CA 3.46Å; V348-Q361 PolarHBondContact O-N 2.91Å; V348-V369 HydrophobicContact CG2-CG2 3.89Å
349	I	89.7	Confident	83.3	Confident	23 Å²	23	53.7 Å²	53.7	12%	0.118	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	113.6	172.3	-61.7	-179.3	0	0	0	109.5	C343 F351 A358	C343-I349 HydrophobicContact CB-CD1 4.4Å; C343-I349 HydrophobicContact CB-CG1 4.36Å; I349-F351 HydrophobicContact CG2-CE2 3.98Å; I349-F351 HydrophobicContact CG2-CZ 4.13Å; I349-A358 HydrophobicContact CG2-CB 3.94Å
350	L	89.6	Confident	83.7	Confident	13 Å²	13	50.9 Å²	50.9	7%	0.068	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	130.4	-179.2	-60.2	177.4	0	0	0	111.4	V348 L357 A358 V359 Q361 V366 V369 W374	V348-L350 HydrophobicContact CG2-CD2 3.77Å; V348-L350 HydrophobicContact CG2-CG 4.38Å; V348-L350 PolarHBondContact O-N 2.88Å; L350-L357 VanDerWaalsContact O-O 3.11Å; L350-A358 WeakPolarHBondContact O-CA 3.48Å; L350-V359 PolarHBondContact N-O 3.45Å; L350-V359 PolarHBondContact O-N 3.35Å; L350-Q361 HydrophobicContact CD1-CB 4.27Å; L350-V366 HydrophobicContact CD1-CB 4Å; L350-V366 HydrophobicContact CD1-CG1 3.8Å; L350-V366 HydrophobicContact CD1-CG2 3.99Å; L350-V369 HydrophobicContact CD2-CB 4.49Å; L350-V369 HydrophobicContact CD2-CG1 3.77Å; L350-V369 HydrophobicContact CD2-CG2 3.94Å; L350-W374 HydrophobicContact CB-CD2 4.08Å; L350-W374 HydrophobicContact CB-CE3 3.89Å; L350-W374 HydrophobicContact CB-CH2 4.31Å; L350-W374 HydrophobicContact CB-CZ2 4.48Å; L350-W374 HydrophobicContact CB-CZ3 3.99Å; L350-W374 HydrophobicContact CD1-CD2 4.34Å; L350-W374 HydrophobicContact CD1-CZ2 4.35Å
351	F	88.8	Confident	84	Confident	68 Å²	68	48.7 Å²	48.7	30%	0.298	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	125	177.4	-64.5	-97.9	0	0	0	110.8	I329 A333 I349 D353 L357 A358	I329-F351 HydrophobicContact CG2-CE2 4.43Å; I329-F351 HydrophobicContact CG2-CZ 4.39Å; A333-F351 HydrophobicContact CB-CE1 3.93Å; A333-F351 HydrophobicContact CB-CZ 3.65Å; I349-F351 HydrophobicContact CG2-CE2 3.98Å; I349-F351 HydrophobicContact CG2-CZ 4.13Å; F351-D353 PolarHBondContact O-N 3.42Å; F351-L357 WeakPolarHBondContact CA-O 3.45Å; F351-A358 HydrophobicContact CD1-CB 3.97Å; F351-A358 HydrophobicContact CE1-CB 3.77Å; F351-A358 HydrophobicContact CZ-CB 4.33Å
352	C	85.5	Confident	84.4	Confident	0 Å²	0	53 Å²	53	0%	0	29%	0.29	C	S	.	.			trans	-79.9	112.6	178.1	174.8	0	0	0	0	112.1	V354 C355 N356 L357 W374 C376	C352-V354 PolarHBondContact O-N 3.39Å; C352-C355 PolarHBondContact O-N 2.93Å; C352-N356 WeakPolarHBondContact O-CA 3.47Å; C352-N356 PolarHBondContact O-N 3.14Å; C352-L357 HydrophobicContact CB-CB 4.09Å; C352-L357 PolarHBondContact N-O 3.09Å; C352-W374 WeakPolarHBondContact CA-O 3.39Å; C352-W374 HydrophobicContact CB-CE3 3.91Å; C352-W374 HydrophobicContact CB-CZ3 3.65Å; C352-C376 HydrophobicContact CB-CB 4.09Å; C352-C376 PolarHBondContact SG-N 3.15Å; C352-C376 VanDerWaalsContact SG-N 3.36Å
353	D	78.6	Confident	84.8	Confident	49 Å²	49	50.6 Å²	50.6	26%	0.262	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.6	-22.6	-173.8	-61.5	-75	0	0	0	115.9	F351 P373 W374 L375	F351-D353 PolarHBondContact O-N 3.42Å; D353-P373 WeakPolarHBondContact OD2-CA 3.2Å; D353-P373 WeakPolarHBondContact OD2-CB 3.42Å; D353-W374 PolarHBondContact N-O 2.85Å; D353-W374 PolarHBondContact OD2-N 3.2Å; D353-W374 VanDerWaalsContact OD2-O 3.13Å; D353-L375 HydrophobicContact CB-CD2 4.25Å
354	V	67.9	Low	85.6	Confident	24 Å²	24	47.3 Å²	47.3	15%	0.145	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.8	-20.3	-176.9	172.4	0	0	0	0	112.8	C352 L375 C379 C553	C352-V354 PolarHBondContact O-N 3.39Å; V354-L375 HydrophobicContact CB-CD2 4.12Å; V354-L375 HydrophobicContact CG2-CD2 3.54Å; V354-C379 HydrophobicContact CB-CB 3.97Å; V354-C379 HydrophobicContact CG1-CB 4.01Å; V354-C553 WeakPolarHBondContact O-CB 3.25Å
355	C	73.9	Confident	86.2	Confident	51 Å²	51	42.1 Å²	42.1	35%	0.345	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-141.3	4.2	-176.5	71.1	0	0	0	0	116.5	C352 L357 C379	C352-C355 PolarHBondContact O-N 2.93Å; C355-L357 PolarHBondContact O-N 3.42Å; C355-C379 PolarHBondContact SG-SG 3.04Å
356	N	81.5	Confident	86.9	Confident	97 Å²	97	35.2 Å²	35.2	52%	0.519	19%	0.194	S	C	.	.			trans	50.5	36.5	-177.3	-147.4	57.1	0	0	0	114.3	C352 A358	C352-N356 WeakPolarHBondContact O-CA 3.47Å; C352-N356 PolarHBondContact O-N 3.14Å; N356-A358 PolarHBondContact O-N 2.74Å
357	L	86.1	Confident	87.2	Confident	16 Å²	16	33.2 Å²	33.2	8%	0.084	18%	0.183	C	C	.	.			trans	-73.7	112.2	168.2	174.9	70	0	0	0	108.4	A336 L350 F351 C352 C355 V359 C376 A398	A336-L357 HydrophobicContact CB-CD1 3.66Å; L350-L357 VanDerWaalsContact O-O 3.11Å; F351-L357 WeakPolarHBondContact CA-O 3.45Å; C352-L357 HydrophobicContact CB-CB 4.09Å; C352-L357 PolarHBondContact N-O 3.09Å; C355-L357 PolarHBondContact O-N 3.42Å; L357-V359 HydrophobicContact CD1-CG1 4.21Å; L357-V359 HydrophobicContact CD2-CG1 4.4Å; L357-V359 HydrophobicContact CG-CG1 4.14Å; L357-C376 HydrophobicContact CD2-CB 3.75Å; L357-A398 HydrophobicContact CD1-CB 4.25Å; L357-A398 HydrophobicContact CD2-CB 4.15Å
358	A	90.6	Very high	87.1	Confident	12 Å²	12	40 Å²	40	10%	0.099	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	128.4	168.4	0	0	0	0	0	110.6	A336 I349 L350 F351 N356	A336-A358 WeakPolarHBondContact CB-O 3.14Å; A336-A358 PolarHBondContact N-O 3.39Å; I349-A358 HydrophobicContact CG2-CB 3.94Å; L350-A358 WeakPolarHBondContact O-CA 3.48Å; F351-A358 HydrophobicContact CD1-CB 3.97Å; F351-A358 HydrophobicContact CE1-CB 3.77Å; F351-A358 HydrophobicContact CZ-CB 4.33Å; N356-A358 PolarHBondContact O-N 2.74Å
359	V	92.2	Very high	86.9	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	143.5	174.5	-75.9	0	0	0	0	111	A336 V337 L350 L357 Y364 W374 A398	A336-V359 HydrophobicContact CB-CG1 4.27Å; V337-V359 HydrophobicContact CG2-CG1 3.87Å; L350-V359 PolarHBondContact N-O 3.45Å; L350-V359 PolarHBondContact O-N 3.35Å; L357-V359 HydrophobicContact CD1-CG1 4.21Å; L357-V359 HydrophobicContact CD2-CG1 4.4Å; L357-V359 HydrophobicContact CG-CG1 4.14Å; V359-Y364 HydrophobicContact CG1-CD2 4.49Å; V359-Y364 HydrophobicContact CG2-CD2 4.3Å; V359-Y364 HydrophobicContact CG2-CG 3.98Å; V359-W374 HydrophobicContact CG2-CH2 3.54Å; V359-W374 HydrophobicContact CG2-CZ2 4.35Å; V359-W374 HydrophobicContact CG2-CZ3 4.18Å; V359-A398 HydrophobicContact CG1-CB 3.89Å
360	H	91.9	Very high	86.4	Confident	8 Å²	8	42.4 Å²	42.4	4%	0.037	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.2	148.4	166.2	-56	95.5	0	0	0	111.4	C335 C338 D340 T342 N347 V348 E362 C363 Y364	C335-H360 WeakPolarHBondContact CB-CE1 3.46Å; C335-H360 WeakPolarHBondContact CB-ND1 3.49Å; C335-H360 PolarHBondContact SG-N 3.04Å; C335-H360 VanDerWaalsContact SG-N 3.38Å; C335-H360 PolarHBondContact SG-ND1 3.22Å; C338-H360 PolarHBondContact SG-CE1 3.29Å; C338-H360 PolarHBondContact SG-ND1 2.87Å; D340-H360 PolarHBondContact O-CE1 3.5Å; T342-H360 PolarHBondContact O-CD2 2.78Å; T342-H360 PolarHBondContact O-NE2 3.1Å; N347-H360 PolarHBondContact O-CD2 3.42Å; V348-H360 WeakPolarHBondContact O-CA 3.46Å; H360-E362 VanDerWaalsContact C-N 3.35Å; H360-E362 PolarHBondContact O-N 3Å; H360-C363 HydrophobicContact CB-CB 3.86Å; H360-C363 PolarHBondContact O-N 2.89Å; H360-Y364 PolarHBondContact O-N 3.45Å
361	Q	90.7	Very high	85.6	Confident	32 Å²	32	52.1 Å²	52.1	15%	0.15	27%	0.27	C	S	.	.	H	α-helix	trans	-48.4	-52.3	175.3	-179.6	173.8	-24.2	0	0	112.2	V348 L350 G365 V366 V369	V348-Q361 PolarHBondContact O-N 2.91Å; L350-Q361 HydrophobicContact CD1-CB 4.27Å; Q361-G365 PolarHBondContact O-N 2.83Å; Q361-V366 HydrophobicContact CG-CB 4.04Å; Q361-V366 HydrophobicContact CG-CG1 4.37Å; Q361-V366 WeakPolarHBondContact CG-O 3.32Å; Q361-V366 PolarHBondContact NE2-O 3.48Å; Q361-V366 PolarHBondContact O-N 2.96Å; Q361-V369 VanDerWaalsContact OE1-CG2 3.27Å
362	E	91.2	Very high	84.9	Confident	126 Å²	126	50.7 Å²	50.7	59%	0.589	27%	0.274	S	S	*	.	H	α-helix	trans	-71.2	-42.9	178.4	-67.3	175	169.7	0	0	112.6	N347 H360 Y364 G365 L427	N347-E362 VanDerWaalsContact ND2-CD 3.29Å; N347-E362 PolarHBondContact ND2-OE2 2.92Å; N347-E362 WeakPolarHBondContact OD1-CB 3.49Å; N347-E362 VanDerWaalsContact OD1-CG 3.3Å; N347-E362 WeakPolarHBondContact OD1-CG 3.41Å; N347-E362 PolarHBondContact OD1-N 2.99Å; H360-E362 VanDerWaalsContact C-N 3.35Å; H360-E362 PolarHBondContact O-N 3Å; E362-Y364 PolarHBondContact O-N 3.31Å; E362-G365 PolarHBondContact O-N 3.3Å; E362-L427 WeakPolarHBondContact O-CD1 3.46Å
363	C	92.8	Very high	84.5	Confident	29 Å²	29	54 Å²	54	20%	0.196	30%	0.296	C	S	.	.	H	α-helix	trans	-57.9	-19.3	179.6	-81.4	0	0	0	0	113.8	V337 H360 V410	V337-C363 HydrophobicContact CB-CB 3.95Å; V337-C363 HydrophobicContact CG1-CB 4.12Å; V337-C363 HydrophobicContact CG2-CB 4.41Å; H360-C363 HydrophobicContact CB-CB 3.86Å; H360-C363 PolarHBondContact O-N 2.89Å; C363-V410 WeakPolarHBondContact O-CG1 3.36Å
364	Y	94	Very high	84.8	Confident	5 Å²	5	53 Å²	53	2%	0.02	29%	0.288	C	S	.	.	H	α-helix	trans	-109.5	-8.4	174.1	-161.9	-107.3	0	0	0	114.3	V359 H360 E362 V366 W374 C376 R377 A398 F399 K400 V410	V359-Y364 HydrophobicContact CG1-CD2 4.49Å; V359-Y364 HydrophobicContact CG2-CD2 4.3Å; V359-Y364 HydrophobicContact CG2-CG 3.98Å; H360-Y364 PolarHBondContact O-N 3.45Å; E362-Y364 PolarHBondContact O-N 3.31Å; Y364-V366 HydrophobicContact CD1-CG2 3.81Å; Y364-W374 HydrophobicContact CD1-CH2 4.1Å; Y364-W374 AromaticContact CD1-CZ2 3.63Å; Y364-W374 HydrophobicContact CD1-CZ2 3.63Å; Y364-W374 HydrophobicContact CE1-CH2 4.29Å; Y364-W374 AromaticContact CE1-CZ2 3.9Å; Y364-W374 HydrophobicContact CE1-CZ2 3.9Å; Y364-W374 HydrophobicContact CG-CZ2 4.43Å; Y364-C376 HydrophobicContact CE1-CB 4.19Å; Y364-R377 HydrophobicContact CE1-CG 4.27Å; Y364-R377 WeakPolarHBondContact OH-CB 3.49Å; Y364-R377 PolarHBondContact OH-N 3.5Å; Y364-A398 HydrophobicContact CD2-CB 3.97Å; Y364-A398 HydrophobicContact CE2-CB 4.02Å; Y364-F399 PolarHBondContact OH-O 2.9Å; Y364-K400 HydrophobicContact CE1-CD 4.25Å; Y364-K400 VanDerWaalsContact CE1-CE 3.44Å; Y364-K400 HydrophobicContact CE2-CD 4.09Å; Y364-K400 HydrophobicContact CE2-CG 4.34Å; Y364-K400 WeakPolarHBondContact O-CE 3.25Å; Y364-K400 PolarHBondContact O-NZ 2.95Å; Y364-V410 HydrophobicContact CD2-CG2 3.96Å; Y364-V410 HydrophobicContact CE2-CG2 4.06Å
365	G	91.5	Very high	85.6	Confident	6 Å²	6	53.4 Å²	53.4	6%	0.062	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	70	54.7	-175.6	0	0	0	0	0	112.5	Q361 E362 T425	Q361-G365 PolarHBondContact O-N 2.83Å; E362-G365 PolarHBondContact O-N 3.3Å; G365-T425 WeakPolarHBondContact CA-O 3.34Å
366	V	91.3	Very high	86.4	Confident	17 Å²	17	51 Å²	51	10%	0.103	27%	0.273	C	S	.	.			trans	-102.3	108.1	174.6	177.1	0	0	0	0	108.5	L350 Q361 Y364 Y368 W374	L350-V366 HydrophobicContact CD1-CB 4Å; L350-V366 HydrophobicContact CD1-CG1 3.8Å; L350-V366 HydrophobicContact CD1-CG2 3.99Å; Q361-V366 HydrophobicContact CG-CB 4.04Å; Q361-V366 HydrophobicContact CG-CG1 4.37Å; Q361-V366 WeakPolarHBondContact CG-O 3.32Å; Q361-V366 PolarHBondContact NE2-O 3.48Å; Q361-V366 PolarHBondContact O-N 2.96Å; Y364-V366 HydrophobicContact CD1-CG2 3.81Å; V366-Y368 WeakPolarHBondContact CG1-O 3.3Å; V366-Y368 PolarHBondContact O-N 3.35Å; V366-W374 HydrophobicContact CG2-CZ2 3.81Å
367	P	86.8	Confident	86.8	Confident	61 Å²	61	50 Å²	50	40%	0.396	26%	0.262	S	S	.	.	S	Bend	trans	-71.4	-30.1	-173.3	28.5	-36.9	0	0	0	113.5	F426	P367-F426 HydrophobicContact CB-CZ 4.4Å; P367-F426 HydrophobicContact CG-CD1 4.22Å; P367-F426 HydrophobicContact CG-CE1 3.63Å; P367-F426 HydrophobicContact CG-CZ 3.91Å
368	Y	85.7	Confident	86.8	Confident	161 Å²	161	51.4 Å²	51.4	63%	0.631	27%	0.268	S	S	*	.	S	Bend	trans	-144.9	144.1	175.8	63.3	-88.9	0	0	0	109.7	V366	V366-Y368 WeakPolarHBondContact CG1-O 3.3Å; V366-Y368 PolarHBondContact O-N 3.35Å
369	V	84.2	Confident	86.4	Confident	66 Å²	66	51.2 Å²	51.2	40%	0.4	27%	0.265	S	S	.	.			trans	-79.2	125.1	172.1	-172.6	0	0	0	0	108.1	V348 L350 Q361	V348-V369 HydrophobicContact CG2-CG2 3.89Å; L350-V369 HydrophobicContact CD2-CB 4.49Å; L350-V369 HydrophobicContact CD2-CG1 3.77Å; L350-V369 HydrophobicContact CD2-CG2 3.94Å; Q361-V369 VanDerWaalsContact OE1-CG2 3.27Å
370	P	80.1	Confident	85.9	Confident	49 Å²	49	54.8 Å²	54.8	32%	0.318	28%	0.284	S	S	.	.			trans	-71.2	140.9	172.7	29.1	-33	0	0	0	110.4	G372 W374	P370-G372 WeakPolarHBondContact CG-O 3.17Å; P370-G372 PolarHBondContact O-N 2.91Å; P370-G372 VanDerWaalsContact O-N 3.14Å; P370-W374 HydrophobicContact CG-CB 4.1Å; P370-W374 HydrophobicContact CG-CG 4.48Å
371	E	72.1	Confident	85.2	Confident	218 Å²	218	58.8 Å²	58.8	100%	1.019	30%	0.302	S	S	*	.	S	Bend	trans	-59.9	-21.5	171.7	-59.4	174.9	162.4	0	0	112.7
372	G	73.6	Confident	84	Confident	37 Å²	37	58.4 Å²	58.4	38%	0.381	30%	0.303	S	S	.	.	S	Bend	trans	-107.3	171.1	177.4	0	0	0	0	0	113.9	P370 W374	P370-G372 WeakPolarHBondContact CG-O 3.17Å; P370-G372 PolarHBondContact O-N 2.91Å; P370-G372 VanDerWaalsContact O-N 3.14Å; G372-W374 PolarHBondContact O-N 2.68Å
373	P	77.9	Confident	82.7	Confident	70 Å²	70	56.1 Å²	56.1	46%	0.455	30%	0.299	S	S	.	.			trans	-46.6	120.9	-173.4	12.9	-30.4	0	0	0	115.4	D353 R610	D353-P373 WeakPolarHBondContact OD2-CA 3.2Å; D353-P373 WeakPolarHBondContact OD2-CB 3.42Å; P373-R610 VanDerWaalsContact CG-NH2 3.34Å; P373-R610 PolarHBondContact O-NH1 3.39Å; P373-R610 PolarHBondContact O-NH2 2.91Å
374	W	84.3	Confident	80.8	Confident	29 Å²	29	56.6 Å²	56.6	11%	0.11	30%	0.303	C	S	.	.			trans	-86.5	135	-175.6	179.6	85.4	0	0	0	113.2	L350 C352 D353 V359 Y364 V366 P370 G372 C376	L350-W374 HydrophobicContact CB-CD2 4.08Å; L350-W374 HydrophobicContact CB-CE3 3.89Å; L350-W374 HydrophobicContact CB-CH2 4.31Å; L350-W374 HydrophobicContact CB-CZ2 4.48Å; L350-W374 HydrophobicContact CB-CZ3 3.99Å; L350-W374 HydrophobicContact CD1-CD2 4.34Å; L350-W374 HydrophobicContact CD1-CZ2 4.35Å; C352-W374 WeakPolarHBondContact CA-O 3.39Å; C352-W374 HydrophobicContact CB-CE3 3.91Å; C352-W374 HydrophobicContact CB-CZ3 3.65Å; D353-W374 PolarHBondContact N-O 2.85Å; D353-W374 PolarHBondContact OD2-N 3.2Å; D353-W374 VanDerWaalsContact OD2-O 3.13Å; V359-W374 HydrophobicContact CG2-CH2 3.54Å; V359-W374 HydrophobicContact CG2-CZ2 4.35Å; V359-W374 HydrophobicContact CG2-CZ3 4.18Å; Y364-W374 HydrophobicContact CD1-CH2 4.1Å; Y364-W374 AromaticContact CD1-CZ2 3.63Å; Y364-W374 HydrophobicContact CD1-CZ2 3.63Å; Y364-W374 HydrophobicContact CE1-CH2 4.29Å; Y364-W374 AromaticContact CE1-CZ2 3.9Å; Y364-W374 HydrophobicContact CE1-CZ2 3.9Å; Y364-W374 HydrophobicContact CG-CZ2 4.43Å; V366-W374 HydrophobicContact CG2-CZ2 3.81Å; P370-W374 HydrophobicContact CG-CB 4.1Å; P370-W374 HydrophobicContact CG-CG 4.48Å; G372-W374 PolarHBondContact O-N 2.68Å; W374-C376 HydrophobicContact CH2-CB 3.83Å; W374-C376 HydrophobicContact CZ2-CB 4.38Å; W374-C376 HydrophobicContact CZ3-CB 4.21Å
375	L	86.2	Confident	79.4	Confident	31 Å²	31	60.4 Å²	60.4	16%	0.162	32%	0.321	C	S	.	.			trans	-125.7	118.2	-178.4	-61.3	179.3	0	0	0	111.7	D353 V354	D353-L375 HydrophobicContact CB-CD2 4.25Å; V354-L375 HydrophobicContact CB-CD2 4.12Å; V354-L375 HydrophobicContact CG2-CD2 3.54Å
376	C	90	Very high	78.3	Confident	1 Å²	1	62.2 Å²	62.2	1%	0.007	33%	0.332	C	S	.	.			trans	-59.5	152.8	170.9	77	0	0	0	0	111.3	C352 L357 Y364 W374 K378 C379 L380	C352-C376 HydrophobicContact CB-CB 4.09Å; C352-C376 PolarHBondContact SG-N 3.15Å; C352-C376 VanDerWaalsContact SG-N 3.36Å; L357-C376 HydrophobicContact CD2-CB 3.75Å; Y364-C376 HydrophobicContact CE1-CB 4.19Å; W374-C376 HydrophobicContact CH2-CB 3.83Å; W374-C376 HydrophobicContact CZ2-CB 4.38Å; W374-C376 HydrophobicContact CZ3-CB 4.21Å; C376-K378 PolarHBondContact O-N 3.1Å; C376-C379 PolarHBondContact O-N 2.92Å; C376-L380 PolarHBondContact O-N 3.36Å
377	R	89.5	Confident	77.9	Confident	77 Å²	77	61.9 Å²	61.9	29%	0.291	33%	0.33	S	S	.	.	H	α-helix	trans	-55.9	-32.6	-173.1	-63.5	-54.9	-159.7	-156.5	7.4	113.2	Y364 L380 H381 K400 W407 E428	Y364-R377 HydrophobicContact CE1-CG 4.27Å; Y364-R377 WeakPolarHBondContact OH-CB 3.49Å; Y364-R377 PolarHBondContact OH-N 3.5Å; R377-L380 PolarHBondContact O-N 3.37Å; R377-H381 WeakPolarHBondContact O-CB 3.21Å; R377-H381 PolarHBondContact O-N 3.2Å; R377-H381 PolarHBondContact O-ND1 3Å; R377-K400 HydrophobicContact CB-CD 4.26Å; R377-K400 HydrophobicContact CG-CD 3.69Å; R377-W407 HydrophobicContact CB-CZ3 4.3Å; R377-W407 WeakPolarHBondContact O-CH2 3.44Å; R377-E428 WeakPolarHBondContact CG-OE2 3.27Å; R377-E428 IonicContact CZ-OE1 3.81Å; R377-E428 IonicContact CZ-OE2 3.6Å; R377-E428 IonicContact NE-OE1 2.78Å; R377-E428 PolarHBondContact NE-OE1 3.44Å; R377-E428 IonicContact NE-OE2 3.85Å; R377-E428 PolarHBondContact NE-OE2 2.83Å; R377-E428 IonicContact NH2-OE1 2.65Å; R377-E428 PolarHBondContact NH2-OE1 3.31Å; R377-E428 IonicContact NH2-OE2 2.65Å
378	K	86.1	Confident	78	Confident	45 Å²	45	62.4 Å²	62.4	20%	0.196	34%	0.335	C	S	.	.	H	α-helix	trans	-57.8	-50.2	172.6	172.4	-176.2	171.6	-66.7	0	111.7	C376 S382 V387 F399	C376-K378 PolarHBondContact O-N 3.1Å; K378-S382 CarbonylContact O-C 3.3Å; K378-S382 VanDerWaalsContact O-CA 3.29Å; K378-S382 WeakPolarHBondContact O-CA 3.32Å; K378-S382 PolarHBondContact O-N 3.44Å; K378-V387 HydrophobicContact CD-CG2 3.72Å; K378-V387 HydrophobicContact CG-CG1 4.39Å; K378-V387 HydrophobicContact CG-CG2 3.85Å; K378-F399 HydrophobicContact CB-CB 4.36Å; K378-F399 HydrophobicContact CD-CD2 4.01Å; K378-F399 HydrophobicContact CD-CE2 4.48Å
379	C	82	Confident	78.4	Confident	7 Å²	7	55.2 Å²	55.2	5%	0.047	31%	0.308	C	S	.	.	H	α-helix	trans	-74.4	-29.4	-179	-68.5	0	0	0	0	112.6	V354 C355 C376 P383	V354-C379 HydrophobicContact CB-CB 3.97Å; V354-C379 HydrophobicContact CG1-CB 4.01Å; C355-C379 PolarHBondContact SG-SG 3.04Å; C376-C379 PolarHBondContact O-N 2.92Å; C379-P383 WeakPolarHBondContact O-CD 3.49Å
380	L	81.8	Confident	78.8	Confident	75 Å²	75	53.4 Å²	53.4	39%	0.393	30%	0.297	S	S	.	.	H	α-helix	trans	-67.4	-42.6	175	-171.9	65.3	0	0	0	112.7	C376 R377	C376-L380 PolarHBondContact O-N 3.36Å; R377-L380 PolarHBondContact O-N 3.37Å
381	H	78	Confident	79.6	Confident	92 Å²	92	51.1 Å²	51.1	43%	0.426	28%	0.282	S	S	.	.	H	α-helix	trans	-96	-23.4	-177	-66.1	92.3	0	0	0	114.5	R377 W407	R377-H381 WeakPolarHBondContact O-CB 3.21Å; R377-H381 PolarHBondContact O-N 3.2Å; R377-H381 PolarHBondContact O-ND1 3Å; H381-W407 HydrophobicContact CB-CH2 3.96Å; H381-W407 HydrophobicContact CB-CZ2 3.9Å
382	S	65.7	Low	80.6	Confident	24 Å²	24	40.8 Å²	40.8	17%	0.168	23%	0.234	C	C	.	.			trans	-154.4	59.9	-167.4	-70	0	0	0	0	111.7	K378 S384	K378-S382 CarbonylContact O-C 3.3Å; K378-S382 VanDerWaalsContact O-CA 3.29Å; K378-S382 WeakPolarHBondContact O-CA 3.32Å; K378-S382 PolarHBondContact O-N 3.44Å; S382-S384 PolarHBondContact O-N 3.23Å
383	P	62.8	Low	81.4	Confident	78 Å²	78	40.4 Å²	40.4	51%	0.506	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-28.6	-179.5	25.8	-33.6	0	0	0	112.8	C379	C379-P383 WeakPolarHBondContact O-CD 3.49Å
384	S	54	Low	82	Confident	40 Å²	40	37.4 Å²	37.4	28%	0.28	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-116.7	5.7	-174.9	57.6	0	0	0	0	114.6	S382 R595	S382-S384 PolarHBondContact O-N 3.23Å; S384-R595 VanDerWaalsContact CB-O 3.26Å; S384-R595 WeakPolarHBondContact CB-O 3.44Å; S384-R595 WeakPolarHBondContact O-CD 3.15Å; S384-R595 PolarHBondContact O-NH1 2.85Å
385	E	62.9	Low	81.9	Confident	85 Å²	85	42.2 Å²	42.2	40%	0.397	22%	0.223	S	C	.	.	S	Bend	trans	-117.2	122.4	176.4	-174	79	-82.5	0	0	109.5	V387 R595 R1056	E385-V387 PolarHBondContact O-N 3.01Å; E385-R595 IonicContact OE1-CZ 3.71Å; E385-R595 IonicContact OE1-NH1 2.64Å; E385-R595 PolarHBondContact OE1-NH1 3.15Å; E385-R1056 IonicContact OE1-CZ 2.73Å; E385-R1056 IonicContact OE1-NH1 3.03Å; E385-R1056 PolarHBondContact OE1-NH1 3.37Å; E385-R1056 IonicContact OE1-NH2 3.69Å; E385-R1056 PolarHBondContact OE1-NH2 3.26Å; E385-R1056 IonicContact OE2-NH1 2.61Å
386	P	69.4	Low	81.6	Confident	44 Å²	44	43 Å²	43	29%	0.286	24%	0.239	S	C	.	.			trans	-72.4	115.4	176.5	28.5	-34.1	0	0	0	110.9	P550	P386-P550 HydrophobicContact CB-CB 3.96Å; P386-P550 HydrophobicContact CB-CG 3.62Å; P386-P550 HydrophobicContact CG-CG 3.93Å
387	V	83.6	Confident	81.5	Confident	10 Å²	10	44.6 Å²	44.6	6%	0.061	26%	0.255	C	S	.	.			trans	-77.8	159.4	172.2	-54.7	0	0	0	0	111.3	K378 E385 F399 W407	K378-V387 HydrophobicContact CD-CG2 3.72Å; K378-V387 HydrophobicContact CG-CG1 4.39Å; K378-V387 HydrophobicContact CG-CG2 3.85Å; E385-V387 PolarHBondContact O-N 3.01Å; V387-F399 HydrophobicContact CG2-CB 4.45Å; V387-F399 HydrophobicContact CG2-CD1 3.94Å; V387-F399 HydrophobicContact CG2-CD2 3.89Å; V387-F399 HydrophobicContact CG2-CE1 4.05Å; V387-F399 HydrophobicContact CG2-CE2 4.02Å; V387-F399 HydrophobicContact CG2-CG 3.84Å; V387-F399 HydrophobicContact CG2-CZ 4.09Å; V387-W407 HydrophobicContact CB-CB 4.21Å; V387-W407 HydrophobicContact CB-CD2 4.05Å; V387-W407 HydrophobicContact CB-CG 3.78Å; V387-W407 HydrophobicContact CG1-CD2 3.79Å; V387-W407 HydrophobicContact CG1-CG 3.91Å; V387-W407 HydrophobicContact CG1-CZ2 4.08Å
388	S	88.7	Confident	81.6	Confident	72 Å²	72	41 Å²	41	50%	0.503	24%	0.243	S	C	.	.			trans	-141.5	137.6	178.8	56.7	0	0	0	0	110.4
389	C	94.1	Very high	82	Confident	10 Å²	10	39 Å²	39	7%	0.068	23%	0.234	C	C	.	.	B	Isolated β-bridge	trans	-70	135.8	179.4	-174.8	0	0	0	0	110.9	L391 F399 W407 H409	C389-L391 VanDerWaalsContact C-N 3.33Å; C389-L391 PolarHBondContact SG-N 3.06Å; C389-L391 VanDerWaalsContact SG-N 3.36Å; C389-F399 HydrophobicContact CB-CE1 4Å; C389-W407 CarbonylContact C-O 3.46Å; C389-W407 WeakPolarHBondContact CA-O 3.38Å; C389-H409 VanDerWaalsContact CB-CE1 3.49Å; C389-H409 WeakPolarHBondContact CB-CE1 3.27Å; C389-H409 VanDerWaalsContact CB-ND1 3.25Å; C389-H409 WeakPolarHBondContact CB-ND1 3.41Å; C389-H409 PolarHBondContact SG-N 3.04Å; C389-H409 VanDerWaalsContact SG-N 3.37Å; C389-H409 PolarHBondContact SG-ND1 3.46Å
390	V	93	Very high	82.6	Confident	28 Å²	28	38.7 Å²	38.7	17%	0.17	23%	0.232	C	C	.	.	S	Bend	trans	-76.9	-21.1	172.7	-62.4	0	0	0	0	113.2	T402 R406 W407 A408 I433 W441	V390-T402 HydrophobicContact CG2-CG2 4.43Å; V390-R406 HydrophobicContact CG1-CB 3.63Å; V390-R406 HydrophobicContact CG1-CG 4.23Å; V390-W407 PolarHBondContact N-O 2.92Å; V390-A408 HydrophobicContact CG2-CB 4.37Å; V390-I433 HydrophobicContact CG2-CD1 4Å; V390-I433 HydrophobicContact CG2-CG2 4.35Å; V390-W441 WeakPolarHBondContact O-CH2 3.43Å; V390-W441 WeakPolarHBondContact O-CZ3 3.43Å
391	L	95	Very high	83	Confident	1 Å²	1	38.2 Å²	38.2	1%	0.005	23%	0.226	C	C	.	.	S	Bend	trans	-93.5	-15	-176.3	-56.6	179.5	0	0	0	113.2	C389 A408 C412 V419 I433 I436 W441 G454 A455	C389-L391 VanDerWaalsContact C-N 3.33Å; C389-L391 PolarHBondContact SG-N 3.06Å; C389-L391 VanDerWaalsContact SG-N 3.36Å; L391-A408 HydrophobicContact CD1-CB 4.32Å; L391-C412 HydrophobicContact CB-CB 3.79Å; L391-C412 HydrophobicContact CD1-CB 3.67Å; L391-C412 HydrophobicContact CG-CB 4.33Å; L391-V419 HydrophobicContact CD1-CG1 4.36Å; L391-V419 HydrophobicContact CD1-CG2 4.05Å; L391-V419 HydrophobicContact CD2-CG2 4.4Å; L391-I433 HydrophobicContact CD2-CG1 4.42Å; L391-I433 HydrophobicContact CD2-CG2 4.25Å; L391-I436 HydrophobicContact CD2-CD1 3.4Å; L391-W441 HydrophobicContact CD2-CH2 4.28Å; L391-G454 CarbonylContact O-C 3.54Å; L391-G454 WeakPolarHBondContact O-CA 3.21Å; L391-A455 PolarHBondContact O-N 2.91Å
392	C	94.2	Very high	83.7	Confident	1 Å²	1	34.1 Å²	34.1	1%	0.007	21%	0.208	C	C	.	.	S	Bend	trans	-155.5	157.8	178.8	80.3	0	0	0	0	112.7	N394 H409 H469 T471	C392-N394 PolarHBondContact O-N 3.01Å; C392-N394 VanDerWaalsContact O-N 3.15Å; C392-H409 PolarHBondContact SG-CE1 3.43Å; C392-H409 PolarHBondContact SG-ND1 3.42Å; C392-H469 HydrophobicContact CB-CB 4.01Å; C392-T471 PolarHBondContact SG-OG1 2.92Å
393	P	91.1	Very high	84.9	Confident	29 Å²	29	37 Å²	37	19%	0.188	22%	0.224	C	C	.	.	S	Bend	trans	-82.8	18.7	-174.7	35.3	-38.9	0	0	0	114.8	V453 H469 R546	P393-V453 HydrophobicContact CB-CB 4.27Å; P393-V453 HydrophobicContact CB-CG2 3.98Å; P393-V453 HydrophobicContact CG-CG2 3.9Å; P393-H469 WeakPolarHBondContact CD-ND1 3.49Å; P393-R546 PolarHBondContact O-NE 2.83Å
394	N	88.8	Confident	86.1	Confident	7 Å²	7	36.4 Å²	36.4	4%	0.037	22%	0.217	C	C	.	.			trans	-105.4	146.6	-174.3	-63.3	-30.3	0	0	0	111.5	C392 H409 T471 C472 R546	C392-N394 PolarHBondContact O-N 3.01Å; C392-N394 VanDerWaalsContact O-N 3.15Å; N394-H409 PolarHBondContact O-CE1 3.17Å; N394-T471 PolarHBondContact ND2-OG1 2.97Å; N394-C472 PolarHBondContact ND2-SG 2.81Å; N394-C472 VanDerWaalsContact ND2-SG 3.44Å; N394-R546 VanDerWaalsContact OD1-CD 3.31Å; N394-R546 WeakPolarHBondContact OD1-CD 3.35Å; N394-R546 PolarHBondContact OD1-NE 3.36Å
395	R	82.6	Confident	87.6	Confident	129 Å²	129	39.9 Å²	39.9	49%	0.487	23%	0.233	S	C	.	.			trans	-111.4	-14.1	-168.7	-67.9	-179	177.2	166.6	-0.1	116.3	F399 R546	R395-F399 WeakPolarHBondContact O-CE2 3.5Å; R395-F399 WeakPolarHBondContact O-CZ 3.49Å; R395-R546 PolarHBondContact NH1-O 2.85Å
396	G	81	Confident	89	Confident	48 Å²	48	40 Å²	40	50%	0.495	23%	0.229	S	C	.	.	S	Bend	trans	-96.1	173.5	173.8	0	0	0	0	0	112.6	H409	G396-H409 PolarHBondContact O-NE2 2.93Å
397	G	86.6	Confident	90.1	Very high	34 Å²	34	39.4 Å²	39.4	35%	0.351	22%	0.221	S	C	.	.	S	Bend	trans	98.4	-171.3	176.5	0	0	0	0	0	115.1	F399	G397-F399 WeakPolarHBondContact O-CD2 3.21Å; G397-F399 WeakPolarHBondContact O-CE2 3.49Å
398	A	92.9	Very high	90.6	Very high	3 Å²	3	38.9 Å²	38.9	3%	0.025	22%	0.218	C	C	.	.			trans	-81.5	120.4	-174	0	0	0	0	0	112.9	V337 L357 V359 Y364 H409 V410	V337-A398 HydrophobicContact CG2-CB 3.56Å; L357-A398 HydrophobicContact CD1-CB 4.25Å; L357-A398 HydrophobicContact CD2-CB 4.15Å; V359-A398 HydrophobicContact CG1-CB 3.89Å; Y364-A398 HydrophobicContact CD2-CB 3.97Å; Y364-A398 HydrophobicContact CE2-CB 4.02Å; A398-H409 WeakPolarHBondContact O-CA 3.38Å; A398-H409 PolarHBondContact O-CD2 3.11Å; A398-V410 HydrophobicContact CB-CG2 4.26Å; A398-V410 PolarHBondContact O-N 3.41Å
399	F	93.7	Very high	90.9	Very high	2 Å²	2	35.6 Å²	35.6	1%	0.009	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	144.8	-175.4	-73.5	-84.7	0	0	0	113.7	Y364 K378 V387 C389 R395 G397 W407 A408 H409	Y364-F399 PolarHBondContact OH-O 2.9Å; K378-F399 HydrophobicContact CB-CB 4.36Å; K378-F399 HydrophobicContact CD-CD2 4.01Å; K378-F399 HydrophobicContact CD-CE2 4.48Å; V387-F399 HydrophobicContact CG2-CB 4.45Å; V387-F399 HydrophobicContact CG2-CD1 3.94Å; V387-F399 HydrophobicContact CG2-CD2 3.89Å; V387-F399 HydrophobicContact CG2-CE1 4.05Å; V387-F399 HydrophobicContact CG2-CE2 4.02Å; V387-F399 HydrophobicContact CG2-CG 3.84Å; V387-F399 HydrophobicContact CG2-CZ 4.09Å; C389-F399 HydrophobicContact CB-CE1 4Å; R395-F399 WeakPolarHBondContact O-CE2 3.5Å; R395-F399 WeakPolarHBondContact O-CZ 3.49Å; G397-F399 WeakPolarHBondContact O-CD2 3.21Å; G397-F399 WeakPolarHBondContact O-CE2 3.49Å; F399-W407 HydrophobicContact CB-CE3 3.94Å; F399-W407 HydrophobicContact CB-CZ3 4.32Å; F399-W407 HydrophobicContact CD1-CB 4.4Å; F399-A408 WeakPolarHBondContact CA-O 3.35Å; F399-H409 AromaticContact CD1-CD2 3.97Å; F399-H409 AromaticContact CE1-CD2 3.7Å; F399-H409 AromaticContact CE1-CE1 3.96Å; F399-H409 AromaticContact CE1-NE2 3.49Å; F399-H409 WeakPolarHBondContact CE1-NE2 3.31Å; F399-H409 AromaticContact CE2-NE2 3.74Å; F399-H409 AromaticContact CZ-CD2 3.76Å; F399-H409 AromaticContact CZ-CE1 3.92Å; F399-H409 AromaticContact CZ-NE2 3.21Å; F399-H409 WeakPolarHBondContact CZ-NE2 3.33Å
400	K	94.2	Very high	90.9	Very high	1 Å²	1	35.1 Å²	35.1	0%	0.004	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	162.6	170.1	-68.1	-64.2	-163.4	79.5	0	110.6	Y364 R377 A408 V410 F426 L427 E428 L430	Y364-K400 HydrophobicContact CE1-CD 4.25Å; Y364-K400 VanDerWaalsContact CE1-CE 3.44Å; Y364-K400 HydrophobicContact CE2-CD 4.09Å; Y364-K400 HydrophobicContact CE2-CG 4.34Å; Y364-K400 WeakPolarHBondContact O-CE 3.25Å; Y364-K400 PolarHBondContact O-NZ 2.95Å; R377-K400 HydrophobicContact CB-CD 4.26Å; R377-K400 HydrophobicContact CG-CD 3.69Å; K400-A408 PolarHBondContact N-O 3.17Å; K400-A408 PolarHBondContact O-N 3.4Å; K400-V410 HydrophobicContact CB-CG2 4.49Å; K400-V410 HydrophobicContact CG-CG2 3.57Å; K400-F426 PolarHBondContact NZ-O 2.61Å; K400-L427 PolarHBondContact NZ-O 3.29Å; K400-E428 HydrophobicContact CD-CB 4.24Å; K400-E428 WeakPolarHBondContact CD-OE2 3.45Å; K400-E428 VanDerWaalsContact CE-OE2 3.25Å; K400-E428 WeakPolarHBondContact CE-OE2 3.34Å; K400-E428 IonicContact NZ-OE2 3.84Å; K400-E428 PolarHBondContact NZ-OE2 3.38Å; K400-L430 HydrophobicContact CB-CD1 3.56Å
401	K	91.3	Very high	91	Very high	65 Å²	65	34.2 Å²	34.2	28%	0.283	19%	0.186	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	152.8	173.7	-84.9	-168.1	171.6	-167.2	0	111.7	D405 R406 W407 P429 L430	K401-D405 WeakPolarHBondContact CD-OD1 3.12Å; K401-D405 VanDerWaalsContact CE-OD1 3.23Å; K401-D405 WeakPolarHBondContact CE-OD1 3.48Å; K401-D405 IonicContact NZ-OD1 3.45Å; K401-D405 PolarHBondContact NZ-OD1 3.19Å; K401-R406 WeakPolarHBondContact CA-O 3.48Å; K401-W407 HydrophobicContact CG-CD2 4.47Å; K401-W407 HydrophobicContact CG-CE3 4.43Å; K401-W407 HydrophobicContact CG-CH2 4.15Å; K401-W407 HydrophobicContact CG-CZ2 4.17Å; K401-W407 HydrophobicContact CG-CZ3 4.28Å; K401-P429 WeakPolarHBondContact O-CA 3.49Å; K401-L430 PolarHBondContact O-N 3.49Å
402	T	92.4	Very high	91	Very high	5 Å²	5	34.2 Å²	34.2	3%	0.031	19%	0.186	C	C	.	.	B	Isolated β-bridge	trans	-99.1	164.7	169.5	62.1	0	0	0	0	109.8	V390 D404 D405 R406 A408 L430 I433	V390-T402 HydrophobicContact CG2-CG2 4.43Å; T402-D404 WeakPolarHBondContact CB-OD1 3.41Å; T402-D404 PolarHBondContact O-N 2.88Å; T402-D404 PolarHBondContact OG1-OD1 3.36Å; T402-D405 PolarHBondContact O-N 3.01Å; T402-D405 VanDerWaalsContact O-N 3.13Å; T402-R406 HydrophobicContact CG2-CB 4.48Å; T402-R406 PolarHBondContact N-O 3.32Å; T402-R406 VanDerWaalsContact OG1-C 3.27Å; T402-R406 VanDerWaalsContact OG1-CA 3.3Å; T402-R406 WeakPolarHBondContact OG1-CA 3.37Å; T402-R406 WeakPolarHBondContact OG1-CB 3.43Å; T402-R406 PolarHBondContact OG1-N 3.45Å; T402-R406 PolarHBondContact OG1-O 2.97Å; T402-R406 VanDerWaalsContact OG1-O 3.13Å; T402-A408 HydrophobicContact CG2-CB 3.79Å; T402-L430 WeakPolarHBondContact CA-O 3.39Å; T402-L430 HydrophobicContact CG2-CB 4.31Å; T402-I433 HydrophobicContact CG2-CD1 3.25Å
403	T	91	Very high	91	Very high	85 Å²	85	34.3 Å²	34.3	52%	0.521	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-18	178.6	45	0	0	0	0	114.5	P429 L430 E431	T403-P429 HydrophobicContact CG2-CB 3.99Å; T403-P429 HydrophobicContact CG2-CG 3.69Å; T403-L430 PolarHBondContact N-O 2.92Å; T403-E431 HydrophobicContact CG2-CG 3.76Å; T403-E431 WeakPolarHBondContact CG2-OE1 3.32Å
404	D	87.5	Confident	91.1	Very high	66 Å²	66	35 Å²	35	35%	0.353	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103	27.8	175.2	68.2	-12.1	0	0	0	113.4	T402 R406	T402-D404 WeakPolarHBondContact CB-OD1 3.41Å; T402-D404 PolarHBondContact O-N 2.88Å; T402-D404 PolarHBondContact OG1-OD1 3.36Å; D404-R406 VanDerWaalsContact CG-NE 3.28Å; D404-R406 PolarHBondContact O-N 3.45Å; D404-R406 IonicContact OD1-NE 3.66Å; D404-R406 PolarHBondContact OD1-NE 3.41Å; D404-R406 IonicContact OD1-NH2 3.2Å; D404-R406 IonicContact OD2-CZ 3.23Å; D404-R406 IonicContact OD2-NE 3.16Å; D404-R406 PolarHBondContact OD2-NE 3.36Å; D404-R406 IonicContact OD2-NH2 2.82Å; D404-R406 PolarHBondContact OD2-NH2 2.91Å
405	D	86.6	Confident	91.3	Very high	113 Å²	113	35.9 Å²	35.9	60%	0.604	19%	0.192	S	C	*	.	S	Bend	trans	61.9	11.6	173.5	-113	-27.8	0	0	0	115.9	K401 T402	K401-D405 WeakPolarHBondContact CD-OD1 3.12Å; K401-D405 VanDerWaalsContact CE-OD1 3.23Å; K401-D405 WeakPolarHBondContact CE-OD1 3.48Å; K401-D405 IonicContact NZ-OD1 3.45Å; K401-D405 PolarHBondContact NZ-OD1 3.19Å; T402-D405 PolarHBondContact O-N 3.01Å; T402-D405 VanDerWaalsContact O-N 3.13Å
406	R	90.9	Very high	91.9	Very high	88 Å²	88	29.8 Å²	29.8	33%	0.332	17%	0.169	S	C	.	.			trans	-82.1	-178.4	169.2	-53.3	-174.3	-71.9	173.9	-18.1	110.4	V390 K401 T402 D404 D434	V390-R406 HydrophobicContact CG1-CB 3.63Å; V390-R406 HydrophobicContact CG1-CG 4.23Å; K401-R406 WeakPolarHBondContact CA-O 3.48Å; T402-R406 HydrophobicContact CG2-CB 4.48Å; T402-R406 PolarHBondContact N-O 3.32Å; T402-R406 VanDerWaalsContact OG1-C 3.27Å; T402-R406 VanDerWaalsContact OG1-CA 3.3Å; T402-R406 WeakPolarHBondContact OG1-CA 3.37Å; T402-R406 WeakPolarHBondContact OG1-CB 3.43Å; T402-R406 PolarHBondContact OG1-N 3.45Å; T402-R406 PolarHBondContact OG1-O 2.97Å; T402-R406 VanDerWaalsContact OG1-O 3.13Å; D404-R406 VanDerWaalsContact CG-NE 3.28Å; D404-R406 PolarHBondContact O-N 3.45Å; D404-R406 IonicContact OD1-NE 3.66Å; D404-R406 PolarHBondContact OD1-NE 3.41Å; D404-R406 IonicContact OD1-NH2 3.2Å; D404-R406 IonicContact OD2-CZ 3.23Å; D404-R406 IonicContact OD2-NE 3.16Å; D404-R406 PolarHBondContact OD2-NE 3.36Å; D404-R406 IonicContact OD2-NH2 2.82Å; D404-R406 PolarHBondContact OD2-NH2 2.91Å; R406-D434 IonicContact NH2-OD1 2.81Å
407	W	92.6	Very high	92.4	Very high	30 Å²	30	31.8 Å²	31.8	11%	0.114	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	141.6	180	-69.3	89.9	0	0	0	111.4	R377 H381 V387 C389 V390 F399 K401	R377-W407 HydrophobicContact CB-CZ3 4.3Å; R377-W407 WeakPolarHBondContact O-CH2 3.44Å; H381-W407 HydrophobicContact CB-CH2 3.96Å; H381-W407 HydrophobicContact CB-CZ2 3.9Å; V387-W407 HydrophobicContact CB-CB 4.21Å; V387-W407 HydrophobicContact CB-CD2 4.05Å; V387-W407 HydrophobicContact CB-CG 3.78Å; V387-W407 HydrophobicContact CG1-CD2 3.79Å; V387-W407 HydrophobicContact CG1-CG 3.91Å; V387-W407 HydrophobicContact CG1-CZ2 4.08Å; C389-W407 CarbonylContact C-O 3.46Å; C389-W407 WeakPolarHBondContact CA-O 3.38Å; V390-W407 PolarHBondContact N-O 2.92Å; F399-W407 HydrophobicContact CB-CE3 3.94Å; F399-W407 HydrophobicContact CB-CZ3 4.32Å; F399-W407 HydrophobicContact CD1-CB 4.4Å; K401-W407 HydrophobicContact CG-CD2 4.47Å; K401-W407 HydrophobicContact CG-CE3 4.43Å; K401-W407 HydrophobicContact CG-CH2 4.15Å; K401-W407 HydrophobicContact CG-CZ2 4.17Å; K401-W407 HydrophobicContact CG-CZ3 4.28Å
408	A	94.5	Very high	92.6	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	158.3	174.4	0	0	0	0	0	110.5	V390 L391 F399 K400 T402 L430	V390-A408 HydrophobicContact CG2-CB 4.37Å; L391-A408 HydrophobicContact CD1-CB 4.32Å; F399-A408 WeakPolarHBondContact CA-O 3.35Å; K400-A408 PolarHBondContact N-O 3.17Å; K400-A408 PolarHBondContact O-N 3.4Å; T402-A408 HydrophobicContact CG2-CB 3.79Å; A408-L430 HydrophobicContact CB-CD2 3.8Å
409	H	94.8	Very high	92.7	Very high	2 Å²	2	32.6 Å²	32.6	1%	0.009	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	143.9	170.1	-66	115.3	0	0	0	110.9	C389 C392 N394 G396 A398 F399 I411 C412 G413 T471	C389-H409 VanDerWaalsContact CB-CE1 3.49Å; C389-H409 WeakPolarHBondContact CB-CE1 3.27Å; C389-H409 VanDerWaalsContact CB-ND1 3.25Å; C389-H409 WeakPolarHBondContact CB-ND1 3.41Å; C389-H409 PolarHBondContact SG-N 3.04Å; C389-H409 VanDerWaalsContact SG-N 3.37Å; C389-H409 PolarHBondContact SG-ND1 3.46Å; C392-H409 PolarHBondContact SG-CE1 3.43Å; C392-H409 PolarHBondContact SG-ND1 3.42Å; N394-H409 PolarHBondContact O-CE1 3.17Å; G396-H409 PolarHBondContact O-NE2 2.93Å; A398-H409 WeakPolarHBondContact O-CA 3.38Å; A398-H409 PolarHBondContact O-CD2 3.11Å; F399-H409 AromaticContact CD1-CD2 3.97Å; F399-H409 AromaticContact CE1-CD2 3.7Å; F399-H409 AromaticContact CE1-CE1 3.96Å; F399-H409 AromaticContact CE1-NE2 3.49Å; F399-H409 WeakPolarHBondContact CE1-NE2 3.31Å; F399-H409 AromaticContact CE2-NE2 3.74Å; F399-H409 AromaticContact CZ-CD2 3.76Å; F399-H409 AromaticContact CZ-CE1 3.92Å; F399-H409 AromaticContact CZ-NE2 3.21Å; F399-H409 WeakPolarHBondContact CZ-NE2 3.33Å; H409-I411 VanDerWaalsContact C-N 3.34Å; H409-I411 HydrophobicContact CB-CG2 4.06Å; H409-I411 PolarHBondContact O-N 3.46Å; H409-C412 HydrophobicContact CB-CB 3.99Å; H409-C412 PolarHBondContact O-N 3.48Å; H409-C412 VanDerWaalsContact O-N 3.13Å; H409-G413 PolarHBondContact O-N 3.41Å; H409-T471 HydrophobicContact CB-CG2 4.49Å
410	V	95.1	Very high	92.6	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-58.4	-47.6	173.4	-173.3	0	0	0	0	110.4	V337 C363 Y364 A398 K400 C412 G413 L414 F421 L427	V337-V410 HydrophobicContact CG1-CG1 4.44Å; V337-V410 HydrophobicContact CG2-CB 4.29Å; C363-V410 WeakPolarHBondContact O-CG1 3.36Å; Y364-V410 HydrophobicContact CD2-CG2 3.96Å; Y364-V410 HydrophobicContact CE2-CG2 4.06Å; A398-V410 HydrophobicContact CB-CG2 4.26Å; A398-V410 PolarHBondContact O-N 3.41Å; K400-V410 HydrophobicContact CB-CG2 4.49Å; K400-V410 HydrophobicContact CG-CG2 3.57Å; V410-C412 VanDerWaalsContact C-N 3.3Å; V410-C412 PolarHBondContact O-N 3.29Å; V410-G413 WeakPolarHBondContact O-CA 3.35Å; V410-G413 PolarHBondContact O-N 3.27Å; V410-L414 HydrophobicContact CG1-CD1 4.12Å; V410-L414 HydrophobicContact CG1-CG 4.46Å; V410-L414 WeakPolarHBondContact O-CG 3.46Å; V410-L414 PolarHBondContact O-N 3.13Å; V410-F421 HydrophobicContact CG1-CE1 4.22Å; V410-F421 HydrophobicContact CG1-CZ 3.99Å; V410-L427 HydrophobicContact CG1-CD1 4.09Å
411	I	94.6	Very high	92.5	Very high	9 Å²	9	37.7 Å²	37.7	5%	0.046	19%	0.193	C	C	.	.	H	α-helix	trans	-59.6	-36.9	176.1	-163.4	-176.1	0	0	0	112.6	V337 H409 G413 L414 W415 V470 T471 Q474	V337-I411 HydrophobicContact CG1-CB 4.48Å; V337-I411 WeakPolarHBondContact O-CD1 3.38Å; H409-I411 VanDerWaalsContact C-N 3.34Å; H409-I411 HydrophobicContact CB-CG2 4.06Å; H409-I411 PolarHBondContact O-N 3.46Å; I411-G413 VanDerWaalsContact C-N 3.33Å; I411-G413 PolarHBondContact O-N 2.83Å; I411-L414 PolarHBondContact O-N 3.12Å; I411-W415 VanDerWaalsContact O-CD1 3.29Å; I411-W415 PolarHBondContact O-N 2.86Å; I411-V470 HydrophobicContact CD1-CG1 4.09Å; I411-V470 HydrophobicContact CG1-CG1 3.79Å; I411-V470 HydrophobicContact CG2-CG1 4.41Å; I411-T471 HydrophobicContact CG2-CG2 3.55Å; I411-Q474 HydrophobicContact CD1-CB 4.1Å; I411-Q474 HydrophobicContact CD1-CG 3.94Å
412	C	95.3	Very high	92.5	Very high	1 Å²	1	37.2 Å²	37.2	1%	0.007	20%	0.201	C	C	.	.	H	α-helix	trans	-67.7	-33.3	175.1	-69.7	0	0	0	0	112.4	L391 H409 V410 V416	L391-C412 HydrophobicContact CB-CB 3.79Å; L391-C412 HydrophobicContact CD1-CB 3.67Å; L391-C412 HydrophobicContact CG-CB 4.33Å; H409-C412 HydrophobicContact CB-CB 3.99Å; H409-C412 PolarHBondContact O-N 3.48Å; H409-C412 VanDerWaalsContact O-N 3.13Å; V410-C412 VanDerWaalsContact C-N 3.3Å; V410-C412 PolarHBondContact O-N 3.29Å; C412-V416 WeakPolarHBondContact O-CB 3.25Å; C412-V416 WeakPolarHBondContact O-CG2 3.39Å; C412-V416 PolarHBondContact O-N 2.93Å; C412-V416 VanDerWaalsContact O-N 3.13Å
413	G	93.5	Very high	92.3	Very high	3 Å²	3	40 Å²	40	3%	0.031	22%	0.216	C	C	.	.	H	α-helix	trans	-69.1	-37.2	172.3	0	0	0	0	0	113.4	H409 V410 I411 W415	H409-G413 PolarHBondContact O-N 3.41Å; V410-G413 WeakPolarHBondContact O-CA 3.35Å; V410-G413 PolarHBondContact O-N 3.27Å; I411-G413 VanDerWaalsContact C-N 3.33Å; I411-G413 PolarHBondContact O-N 2.83Å; G413-W415 VanDerWaalsContact C-N 3.32Å; G413-W415 PolarHBondContact O-N 3.22Å
414	L	92.9	Very high	92.1	Very high	44 Å²	44	42.4 Å²	42.4	23%	0.23	23%	0.225	C	C	.	.	H	α-helix	trans	-67.5	-30.2	177.8	-72.3	167	0	0	0	113.4	V337 V410 I411 F421 K495	V337-L414 HydrophobicContact CG1-CD1 3.82Å; V410-L414 HydrophobicContact CG1-CD1 4.12Å; V410-L414 HydrophobicContact CG1-CG 4.46Å; V410-L414 WeakPolarHBondContact O-CG 3.46Å; V410-L414 PolarHBondContact O-N 3.13Å; I411-L414 PolarHBondContact O-N 3.12Å; L414-F421 HydrophobicContact CD2-CE2 3.87Å; L414-F421 HydrophobicContact CD2-CZ 4.39Å; L414-F421 HydrophobicContact CG-CE2 4.05Å; L414-F421 HydrophobicContact CG-CZ 4.14Å; L414-K495 WeakPolarHBondContact O-CD 3.38Å; L414-K495 PolarHBondContact O-NZ 2.83Å
415	W	94.4	Very high	92.1	Very high	25 Å²	25	43.9 Å²	43.9	10%	0.095	24%	0.236	C	C	.	.	H	α-helix	trans	-110.9	-17.5	-168.7	-77.5	90.3	0	0	0	116.1	I411 G413 P417 I457 V470 M480 K481 I482 K495 S496 A497	I411-W415 VanDerWaalsContact O-CD1 3.29Å; I411-W415 PolarHBondContact O-N 2.86Å; G413-W415 VanDerWaalsContact C-N 3.32Å; G413-W415 PolarHBondContact O-N 3.22Å; W415-P417 WeakPolarHBondContact O-CD 3.23Å; W415-I457 HydrophobicContact CE3-CD1 4.31Å; W415-I457 WeakPolarHBondContact O-CG2 3.37Å; W415-V470 HydrophobicContact CB-CB 4.27Å; W415-V470 HydrophobicContact CB-CG1 3.56Å; W415-V470 HydrophobicContact CB-CG2 3.63Å; W415-V470 HydrophobicContact CG-CG1 3.76Å; W415-M480 HydrophobicContact CD2-CE 3.66Å; W415-M480 HydrophobicContact CE3-CE 4.14Å; W415-M480 HydrophobicContact CG-CE 4.01Å; W415-M480 HydrophobicContact CH2-CB 3.9Å; W415-M480 HydrophobicContact CH2-CE 4.42Å; W415-M480 HydrophobicContact CZ2-CB 3.82Å; W415-M480 HydrophobicContact CZ2-CE 3.98Å; W415-K481 WeakPolarHBondContact CH2-O 3.35Å; W415-I482 HydrophobicContact CH2-CG1 4.33Å; W415-I482 HydrophobicContact CZ2-CD1 4.38Å; W415-I482 HydrophobicContact CZ2-CG1 3.84Å; W415-K495 HydrophobicContact CE3-CB 4.34Å; W415-K495 HydrophobicContact CH2-CB 4.45Å; W415-K495 HydrophobicContact CZ3-CB 3.98Å; W415-S496 WeakPolarHBondContact CH2-O 3.36Å; W415-A497 HydrophobicContact CE3-CB 4.22Å; W415-A497 HydrophobicContact CH2-CB 4.29Å; W415-A497 HydrophobicContact CZ3-CB 3.63Å
416	V	93.7	Very high	92.2	Very high	2 Å²	2	42.3 Å²	42.3	1%	0.012	22%	0.224	C	C	.	.	S	Bend	trans	-86.2	113.1	172.8	177.8	0	0	0	0	108.7	C412 E418 V419 I436 A455 I457 V470	C412-V416 WeakPolarHBondContact O-CB 3.25Å; C412-V416 WeakPolarHBondContact O-CG2 3.39Å; C412-V416 PolarHBondContact O-N 2.93Å; C412-V416 VanDerWaalsContact O-N 3.13Å; V416-E418 VanDerWaalsContact C-N 3.29Å; V416-E418 WeakPolarHBondContact CG1-OE2 3.46Å; V416-E418 PolarHBondContact O-N 2.95Å; V416-E418 VanDerWaalsContact O-N 3.1Å; V416-V419 HydrophobicContact CB-CB 4.33Å; V416-V419 HydrophobicContact CB-CG2 3.9Å; V416-V419 HydrophobicContact CG1-CG2 3.76Å; V416-V419 WeakPolarHBondContact O-CB 3.49Å; V416-V419 PolarHBondContact O-N 3.27Å; V416-I436 HydrophobicContact CG1-CD1 4.07Å; V416-I436 HydrophobicContact CG1-CG1 4.09Å; V416-I436 HydrophobicContact CG1-CG2 4.38Å; V416-A455 HydrophobicContact CG1-CB 4.34Å; V416-A455 HydrophobicContact CG2-CB 4.34Å; V416-I457 HydrophobicContact CG2-CG2 4.49Å; V416-V470 HydrophobicContact CG2-CG2 4.11Å
417	P	91.3	Very high	92.3	Very high	90 Å²	90	39.1 Å²	39.1	58%	0.584	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62	-25	-165.2	-27.8	37	0	0	0	116.7	W415 V419	W415-P417 WeakPolarHBondContact O-CD 3.23Å; P417-V419 VanDerWaalsContact C-N 3.34Å
418	E	92.5	Very high	92.1	Very high	42 Å²	42	39.6 Å²	39.6	20%	0.196	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.8	-4.3	178.7	-51.2	82.8	179	0	0	113.5	V416 G432 I436 R440	V416-E418 VanDerWaalsContact C-N 3.29Å; V416-E418 WeakPolarHBondContact CG1-OE2 3.46Å; V416-E418 PolarHBondContact O-N 2.95Å; V416-E418 VanDerWaalsContact O-N 3.1Å; E418-G432 CarbonylContact O-C 3.55Å; E418-G432 WeakPolarHBondContact O-CA 3.34Å; E418-I436 HydrophobicContact CB-CB 4.48Å; E418-I436 HydrophobicContact CB-CG1 4.09Å; E418-R440 IonicContact OE1-CZ 4Å; E418-R440 IonicContact OE1-NE 2.69Å; E418-R440 PolarHBondContact OE1-NE 3.12Å; E418-R440 IonicContact OE1-NH2 3.72Å; E418-R440 PolarHBondContact OE1-NH2 3.07Å; E418-R440 IonicContact OE2-CZ 2.6Å; E418-R440 IonicContact OE2-NE 3.24Å; E418-R440 PolarHBondContact OE2-NE 3.47Å; E418-R440 IonicContact OE2-NH2 2.7Å
419	V	93.8	Very high	91.9	Very high	11 Å²	11	42 Å²	42	7%	0.067	23%	0.232	C	C	.	.			trans	-96.1	138.3	179.7	-178.6	0	0	0	0	109.5	L391 V416 P417 L430 E431 I433 I436	L391-V419 HydrophobicContact CD1-CG1 4.36Å; L391-V419 HydrophobicContact CD1-CG2 4.05Å; L391-V419 HydrophobicContact CD2-CG2 4.4Å; V416-V419 HydrophobicContact CB-CB 4.33Å; V416-V419 HydrophobicContact CB-CG2 3.9Å; V416-V419 HydrophobicContact CG1-CG2 3.76Å; V416-V419 WeakPolarHBondContact O-CB 3.49Å; V416-V419 PolarHBondContact O-N 3.27Å; P417-V419 VanDerWaalsContact C-N 3.34Å; V419-L430 HydrophobicContact CG1-CB 4.36Å; V419-L430 HydrophobicContact CG1-CD2 3.85Å; V419-E431 WeakPolarHBondContact CG1-O 3.45Å; V419-I433 HydrophobicContact CG1-CG1 4.41Å; V419-I433 HydrophobicContact CG2-CG1 4.23Å; V419-I436 HydrophobicContact CG2-CD1 3.54Å; V419-I436 HydrophobicContact CG2-CG1 3.79Å
420	M	92	Very high	91.9	Very high	89 Å²	89	41.9 Å²	41.9	44%	0.438	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	168.3	-178	-59.2	-177.8	-62.2	0	0	109.8	L430 E431	M420-L430 CarbonylContact O-C 3.59Å; M420-L430 WeakPolarHBondContact O-CA 3.49Å; M420-E431 PolarHBondContact N-O 2.74Å; M420-E431 PolarHBondContact O-N 3.22Å
421	F	92.9	Very high	91.7	Very high	21 Å²	21	45.2 Å²	45.2	9%	0.092	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	131.8	167.1	-57.7	-90.8	0	0	0	108.2	V410 L414 N423 L424 L427 P429 L430	V410-F421 HydrophobicContact CG1-CE1 4.22Å; V410-F421 HydrophobicContact CG1-CZ 3.99Å; L414-F421 HydrophobicContact CD2-CE2 3.87Å; L414-F421 HydrophobicContact CD2-CZ 4.39Å; L414-F421 HydrophobicContact CG-CE2 4.05Å; L414-F421 HydrophobicContact CG-CZ 4.14Å; F421-N423 PolarHBondContact O-N 3.45Å; F421-L424 HydrophobicContact CB-CD2 4.42Å; F421-L427 HydrophobicContact CB-CD2 4.45Å; F421-L427 HydrophobicContact CD1-CB 3.95Å; F421-L427 HydrophobicContact CD1-CD2 4.26Å; F421-L427 WeakPolarHBondContact CD1-O 3.3Å; F421-L427 HydrophobicContact CD2-CD2 3.86Å; F421-L427 HydrophobicContact CE1-CB 4.06Å; F421-L427 HydrophobicContact CE1-CD2 4.47Å; F421-L427 HydrophobicContact CE2-CD2 4.12Å; F421-L427 HydrophobicContact CG-CB 4.42Å; F421-L427 HydrophobicContact CG-CD2 3.94Å; F421-L427 HydrophobicContact CZ-CD2 4.41Å; F421-P429 WeakPolarHBondContact CA-O 3.31Å; F421-L430 HydrophobicContact CD1-CD1 3.97Å; F421-L430 HydrophobicContact CD1-CG 3.75Å; F421-L430 HydrophobicContact CE1-CD1 3.74Å; F421-L430 HydrophobicContact CE1-CD2 3.99Å; F421-L430 HydrophobicContact CE1-CG 3.62Å; F421-L430 HydrophobicContact CZ-CD2 4.4Å; F421-L430 HydrophobicContact CZ-CG 4.44Å
422	A	89.2	Confident	91.5	Very high	56 Å²	56	45.3 Å²	45.3	46%	0.463	25%	0.251	S	S	.	.	S	Bend	trans	-63.8	-30	179.7	0	0	0	0	0	112.1	P429 E431	A422-P429 HydrophobicContact CB-CG 3.93Å; A422-P429 PolarHBondContact N-O 3.07Å; A422-E431 HydrophobicContact CB-CG 3.78Å
423	N	89	Confident	91.3	Very high	63 Å²	63	45.7 Å²	45.7	34%	0.337	25%	0.253	S	S	.	.			trans	-128.2	125.2	170.7	-174.8	-54.8	0	0	0	109.2	F421 T425 F426 L427	F421-N423 PolarHBondContact O-N 3.45Å; N423-T425 WeakPolarHBondContact OD1-CA 3.42Å; N423-T425 WeakPolarHBondContact OD1-CB 3.45Å; N423-T425 PolarHBondContact OD1-N 3.07Å; N423-F426 HydrophobicContact CB-CB 4.38Å; N423-F426 WeakPolarHBondContact OD1-CD2 3.44Å; N423-F426 PolarHBondContact OD1-N 3.41Å; N423-L427 VanDerWaalsContact O-CA 3.31Å; N423-L427 WeakPolarHBondContact O-CA 3.43Å; N423-L427 PolarHBondContact O-N 2.72Å
424	L	87.2	Confident	91.2	Very high	136 Å²	136	52.3 Å²	52.3	71%	0.712	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.7	-30.9	-177	-61.3	178	0	0	0	113	F421 L427	F421-L424 HydrophobicContact CB-CD2 4.42Å; L424-L427 VanDerWaalsContact O-CD2 3.25Å; L424-L427 WeakPolarHBondContact O-CD2 3.41Å
425	T	87.3	Confident	91.1	Very high	97 Å²	97	59.3 Å²	59.3	60%	0.595	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.2	-43.2	176.8	-47.1	0	0	0	0	111.7	G365 N423	G365-T425 WeakPolarHBondContact CA-O 3.34Å; N423-T425 WeakPolarHBondContact OD1-CA 3.42Å; N423-T425 WeakPolarHBondContact OD1-CB 3.45Å; N423-T425 PolarHBondContact OD1-N 3.07Å
426	F	89.1	Confident	91.1	Very high	80 Å²	80	58.6 Å²	58.6	35%	0.351	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.9	-10.5	-179.1	-73	-100.5	0	0	0	113.2	P367 K400 N423 E428	P367-F426 HydrophobicContact CB-CZ 4.4Å; P367-F426 HydrophobicContact CG-CD1 4.22Å; P367-F426 HydrophobicContact CG-CE1 3.63Å; P367-F426 HydrophobicContact CG-CZ 3.91Å; K400-F426 PolarHBondContact NZ-O 2.61Å; N423-F426 HydrophobicContact CB-CB 4.38Å; N423-F426 WeakPolarHBondContact OD1-CD2 3.44Å; N423-F426 PolarHBondContact OD1-N 3.41Å; F426-E428 HydrophobicContact CB-CG 4.09Å; F426-E428 PolarHBondContact O-N 3.33Å
427	L	91.7	Very high	91	Very high	20 Å²	20	60.7 Å²	60.7	11%	0.105	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	45.2	45.1	-173.7	-62.1	-179.5	0	0	0	113.3	E362 K400 V410 F421 N423 L424	E362-L427 WeakPolarHBondContact O-CD1 3.46Å; K400-L427 PolarHBondContact NZ-O 3.29Å; V410-L427 HydrophobicContact CG1-CD1 4.09Å; F421-L427 HydrophobicContact CB-CD2 4.45Å; F421-L427 HydrophobicContact CD1-CB 3.95Å; F421-L427 HydrophobicContact CD1-CD2 4.26Å; F421-L427 WeakPolarHBondContact CD1-O 3.3Å; F421-L427 HydrophobicContact CD2-CD2 3.86Å; F421-L427 HydrophobicContact CE1-CB 4.06Å; F421-L427 HydrophobicContact CE1-CD2 4.47Å; F421-L427 HydrophobicContact CE2-CD2 4.12Å; F421-L427 HydrophobicContact CG-CB 4.42Å; F421-L427 HydrophobicContact CG-CD2 3.94Å; F421-L427 HydrophobicContact CZ-CD2 4.41Å; N423-L427 VanDerWaalsContact O-CA 3.31Å; N423-L427 WeakPolarHBondContact O-CA 3.43Å; N423-L427 PolarHBondContact O-N 2.72Å; L424-L427 VanDerWaalsContact O-CD2 3.25Å; L424-L427 WeakPolarHBondContact O-CD2 3.41Å
428	E	89.2	Confident	91.1	Very high	41 Å²	41	59.3 Å²	59.3	19%	0.192	32%	0.322	C	S	.	.			trans	-164.5	159.7	175.8	63.5	-170.4	-138.9	0	0	112.4	R377 K400 F426	R377-E428 WeakPolarHBondContact CG-OE2 3.27Å; R377-E428 IonicContact CZ-OE1 3.81Å; R377-E428 IonicContact CZ-OE2 3.6Å; R377-E428 IonicContact NE-OE1 2.78Å; R377-E428 PolarHBondContact NE-OE1 3.44Å; R377-E428 IonicContact NE-OE2 3.85Å; R377-E428 PolarHBondContact NE-OE2 2.83Å; R377-E428 IonicContact NH2-OE1 2.65Å; R377-E428 PolarHBondContact NH2-OE1 3.31Å; R377-E428 IonicContact NH2-OE2 2.65Å; K400-E428 HydrophobicContact CD-CB 4.24Å; K400-E428 WeakPolarHBondContact CD-OE2 3.45Å; K400-E428 VanDerWaalsContact CE-OE2 3.25Å; K400-E428 WeakPolarHBondContact CE-OE2 3.34Å; K400-E428 IonicContact NZ-OE2 3.84Å; K400-E428 PolarHBondContact NZ-OE2 3.38Å; F426-E428 HydrophobicContact CB-CG 4.09Å; F426-E428 PolarHBondContact O-N 3.33Å
429	P	91.1	Very high	91.1	Very high	49 Å²	49	60.4 Å²	60.4	32%	0.318	34%	0.338	S	S	.	.	S	Bend	cis	-62.7	166.3	-23.5	29.2	-37.8	0	0	0	112.3	K401 T403 F421 A422	K401-P429 WeakPolarHBondContact O-CA 3.49Å; T403-P429 HydrophobicContact CG2-CB 3.99Å; T403-P429 HydrophobicContact CG2-CG 3.69Å; F421-P429 WeakPolarHBondContact CA-O 3.31Å; A422-P429 HydrophobicContact CB-CG 3.93Å; A422-P429 PolarHBondContact N-O 3.07Å
430	L	93.2	Very high	91.1	Very high	0 Å²	0	62.1 Å²	62.1	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	132.8	168.6	-73.2	84.1	0	0	0	111.1	K400 K401 T402 T403 A408 V419 M420 F421	K400-L430 HydrophobicContact CB-CD1 3.56Å; K401-L430 PolarHBondContact O-N 3.49Å; T402-L430 WeakPolarHBondContact CA-O 3.39Å; T402-L430 HydrophobicContact CG2-CB 4.31Å; T403-L430 PolarHBondContact N-O 2.92Å; A408-L430 HydrophobicContact CB-CD2 3.8Å; V419-L430 HydrophobicContact CG1-CB 4.36Å; V419-L430 HydrophobicContact CG1-CD2 3.85Å; M420-L430 CarbonylContact O-C 3.59Å; M420-L430 WeakPolarHBondContact O-CA 3.49Å; F421-L430 HydrophobicContact CD1-CD1 3.97Å; F421-L430 HydrophobicContact CD1-CG 3.75Å; F421-L430 HydrophobicContact CE1-CD1 3.74Å; F421-L430 HydrophobicContact CE1-CD2 3.99Å; F421-L430 HydrophobicContact CE1-CG 3.62Å; F421-L430 HydrophobicContact CZ-CD2 4.4Å; F421-L430 HydrophobicContact CZ-CG 4.44Å
431	E	92.5	Very high	91.2	Very high	71 Å²	71	61.1 Å²	61.1	33%	0.332	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	179.9	177.8	-48.6	-144.2	142.4	0	0	112	T403 V419 M420 A422 I433	T403-E431 HydrophobicContact CG2-CG 3.76Å; T403-E431 WeakPolarHBondContact CG2-OE1 3.32Å; V419-E431 WeakPolarHBondContact CG1-O 3.45Å; M420-E431 PolarHBondContact N-O 2.74Å; M420-E431 PolarHBondContact O-N 3.22Å; A422-E431 HydrophobicContact CB-CG 3.78Å; E431-I433 PolarHBondContact O-N 3.31Å; E431-I433 VanDerWaalsContact O-N 3.16Å
432	G	89.5	Confident	91.2	Very high	11 Å²	11	67.7 Å²	67.7	11%	0.113	36%	0.359	C	S	.	.			trans	77	-2.6	169.8	0	0	0	0	0	115.5	E418 D434 R435 I436	E418-G432 CarbonylContact O-C 3.55Å; E418-G432 WeakPolarHBondContact O-CA 3.34Å; G432-D434 VanDerWaalsContact C-N 3.27Å; G432-D434 PolarHBondContact O-N 3.49Å; G432-R435 WeakPolarHBondContact O-CA 3.47Å; G432-R435 VanDerWaalsContact O-CB 3.25Å; G432-R435 WeakPolarHBondContact O-CB 3.21Å; G432-R435 PolarHBondContact O-N 2.84Å; G432-I436 PolarHBondContact O-N 2.91Å
433	I	91.6	Very high	91.4	Very high	9 Å²	9	67 Å²	67	5%	0.046	35%	0.347	C	S	.	.	G	3₁₀ helix	trans	-59.1	-37	-176.6	-63	173.9	0	0	0	112.5	V390 L391 T402 V419 E431 R435 I436 W441	V390-I433 HydrophobicContact CG2-CD1 4Å; V390-I433 HydrophobicContact CG2-CG2 4.35Å; L391-I433 HydrophobicContact CD2-CG1 4.42Å; L391-I433 HydrophobicContact CD2-CG2 4.25Å; T402-I433 HydrophobicContact CG2-CD1 3.25Å; V419-I433 HydrophobicContact CG1-CG1 4.41Å; V419-I433 HydrophobicContact CG2-CG1 4.23Å; E431-I433 PolarHBondContact O-N 3.31Å; E431-I433 VanDerWaalsContact O-N 3.16Å; I433-R435 VanDerWaalsContact C-N 3.25Å; I433-R435 PolarHBondContact O-N 3.06Å; I433-I436 HydrophobicContact CB-CD1 4.37Å; I433-I436 HydrophobicContact CG2-CD1 4.14Å; I433-I436 WeakPolarHBondContact O-CB 3.26Å; I433-I436 WeakPolarHBondContact O-CD1 3.41Å; I433-I436 VanDerWaalsContact O-CG1 3.3Å; I433-I436 WeakPolarHBondContact O-CG1 3.25Å; I433-I436 PolarHBondContact O-N 3.3Å; I433-W441 HydrophobicContact CG2-CZ2 4.46Å
434	D	90.6	Very high	91.7	Very high	142 Å²	142	69 Å²	69	76%	0.759	36%	0.355	S	S	*	.	G	3₁₀ helix	trans	-78	-9.3	175.4	-60.1	-30.8	0	0	0	113.4	R406 G432	R406-D434 IonicContact NH2-OD1 2.81Å; G432-D434 VanDerWaalsContact C-N 3.27Å; G432-D434 PolarHBondContact O-N 3.49Å
435	R	91.7	Very high	92.1	Very high	191 Å²	191	62.6 Å²	62.6	72%	0.721	32%	0.321	S	S	*	.	G	3₁₀ helix	trans	-89.4	-11.7	172.1	-51.4	-175.1	-175.4	-161.3	4.4	112.6	G432 I433 A437	G432-R435 WeakPolarHBondContact O-CA 3.47Å; G432-R435 VanDerWaalsContact O-CB 3.25Å; G432-R435 WeakPolarHBondContact O-CB 3.21Å; G432-R435 PolarHBondContact O-N 2.84Å; I433-R435 VanDerWaalsContact C-N 3.25Å; I433-R435 PolarHBondContact O-N 3.06Å; R435-A437 PolarHBondContact O-N 3.11Å
436	I	93.4	Very high	92.3	Very high	10 Å²	10	58.9 Å²	58.9	5%	0.051	30%	0.297	C	S	.	.	S	Bend	trans	-58.4	121.3	178.9	-61.9	168.9	0	0	0	110.2	L391 V416 E418 V419 G432 I433 A438 R440 W441 A455	L391-I436 HydrophobicContact CD2-CD1 3.4Å; V416-I436 HydrophobicContact CG1-CD1 4.07Å; V416-I436 HydrophobicContact CG1-CG1 4.09Å; V416-I436 HydrophobicContact CG1-CG2 4.38Å; E418-I436 HydrophobicContact CB-CB 4.48Å; E418-I436 HydrophobicContact CB-CG1 4.09Å; V419-I436 HydrophobicContact CG2-CD1 3.54Å; V419-I436 HydrophobicContact CG2-CG1 3.79Å; G432-I436 PolarHBondContact O-N 2.91Å; I433-I436 HydrophobicContact CB-CD1 4.37Å; I433-I436 HydrophobicContact CG2-CD1 4.14Å; I433-I436 WeakPolarHBondContact O-CB 3.26Å; I433-I436 WeakPolarHBondContact O-CD1 3.41Å; I433-I436 VanDerWaalsContact O-CG1 3.3Å; I433-I436 WeakPolarHBondContact O-CG1 3.25Å; I433-I436 PolarHBondContact O-N 3.3Å; I436-A438 PolarHBondContact O-N 3.19Å; I436-R440 HydrophobicContact CG2-CB 4.01Å; I436-R440 HydrophobicContact CG2-CG 4.33Å; I436-W441 HydrophobicContact CB-CZ2 4.47Å; I436-W441 HydrophobicContact CD1-CZ2 3.9Å; I436-A455 HydrophobicContact CD1-CB 4.39Å; I436-A455 HydrophobicContact CG2-CB 4.04Å
437	A	92.9	Very high	92.4	Very high	46 Å²	46	55.1 Å²	55.1	38%	0.38	28%	0.281	S	S	.	.			trans	-52.1	129.3	-178.3	0	0	0	0	0	112	R435 A439 R440	R435-A437 PolarHBondContact O-N 3.11Å; A437-A439 PolarHBondContact O-N 3.08Å; A437-R440 PolarHBondContact O-N 2.87Å
438	A	91.9	Very high	92.3	Very high	60 Å²	60	55 Å²	55	50%	0.496	28%	0.281	S	S	.	.	H	α-helix	trans	-55.7	-18.7	-177.3	0	0	0	0	0	114.2	I436 R442	I436-A438 PolarHBondContact O-N 3.19Å; A438-R442 WeakPolarHBondContact O-CD 3.3Å; A438-R442 VanDerWaalsContact O-CG 3.32Å; A438-R442 WeakPolarHBondContact O-CG 3.41Å
439	A	93	Very high	92.3	Very high	65 Å²	65	59.1 Å²	59.1	54%	0.537	30%	0.298	S	S	.	.	H	α-helix	trans	-62.8	-45.4	170.4	0	0	0	0	0	112.9	A437 W441 R442 L443	A437-A439 PolarHBondContact O-N 3.08Å; A439-W441 VanDerWaalsContact C-N 3.28Å; A439-W441 PolarHBondContact O-N 2.92Å; A439-R442 CarbonylContact O-C 3.38Å; A439-R442 WeakPolarHBondContact O-CA 3.32Å; A439-R442 WeakPolarHBondContact O-CB 3.46Å; A439-R442 PolarHBondContact O-N 3.02Å; A439-L443 PolarHBondContact O-N 2.96Å; A439-L443 VanDerWaalsContact O-N 3.09Å
440	R	94.6	Very high	92.2	Very high	47 Å²	47	60.3 Å²	60.3	18%	0.177	30%	0.3	C	S	.	.	H	α-helix	trans	-60.4	-36	-174.3	-65.2	-160.9	-164.9	-77.2	-7.3	113.4	E418 I436 A437 R442 A455 C456	E418-R440 IonicContact OE1-CZ 4Å; E418-R440 IonicContact OE1-NE 2.69Å; E418-R440 PolarHBondContact OE1-NE 3.12Å; E418-R440 IonicContact OE1-NH2 3.72Å; E418-R440 PolarHBondContact OE1-NH2 3.07Å; E418-R440 IonicContact OE2-CZ 2.6Å; E418-R440 IonicContact OE2-NE 3.24Å; E418-R440 PolarHBondContact OE2-NE 3.47Å; E418-R440 IonicContact OE2-NH2 2.7Å; I436-R440 HydrophobicContact CG2-CB 4.01Å; I436-R440 HydrophobicContact CG2-CG 4.33Å; A437-R440 PolarHBondContact O-N 2.87Å; R440-R442 VanDerWaalsContact C-N 3.33Å; R440-A455 HydrophobicContact CB-CB 4.15Å; R440-C456 WeakPolarHBondContact CD-O 3.48Å; R440-C456 WeakPolarHBondContact CG-O 3.21Å; R440-C456 PolarHBondContact O-N 3.29Å
441	W	93.6	Very high	92.1	Very high	69 Å²	69	67.4 Å²	67.4	26%	0.261	33%	0.326	S	S	.	.	H	α-helix	trans	-68.2	-32.5	174.8	-59.5	96.8	0	0	0	112.7	V390 L391 I433 I436 A439 N452	V390-W441 WeakPolarHBondContact O-CH2 3.43Å; V390-W441 WeakPolarHBondContact O-CZ3 3.43Å; L391-W441 HydrophobicContact CD2-CH2 4.28Å; I433-W441 HydrophobicContact CG2-CZ2 4.46Å; I436-W441 HydrophobicContact CB-CZ2 4.47Å; I436-W441 HydrophobicContact CD1-CZ2 3.9Å; A439-W441 VanDerWaalsContact C-N 3.28Å; A439-W441 PolarHBondContact O-N 2.92Å; W441-N452 WeakPolarHBondContact O-CA 3.37Å; W441-N452 PolarHBondContact O-N 2.85Å; W441-N452 PolarHBondContact O-OD1 3.39Å
442	R	92.3	Very high	91.9	Very high	159 Å²	159	68.5 Å²	68.5	60%	0.6	34%	0.335	S	S	*	.	H	α-helix	trans	-88	-3.8	-178.8	-65.8	174.4	-175.8	-178.8	2.4	113.7	A438 A439 R440 R451	A438-R442 WeakPolarHBondContact O-CD 3.3Å; A438-R442 VanDerWaalsContact O-CG 3.32Å; A438-R442 WeakPolarHBondContact O-CG 3.41Å; A439-R442 CarbonylContact O-C 3.38Å; A439-R442 WeakPolarHBondContact O-CA 3.32Å; A439-R442 WeakPolarHBondContact O-CB 3.46Å; A439-R442 PolarHBondContact O-N 3.02Å; R440-R442 VanDerWaalsContact C-N 3.33Å; R442-R451 VanDerWaalsContact O-CZ 3.32Å; R442-R451 PolarHBondContact O-NE 3.1Å; R442-R451 PolarHBondContact O-NH2 3.03Å
443	L	94.4	Very high	92	Very high	40 Å²	40	70.7 Å²	70.7	21%	0.209	35%	0.346	C	S	.	.	S	Bend	trans	-72.7	154	169.6	-69.5	173.3	0	0	0	110.4	A439 C456 Q458 A467	A439-L443 PolarHBondContact O-N 2.96Å; A439-L443 VanDerWaalsContact O-N 3.09Å; L443-C456 HydrophobicContact CB-CB 3.79Å; L443-C456 HydrophobicContact CD1-CB 4.06Å; L443-Q458 HydrophobicContact CD1-CG 3.72Å; L443-A467 HydrophobicContact CB-CB 3.8Å; L443-A467 HydrophobicContact CD1-CB 3.81Å; L443-A467 HydrophobicContact CD2-CB 4.11Å; L443-A467 HydrophobicContact CG-CB 4.11Å
444	Q	94.7	Very high	92	Very high	107 Å²	107	70.3 Å²	70.3	50%	0.5	34%	0.344	S	S	.	.	B	Isolated β-bridge	trans	-105.9	126.6	174.1	-174.5	-179.5	8.3	0	0	108.7	F446 K449 R451	Q444-F446 PolarHBondContact O-N 2.95Å; Q444-K449 WeakPolarHBondContact CG-O 3.49Å; Q444-K449 PolarHBondContact NE2-O 2.95Å; Q444-R451 HydrophobicContact CB-CB 4.19Å; Q444-R451 HydrophobicContact CB-CG 4.44Å; Q444-R451 HydrophobicContact CG-CB 4.32Å
445	C	95.7	Very high	92.2	Very high	0 Å²	0	63.6 Å²	63.6	0%	0	31%	0.308	C	S	.	.			trans	-69.9	115.6	177.6	175.6	0	0	0	0	110	I447 C448 K449 Q450 A467 H469	C445-I447 PolarHBondContact O-N 2.69Å; C445-I447 VanDerWaalsContact O-N 3.15Å; C445-C448 PolarHBondContact SG-N 2.84Å; C445-K449 WeakPolarHBondContact O-CA 3.45Å; C445-K449 PolarHBondContact O-N 3.15Å; C445-Q450 PolarHBondContact N-O 2.78Å; C445-A467 CarbonylContact C-O 3.59Å; C445-A467 WeakPolarHBondContact CA-O 3.49Å; C445-H469 WeakPolarHBondContact CB-ND1 3.01Å; C445-H469 PolarHBondContact SG-N 2.86Å
446	F	92.7	Very high	92.5	Very high	20 Å²	20	54.5 Å²	54.5	9%	0.088	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-26	-177	86.1	-100.4	0	0	0	112.7	Q444 K449 R466 A467 F468 L478 C499 D500 L535 R539	Q444-F446 PolarHBondContact O-N 2.95Å; F446-K449 WeakPolarHBondContact O-CE 3.47Å; F446-R466 HydrophobicContact CD1-CB 4.34Å; F446-A467 WeakPolarHBondContact CD1-O 3.3Å; F446-A467 PolarHBondContact N-O 3.39Å; F446-F468 HydrophobicContact CD1-CB 4.11Å; F446-F468 AromaticContact CD1-CD1 3.88Å; F446-F468 HydrophobicContact CD1-CD1 3.88Å; F446-F468 HydrophobicContact CD1-CG 4.45Å; F446-F468 HydrophobicContact CE1-CB 4.1Å; F446-F468 AromaticContact CE1-CD1 3.54Å; F446-F468 HydrophobicContact CE1-CD1 3.54Å; F446-F468 HydrophobicContact CE1-CE1 4.27Å; F446-F468 HydrophobicContact CE1-CG 4.12Å; F446-L478 HydrophobicContact CE1-CD1 4.05Å; F446-L478 HydrophobicContact CZ-CD1 3.78Å; F446-C499 HydrophobicContact CE1-CB 3.98Å; F446-C499 HydrophobicContact CZ-CB 4.22Å; F446-D500 WeakPolarHBondContact CE2-OD1 3.4Å; F446-D500 WeakPolarHBondContact CZ-OD1 3.24Å; F446-L535 HydrophobicContact CD2-CD2 4.5Å; F446-L535 HydrophobicContact CE2-CD1 3.9Å; F446-L535 HydrophobicContact CE2-CD2 3.88Å; F446-R539 PolarHBondContact O-NH2 3.36Å
447	I	90.6	Very high	92.6	Very high	1 Å²	1	54.6 Å²	54.6	1%	0.005	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.2	-66.1	179.3	-52.7	170.5	0	0	0	108.9	C445 F468 C472 A473 A476 L478 L535 R539 L542	C445-I447 PolarHBondContact O-N 2.69Å; C445-I447 VanDerWaalsContact O-N 3.15Å; I447-F468 HydrophobicContact CD1-CB 3.87Å; I447-F468 HydrophobicContact CG1-CB 4.32Å; I447-C472 HydrophobicContact CB-CB 4.17Å; I447-C472 VanDerWaalsContact CD1-C 3.44Å; I447-C472 HydrophobicContact CD1-CB 3.88Å; I447-C472 WeakPolarHBondContact CD1-O 3.31Å; I447-C472 HydrophobicContact CG2-CB 4.22Å; I447-A473 HydrophobicContact CD1-CB 4.29Å; I447-A476 HydrophobicContact CD1-CB 4.06Å; I447-A476 HydrophobicContact CG2-CB 4.31Å; I447-L478 HydrophobicContact CD1-CD1 3.77Å; I447-L535 HydrophobicContact CB-CD1 4.38Å; I447-L535 HydrophobicContact CG1-CD1 4.08Å; I447-L535 HydrophobicContact CG2-CD1 3.98Å; I447-R539 HydrophobicContact CG2-CG 4.42Å; I447-R539 VanDerWaalsContact O-CG 3.31Å; I447-R539 WeakPolarHBondContact O-CG 3.48Å; I447-R539 PolarHBondContact O-NE 2.86Å; I447-L542 HydrophobicContact CG2-CD1 4.12Å
448	C	89.9	Confident	92.6	Very high	16 Å²	16	55.9 Å²	55.9	11%	0.108	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.2	9.7	-171.6	80.4	0	0	0	0	114.9	C445 Q450 H469	C445-C448 PolarHBondContact SG-N 2.84Å; C448-Q450 PolarHBondContact O-N 2.74Å; C448-H469 PolarHBondContact SG-ND1 3.21Å
449	K	89.4	Confident	92.8	Very high	129 Å²	129	53.5 Å²	53.5	56%	0.561	25%	0.252	S	S	*	.			trans	53.9	1.8	175	-59.5	-67.7	-171.9	163	0	117.9	Q444 C445 F446	Q444-K449 WeakPolarHBondContact CG-O 3.49Å; Q444-K449 PolarHBondContact NE2-O 2.95Å; C445-K449 WeakPolarHBondContact O-CA 3.45Å; C445-K449 PolarHBondContact O-N 3.15Å; F446-K449 WeakPolarHBondContact O-CE 3.47Å
450	Q	88.2	Confident	92.8	Very high	74 Å²	74	54.9 Å²	54.9	35%	0.346	25%	0.247	S	C	.	.			trans	-89.1	154.6	179.7	-69.5	177	8.2	0	0	113.2	C445 C448 V453	C445-Q450 PolarHBondContact N-O 2.78Å; C448-Q450 PolarHBondContact O-N 2.74Å; Q450-V453 HydrophobicContact CB-CG1 4.27Å; Q450-V453 HydrophobicContact CB-CG2 3.63Å
451	R	91.1	Very high	92.6	Very high	149 Å²	149	57.6 Å²	57.6	56%	0.562	26%	0.26	S	S	*	.	B	Isolated β-bridge	trans	-135	147.5	-176	-173.6	-176.9	-167.9	177.3	10.3	109	R442 Q444 V453	R442-R451 VanDerWaalsContact O-CZ 3.32Å; R442-R451 PolarHBondContact O-NE 3.1Å; R442-R451 PolarHBondContact O-NH2 3.03Å; Q444-R451 HydrophobicContact CB-CB 4.19Å; Q444-R451 HydrophobicContact CB-CG 4.44Å; Q444-R451 HydrophobicContact CG-CB 4.32Å; R451-V453 VanDerWaalsContact C-N 3.28Å; R451-V453 PolarHBondContact O-N 2.9Å
452	N	88.9	Confident	92.4	Very high	94 Å²	94	59.5 Å²	59.5	50%	0.503	28%	0.284	S	S	.	.	S	Bend	trans	58.8	31.2	-177.8	-49.1	-48.2	0	0	0	114.6	W441	W441-N452 WeakPolarHBondContact O-CA 3.37Å; W441-N452 PolarHBondContact O-N 2.85Å; W441-N452 PolarHBondContact O-OD1 3.39Å
453	V	90.5	Very high	92.3	Very high	57 Å²	57	55.8 Å²	55.8	35%	0.345	28%	0.282	S	S	.	.	S	Bend	trans	-120.5	2.8	178.7	-61.1	0	0	0	0	113.8	P393 Q450 R451	P393-V453 HydrophobicContact CB-CB 4.27Å; P393-V453 HydrophobicContact CB-CG2 3.98Å; P393-V453 HydrophobicContact CG-CG2 3.9Å; Q450-V453 HydrophobicContact CB-CG1 4.27Å; Q450-V453 HydrophobicContact CB-CG2 3.63Å; R451-V453 VanDerWaalsContact C-N 3.28Å; R451-V453 PolarHBondContact O-N 2.9Å
454	G	92.6	Very high	92.3	Very high	1 Å²	1	54.4 Å²	54.4	1%	0.01	28%	0.276	C	S	.	.	S	Bend	trans	170.3	175.8	-173.7	0	0	0	0	0	110.1	L391	L391-G454 CarbonylContact O-C 3.54Å; L391-G454 WeakPolarHBondContact O-CA 3.21Å
455	A	95.3	Very high	92.2	Very high	1 Å²	1	57.8 Å²	57.8	1%	0.008	29%	0.285	C	S	.	.	P	Polyproline II helix	trans	-92.6	122.8	174	0	0	0	0	0	109.3	L391 V416 I436 R440	L391-A455 PolarHBondContact O-N 2.91Å; V416-A455 HydrophobicContact CG1-CB 4.34Å; V416-A455 HydrophobicContact CG2-CB 4.34Å; I436-A455 HydrophobicContact CD1-CB 4.39Å; I436-A455 HydrophobicContact CG2-CB 4.04Å; R440-A455 HydrophobicContact CB-CB 4.15Å
456	C	96.4	Very high	92.1	Very high	0 Å²	0	60.8 Å²	60.8	0%	0	30%	0.296	C	S	.	.	P	Polyproline II helix	trans	-89.4	142.8	172	-63.9	0	0	0	0	111.5	R440 L443 A467 F468	R440-C456 WeakPolarHBondContact CD-O 3.48Å; R440-C456 WeakPolarHBondContact CG-O 3.21Å; R440-C456 PolarHBondContact O-N 3.29Å; L443-C456 HydrophobicContact CB-CB 3.79Å; L443-C456 HydrophobicContact CD1-CB 4.06Å; C456-A467 HydrophobicContact CB-CB 4.07Å; C456-F468 CarbonylContact C-O 3.52Å; C456-F468 VanDerWaalsContact CA-O 3.28Å; C456-F468 WeakPolarHBondContact CA-O 3.33Å; C456-F468 WeakPolarHBondContact CB-O 3.46Å
457	I	95.4	Very high	92.2	Very high	11 Å²	11	60.1 Å²	60.1	6%	0.056	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	171.2	156.6	57.3	171.5	0	0	0	109.8	W415 V416 A467 F468 V470 A497	W415-I457 HydrophobicContact CE3-CD1 4.31Å; W415-I457 WeakPolarHBondContact O-CG2 3.37Å; V416-I457 HydrophobicContact CG2-CG2 4.49Å; I457-A467 CarbonylContact O-C 3.53Å; I457-A467 VanDerWaalsContact O-CA 3.27Å; I457-A467 WeakPolarHBondContact O-CA 3.38Å; I457-F468 HydrophobicContact CD1-CD2 4.03Å; I457-F468 HydrophobicContact CD1-CE2 3.57Å; I457-F468 HydrophobicContact CD1-CZ 4.46Å; I457-F468 HydrophobicContact CG1-CD2 3.68Å; I457-F468 HydrophobicContact CG1-CE2 3.62Å; I457-F468 HydrophobicContact CG1-CZ 4.43Å; I457-F468 WeakPolarHBondContact CG1-O 3.43Å; I457-F468 PolarHBondContact N-O 2.95Å; I457-F468 PolarHBondContact O-N 2.95Å; I457-V470 HydrophobicContact CD1-CG2 4.11Å; I457-V470 HydrophobicContact CG1-CG2 4.28Å; I457-V470 HydrophobicContact CG2-CG2 4.28Å; I457-A497 HydrophobicContact CD1-CB 4.18Å
458	Q	94.5	Very high	92.5	Very high	73 Å²	73	60 Å²	60	34%	0.341	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	161.6	178.2	-67.5	179.5	-88.9	0	0	109.8	L443 Y465 A467	L443-Q458 HydrophobicContact CD1-CG 3.72Å; Q458-Y465 PolarHBondContact NE2-O 3.44Å; Q458-Y465 VanDerWaalsContact NE2-O 3.07Å; Q458-A467 HydrophobicContact CG-CB 3.95Å
459	C	95.1	Very high	92.8	Very high	10 Å²	10	59.3 Å²	59.3	7%	0.068	29%	0.289	C	S	.	.			trans	-58.3	136.5	173.7	-177.2	0	0	0	0	111.1	K461 C464 R466 F468 A497 C499	C459-K461 VanDerWaalsContact C-N 3.26Å; C459-K461 PolarHBondContact O-N 3.25Å; C459-C464 HydrophobicContact CB-CB 3.84Å; C459-C464 VanDerWaalsContact CB-SG 3.53Å; C459-R466 PolarHBondContact N-O 2.87Å; C459-R466 VanDerWaalsContact N-O 3.1Å; C459-F468 HydrophobicContact CB-CE1 4.38Å; C459-A497 CarbonylContact C-O 3.59Å; C459-A497 WeakPolarHBondContact CA-O 3.32Å; C459-C499 HydrophobicContact CB-CB 4.41Å; C459-C499 PolarHBondContact SG-N 2.95Å
460	H	92.9	Very high	93	Very high	95 Å²	95	53.2 Å²	53.2	44%	0.44	26%	0.263	S	S	.	.	S	Bend	trans	-70.3	-17.7	-178.5	-171.3	93.7	0	0	0	113.6	S462 A497 F498	H460-S462 PolarHBondContact O-N 2.84Å; H460-A497 WeakPolarHBondContact CB-O 3.47Å; H460-A497 PolarHBondContact N-O 2.97Å; H460-F498 HydrophobicContact CB-CD1 4.31Å; H460-F498 HydrophobicContact CB-CE1 3.86Å; H460-F498 HydrophobicContact CB-CZ 4.08Å
461	K	91.5	Very high	93.3	Very high	104 Å²	104	49.9 Å²	49.9	45%	0.452	25%	0.247	S	C	.	.	S	Bend	trans	-65.8	118.7	171.7	-178.2	70.6	174.3	-175.1	0	109	C459 S463 C464 F498 H502	C459-K461 VanDerWaalsContact C-N 3.26Å; C459-K461 PolarHBondContact O-N 3.25Å; K461-S463 PolarHBondContact O-N 2.82Å; K461-C464 HydrophobicContact CB-CB 4.03Å; K461-C464 HydrophobicContact CG-CB 4.4Å; K461-C464 WeakPolarHBondContact O-CB 3.25Å; K461-C464 PolarHBondContact O-N 2.88Å; K461-F498 HydrophobicContact CB-CD1 4.45Å; K461-F498 HydrophobicContact CB-CE1 4.46Å; K461-H502 HydrophobicContact CB-CB 4.44Å
462	S	87.9	Confident	93.3	Very high	109 Å²	109	42.8 Å²	42.8	76%	0.762	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.1	-30	-172	51.4	0	0	0	0	115.9	H460	H460-S462 PolarHBondContact O-N 2.84Å
463	S	90.5	Very high	93.5	Very high	80 Å²	80	38.3 Å²	38.3	56%	0.559	20%	0.197	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.9	-1.8	176	54.6	0	0	0	0	114.7	K461	K461-S463 PolarHBondContact O-N 2.82Å
464	C	94.4	Very high	93.5	Very high	11 Å²	11	36.1 Å²	36.1	7%	0.074	18%	0.183	C	C	.	.			trans	-113.3	99.5	-168.2	-172.6	0	0	0	0	113.4	C459 K461 R466 C499 H502	C459-C464 HydrophobicContact CB-CB 3.84Å; C459-C464 VanDerWaalsContact CB-SG 3.53Å; K461-C464 HydrophobicContact CB-CB 4.03Å; K461-C464 HydrophobicContact CG-CB 4.4Å; K461-C464 WeakPolarHBondContact O-CB 3.25Å; K461-C464 PolarHBondContact O-N 2.88Å; C464-R466 PolarHBondContact O-N 2.93Å; C464-C499 PolarHBondContact SG-SG 2.83Å; C464-H502 PolarHBondContact SG-ND1 2.89Å; C464-H502 VanDerWaalsContact SG-ND1 3.41Å
465	Y	92.9	Very high	93.1	Very high	178 Å²	178	38.2 Å²	38.2	70%	0.698	19%	0.192	S	C	*	.			trans	-79.6	3.2	178.8	-55.1	-65.9	0	0	0	115	Q458 A467	Q458-Y465 PolarHBondContact NE2-O 3.44Å; Q458-Y465 VanDerWaalsContact NE2-O 3.07Å; Y465-A467 PolarHBondContact O-N 2.88Å; Y465-A467 VanDerWaalsContact O-N 3.15Å
466	R	93.8	Very high	92.7	Very high	63 Å²	63	38.5 Å²	38.5	24%	0.238	19%	0.194	C	C	.	.			trans	-59.2	117.1	-178	-68.3	-175.8	65.3	169.2	-3.6	110.6	F446 C459 C464 C499 D500	F446-R466 HydrophobicContact CD1-CB 4.34Å; C459-R466 PolarHBondContact N-O 2.87Å; C459-R466 VanDerWaalsContact N-O 3.1Å; C464-R466 PolarHBondContact O-N 2.93Å; R466-C499 HydrophobicContact CB-CB 4.16Å; R466-D500 IonicContact CZ-OD1 3.6Å; R466-D500 VanDerWaalsContact CZ-OD1 3.24Å; R466-D500 IonicContact CZ-OD2 3.11Å; R466-D500 IonicContact NE-OD1 2.8Å; R466-D500 IonicContact NH1-OD1 2.81Å; R466-D500 IonicContact NH1-OD2 3.97Å; R466-D500 PolarHBondContact NH1-OD2 2.93Å; R466-D500 IonicContact NH2-OD1 2.73Å; R466-D500 PolarHBondContact NH2-OD1 2.93Å; R466-D500 IonicContact NH2-OD2 2.96Å; R466-D500 PolarHBondContact NH2-OD2 3.44Å
467	A	95	Very high	92.1	Very high	6 Å²	6	39 Å²	39	5%	0.05	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	148.6	-172.3	0	0	0	0	0	113.1	L443 C445 F446 C456 I457 Q458 Y465	L443-A467 HydrophobicContact CB-CB 3.8Å; L443-A467 HydrophobicContact CD1-CB 3.81Å; L443-A467 HydrophobicContact CD2-CB 4.11Å; L443-A467 HydrophobicContact CG-CB 4.11Å; C445-A467 CarbonylContact C-O 3.59Å; C445-A467 WeakPolarHBondContact CA-O 3.49Å; F446-A467 WeakPolarHBondContact CD1-O 3.3Å; F446-A467 PolarHBondContact N-O 3.39Å; C456-A467 HydrophobicContact CB-CB 4.07Å; I457-A467 CarbonylContact O-C 3.53Å; I457-A467 VanDerWaalsContact O-CA 3.27Å; I457-A467 WeakPolarHBondContact O-CA 3.38Å; Q458-A467 HydrophobicContact CG-CB 3.95Å; Y465-A467 PolarHBondContact O-N 2.88Å; Y465-A467 VanDerWaalsContact O-N 3.15Å
468	F	95.7	Very high	91.8	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.6	150.3	-178	44.2	-90	0	0	0	113	F446 I447 C456 I457 C459 A473 A497	F446-F468 HydrophobicContact CD1-CB 4.11Å; F446-F468 AromaticContact CD1-CD1 3.88Å; F446-F468 HydrophobicContact CD1-CD1 3.88Å; F446-F468 HydrophobicContact CD1-CG 4.45Å; F446-F468 HydrophobicContact CE1-CB 4.1Å; F446-F468 AromaticContact CE1-CD1 3.54Å; F446-F468 HydrophobicContact CE1-CD1 3.54Å; F446-F468 HydrophobicContact CE1-CE1 4.27Å; F446-F468 HydrophobicContact CE1-CG 4.12Å; I447-F468 HydrophobicContact CD1-CB 3.87Å; I447-F468 HydrophobicContact CG1-CB 4.32Å; C456-F468 CarbonylContact C-O 3.52Å; C456-F468 VanDerWaalsContact CA-O 3.28Å; C456-F468 WeakPolarHBondContact CA-O 3.33Å; C456-F468 WeakPolarHBondContact CB-O 3.46Å; I457-F468 HydrophobicContact CD1-CD2 4.03Å; I457-F468 HydrophobicContact CD1-CE2 3.57Å; I457-F468 HydrophobicContact CD1-CZ 4.46Å; I457-F468 HydrophobicContact CG1-CD2 3.68Å; I457-F468 HydrophobicContact CG1-CE2 3.62Å; I457-F468 HydrophobicContact CG1-CZ 4.43Å; I457-F468 WeakPolarHBondContact CG1-O 3.43Å; I457-F468 PolarHBondContact N-O 2.95Å; I457-F468 PolarHBondContact O-N 2.95Å; C459-F468 HydrophobicContact CB-CE1 4.38Å; F468-A473 HydrophobicContact CD2-CB 3.47Å; F468-A473 VanDerWaalsContact CD2-CB 3.47Å; F468-A473 HydrophobicContact CE2-CB 3.71Å; F468-A473 HydrophobicContact CG-CB 4.35Å; F468-A497 HydrophobicContact CE2-CB 4.2Å; F468-A497 HydrophobicContact CZ-CB 4.18Å
469	H	96	Very high	91.6	Very high	1 Å²	1	37.6 Å²	37.6	1%	0.005	19%	0.192	C	C	.	.			trans	-72.2	141.1	166.6	-57.2	114.8	0	0	0	109.6	C392 P393 C445 C448 T471 C472 A473	C392-H469 HydrophobicContact CB-CB 4.01Å; P393-H469 WeakPolarHBondContact CD-ND1 3.49Å; C445-H469 WeakPolarHBondContact CB-ND1 3.01Å; C445-H469 PolarHBondContact SG-N 2.86Å; C448-H469 PolarHBondContact SG-ND1 3.21Å; H469-T471 PolarHBondContact O-N 2.99Å; H469-C472 HydrophobicContact CB-CB 4.11Å; H469-C472 WeakPolarHBondContact O-CA 3.45Å; H469-C472 WeakPolarHBondContact O-CB 3.03Å; H469-C472 PolarHBondContact O-N 3.35Å; H469-A473 PolarHBondContact O-N 3.49Å; H469-A473 VanDerWaalsContact O-N 3.08Å
470	V	95.2	Very high	91.4	Very high	1 Å²	1	39 Å²	39	1%	0.006	20%	0.198	C	C	.	.	H	α-helix	trans	-49.1	-56.2	-179.5	-176.8	0	0	0	0	112.4	I411 W415 V416 I457 C472 A473 Q474 M480	I411-V470 HydrophobicContact CD1-CG1 4.09Å; I411-V470 HydrophobicContact CG1-CG1 3.79Å; I411-V470 HydrophobicContact CG2-CG1 4.41Å; W415-V470 HydrophobicContact CB-CB 4.27Å; W415-V470 HydrophobicContact CB-CG1 3.56Å; W415-V470 HydrophobicContact CB-CG2 3.63Å; W415-V470 HydrophobicContact CG-CG1 3.76Å; V416-V470 HydrophobicContact CG2-CG2 4.11Å; I457-V470 HydrophobicContact CD1-CG2 4.11Å; I457-V470 HydrophobicContact CG1-CG2 4.28Å; I457-V470 HydrophobicContact CG2-CG2 4.28Å; V470-C472 PolarHBondContact O-N 3.31Å; V470-A473 WeakPolarHBondContact O-CB 3.34Å; V470-A473 PolarHBondContact O-N 3.13Å; V470-A473 VanDerWaalsContact O-N 3.09Å; V470-Q474 PolarHBondContact O-N 3.32Å; V470-M480 HydrophobicContact CG1-CE 3.81Å
471	T	93.2	Very high	91.1	Very high	3 Å²	3	38.9 Å²	38.9	2%	0.018	20%	0.196	C	C	.	.	H	α-helix	trans	-68.6	-20.3	180	52.8	0	0	0	0	113.7	C392 N394 H409 I411 H469 H475	C392-T471 PolarHBondContact SG-OG1 2.92Å; N394-T471 PolarHBondContact ND2-OG1 2.97Å; H409-T471 HydrophobicContact CB-CG2 4.49Å; I411-T471 HydrophobicContact CG2-CG2 3.55Å; H469-T471 PolarHBondContact O-N 2.99Å; T471-H475 WeakPolarHBondContact O-CB 3.26Å; T471-H475 PolarHBondContact O-N 2.64Å; T471-H475 VanDerWaalsContact O-N 3.09Å; T471-H475 PolarHBondContact O-ND1 3.16Å
472	C	92.5	Very high	90.8	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-73.5	-35.5	171.1	-70.5	0	0	0	0	111.6	N394 I447 H469 V470 A476 L542	N394-C472 PolarHBondContact ND2-SG 2.81Å; N394-C472 VanDerWaalsContact ND2-SG 3.44Å; I447-C472 HydrophobicContact CB-CB 4.17Å; I447-C472 VanDerWaalsContact CD1-C 3.44Å; I447-C472 HydrophobicContact CD1-CB 3.88Å; I447-C472 WeakPolarHBondContact CD1-O 3.31Å; I447-C472 HydrophobicContact CG2-CB 4.22Å; H469-C472 HydrophobicContact CB-CB 4.11Å; H469-C472 WeakPolarHBondContact O-CA 3.45Å; H469-C472 WeakPolarHBondContact O-CB 3.03Å; H469-C472 PolarHBondContact O-N 3.35Å; V470-C472 PolarHBondContact O-N 3.31Å; C472-A476 WeakPolarHBondContact O-CB 3.5Å; C472-A476 PolarHBondContact O-N 3.43Å; C472-A476 VanDerWaalsContact O-N 3.09Å; C472-L542 HydrophobicContact CB-CD1 4.26Å
473	A	92.5	Very high	90.4	Very high	0 Å²	0	35 Å²	35	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-69.2	-44.9	174.7	0	0	0	0	0	111.8	I447 F468 H469 V470 H475 A476 G477 L478 M480	I447-A473 HydrophobicContact CD1-CB 4.29Å; F468-A473 HydrophobicContact CD2-CB 3.47Å; F468-A473 VanDerWaalsContact CD2-CB 3.47Å; F468-A473 HydrophobicContact CE2-CB 3.71Å; F468-A473 HydrophobicContact CG-CB 4.35Å; H469-A473 PolarHBondContact O-N 3.49Å; H469-A473 VanDerWaalsContact O-N 3.08Å; V470-A473 WeakPolarHBondContact O-CB 3.34Å; V470-A473 PolarHBondContact O-N 3.13Å; V470-A473 VanDerWaalsContact O-N 3.09Å; A473-H475 PolarHBondContact O-N 3.22Å; A473-A476 CarbonylContact O-C 3.54Å; A473-A476 PolarHBondContact O-N 3.22Å; A473-G477 PolarHBondContact O-N 3.2Å; A473-G477 VanDerWaalsContact O-N 3.17Å; A473-L478 HydrophobicContact CB-CB 4.17Å; A473-L478 HydrophobicContact CB-CD1 3.81Å; A473-L478 HydrophobicContact CB-CG 4.36Å; A473-L478 PolarHBondContact O-N 3.18Å; A473-L478 VanDerWaalsContact O-N 3.16Å; A473-M480 HydrophobicContact CB-CG 4.49Å; A473-M480 HydrophobicContact CB-SD 3.53Å; A473-M480 VanDerWaalsContact CB-SD 3.53Å
474	Q	90.5	Very high	89.5	Confident	11 Å²	11	38 Å²	38	5%	0.051	17%	0.174	C	C	.	.	H	α-helix	trans	-49.4	-59.6	170	-172.9	-168.3	23	0	0	110.9	A336 Q339 I411 V470 A476 G477	A336-Q474 PolarHBondContact O-NE2 2.99Å; Q339-Q474 VanDerWaalsContact CD-CG 3.4Å; Q339-Q474 HydrophobicContact CG-CG 3.83Å; Q339-Q474 VanDerWaalsContact OE1-CG 3.3Å; Q339-Q474 PolarHBondContact OE1-O 2.8Å; Q339-Q474 VanDerWaalsContact OE1-O 3.13Å; I411-Q474 HydrophobicContact CD1-CB 4.1Å; I411-Q474 HydrophobicContact CD1-CG 3.94Å; V470-Q474 PolarHBondContact O-N 3.32Å; Q474-A476 PolarHBondContact O-N 3.01Å; Q474-A476 VanDerWaalsContact O-N 3.11Å; Q474-G477 PolarHBondContact O-N 3Å
475	H	85.1	Confident	88.2	Confident	46 Å²	46	38.8 Å²	38.8	21%	0.213	18%	0.178	C	C	.	.	H	α-helix	trans	-66.4	-13.4	179.9	-75.9	68.8	0	0	0	114.6	T471 A473 A538 L542	T471-H475 WeakPolarHBondContact O-CB 3.26Å; T471-H475 PolarHBondContact O-N 2.64Å; T471-H475 VanDerWaalsContact O-N 3.09Å; T471-H475 PolarHBondContact O-ND1 3.16Å; A473-H475 PolarHBondContact O-N 3.22Å; H475-A538 VanDerWaalsContact O-CB 3.25Å; H475-A538 WeakPolarHBondContact O-CB 3.46Å; H475-L542 HydrophobicContact CB-CD1 4.09Å; H475-L542 HydrophobicContact CB-CD2 3.79Å; H475-L542 HydrophobicContact CB-CG 4.03Å
476	A	85.4	Confident	86.8	Confident	6 Å²	6	38 Å²	38	5%	0.05	19%	0.186	C	C	.	.	H	α-helix	trans	-94	-5.3	175.6	0	0	0	0	0	113.8	I447 C472 A473 Q474 L478 L535 A538	I447-A476 HydrophobicContact CD1-CB 4.06Å; I447-A476 HydrophobicContact CG2-CB 4.31Å; C472-A476 WeakPolarHBondContact O-CB 3.5Å; C472-A476 PolarHBondContact O-N 3.43Å; C472-A476 VanDerWaalsContact O-N 3.09Å; A473-A476 CarbonylContact O-C 3.54Å; A473-A476 PolarHBondContact O-N 3.22Å; Q474-A476 PolarHBondContact O-N 3.01Å; Q474-A476 VanDerWaalsContact O-N 3.11Å; A476-L478 VanDerWaalsContact C-N 3.32Å; A476-L478 HydrophobicContact CB-CG 4.15Å; A476-L535 HydrophobicContact CB-CD1 4.29Å; A476-A538 HydrophobicContact CB-CB 4.01Å
477	G	84.8	Confident	85.2	Confident	12 Å²	12	39.2 Å²	39.2	12%	0.124	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	62.5	39	-174.1	0	0	0	0	0	112.3	A473 Q474 H507 F508	A473-G477 PolarHBondContact O-N 3.2Å; A473-G477 VanDerWaalsContact O-N 3.17Å; Q474-G477 PolarHBondContact O-N 3Å; G477-H507 PolarHBondContact O-CE1 2.88Å; G477-H507 VanDerWaalsContact O-CE1 3.24Å; G477-F508 WeakPolarHBondContact O-CE1 3.43Å
478	L	89.1	Confident	83.5	Confident	7 Å²	7	45.7 Å²	45.7	4%	0.037	24%	0.239	C	C	.	.			trans	-79	148.9	170.1	-64.1	-176.8	0	0	0	110.4	F446 I447 A473 A476 M480 D500	F446-L478 HydrophobicContact CE1-CD1 4.05Å; F446-L478 HydrophobicContact CZ-CD1 3.78Å; I447-L478 HydrophobicContact CD1-CD1 3.77Å; A473-L478 HydrophobicContact CB-CB 4.17Å; A473-L478 HydrophobicContact CB-CD1 3.81Å; A473-L478 HydrophobicContact CB-CG 4.36Å; A473-L478 PolarHBondContact O-N 3.18Å; A473-L478 VanDerWaalsContact O-N 3.16Å; A476-L478 VanDerWaalsContact C-N 3.32Å; A476-L478 HydrophobicContact CB-CG 4.15Å; L478-M480 PolarHBondContact O-N 2.81Å; L478-D500 HydrophobicContact CD2-CB 4.35Å
479	Y	89.6	Confident	81.7	Confident	46 Å²	46	49.6 Å²	49.6	18%	0.18	28%	0.28	C	S	.	.			trans	-59.1	121.8	174.6	-171.3	-75.4	0	0	0	110.3	K481 A497 F498 P504 H507	Y479-K481 HydrophobicContact CD1-CB 4.35Å; Y479-K481 HydrophobicContact CE1-CB 3.5Å; Y479-K481 VanDerWaalsContact CE1-CB 3.5Å; Y479-K481 HydrophobicContact CE1-CD 4.49Å; Y479-K481 WeakPolarHBondContact OH-CD 3.48Å; Y479-A497 WeakPolarHBondContact O-CA 3.39Å; Y479-F498 AromaticContact CD1-CD2 3.59Å; Y479-F498 HydrophobicContact CD1-CD2 3.59Å; Y479-F498 AromaticContact CD1-CE2 3.92Å; Y479-F498 HydrophobicContact CD1-CE2 3.92Å; Y479-F498 HydrophobicContact CE1-CD2 4.25Å; Y479-F498 HydrophobicContact CE1-CE2 4.1Å; Y479-F498 HydrophobicContact CG-CD2 4.15Å; Y479-F498 PolarHBondContact O-N 2.82Å; Y479-P504 HydrophobicContact CD2-CG 3.67Å; Y479-P504 HydrophobicContact CE2-CG 3.68Å; Y479-P504 HydrophobicContact CG-CG 4.29Å; Y479-H507 HydrophobicContact CD2-CB 4.25Å; Y479-H507 AromaticContact CD2-CD2 3.41Å; Y479-H507 VanDerWaalsContact CD2-CD2 3.41Å; Y479-H507 WeakPolarHBondContact CD2-CD2 3.29Å; Y479-H507 AromaticContact CD2-CG 3.91Å
480	M	90.4	Very high	79.9	Confident	39 Å²	39	54.4 Å²	54.4	19%	0.192	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	102.1	178.7	-70.2	-178.8	68.9	0	0	108.3	W415 V470 A473 L478 S496 A497	W415-M480 HydrophobicContact CD2-CE 3.66Å; W415-M480 HydrophobicContact CE3-CE 4.14Å; W415-M480 HydrophobicContact CG-CE 4.01Å; W415-M480 HydrophobicContact CH2-CB 3.9Å; W415-M480 HydrophobicContact CH2-CE 4.42Å; W415-M480 HydrophobicContact CZ2-CB 3.82Å; W415-M480 HydrophobicContact CZ2-CE 3.98Å; V470-M480 HydrophobicContact CG1-CE 3.81Å; A473-M480 HydrophobicContact CB-CG 4.49Å; A473-M480 HydrophobicContact CB-SD 3.53Å; A473-M480 VanDerWaalsContact CB-SD 3.53Å; L478-M480 PolarHBondContact O-N 2.81Å; M480-S496 WeakPolarHBondContact CA-O 3.43Å; M480-A497 HydrophobicContact CG-CB 4.05Å
481	K	86.8	Confident	77.9	Confident	94 Å²	94	62.3 Å²	62.3	41%	0.409	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	146.5	-179.9	-165.5	-179.3	171	-153.9	0	111.3	W415 Y479 E483 S496	W415-K481 WeakPolarHBondContact CH2-O 3.35Å; Y479-K481 HydrophobicContact CD1-CB 4.35Å; Y479-K481 HydrophobicContact CE1-CB 3.5Å; Y479-K481 VanDerWaalsContact CE1-CB 3.5Å; Y479-K481 HydrophobicContact CE1-CD 4.49Å; Y479-K481 WeakPolarHBondContact OH-CD 3.48Å; K481-E483 HydrophobicContact CB-CG 4.4Å; K481-E483 HydrophobicContact CD-CG 3.66Å; K481-E483 WeakPolarHBondContact CD-OE1 3.29Å; K481-E483 WeakPolarHBondContact CE-OE1 3.25Å; K481-E483 HydrophobicContact CG-CG 3.77Å; K481-E483 IonicContact NZ-OE1 3.96Å; K481-E483 PolarHBondContact NZ-OE1 2.64Å; K481-S496 PolarHBondContact N-O 3.23Å; K481-S496 PolarHBondContact O-N 2.9Å; K481-S496 PolarHBondContact O-OG 2.65Å
482	I	86.1	Confident	76.4	Confident	72 Å²	72	63.4 Å²	63.4	37%	0.369	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	128.7	168	-56.1	-177.2	0	0	0	106	W415 I493 K495	W415-I482 HydrophobicContact CH2-CG1 4.33Å; W415-I482 HydrophobicContact CZ2-CD1 4.38Å; W415-I482 HydrophobicContact CZ2-CG1 3.84Å; I482-I493 HydrophobicContact CG2-CG2 3.41Å; I482-I493 VanDerWaalsContact CG2-CG2 3.41Å; I482-K495 HydrophobicContact CG1-CG 4.25Å; I482-K495 HydrophobicContact CG2-CG 4.29Å
483	E	79.4	Confident	75.6	Confident	58 Å²	58	67.7 Å²	67.7	27%	0.271	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	128.6	-171.9	-61.1	-177.7	114.5	0	0	108.4	K481 I493 R494 S496	K481-E483 HydrophobicContact CB-CG 4.4Å; K481-E483 HydrophobicContact CD-CG 3.66Å; K481-E483 WeakPolarHBondContact CD-OE1 3.29Å; K481-E483 WeakPolarHBondContact CE-OE1 3.25Å; K481-E483 HydrophobicContact CG-CG 3.77Å; K481-E483 IonicContact NZ-OE1 3.96Å; K481-E483 PolarHBondContact NZ-OE1 2.64Å; E483-I493 CarbonylContact O-C 3.56Å; E483-R494 HydrophobicContact CB-CB 4.48Å; E483-R494 PolarHBondContact N-O 3.32Å; E483-R494 PolarHBondContact O-N 3.01Å; E483-S496 PolarHBondContact OE2-OG 2.96Å
484	H	71.6	Confident	75.1	Confident	145 Å²	145	72.4 Å²	72.4	67%	0.671	40%	0.398	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.6	150.3	167.9	-70.2	-85.2	0	0	0	109.4	G492	H484-G492 VanDerWaalsContact CA-O 3.28Å; H484-G492 WeakPolarHBondContact CA-O 3.47Å
485	T	66.7	Low	75	Confident	27 Å²	27	76.2 Å²	76.2	17%	0.166	42%	0.415	C	S	.	.			trans	-138.1	124.1	179.2	-55.8	0	0	0	0	108.4	D487 G492 R494	T485-D487 HydrophobicContact CG2-CB 3.96Å; T485-D487 WeakPolarHBondContact CG2-OD2 3.41Å; T485-D487 PolarHBondContact O-N 2.75Å; T485-G492 PolarHBondContact N-O 2.96Å; T485-R494 PolarHBondContact OG1-NE 2.93Å
486	D	62.8	Low	75.3	Confident	160 Å²	160	74.2 Å²	74.2	86%	0.856	41%	0.406	S	S	*	.			trans	-82.3	8.1	-173	-49.9	-60.4	0	0	0	113.7	P488	D486-P488 VanDerWaalsContact O-CD 3.28Å; D486-P488 WeakPolarHBondContact O-CD 3.44Å
487	D	62	Low	75.6	Confident	90 Å²	90	74.1 Å²	74.1	48%	0.481	41%	0.405	S	S	.	.			trans	-65.5	115.7	179.4	-75.9	-41.1	0	0	0	111	T485 G489 D490 R494	T485-D487 HydrophobicContact CG2-CB 3.96Å; T485-D487 WeakPolarHBondContact CG2-OD2 3.41Å; T485-D487 PolarHBondContact O-N 2.75Å; D487-G489 PolarHBondContact O-N 2.74Å; D487-D490 PolarHBondContact O-N 3Å; D487-R494 IonicContact OD2-NH2 2.77Å
488	P	57.3	Low	76	Confident	141 Å²	141	75.3 Å²	75.3	92%	0.916	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	2.7	-173.8	-24.3	35.5	0	0	0	116.9	D486	D486-P488 VanDerWaalsContact O-CD 3.28Å; D486-P488 WeakPolarHBondContact O-CD 3.44Å
489	G	58.7	Low	76.2	Confident	83 Å²	83	75 Å²	75	86%	0.856	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120.2	-1.3	-175.5	0	0	0	0	0	115.6	D487	D487-G489 PolarHBondContact O-N 2.74Å
490	D	57.8	Low	75.9	Confident	102 Å²	102	74.6 Å²	74.6	55%	0.545	41%	0.406	S	S	.	.	S	Bend	trans	-118.2	162	175.6	-159.3	-7.3	0	0	0	109.9	D487 G492	D487-D490 PolarHBondContact O-N 3Å; D490-G492 PolarHBondContact O-N 2.96Å
491	L	54.6	Low	75.7	Confident	166 Å²	166	78.9 Å²	78.9	87%	0.869	43%	0.426	S	S	*	.			trans	-79.2	42.5	-176.1	-77.6	123.8	0	0	0	113.4	I493	L491-I493 PolarHBondContact O-N 2.93Å
492	G	61.7	Low	75.8	Confident	26 Å²	26	77.3 Å²	77.3	27%	0.268	42%	0.42	S	S	.	.	S	Bend	trans	61.7	-7.3	162.4	0	0	0	0	0	118.7	H484 T485 D490	H484-G492 VanDerWaalsContact CA-O 3.28Å; H484-G492 WeakPolarHBondContact CA-O 3.47Å; T485-G492 PolarHBondContact N-O 2.96Å; D490-G492 PolarHBondContact O-N 2.96Å
493	I	75	Confident	75.7	Confident	91 Å²	91	74.7 Å²	74.7	47%	0.467	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	98.9	-169.2	-54.8	-179.2	0	0	0	110.9	I482 E483 L491 K495	I482-I493 HydrophobicContact CG2-CG2 3.41Å; I482-I493 VanDerWaalsContact CG2-CG2 3.41Å; E483-I493 CarbonylContact O-C 3.56Å; L491-I493 PolarHBondContact O-N 2.93Å; I493-K495 HydrophobicContact CG2-CG 4.41Å
494	R	82	Confident	75.7	Confident	99 Å²	99	74.1 Å²	74.1	37%	0.374	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	128.9	176.1	-167.5	177.6	-60.6	-111.7	-0.3	110.1	E483 T485 D487	E483-R494 HydrophobicContact CB-CB 4.48Å; E483-R494 PolarHBondContact N-O 3.32Å; E483-R494 PolarHBondContact O-N 3.01Å; T485-R494 PolarHBondContact OG1-NE 2.93Å; D487-R494 IonicContact OD2-NH2 2.77Å
495	K	88.6	Confident	75.5	Confident	91 Å²	91	72.1 Å²	72.1	40%	0.396	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	108	-179.4	-61.6	178.7	-177.3	171.7	0	109.9	L414 W415 I482 I493	L414-K495 WeakPolarHBondContact O-CD 3.38Å; L414-K495 PolarHBondContact O-NZ 2.83Å; W415-K495 HydrophobicContact CE3-CB 4.34Å; W415-K495 HydrophobicContact CH2-CB 4.45Å; W415-K495 HydrophobicContact CZ3-CB 3.98Å; I482-K495 HydrophobicContact CG1-CG 4.25Å; I482-K495 HydrophobicContact CG2-CG 4.29Å; I493-K495 HydrophobicContact CG2-CG 4.41Å
496	S	90.6	Very high	75.6	Confident	4 Å²	4	76 Å²	76	3%	0.028	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	120.8	-173.7	58.9	0	0	0	0	111	W415 M480 K481 E483	W415-S496 WeakPolarHBondContact CH2-O 3.36Å; M480-S496 WeakPolarHBondContact CA-O 3.43Å; K481-S496 PolarHBondContact N-O 3.23Å; K481-S496 PolarHBondContact O-N 2.9Å; K481-S496 PolarHBondContact O-OG 2.65Å; E483-S496 PolarHBondContact OE2-OG 2.96Å
497	A	93.1	Very high	75.9	Confident	4 Å²	4	69.8 Å²	69.8	3%	0.033	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	132.9	176.7	0	0	0	0	0	110.7	W415 I457 C459 H460 F468 Y479 M480	W415-A497 HydrophobicContact CE3-CB 4.22Å; W415-A497 HydrophobicContact CH2-CB 4.29Å; W415-A497 HydrophobicContact CZ3-CB 3.63Å; I457-A497 HydrophobicContact CD1-CB 4.18Å; C459-A497 CarbonylContact C-O 3.59Å; C459-A497 WeakPolarHBondContact CA-O 3.32Å; H460-A497 WeakPolarHBondContact CB-O 3.47Å; H460-A497 PolarHBondContact N-O 2.97Å; F468-A497 HydrophobicContact CE2-CB 4.2Å; F468-A497 HydrophobicContact CZ-CB 4.18Å; Y479-A497 WeakPolarHBondContact O-CA 3.39Å; M480-A497 HydrophobicContact CG-CB 4.05Å
498	F	93.3	Very high	76	Confident	37 Å²	37	68 Å²	68	16%	0.162	38%	0.382	C	S	.	.			trans	-121.9	157.4	-174.5	-59.6	-85.1	0	0	0	112.6	H460 K461 Y479 H502	H460-F498 HydrophobicContact CB-CD1 4.31Å; H460-F498 HydrophobicContact CB-CE1 3.86Å; H460-F498 HydrophobicContact CB-CZ 4.08Å; K461-F498 HydrophobicContact CB-CD1 4.45Å; K461-F498 HydrophobicContact CB-CE1 4.46Å; Y479-F498 AromaticContact CD1-CD2 3.59Å; Y479-F498 HydrophobicContact CD1-CD2 3.59Å; Y479-F498 AromaticContact CD1-CE2 3.92Å; Y479-F498 HydrophobicContact CD1-CE2 3.92Å; Y479-F498 HydrophobicContact CE1-CD2 4.25Å; Y479-F498 HydrophobicContact CE1-CE2 4.1Å; Y479-F498 HydrophobicContact CG-CD2 4.15Å; Y479-F498 PolarHBondContact O-N 2.82Å; F498-H502 HydrophobicContact CB-CB 4.13Å; F498-H502 VanDerWaalsContact CB-O 3.25Å; F498-H502 WeakPolarHBondContact CB-O 3.46Å; F498-H502 HydrophobicContact CD1-CB 4Å; F498-H502 WeakPolarHBondContact CD1-O 3.36Å; F498-H502 HydrophobicContact CG-CB 4.46Å; F498-H502 VanDerWaalsContact CG-O 3.28Å; F498-H502 WeakPolarHBondContact CG-O 3.24Å
499	C	92	Very high	75.9	Confident	0 Å²	0	65.6 Å²	65.6	0%	0	37%	0.369	C	S	.	.			trans	-81.6	168.3	166	61.1	0	0	0	0	110.8	F446 C459 C464 R466 Q501 H502 C503	F446-C499 HydrophobicContact CE1-CB 3.98Å; F446-C499 HydrophobicContact CZ-CB 4.22Å; C459-C499 HydrophobicContact CB-CB 4.41Å; C459-C499 PolarHBondContact SG-N 2.95Å; C464-C499 PolarHBondContact SG-SG 2.83Å; R466-C499 HydrophobicContact CB-CB 4.16Å; C499-Q501 VanDerWaalsContact C-N 3.25Å; C499-Q501 PolarHBondContact O-N 3.41Å; C499-Q501 VanDerWaalsContact O-N 3.15Å; C499-H502 CarbonylContact O-C 3.47Å; C499-H502 WeakPolarHBondContact O-CA 3.47Å; C499-H502 PolarHBondContact O-N 3.24Å; C499-H502 PolarHBondContact SG-ND1 2.85Å; C499-C503 PolarHBondContact O-N 2.65Å; C499-C503 PolarHBondContact O-SG 3.2Å
500	D	84.4	Confident	75.5	Confident	37 Å²	37	65.4 Å²	65.4	20%	0.198	36%	0.355	C	S	.	.	G	3₁₀ helix	trans	-41.4	-44.9	172	40.1	-60.5	0	0	0	114.3	F446 R466 L478 H502	F446-D500 WeakPolarHBondContact CE2-OD1 3.4Å; F446-D500 WeakPolarHBondContact CZ-OD1 3.24Å; R466-D500 IonicContact CZ-OD1 3.6Å; R466-D500 VanDerWaalsContact CZ-OD1 3.24Å; R466-D500 IonicContact CZ-OD2 3.11Å; R466-D500 IonicContact NE-OD1 2.8Å; R466-D500 IonicContact NH1-OD1 2.81Å; R466-D500 IonicContact NH1-OD2 3.97Å; R466-D500 PolarHBondContact NH1-OD2 2.93Å; R466-D500 IonicContact NH2-OD1 2.73Å; R466-D500 PolarHBondContact NH2-OD1 2.93Å; R466-D500 IonicContact NH2-OD2 2.96Å; R466-D500 PolarHBondContact NH2-OD2 3.44Å; L478-D500 HydrophobicContact CD2-CB 4.35Å; D500-H502 VanDerWaalsContact C-N 3.27Å; D500-H502 PolarHBondContact O-N 2.91Å
501	Q	85.5	Confident	75	Confident	129 Å²	129	65.9 Å²	65.9	60%	0.603	37%	0.366	S	S	*	.	G	3₁₀ helix	trans	-73.9	-8.3	178.4	-74.6	171.9	-44	0	0	115.4	C499	C499-Q501 VanDerWaalsContact C-N 3.25Å; C499-Q501 PolarHBondContact O-N 3.41Å; C499-Q501 VanDerWaalsContact O-N 3.15Å
502	H	88.8	Confident	74.6	Confident	61 Å²	61	64 Å²	64	28%	0.282	36%	0.357	S	S	.	.	G	3₁₀ helix	trans	-133.8	11.9	-174.7	-65.1	116.1	0	0	0	112.9	K461 C464 F498 C499 D500	K461-H502 HydrophobicContact CB-CB 4.44Å; C464-H502 PolarHBondContact SG-ND1 2.89Å; C464-H502 VanDerWaalsContact SG-ND1 3.41Å; F498-H502 HydrophobicContact CB-CB 4.13Å; F498-H502 VanDerWaalsContact CB-O 3.25Å; F498-H502 WeakPolarHBondContact CB-O 3.46Å; F498-H502 HydrophobicContact CD1-CB 4Å; F498-H502 WeakPolarHBondContact CD1-O 3.36Å; F498-H502 HydrophobicContact CG-CB 4.46Å; F498-H502 VanDerWaalsContact CG-O 3.28Å; F498-H502 WeakPolarHBondContact CG-O 3.24Å; C499-H502 CarbonylContact O-C 3.47Å; C499-H502 WeakPolarHBondContact O-CA 3.47Å; C499-H502 PolarHBondContact O-N 3.24Å; C499-H502 PolarHBondContact SG-ND1 2.85Å; D500-H502 VanDerWaalsContact C-N 3.27Å; D500-H502 PolarHBondContact O-N 2.91Å
503	C	83.6	Confident	74.1	Confident	17 Å²	17	68.7 Å²	68.7	12%	0.115	37%	0.37	C	S	.	.	S	Bend	trans	-67.6	140.8	166.4	-66.1	0	0	0	0	108.5	C499 H507 F508	C499-C503 PolarHBondContact O-N 2.65Å; C499-C503 PolarHBondContact O-SG 3.2Å; C503-H507 HydrophobicContact CB-CB 4.45Å; C503-F508 HydrophobicContact CB-CD2 4.5Å; C503-F508 HydrophobicContact CB-CE2 3.75Å; C503-F508 HydrophobicContact CB-CZ 4.37Å
504	P	80.9	Confident	72.8	Confident	46 Å²	46	65.7 Å²	65.7	30%	0.299	36%	0.361	S	S	.	.			trans	-53.2	142.8	172.2	-27.9	36.8	0	0	0	111.5	Y479 D506 H507	Y479-P504 HydrophobicContact CD2-CG 3.67Å; Y479-P504 HydrophobicContact CE2-CG 3.68Å; Y479-P504 HydrophobicContact CG-CG 4.29Å; P504-D506 PolarHBondContact O-N 3.45Å; P504-D506 VanDerWaalsContact O-N 3.13Å; P504-H507 VanDerWaalsContact O-CB 3.24Å; P504-H507 WeakPolarHBondContact O-CB 3.45Å; P504-H507 PolarHBondContact O-N 3Å
505	P	67	Low	71.2	Confident	103 Å²	103	65.1 Å²	65.1	67%	0.669	36%	0.364	S	S	*	.	G	3₁₀ helix	trans	-52.5	-40.4	-172.9	-28.9	36.1	0	0	0	113.8	H507	P505-H507 PolarHBondContact O-N 3.06Å
506	D	68.8	Low	69.2	Low	108 Å²	108	65.6 Å²	65.6	58%	0.578	36%	0.364	S	S	*	.	G	3₁₀ helix	trans	-73.4	-13.1	-175.8	-44.1	-67.5	0	0	0	113.7	P504 F508 S509 S510	P504-D506 PolarHBondContact O-N 3.45Å; P504-D506 VanDerWaalsContact O-N 3.13Å; D506-F508 VanDerWaalsContact C-N 3.3Å; D506-F508 PolarHBondContact O-N 3.01Å; D506-S509 PolarHBondContact O-N 2.86Å; D506-S509 VanDerWaalsContact O-N 3.08Å; D506-S510 PolarHBondContact O-N 3.46Å
507	H	68.9	Low	66.9	Low	31 Å²	31	66.7 Å²	66.7	14%	0.144	37%	0.373	C	S	.	.	G	3₁₀ helix	trans	-66.1	-29.1	-173	-174.3	-95.1	0	0	0	113.7	G477 Y479 C503 P504 P505	G477-H507 PolarHBondContact O-CE1 2.88Å; G477-H507 VanDerWaalsContact O-CE1 3.24Å; Y479-H507 HydrophobicContact CD2-CB 4.25Å; Y479-H507 AromaticContact CD2-CD2 3.41Å; Y479-H507 VanDerWaalsContact CD2-CD2 3.41Å; Y479-H507 WeakPolarHBondContact CD2-CD2 3.29Å; Y479-H507 AromaticContact CD2-CG 3.91Å; C503-H507 HydrophobicContact CB-CB 4.45Å; P504-H507 VanDerWaalsContact O-CB 3.24Å; P504-H507 WeakPolarHBondContact O-CB 3.45Å; P504-H507 PolarHBondContact O-N 3Å; P505-H507 PolarHBondContact O-N 3.06Å
508	F	63.8	Low	64.4	Low	51 Å²	51	72.4 Å²	72.4	22%	0.224	40%	0.399	C	S	.	.	G	3₁₀ helix	trans	-97.2	-6.5	174.2	-64	-66.6	0	0	0	113.1	G477 C503 D506 A531	G477-F508 WeakPolarHBondContact O-CE1 3.43Å; C503-F508 HydrophobicContact CB-CD2 4.5Å; C503-F508 HydrophobicContact CB-CE2 3.75Å; C503-F508 HydrophobicContact CB-CZ 4.37Å; D506-F508 VanDerWaalsContact C-N 3.3Å; D506-F508 PolarHBondContact O-N 3.01Å; F508-A531 HydrophobicContact CD2-CB 4Å; F508-A531 HydrophobicContact CE1-CB 4.49Å; F508-A531 HydrophobicContact CE2-CB 3.72Å; F508-A531 HydrophobicContact CG-CB 4.49Å; F508-A531 HydrophobicContact CZ-CB 4Å
509	S	54.8	Low	62.2	Low	92 Å²	92	75.9 Å²	75.9	64%	0.643	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.6	-36	179.4	-57.6	0	0	0	0	112.4	D506	D506-S509 PolarHBondContact O-N 2.86Å; D506-S509 VanDerWaalsContact O-N 3.08Å
510	S	49.9	Very low	59.8	Low	79 Å²	79	83.4 Å²	83.4	55%	0.552	47%	0.468	S	S	*	.	S	Bend	trans	-89.2	151.9	177.1	-68.9	0	0	0	0	112.2	D506 N512	D506-S510 PolarHBondContact O-N 3.46Å; S510-N512 PolarHBondContact O-N 3.28Å
511	S	48	Very low	57.7	Low	111 Å²	111	86.8 Å²	86.8	78%	0.776	50%	0.495	S	S	*	.	S	Bend	trans	-57.4	18.3	-163.6	-80.5	0	0	0	0	120.3	K513	S511-K513 PolarHBondContact O-N 2.86Å
512	N	45.2	Very low	55.9	Low	127 Å²	127	88.3 Å²	88.3	68%	0.679	51%	0.507	S	S	*	.			trans	-72.6	62	173.4	-81.5	1.4	0	0	0	112.5	S510 G514	S510-N512 PolarHBondContact O-N 3.28Å; N512-G514 VanDerWaalsContact C-N 3.33Å; N512-G514 PolarHBondContact O-N 3.32Å
513	K	52.2	Low	54	Low	125 Å²	125	88.8 Å²	88.8	54%	0.543	53%	0.529	S	S	.	.			trans	-66.2	85	172.3	-78.8	-176.6	-176.8	177.6	0	110.1	S511 M515 A517	S511-K513 PolarHBondContact O-N 2.86Å; K513-M515 PolarHBondContact O-N 3.37Å; K513-A517 HydrophobicContact CB-CB 3.9Å; K513-A517 HydrophobicContact CD-CB 4.36Å; K513-A517 HydrophobicContact CG-CB 3.99Å
514	G	47.8	Very low	52.2	Low	28 Å²	28	90.6 Å²	90.6	29%	0.289	54%	0.54	S	S	.	.			trans	-48.2	135.2	170.8	0	0	0	0	0	111.3	N512 Y516 A517	N512-G514 VanDerWaalsContact C-N 3.33Å; N512-G514 PolarHBondContact O-N 3.32Å; G514-Y516 PolarHBondContact O-N 3.09Å; G514-A517 PolarHBondContact O-N 2.9Å
515	M	47.7	Very low	51	Low	87 Å²	87	97.4 Å²	97.4	43%	0.429	57%	0.568	S	S	.	*	T	Hydrogen-bonded Turn	trans	-23.5	-2.2	-165.3	-161	169.2	32.9	0	0	122.6	K513	K513-M515 PolarHBondContact O-N 3.37Å
516	Y	46.6	Very low	50.7	Low	100 Å²	100	94.9 Å²	94.9	39%	0.392	55%	0.552	S	S	.	*	T	Hydrogen-bonded Turn	trans	-135.2	19	180	-58.7	-63.3	0	0	0	114.7	G514 H518 I541 R545	G514-Y516 PolarHBondContact O-N 3.09Å; Y516-H518 VanDerWaalsContact C-N 3.32Å; Y516-H518 PolarHBondContact O-N 2.86Å; Y516-I541 HydrophobicContact CD2-CD1 4.05Å; Y516-I541 HydrophobicContact CD2-CG2 4.13Å; Y516-I541 HydrophobicContact CE2-CG2 4.34Å; Y516-I541 HydrophobicContact CG-CD1 3.98Å; Y516-R545 VanDerWaalsContact CZ-CZ 3.49Å; Y516-R545 VanDerWaalsContact OH-CZ 3.29Å; Y516-R545 PolarHBondContact OH-NH1 3.33Å; Y516-R545 PolarHBondContact OH-NH2 3.17Å
517	A	43.9	Very low	50.5	Low	28 Å²	28	93.4 Å²	93.4	23%	0.231	55%	0.549	C	S	.	.			trans	-90.4	24.6	-177.4	0	0	0	0	0	114.9	K513 G514	K513-A517 HydrophobicContact CB-CB 3.9Å; K513-A517 HydrophobicContact CD-CB 4.36Å; K513-A517 HydrophobicContact CG-CB 3.99Å; G514-A517 PolarHBondContact O-N 2.9Å
518	H	40.4	Very low	50.4	Low	123 Å²	123	96.9 Å²	96.9	57%	0.569	57%	0.565	S	S	*	*			trans	-107.1	78.9	179.9	-70.7	-130	0	0	0	110.5	Y516	Y516-H518 VanDerWaalsContact C-N 3.32Å; Y516-H518 PolarHBondContact O-N 2.86Å
519	S	47.2	Very low	50.6	Low	110 Å²	110	101.8 Å²	101.8	77%	0.769	58%	0.582	S	S	*	*			trans	-159.3	142.9	162.4	-40.4	0	0	0	0	109
520	D	39.9	Very low	51.2	Low	159 Å²	159	98.2 Å²	98.2	85%	0.85	56%	0.558	S	S	*	*			trans	-75	177.5	-166.3	-60	-78.3	0	0	0	117
521	S	41.2	Very low	52.1	Low	108 Å²	108	94.8 Å²	94.8	76%	0.755	54%	0.535	S	S	*	.	S	Bend	trans	78.8	127	171	52.1	0	0	0	0	119.2
522	D	47.4	Very low	53.4	Low	161 Å²	161	96.7 Å²	96.7	86%	0.861	53%	0.525	S	S	*	.			trans	52.4	108.2	162.9	-51.4	-23.1	0	0	0	119.4
523	G	48.2	Very low	54.8	Low	71 Å²	71	93.7 Å²	93.7	73%	0.732	51%	0.508	S	S	*	.			trans	-79.9	136	179.1	0	0	0	0	0	113.4
524	P	46.8	Very low	55.8	Low	54 Å²	54	91 Å²	91	35%	0.351	50%	0.497	S	S	.	.			trans	-74.7	135.1	179.6	30.4	-34.9	0	0	0	112.2	S526 R529 A530 I533	P524-S526 PolarHBondContact O-N 2.82Å; P524-R529 HydrophobicContact CB-CB 4.21Å; P524-R529 HydrophobicContact CB-CG 4.08Å; P524-A530 HydrophobicContact CG-CB 3.87Å; P524-I533 HydrophobicContact CB-CD1 3.93Å; P524-I533 HydrophobicContact CG-CD1 4.09Å
525	Q	54.7	Low	57.1	Low	189 Å²	189	90.2 Å²	90.2	88%	0.883	49%	0.487	S	S	*	.	S	Bend	trans	-67.4	7.9	-172.1	-65.4	167.2	-22	0	0	116.6
526	S	62.1	Low	58.6	Low	50 Å²	50	95.1 Å²	95.1	35%	0.35	50%	0.501	S	S	.	.	S	Bend	trans	-151.5	148.1	171.2	83.7	0	0	0	0	112.7	P524 E528 R529 A530	P524-S526 PolarHBondContact O-N 2.82Å; S526-E528 PolarHBondContact O-N 3.46Å; S526-R529 PolarHBondContact O-N 2.82Å; S526-R529 VanDerWaalsContact O-N 3.13Å; S526-R529 WeakPolarHBondContact OG-CB 3.31Å; S526-R529 PolarHBondContact OG-N 3.37Å; S526-R529 VanDerWaalsContact OG-N 3.16Å; S526-A530 PolarHBondContact O-N 3.11Å
527	P	64.5	Low	60.1	Low	78 Å²	78	96.1 Å²	96.1	51%	0.506	51%	0.507	S	S	.	.	H	α-helix	trans	-63.9	-29.6	179.3	25.1	-34	0	0	0	112.3	A530 A531	P527-A530 WeakPolarHBondContact O-CB 3.44Å; P527-A530 PolarHBondContact O-N 3.25Å; P527-A531 WeakPolarHBondContact O-CB 3.41Å; P527-A531 PolarHBondContact O-N 3.3Å
528	E	66.7	Low	61.5	Low	103 Å²	103	95.1 Å²	95.1	48%	0.481	50%	0.499	S	S	.	.	H	α-helix	trans	-69.4	-40.1	174.3	-151.9	-149.1	150.1	0	0	111.7	S526 A530 A531 R532	S526-E528 PolarHBondContact O-N 3.46Å; E528-A530 VanDerWaalsContact C-N 3.31Å; E528-A530 PolarHBondContact O-N 2.95Å; E528-A531 PolarHBondContact O-N 3.22Å; E528-R532 WeakPolarHBondContact O-CB 3.4Å; E528-R532 VanDerWaalsContact O-CG 3.3Å; E528-R532 WeakPolarHBondContact O-CG 3.38Å; E528-R532 PolarHBondContact O-N 2.96Å; E528-R532 IonicContact OE1-CZ 3.15Å; E528-R532 IonicContact OE1-NE 2.8Å; E528-R532 PolarHBondContact OE1-NE 3.29Å; E528-R532 IonicContact OE1-NH2 2.68Å; E528-R532 PolarHBondContact OE1-NH2 3.14Å; E528-R532 IonicContact OE2-NH2 3.44Å; E528-R532 PolarHBondContact OE2-NH2 2.93Å
529	R	68.2	Low	63.2	Low	154 Å²	154	93.3 Å²	93.3	58%	0.581	49%	0.487	S	S	*	.	H	α-helix	trans	-65.2	-37.8	174.8	-163.9	171.4	-172.5	165	2.6	110.5	P524 S526 I533	P524-R529 HydrophobicContact CB-CB 4.21Å; P524-R529 HydrophobicContact CB-CG 4.08Å; S526-R529 PolarHBondContact O-N 2.82Å; S526-R529 VanDerWaalsContact O-N 3.13Å; S526-R529 WeakPolarHBondContact OG-CB 3.31Å; S526-R529 PolarHBondContact OG-N 3.37Å; S526-R529 VanDerWaalsContact OG-N 3.16Å; R529-I533 HydrophobicContact CG-CD1 4.21Å; R529-I533 WeakPolarHBondContact O-CB 3.37Å; R529-I533 WeakPolarHBondContact O-CD1 3.24Å; R529-I533 VanDerWaalsContact O-CG1 3.23Å; R529-I533 WeakPolarHBondContact O-CG1 3.43Å; R529-I533 PolarHBondContact O-N 2.75Å
530	A	67.4	Low	64.7	Low	17 Å²	17	94.6 Å²	94.6	14%	0.14	48%	0.479	C	S	.	.	H	α-helix	trans	-59.7	-51.6	170.7	0	0	0	0	0	112.2	P524 S526 P527 E528 R532 I533 H534	P524-A530 HydrophobicContact CG-CB 3.87Å; S526-A530 PolarHBondContact O-N 3.11Å; P527-A530 WeakPolarHBondContact O-CB 3.44Å; P527-A530 PolarHBondContact O-N 3.25Å; E528-A530 VanDerWaalsContact C-N 3.31Å; E528-A530 PolarHBondContact O-N 2.95Å; A530-R532 PolarHBondContact O-N 2.92Å; A530-I533 PolarHBondContact O-N 3.44Å; A530-I533 VanDerWaalsContact O-N 3.1Å; A530-H534 PolarHBondContact O-CD2 3.38Å; A530-H534 PolarHBondContact O-N 3.08Å
531	A	67.6	Low	66.3	Low	8 Å²	8	88.8 Å²	88.8	7%	0.066	45%	0.447	C	S	.	.	H	α-helix	trans	-59.7	-43.1	178.2	0	0	0	0	0	112.5	F508 P527 E528 I533 H534 L535	F508-A531 HydrophobicContact CD2-CB 4Å; F508-A531 HydrophobicContact CE1-CB 4.49Å; F508-A531 HydrophobicContact CE2-CB 3.72Å; F508-A531 HydrophobicContact CG-CB 4.49Å; F508-A531 HydrophobicContact CZ-CB 4Å; P527-A531 WeakPolarHBondContact O-CB 3.41Å; P527-A531 PolarHBondContact O-N 3.3Å; E528-A531 PolarHBondContact O-N 3.22Å; A531-I533 VanDerWaalsContact C-N 3.34Å; A531-I533 PolarHBondContact O-N 3.22Å; A531-H534 PolarHBondContact O-N 3.45Å; A531-L535 VanDerWaalsContact O-CB 3.29Å; A531-L535 WeakPolarHBondContact O-CB 3.23Å; A531-L535 PolarHBondContact O-N 2.73Å
532	R	75.2	Confident	67.8	Low	151 Å²	151	83.8 Å²	83.8	57%	0.57	41%	0.412	S	S	*	.	H	α-helix	trans	-60.3	-40.3	173.8	-71	177.8	-173.7	-161.5	9.8	111.7	E528 A530 R536	E528-R532 WeakPolarHBondContact O-CB 3.4Å; E528-R532 VanDerWaalsContact O-CG 3.3Å; E528-R532 WeakPolarHBondContact O-CG 3.38Å; E528-R532 PolarHBondContact O-N 2.96Å; E528-R532 IonicContact OE1-CZ 3.15Å; E528-R532 IonicContact OE1-NE 2.8Å; E528-R532 PolarHBondContact OE1-NE 3.29Å; E528-R532 IonicContact OE1-NH2 2.68Å; E528-R532 PolarHBondContact OE1-NH2 3.14Å; E528-R532 IonicContact OE2-NH2 3.44Å; E528-R532 PolarHBondContact OE2-NH2 2.93Å; A530-R532 PolarHBondContact O-N 2.92Å; R532-R536 WeakPolarHBondContact O-CG 3.45Å; R532-R536 PolarHBondContact O-N 3.37Å
533	I	75	Confident	69.1	Low	63 Å²	63	78.3 Å²	78.3	32%	0.323	39%	0.389	S	S	.	.	H	α-helix	trans	-69.3	-46.8	177.3	-71.7	163.9	0	0	0	111.5	P524 R529 A530 A531 L535 R536 K537	P524-I533 HydrophobicContact CB-CD1 3.93Å; P524-I533 HydrophobicContact CG-CD1 4.09Å; R529-I533 HydrophobicContact CG-CD1 4.21Å; R529-I533 WeakPolarHBondContact O-CB 3.37Å; R529-I533 WeakPolarHBondContact O-CD1 3.24Å; R529-I533 VanDerWaalsContact O-CG1 3.23Å; R529-I533 WeakPolarHBondContact O-CG1 3.43Å; R529-I533 PolarHBondContact O-N 2.75Å; A530-I533 PolarHBondContact O-N 3.44Å; A530-I533 VanDerWaalsContact O-N 3.1Å; A531-I533 VanDerWaalsContact C-N 3.34Å; A531-I533 PolarHBondContact O-N 3.22Å; I533-L535 VanDerWaalsContact C-N 3.33Å; I533-L535 PolarHBondContact O-N 2.91Å; I533-R536 PolarHBondContact O-N 2.87Å; I533-R536 VanDerWaalsContact O-N 3.16Å; I533-K537 HydrophobicContact CG2-CD 4.32Å; I533-K537 HydrophobicContact CG2-CG 4.49Å; I533-K537 PolarHBondContact O-N 3.48Å
534	H	72.5	Confident	70.1	Confident	68 Å²	68	79.6 Å²	79.6	32%	0.315	38%	0.376	S	S	.	.	H	α-helix	trans	-59.1	-44.2	176.3	-85.7	-115.2	0	0	0	111.3	A530 A531 R536 K537 A538	A530-H534 PolarHBondContact O-CD2 3.38Å; A530-H534 PolarHBondContact O-N 3.08Å; A531-H534 PolarHBondContact O-N 3.45Å; H534-R536 VanDerWaalsContact C-N 3.35Å; H534-R536 PolarHBondContact O-N 2.9Å; H534-K537 PolarHBondContact O-N 3.22Å; H534-A538 VanDerWaalsContact O-CB 3.26Å; H534-A538 WeakPolarHBondContact O-CB 3.44Å; H534-A538 PolarHBondContact O-N 2.92Å
535	L	76	Confident	71.2	Confident	13 Å²	13	81.6 Å²	81.6	7%	0.068	38%	0.377	C	S	.	.	H	α-helix	trans	-63.8	-36.2	175.9	-173.8	65	0	0	0	112.7	F446 I447 A476 A531 I533 R539	F446-L535 HydrophobicContact CD2-CD2 4.5Å; F446-L535 HydrophobicContact CE2-CD1 3.9Å; F446-L535 HydrophobicContact CE2-CD2 3.88Å; I447-L535 HydrophobicContact CB-CD1 4.38Å; I447-L535 HydrophobicContact CG1-CD1 4.08Å; I447-L535 HydrophobicContact CG2-CD1 3.98Å; A476-L535 HydrophobicContact CB-CD1 4.29Å; A531-L535 VanDerWaalsContact O-CB 3.29Å; A531-L535 WeakPolarHBondContact O-CB 3.23Å; A531-L535 PolarHBondContact O-N 2.73Å; I533-L535 VanDerWaalsContact C-N 3.33Å; I533-L535 PolarHBondContact O-N 2.91Å; L535-R539 WeakPolarHBondContact O-CB 3.19Å; L535-R539 VanDerWaalsContact O-CG 3.26Å; L535-R539 WeakPolarHBondContact O-CG 3.46Å; L535-R539 PolarHBondContact O-N 2.81Å
536	R	79.1	Confident	71.8	Confident	190 Å²	190	74.3 Å²	74.3	72%	0.717	34%	0.341	S	S	*	.	H	α-helix	trans	-66.8	-48.2	172.6	-78.1	178.8	175	-169.5	-1.4	111.7	R532 I533 H534 A538 R539 K540	R532-R536 WeakPolarHBondContact O-CG 3.45Å; R532-R536 PolarHBondContact O-N 3.37Å; I533-R536 PolarHBondContact O-N 2.87Å; I533-R536 VanDerWaalsContact O-N 3.16Å; H534-R536 VanDerWaalsContact C-N 3.35Å; H534-R536 PolarHBondContact O-N 2.9Å; R536-A538 PolarHBondContact O-N 2.9Å; R536-R539 PolarHBondContact O-N 2.85Å; R536-K540 PolarHBondContact O-N 2.97Å; R536-K540 VanDerWaalsContact O-N 3.16Å
537	K	77.4	Confident	71.8	Confident	120 Å²	120	78.2 Å²	78.2	52%	0.522	36%	0.358	S	S	.	.	H	α-helix	trans	-57.7	-48.7	175.7	-72.8	-176.9	177	-176.7	0	111.3	I533 H534 R539 K540 I541	I533-K537 HydrophobicContact CG2-CD 4.32Å; I533-K537 HydrophobicContact CG2-CG 4.49Å; I533-K537 PolarHBondContact O-N 3.48Å; H534-K537 PolarHBondContact O-N 3.22Å; K537-R539 PolarHBondContact O-N 2.86Å; K537-K540 PolarHBondContact O-N 3.46Å; K537-I541 WeakPolarHBondContact O-CG1 3.36Å; K537-I541 PolarHBondContact O-N 2.86Å
538	A	73.4	Confident	71.4	Confident	8 Å²	8	77.3 Å²	77.3	7%	0.066	35%	0.354	C	S	.	.	H	α-helix	trans	-62	-39.6	178.3	0	0	0	0	0	113.3	H475 A476 H534 R536 L542	H475-A538 VanDerWaalsContact O-CB 3.25Å; H475-A538 WeakPolarHBondContact O-CB 3.46Å; A476-A538 HydrophobicContact CB-CB 4.01Å; H534-A538 VanDerWaalsContact O-CB 3.26Å; H534-A538 WeakPolarHBondContact O-CB 3.44Å; H534-A538 PolarHBondContact O-N 2.92Å; R536-A538 PolarHBondContact O-N 2.9Å; A538-L542 WeakPolarHBondContact O-CB 3.35Å; A538-L542 VanDerWaalsContact O-CG 3.23Å; A538-L542 WeakPolarHBondContact O-CG 3.34Å; A538-L542 PolarHBondContact O-N 2.8Å
539	R	77.1	Confident	70.8	Confident	84 Å²	84	81.5 Å²	81.5	32%	0.317	37%	0.37	S	S	.	.	H	α-helix	trans	-59	-47.1	173.7	-83.8	173.5	175.9	149	5.3	112.1	F446 I447 L535 R536 K537 L542 A543	F446-R539 PolarHBondContact O-NH2 3.36Å; I447-R539 HydrophobicContact CG2-CG 4.42Å; I447-R539 VanDerWaalsContact O-CG 3.31Å; I447-R539 WeakPolarHBondContact O-CG 3.48Å; I447-R539 PolarHBondContact O-NE 2.86Å; L535-R539 WeakPolarHBondContact O-CB 3.19Å; L535-R539 VanDerWaalsContact O-CG 3.26Å; L535-R539 WeakPolarHBondContact O-CG 3.46Å; L535-R539 PolarHBondContact O-N 2.81Å; R536-R539 PolarHBondContact O-N 2.85Å; K537-R539 PolarHBondContact O-N 2.86Å; R539-L542 PolarHBondContact O-N 2.86Å; R539-A543 WeakPolarHBondContact O-CB 3.34Å; R539-A543 PolarHBondContact O-N 2.78Å
540	K	78.4	Confident	70	Confident	137 Å²	137	76.8 Å²	76.8	60%	0.596	36%	0.36	S	S	*	.	H	α-helix	trans	-61.3	-53.8	178.2	179.3	168.3	176.2	171.7	0	111.3	R536 K537 L542 A543 E544	R536-K540 PolarHBondContact O-N 2.97Å; R536-K540 VanDerWaalsContact O-N 3.16Å; K537-K540 PolarHBondContact O-N 3.46Å; K540-L542 VanDerWaalsContact C-N 3.3Å; K540-L542 PolarHBondContact O-N 2.8Å; K540-A543 WeakPolarHBondContact O-CB 3.42Å; K540-A543 PolarHBondContact O-N 3.24Å; K540-E544 WeakPolarHBondContact CE-OE1 3.3Å; K540-E544 HydrophobicContact CG-CG 4.45Å; K540-E544 VanDerWaalsContact CG-OE1 3.29Å; K540-E544 WeakPolarHBondContact CG-OE1 3.25Å; K540-E544 WeakPolarHBondContact O-CG 3.33Å; K540-E544 PolarHBondContact O-N 3.45Å
541	I	73.5	Confident	69.3	Low	37 Å²	37	82 Å²	82	19%	0.19	40%	0.395	C	S	.	.	H	α-helix	trans	-60.1	-39	179.9	-65	165.8	0	0	0	111.7	Y516 K537 R545	Y516-I541 HydrophobicContact CD2-CD1 4.05Å; Y516-I541 HydrophobicContact CD2-CG2 4.13Å; Y516-I541 HydrophobicContact CE2-CG2 4.34Å; Y516-I541 HydrophobicContact CG-CD1 3.98Å; K537-I541 WeakPolarHBondContact O-CG1 3.36Å; K537-I541 PolarHBondContact O-N 2.86Å; I541-R545 VanDerWaalsContact O-CB 3.31Å; I541-R545 WeakPolarHBondContact O-CB 3.4Å; I541-R545 WeakPolarHBondContact O-CD 3.33Å; I541-R545 WeakPolarHBondContact O-CG 3.38Å; I541-R545 PolarHBondContact O-N 2.81Å
542	L	73.7	Confident	68.6	Low	4 Å²	4	84.4 Å²	84.4	2%	0.021	41%	0.409	C	S	.	.	H	α-helix	trans	-66.4	-41.1	174.8	-78	170.4	0	0	0	112.1	I447 C472 H475 A538 R539 K540 R546	I447-L542 HydrophobicContact CG2-CD1 4.12Å; C472-L542 HydrophobicContact CB-CD1 4.26Å; H475-L542 HydrophobicContact CB-CD1 4.09Å; H475-L542 HydrophobicContact CB-CD2 3.79Å; H475-L542 HydrophobicContact CB-CG 4.03Å; A538-L542 WeakPolarHBondContact O-CB 3.35Å; A538-L542 VanDerWaalsContact O-CG 3.23Å; A538-L542 WeakPolarHBondContact O-CG 3.34Å; A538-L542 PolarHBondContact O-N 2.8Å; R539-L542 PolarHBondContact O-N 2.86Å; K540-L542 VanDerWaalsContact C-N 3.3Å; K540-L542 PolarHBondContact O-N 2.8Å; L542-R546 WeakPolarHBondContact O-CB 3.4Å; L542-R546 WeakPolarHBondContact O-CD 3.31Å; L542-R546 WeakPolarHBondContact O-CG 3.48Å; L542-R546 PolarHBondContact O-N 3.36Å; L542-R546 VanDerWaalsContact O-N 3.16Å
543	A	73.4	Confident	67.6	Low	45 Å²	45	79.5 Å²	79.5	37%	0.372	40%	0.397	S	S	.	.	H	α-helix	trans	-62.6	-53.3	176.8	0	0	0	0	0	111.3	R539 K540 R545 R546 N547	R539-A543 WeakPolarHBondContact O-CB 3.34Å; R539-A543 PolarHBondContact O-N 2.78Å; K540-A543 WeakPolarHBondContact O-CB 3.42Å; K540-A543 PolarHBondContact O-N 3.24Å; A543-R545 VanDerWaalsContact C-N 3.3Å; A543-R545 PolarHBondContact O-N 3.22Å; A543-R546 PolarHBondContact O-N 3.13Å; A543-N547 PolarHBondContact O-N 2.66Å; A543-N547 VanDerWaalsContact O-N 3.14Å
544	E	70	Confident	67	Low	99 Å²	99	77.3 Å²	77.3	46%	0.463	39%	0.386	S	S	.	.	H	α-helix	trans	-51.1	-48.1	176.1	-69.7	166.1	171.3	0	0	111.3	K540 R546 N547 S548	K540-E544 WeakPolarHBondContact CE-OE1 3.3Å; K540-E544 HydrophobicContact CG-CG 4.45Å; K540-E544 VanDerWaalsContact CG-OE1 3.29Å; K540-E544 WeakPolarHBondContact CG-OE1 3.25Å; K540-E544 WeakPolarHBondContact O-CG 3.33Å; K540-E544 PolarHBondContact O-N 3.45Å; E544-R546 VanDerWaalsContact C-N 3.32Å; E544-R546 PolarHBondContact O-N 2.83Å; E544-N547 PolarHBondContact O-N 2.85Å; E544-S548 VanDerWaalsContact O-CB 3.27Å; E544-S548 WeakPolarHBondContact O-CB 3.48Å; E544-S548 PolarHBondContact O-N 3.06Å
545	R	69.3	Low	66.7	Low	96 Å²	96	74.2 Å²	74.2	36%	0.362	37%	0.372	S	S	.	.	H	α-helix	trans	-65.7	-28.6	179.8	-75.4	173.3	178.8	-143.2	-15.4	114.6	Y516 I541 A543 S548	Y516-R545 VanDerWaalsContact CZ-CZ 3.49Å; Y516-R545 VanDerWaalsContact OH-CZ 3.29Å; Y516-R545 PolarHBondContact OH-NH1 3.33Å; Y516-R545 PolarHBondContact OH-NH2 3.17Å; I541-R545 VanDerWaalsContact O-CB 3.31Å; I541-R545 WeakPolarHBondContact O-CB 3.4Å; I541-R545 WeakPolarHBondContact O-CD 3.33Å; I541-R545 WeakPolarHBondContact O-CG 3.38Å; I541-R545 PolarHBondContact O-N 2.81Å; A543-R545 VanDerWaalsContact C-N 3.3Å; A543-R545 PolarHBondContact O-N 3.22Å; R545-S548 PolarHBondContact O-OG 3.08Å
546	R	67.8	Low	66.5	Low	36 Å²	36	76 Å²	76	14%	0.136	38%	0.381	C	S	.	.	H	α-helix	trans	-81.7	-31.6	-178.4	-69.9	152.1	88.3	-148.2	9.7	111.6	P393 N394 R395 L542 A543 E544	P393-R546 PolarHBondContact O-NE 2.83Å; N394-R546 VanDerWaalsContact OD1-CD 3.31Å; N394-R546 WeakPolarHBondContact OD1-CD 3.35Å; N394-R546 PolarHBondContact OD1-NE 3.36Å; R395-R546 PolarHBondContact NH1-O 2.85Å; L542-R546 WeakPolarHBondContact O-CB 3.4Å; L542-R546 WeakPolarHBondContact O-CD 3.31Å; L542-R546 WeakPolarHBondContact O-CG 3.48Å; L542-R546 PolarHBondContact O-N 3.36Å; L542-R546 VanDerWaalsContact O-N 3.16Å; A543-R546 PolarHBondContact O-N 3.13Å; E544-R546 VanDerWaalsContact C-N 3.32Å; E544-R546 PolarHBondContact O-N 2.83Å
547	N	61.4	Low	66.7	Low	132 Å²	132	67.1 Å²	67.1	71%	0.706	35%	0.348	S	S	*	.	H	α-helix	trans	-81.5	-31.8	173	-65	13.5	0	0	0	111.6	A543 E544 K549	A543-N547 PolarHBondContact O-N 2.66Å; A543-N547 VanDerWaalsContact O-N 3.14Å; E544-N547 PolarHBondContact O-N 2.85Å; N547-K549 PolarHBondContact O-N 2.98Å
548	S	56.4	Low	66.9	Low	59 Å²	59	64.1 Å²	64.1	41%	0.413	34%	0.343	S	S	.	.	S	Bend	trans	-53.1	133.5	-178.4	72.6	0	0	0	0	113.3	E544 R545	E544-S548 VanDerWaalsContact O-CB 3.27Å; E544-S548 WeakPolarHBondContact O-CB 3.48Å; E544-S548 PolarHBondContact O-N 3.06Å; R545-S548 PolarHBondContact O-OG 3.08Å
549	K	53.8	Low	67.3	Low	190 Å²	190	71.5 Å²	71.5	83%	0.826	37%	0.373	S	S	*	.	P	Polyproline II helix	trans	-63.4	125.8	171.5	-164.8	171.4	-168.7	164.6	0	107.9	N547 S551	N547-K549 PolarHBondContact O-N 2.98Å; K549-S551 PolarHBondContact O-N 2.99Å
550	P	52.4	Low	67.5	Low	56 Å²	56	70 Å²	70	36%	0.364	38%	0.379	S	S	.	.	P	Polyproline II helix	trans	-59.8	127.5	-173	22.9	-33	0	0	0	110.4	P386 V552	P386-P550 HydrophobicContact CB-CB 3.96Å; P386-P550 HydrophobicContact CB-CG 3.62Å; P386-P550 HydrophobicContact CG-CG 3.93Å; P550-V552 PolarHBondContact O-N 3.26Å
551	S	51.9	Low	67.8	Low	125 Å²	125	65.3 Å²	65.3	87%	0.874	36%	0.359	S	S	*	.			trans	-62	106.8	-178.9	40.8	0	0	0	0	110.7	K549 C553	K549-S551 PolarHBondContact O-N 2.99Å; S551-C553 PolarHBondContact O-N 3.33Å
552	V	52.4	Low	68.4	Low	60 Å²	60	64.9 Å²	64.9	36%	0.364	36%	0.357	S	S	.	.			trans	-74	117.8	167	176.9	0	0	0	0	106.9	P550 V554 R595	P550-V552 PolarHBondContact O-N 3.26Å; V552-V554 HydrophobicContact CB-CG2 4.42Å; V552-V554 HydrophobicContact CG1-CG2 3.83Å; V552-V554 PolarHBondContact O-N 3.22Å; V552-R595 HydrophobicContact CG1-CB 4.42Å; V552-R595 HydrophobicContact CG2-CB 4.31Å
553	C	55.2	Low	69.1	Low	47 Å²	47	67.4 Å²	67.4	32%	0.318	37%	0.37	S	S	.	.			trans	-71.7	118.3	168.9	-165.1	0	0	0	0	108.5	F305 V354 S551	F305-C553 HydrophobicContact CD1-CB 4.38Å; F305-C553 HydrophobicContact CE1-CB 4.49Å; V354-C553 WeakPolarHBondContact O-CB 3.25Å; S551-C553 PolarHBondContact O-N 3.33Å
554	V	61.6	Low	69.7	Low	17 Å²	17	69.5 Å²	69.5	10%	0.103	37%	0.374	C	S	.	.			trans	-110.9	126.6	-177.4	175.8	0	0	0	0	108	V552 R591 E592	V552-V554 HydrophobicContact CB-CG2 4.42Å; V552-V554 HydrophobicContact CG1-CG2 3.83Å; V552-V554 PolarHBondContact O-N 3.22Å; V554-R591 HydrophobicContact CG1-CB 3.88Å; V554-E592 HydrophobicContact CG1-CG 4.5Å; V554-E592 HydrophobicContact CG2-CG 3.67Å
555	P	66.2	Low	70.6	Confident	4 Å²	4	65 Å²	65	3%	0.026	35%	0.354	C	S	.	.			trans	-53.6	145	173.2	-33	41.6	0	0	0	112.7	A303 R304 F305 W587	A303-P555 HydrophobicContact CB-CB 3.84Å; R304-P555 CarbonylContact O-C 3.44Å; R304-P555 VanDerWaalsContact O-CA 3.26Å; R304-P555 WeakPolarHBondContact O-CA 3.21Å; R304-P555 WeakPolarHBondContact O-CB 3.41Å; F305-P555 HydrophobicContact CD1-CG 3.8Å; F305-P555 HydrophobicContact CD2-CG 4.14Å; F305-P555 HydrophobicContact CE1-CG 3.6Å; F305-P555 HydrophobicContact CE2-CG 3.94Å; F305-P555 HydrophobicContact CG-CG 4.07Å; F305-P555 HydrophobicContact CZ-CG 3.67Å; P555-W587 VanDerWaalsContact O-CH2 3.25Å; P555-W587 WeakPolarHBondContact O-CH2 3.09Å
556	I	73.4	Confident	71.5	Confident	49 Å²	49	62.1 Å²	62.1	25%	0.251	35%	0.345	S	S	.	.	B	Isolated β-bridge	trans	-122.8	143.2	-178.3	-77.6	170.5	0	0	0	108.4	R304 R306	R304-I556 PolarHBondContact N-O 3Å; R304-I556 VanDerWaalsContact N-O 3.13Å; R304-I556 PolarHBondContact O-N 2.86Å; R304-I556 VanDerWaalsContact O-O 3.1Å; R306-I556 HydrophobicContact CG-CD1 4.12Å
557	V	82	Confident	72.5	Confident	4 Å²	4	64.7 Å²	64.7	2%	0.024	37%	0.369	C	S	.	.			trans	-91.8	120.9	169.2	-172.1	0	0	0	0	106.4	F299 A303 K561 I562 I565 Y584 W587	F299-V557 HydrophobicContact CB-CG2 4.21Å; F299-V557 HydrophobicContact CD1-CG1 4.42Å; F299-V557 HydrophobicContact CD1-CG2 4.01Å; F299-V557 HydrophobicContact CG-CG2 4.49Å; A303-V557 HydrophobicContact CB-CG2 3.91Å; V557-K561 HydrophobicContact CG1-CB 3.57Å; V557-I562 HydrophobicContact CB-CD1 4.48Å; V557-I562 HydrophobicContact CB-CG1 4.03Å; V557-I562 HydrophobicContact CG1-CG1 3.68Å; V557-I565 HydrophobicContact CG1-CD1 4.46Å; V557-Y584 HydrophobicContact CB-CE2 3.9Å; V557-Y584 HydrophobicContact CG2-CD2 4.5Å; V557-Y584 HydrophobicContact CG2-CE2 3.95Å; V557-W587 HydrophobicContact CG2-CH2 4.06Å; V557-W587 HydrophobicContact CG2-CZ3 4.16Å
558	S	81.2	Confident	73.7	Confident	58 Å²	58	65.2 Å²	65.2	41%	0.406	36%	0.364	S	S	.	.			trans	-67.7	154.2	178.8	59.1	0	0	0	0	111	A560 K561 I562	S558-A560 PolarHBondContact O-N 2.69Å; S558-K561 WeakPolarHBondContact O-CA 3.43Å; S558-K561 WeakPolarHBondContact O-CB 3.5Å; S558-K561 PolarHBondContact O-N 2.66Å; S558-K561 WeakPolarHBondContact OG-CD 3.33Å; S558-K561 WeakPolarHBondContact OG-CG 2.94Å; S558-I562 PolarHBondContact O-N 2.87Å
559	K	81.8	Confident	75.1	Confident	162 Å²	162	62.6 Å²	62.6	70%	0.704	35%	0.346	S	S	*	.	H	α-helix	trans	-52	-51.3	-174.8	-168.4	-167.9	167.3	-170.2	0	112.4	K561 I562 D563	K559-K561 PolarHBondContact O-N 3.34Å; K559-K561 VanDerWaalsContact O-N 3.11Å; K559-I562 CarbonylContact O-C 3.6Å; K559-I562 WeakPolarHBondContact O-CA 3.26Å; K559-I562 WeakPolarHBondContact O-CB 3.29Å; K559-I562 PolarHBondContact O-N 2.99Å; K559-D563 PolarHBondContact O-N 3.37Å
560	A	82.4	Confident	76.4	Confident	54 Å²	54	58 Å²	58	45%	0.446	34%	0.338	S	S	.	.	H	α-helix	trans	-55.8	-31	176.4	0	0	0	0	0	114.1	S558 L564	S558-A560 PolarHBondContact O-N 2.69Å; A560-L564 WeakPolarHBondContact O-CB 3.48Å; A560-L564 PolarHBondContact O-N 3.36Å
561	K	85.2	Confident	77.4	Confident	38 Å²	38	58.3 Å²	58.3	17%	0.165	35%	0.351	C	S	.	.	H	α-helix	trans	-76.3	-32.5	173.5	-70.9	172.8	169.6	-177.5	0	112.7	K302 V557 S558 K559 I565	K302-K561 HydrophobicContact CB-CB 4.5Å; K302-K561 HydrophobicContact CB-CD 4.2Å; K302-K561 VanDerWaalsContact O-CD 3.32Å; K302-K561 WeakPolarHBondContact O-CD 3.21Å; K302-K561 PolarHBondContact O-NZ 2.99Å; V557-K561 HydrophobicContact CG1-CB 3.57Å; S558-K561 WeakPolarHBondContact O-CA 3.43Å; S558-K561 WeakPolarHBondContact O-CB 3.5Å; S558-K561 PolarHBondContact O-N 2.66Å; S558-K561 WeakPolarHBondContact OG-CD 3.33Å; S558-K561 WeakPolarHBondContact OG-CG 2.94Å; K559-K561 PolarHBondContact O-N 3.34Å; K559-K561 VanDerWaalsContact O-N 3.11Å; K561-I565 VanDerWaalsContact O-CG1 3.24Å; K561-I565 WeakPolarHBondContact O-CG1 3.37Å; K561-I565 PolarHBondContact O-N 3.04Å
562	I	86.2	Confident	78.7	Confident	28 Å²	28	52.8 Å²	52.8	14%	0.144	31%	0.312	C	S	.	.	H	α-helix	trans	-65.9	-43.1	170.8	-59.6	178.1	0	0	0	109.2	F299 V557 S558 K559 L564 I565 L566 L580 Y584	F299-I562 HydrophobicContact CE1-CG1 4.45Å; V557-I562 HydrophobicContact CB-CD1 4.48Å; V557-I562 HydrophobicContact CB-CG1 4.03Å; V557-I562 HydrophobicContact CG1-CG1 3.68Å; S558-I562 PolarHBondContact O-N 2.87Å; K559-I562 CarbonylContact O-C 3.6Å; K559-I562 WeakPolarHBondContact O-CA 3.26Å; K559-I562 WeakPolarHBondContact O-CB 3.29Å; K559-I562 PolarHBondContact O-N 2.99Å; I562-L564 PolarHBondContact O-N 3.13Å; I562-I565 WeakPolarHBondContact O-CB 3.39Å; I562-I565 PolarHBondContact O-N 2.55Å; I562-I565 VanDerWaalsContact O-N 3.12Å; I562-L566 WeakPolarHBondContact O-CB 3.44Å; I562-L566 PolarHBondContact O-N 3.19Å; I562-L580 HydrophobicContact CG2-CD2 3.57Å; I562-L580 HydrophobicContact CG2-CG 4.11Å; I562-Y584 HydrophobicContact CD1-CD2 4.32Å; I562-Y584 HydrophobicContact CD1-CE2 4.37Å; I562-Y584 HydrophobicContact CD1-CG 4.49Å
563	D	86.4	Confident	79.7	Confident	57 Å²	57	52.4 Å²	52.4	31%	0.305	31%	0.312	S	S	.	.	H	α-helix	trans	-65.2	-36.7	177.3	-59	-37.9	0	0	0	111.8	K559 I565 L566 S567	K559-D563 PolarHBondContact O-N 3.37Å; D563-I565 VanDerWaalsContact C-N 3.35Å; D563-L566 WeakPolarHBondContact O-CB 3.49Å; D563-L566 PolarHBondContact O-N 3.13Å; D563-S567 PolarHBondContact O-N 2.95Å
564	L	87.7	Confident	80.8	Confident	88 Å²	88	52.3 Å²	52.3	46%	0.461	32%	0.319	S	S	.	.	H	α-helix	trans	-67.6	-28.9	171.2	-178.4	62.8	0	0	0	113.8	A560 I562 S567	A560-L564 WeakPolarHBondContact O-CB 3.48Å; A560-L564 PolarHBondContact O-N 3.36Å; I562-L564 PolarHBondContact O-N 3.13Å; L564-S567 PolarHBondContact O-OG 2.88Å
565	I	88.3	Confident	81.6	Confident	6 Å²	6	56.1 Å²	56.1	3%	0.031	34%	0.339	C	S	.	.	H	α-helix	trans	-74.6	-40.5	171.7	-69.8	167.9	0	0	0	109.7	W294 R298 F299 V557 K561 I562 D563 K568 L569 L580	W294-I565 HydrophobicContact CH2-CG2 4.23Å; W294-I565 HydrophobicContact CZ3-CG2 3.86Å; R298-I565 HydrophobicContact CB-CD1 3.8Å; R298-I565 HydrophobicContact CB-CG1 3.87Å; R298-I565 HydrophobicContact CB-CG2 4.39Å; F299-I565 HydrophobicContact CD1-CD1 3.66Å; F299-I565 HydrophobicContact CE1-CD1 4.09Å; V557-I565 HydrophobicContact CG1-CD1 4.46Å; K561-I565 VanDerWaalsContact O-CG1 3.24Å; K561-I565 WeakPolarHBondContact O-CG1 3.37Å; K561-I565 PolarHBondContact O-N 3.04Å; I562-I565 WeakPolarHBondContact O-CB 3.39Å; I562-I565 PolarHBondContact O-N 2.55Å; I562-I565 VanDerWaalsContact O-N 3.12Å; D563-I565 VanDerWaalsContact C-N 3.35Å; I565-K568 PolarHBondContact O-N 3.01Å; I565-L569 WeakPolarHBondContact O-CB 3.19Å; I565-L569 PolarHBondContact O-N 3.17Å; I565-L569 VanDerWaalsContact O-N 3.13Å; I565-L580 HydrophobicContact CG2-CD1 4.07Å; I565-L580 HydrophobicContact CG2-CD2 4.5Å
566	L	89	Confident	82.6	Confident	35 Å²	35	59.6 Å²	59.6	18%	0.183	35%	0.354	C	S	.	.	H	α-helix	trans	-63.2	-41.2	178.4	-175.8	62.1	0	0	0	112.8	I562 D563 K568 L569 K576 M577 L580	I562-L566 WeakPolarHBondContact O-CB 3.44Å; I562-L566 PolarHBondContact O-N 3.19Å; D563-L566 WeakPolarHBondContact O-CB 3.49Å; D563-L566 PolarHBondContact O-N 3.13Å; L566-K568 VanDerWaalsContact C-N 3.31Å; L566-K568 PolarHBondContact O-N 2.68Å; L566-L569 WeakPolarHBondContact O-CB 3.46Å; L566-L569 PolarHBondContact O-N 3.35Å; L566-K576 HydrophobicContact CD1-CB 3.52Å; L566-K576 HydrophobicContact CD1-CD 4.25Å; L566-M577 HydrophobicContact CD2-CB 4.4Å; L566-M577 HydrophobicContact CD2-CE 3.58Å; L566-M577 HydrophobicContact CD2-SD 4.38Å; L566-L580 HydrophobicContact CB-CD2 3.77Å; L566-L580 HydrophobicContact CD1-CD2 4.06Å; L566-L580 HydrophobicContact CG-CD2 4.43Å
567	S	87.4	Confident	83.2	Confident	90 Å²	90	60.1 Å²	60.1	63%	0.629	36%	0.356	S	S	*	.	H	α-helix	trans	-66.9	-31.2	178	65.3	0	0	0	0	112.9	D563 L564	D563-S567 PolarHBondContact O-N 2.95Å; L564-S567 PolarHBondContact O-OG 2.88Å
568	K	87.1	Confident	83.4	Confident	142 Å²	142	63.4 Å²	63.4	62%	0.617	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.7	-2.1	175.3	-65.4	-172.3	179.8	-167.7	0	113.9	W294 I565 L566 S570	W294-K568 HydrophobicContact CH2-CB 3.74Å; W294-K568 HydrophobicContact CZ2-CB 3.97Å; I565-K568 PolarHBondContact O-N 3.01Å; L566-K568 VanDerWaalsContact C-N 3.31Å; L566-K568 PolarHBondContact O-N 2.68Å; K568-S570 PolarHBondContact O-N 2.88Å
569	L	86.5	Confident	83.8	Confident	4 Å²	4	61 Å²	61	2%	0.021	35%	0.353	C	S	.	.			trans	-82.7	105.3	-175.4	-178.9	58.9	0	0	0	112.9	T291 W294 I295 I565 L566 V572 K576	T291-L569 HydrophobicContact CG2-CD1 3.74Å; W294-L569 HydrophobicContact CE3-CD1 4.38Å; W294-L569 HydrophobicContact CZ3-CB 4.44Å; W294-L569 HydrophobicContact CZ3-CD1 4.19Å; I295-L569 HydrophobicContact CD1-CD1 3.82Å; I295-L569 HydrophobicContact CD1-CD2 4.2Å; I295-L569 HydrophobicContact CG1-CD1 3.93Å; I565-L569 WeakPolarHBondContact O-CB 3.19Å; I565-L569 PolarHBondContact O-N 3.17Å; I565-L569 VanDerWaalsContact O-N 3.13Å; L566-L569 WeakPolarHBondContact O-CB 3.46Å; L566-L569 PolarHBondContact O-N 3.35Å; L569-V572 HydrophobicContact CD1-CG2 4.11Å; L569-V572 HydrophobicContact CD2-CB 4.47Å; L569-V572 HydrophobicContact CD2-CG2 4.1Å; L569-V572 HydrophobicContact CG-CG2 4.18Å; L569-K576 PolarHBondContact O-NZ 3.25Å
570	S	80	Confident	84.2	Confident	94 Å²	94	53.2 Å²	53.2	66%	0.657	32%	0.319	S	S	*	.			trans	-95.4	170	166.9	62.2	0	0	0	0	111.8	K568 V572	K568-S570 PolarHBondContact O-N 2.88Å; S570-V572 VanDerWaalsContact C-N 3.31Å; S570-V572 PolarHBondContact O-N 3.5Å
571	G	73.8	Confident	84.6	Confident	63 Å²	63	55.9 Å²	55.9	65%	0.649	32%	0.321	S	S	*	.	S	Bend	trans	81.5	-13.1	175.2	0	0	0	0	0	117
572	V	78.8	Confident	84.9	Confident	8 Å²	8	56.4 Å²	56.4	5%	0.048	32%	0.324	C	S	.	.			trans	-105.8	128.3	176	-171.1	0	0	0	0	111.1	V287 T291 L569 S570 K576 F579	V287-V572 HydrophobicContact CG1-CG2 4.1Å; V287-V572 HydrophobicContact CG2-CG1 4.19Å; V287-V572 HydrophobicContact CG2-CG2 4.05Å; T291-V572 HydrophobicContact CG2-CG2 3.73Å; L569-V572 HydrophobicContact CD1-CG2 4.11Å; L569-V572 HydrophobicContact CD2-CB 4.47Å; L569-V572 HydrophobicContact CD2-CG2 4.1Å; L569-V572 HydrophobicContact CG-CG2 4.18Å; S570-V572 VanDerWaalsContact C-N 3.31Å; S570-V572 PolarHBondContact O-N 3.5Å; V572-K576 HydrophobicContact CB-CG 4.3Å; V572-K576 HydrophobicContact CG1-CG 4.35Å; V572-K576 WeakPolarHBondContact O-CE 3.5Å; V572-F579 HydrophobicContact CG1-CB 4.43Å; V572-F579 HydrophobicContact CG1-CD1 3.98Å; V572-F579 HydrophobicContact CG1-CG 4.34Å; V572-F579 HydrophobicContact CG2-CD1 3.99Å; V572-F579 HydrophobicContact CG2-CE1 3.99Å
573	S	74.6	Confident	85.2	Confident	53 Å²	53	55 Å²	55	37%	0.371	32%	0.317	S	S	.	.			trans	-117.1	167.3	169.6	66.3	0	0	0	0	112.4	R279 P285	R279-S573 PolarHBondContact NH1-O 3.06Å; R279-S573 PolarHBondContact NH2-O 3.3Å; P285-S573 WeakPolarHBondContact CD-OG 3.36Å; P285-S573 WeakPolarHBondContact CG-OG 3.49Å
574	G	76.9	Confident	85.4	Confident	45 Å²	45	54.3 Å²	54.3	46%	0.464	31%	0.31	S	S	.	.	S	Bend	trans	77.1	-158.9	-161.3	0	0	0	0	0	111	K576	G574-K576 PolarHBondContact O-N 3.02Å
575	D	79.7	Confident	85.5	Confident	97 Å²	97	52.5 Å²	52.5	52%	0.519	31%	0.308	S	S	.	.			trans	-67.6	100.1	177.1	-172.1	-15.3	0	0	0	111.3	M577 E578 F579	D575-M577 VanDerWaalsContact C-N 3.34Å; D575-M577 WeakPolarHBondContact OD1-CA 3.41Å; D575-M577 WeakPolarHBondContact OD1-CB 3.16Å; D575-M577 PolarHBondContact OD1-N 3.05Å; D575-E578 HydrophobicContact CB-CB 4.05Å; D575-E578 VanDerWaalsContact CG-CB 3.46Å; D575-E578 PolarHBondContact OD1-N 3.44Å; D575-E578 VanDerWaalsContact OD2-CB 3.31Å; D575-E578 WeakPolarHBondContact OD2-CB 3.47Å; D575-F579 PolarHBondContact O-N 2.99Å
576	K	86.2	Confident	85.8	Confident	77 Å²	77	53 Å²	53	34%	0.335	31%	0.31	S	S	.	.	H	α-helix	trans	-65.9	-35.2	174.3	-65.5	-171.6	-177.6	-175.8	0	112.3	L566 L569 V572 G574 L580	L566-K576 HydrophobicContact CD1-CB 3.52Å; L566-K576 HydrophobicContact CD1-CD 4.25Å; L569-K576 PolarHBondContact O-NZ 3.25Å; V572-K576 HydrophobicContact CB-CG 4.3Å; V572-K576 HydrophobicContact CG1-CG 4.35Å; V572-K576 WeakPolarHBondContact O-CE 3.5Å; G574-K576 PolarHBondContact O-N 3.02Å; K576-L580 VanDerWaalsContact O-CB 3.24Å; K576-L580 WeakPolarHBondContact O-CB 3.45Å; K576-L580 PolarHBondContact O-N 2.98Å
577	M	86.2	Confident	85.9	Confident	60 Å²	60	51.3 Å²	51.3	30%	0.296	30%	0.301	S	S	.	.	H	α-helix	trans	-70	-42.3	-177.1	174.4	61.6	85.1	0	0	110.2	L566 D575 L580 K581	L566-M577 HydrophobicContact CD2-CB 4.4Å; L566-M577 HydrophobicContact CD2-CE 3.58Å; L566-M577 HydrophobicContact CD2-SD 4.38Å; D575-M577 VanDerWaalsContact C-N 3.34Å; D575-M577 WeakPolarHBondContact OD1-CA 3.41Å; D575-M577 WeakPolarHBondContact OD1-CB 3.16Å; D575-M577 PolarHBondContact OD1-N 3.05Å; M577-L580 PolarHBondContact O-N 3.28Å; M577-K581 WeakPolarHBondContact O-CG 3.38Å; M577-K581 PolarHBondContact O-N 2.7Å; M577-K581 HydrophobicContact SD-CG 4.42Å
578	E	86.7	Confident	85.9	Confident	72 Å²	72	50.4 Å²	50.4	34%	0.336	29%	0.286	S	S	.	.	H	α-helix	trans	-67.1	-39.4	176.5	-175.2	52.2	-147.3	0	0	112.7	D575 L580 K581 Q582	D575-E578 HydrophobicContact CB-CB 4.05Å; D575-E578 VanDerWaalsContact CG-CB 3.46Å; D575-E578 PolarHBondContact OD1-N 3.44Å; D575-E578 VanDerWaalsContact OD2-CB 3.31Å; D575-E578 WeakPolarHBondContact OD2-CB 3.47Å; E578-L580 VanDerWaalsContact C-N 3.34Å; E578-L580 PolarHBondContact O-N 3.01Å; E578-K581 PolarHBondContact O-N 3.04Å; E578-K581 VanDerWaalsContact OE2-CD 3.27Å; E578-K581 WeakPolarHBondContact OE2-CD 2.93Å; E578-K581 IonicContact OE2-NZ 3.58Å; E578-K581 PolarHBondContact OE2-NZ 2.73Å; E578-Q582 WeakPolarHBondContact O-CG 3.36Å; E578-Q582 PolarHBondContact O-N 2.9Å; E578-Q582 PolarHBondContact OE1-NE2 2.71Å
579	F	89.6	Confident	86	Confident	7 Å²	7	48.7 Å²	48.7	3%	0.031	28%	0.283	C	S	.	.	H	α-helix	trans	-62.4	-40.9	169.7	178.8	-109.9	0	0	0	112.1	W271 I275 V287 I295 V572 D575 Q582 T583	W271-F579 HydrophobicContact CH2-CE2 4.07Å; W271-F579 HydrophobicContact CZ3-CE2 4.16Å; W271-F579 HydrophobicContact CZ3-CZ 4.48Å; I275-F579 HydrophobicContact CG2-CD2 3.97Å; I275-F579 HydrophobicContact CG2-CE2 3.84Å; V287-F579 HydrophobicContact CB-CZ 4.09Å; V287-F579 HydrophobicContact CG1-CE1 4.02Å; V287-F579 HydrophobicContact CG1-CZ 3.83Å; V287-F579 HydrophobicContact CG2-CE1 4.1Å; V287-F579 HydrophobicContact CG2-CE2 4.1Å; V287-F579 HydrophobicContact CG2-CZ 3.87Å; I295-F579 HydrophobicContact CD1-CD1 4.33Å; I295-F579 HydrophobicContact CD1-CE1 3.64Å; V572-F579 HydrophobicContact CG1-CB 4.43Å; V572-F579 HydrophobicContact CG1-CD1 3.98Å; V572-F579 HydrophobicContact CG1-CG 4.34Å; V572-F579 HydrophobicContact CG2-CD1 3.99Å; V572-F579 HydrophobicContact CG2-CE1 3.99Å; D575-F579 PolarHBondContact O-N 2.99Å; F579-Q582 PolarHBondContact O-N 3.2Å; F579-T583 WeakPolarHBondContact O-CB 3.1Å; F579-T583 PolarHBondContact O-N 2.77Å; F579-T583 PolarHBondContact O-OG1 3.22Å
580	L	90.8	Very high	86.1	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-68.3	-38.2	179.5	-167.4	64.4	0	0	0	112.3	I295 F299 I562 I565 L566 K576 M577 E578 T583 Y584	I295-L580 HydrophobicContact CG2-CD1 3.81Å; F299-L580 HydrophobicContact CE1-CD1 4.02Å; F299-L580 HydrophobicContact CE1-CG 4.39Å; F299-L580 HydrophobicContact CE2-CD1 4.21Å; F299-L580 HydrophobicContact CZ-CD1 3.43Å; F299-L580 VanDerWaalsContact CZ-CD1 3.43Å; F299-L580 HydrophobicContact CZ-CG 3.9Å; I562-L580 HydrophobicContact CG2-CD2 3.57Å; I562-L580 HydrophobicContact CG2-CG 4.11Å; I565-L580 HydrophobicContact CG2-CD1 4.07Å; I565-L580 HydrophobicContact CG2-CD2 4.5Å; L566-L580 HydrophobicContact CB-CD2 3.77Å; L566-L580 HydrophobicContact CD1-CD2 4.06Å; L566-L580 HydrophobicContact CG-CD2 4.43Å; K576-L580 VanDerWaalsContact O-CB 3.24Å; K576-L580 WeakPolarHBondContact O-CB 3.45Å; K576-L580 PolarHBondContact O-N 2.98Å; M577-L580 PolarHBondContact O-N 3.28Å; E578-L580 VanDerWaalsContact C-N 3.34Å; E578-L580 PolarHBondContact O-N 3.01Å; L580-T583 PolarHBondContact O-N 2.75Å; L580-Y584 VanDerWaalsContact O-CB 3.29Å; L580-Y584 WeakPolarHBondContact O-CB 3.26Å; L580-Y584 PolarHBondContact O-N 2.85Å
581	K	89.8	Confident	86.1	Confident	109 Å²	109	45 Å²	45	47%	0.474	26%	0.255	S	S	.	.	H	α-helix	trans	-60.1	-47.9	170.6	-72.7	167.1	-174.6	162.3	0	111.8	M577 E578 T583 Y584 A585	M577-K581 WeakPolarHBondContact O-CG 3.38Å; M577-K581 PolarHBondContact O-N 2.7Å; M577-K581 HydrophobicContact SD-CG 4.42Å; E578-K581 PolarHBondContact O-N 3.04Å; E578-K581 VanDerWaalsContact OE2-CD 3.27Å; E578-K581 WeakPolarHBondContact OE2-CD 2.93Å; E578-K581 IonicContact OE2-NZ 3.58Å; E578-K581 PolarHBondContact OE2-NZ 2.73Å; K581-T583 VanDerWaalsContact C-N 3.32Å; K581-T583 PolarHBondContact O-N 3.07Å; K581-Y584 PolarHBondContact O-N 3Å; K581-A585 PolarHBondContact O-N 3.45Å
582	Q	90.6	Very high	86	Confident	49 Å²	49	45.5 Å²	45.5	23%	0.229	24%	0.24	C	C	.	.	H	α-helix	trans	-63	-40.1	178.8	-71.1	172.2	26.4	0	0	111.2	W271 E578 F579 F586	W271-Q582 HydrophobicContact CZ2-CB 4.24Å; E578-Q582 WeakPolarHBondContact O-CG 3.36Å; E578-Q582 PolarHBondContact O-N 2.9Å; E578-Q582 PolarHBondContact OE1-NE2 2.71Å; F579-Q582 PolarHBondContact O-N 3.2Å; Q582-F586 PolarHBondContact O-N 3.05Å; Q582-F586 VanDerWaalsContact O-N 3.12Å
583	T	92.3	Very high	86	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-67.7	-39.8	175.6	-46.5	0	0	0	0	111.7	W271 L292 I295 M296 F299 F579 L580 K581 F586 W587	W271-T583 HydrophobicContact CH2-CG2 4.27Å; W271-T583 WeakPolarHBondContact CH2-OG1 3.38Å; L292-T583 HydrophobicContact CD1-CG2 3.57Å; I295-T583 HydrophobicContact CB-CG2 4.43Å; I295-T583 HydrophobicContact CG2-CG2 3.63Å; M296-T583 HydrophobicContact SD-CG2 4.2Å; F299-T583 HydrophobicContact CE2-CG2 4.06Å; F579-T583 WeakPolarHBondContact O-CB 3.1Å; F579-T583 PolarHBondContact O-N 2.77Å; F579-T583 PolarHBondContact O-OG1 3.22Å; L580-T583 PolarHBondContact O-N 2.75Å; K581-T583 VanDerWaalsContact C-N 3.32Å; K581-T583 PolarHBondContact O-N 3.07Å; T583-F586 PolarHBondContact O-N 3.3Å; T583-W587 WeakPolarHBondContact O-CB 3.46Å; T583-W587 PolarHBondContact O-N 3.42Å
584	Y	92.1	Very high	85.8	Confident	41 Å²	41	54.2 Å²	54.2	16%	0.161	27%	0.268	C	S	.	.	H	α-helix	trans	-63.3	-42.7	175.9	178.1	-105.5	0	0	0	112.3	F299 V557 I562 L580 K581 F586 W587 K588	F299-Y584 HydrophobicContact CD1-CD2 4.18Å; F299-Y584 AromaticContact CE1-CD2 3.98Å; F299-Y584 HydrophobicContact CE1-CD2 3.98Å; F299-Y584 HydrophobicContact CE2-CD2 4.44Å; F299-Y584 HydrophobicContact CZ-CD2 4.12Å; F299-Y584 HydrophobicContact CZ-CG 4.36Å; V557-Y584 HydrophobicContact CB-CE2 3.9Å; V557-Y584 HydrophobicContact CG2-CD2 4.5Å; V557-Y584 HydrophobicContact CG2-CE2 3.95Å; I562-Y584 HydrophobicContact CD1-CD2 4.32Å; I562-Y584 HydrophobicContact CD1-CE2 4.37Å; I562-Y584 HydrophobicContact CD1-CG 4.49Å; L580-Y584 VanDerWaalsContact O-CB 3.29Å; L580-Y584 WeakPolarHBondContact O-CB 3.26Å; L580-Y584 PolarHBondContact O-N 2.85Å; K581-Y584 PolarHBondContact O-N 3Å; Y584-F586 VanDerWaalsContact C-N 3.33Å; Y584-F586 PolarHBondContact O-N 3.1Å; Y584-W587 AromaticContact CD2-CE3 3.83Å; Y584-W587 HydrophobicContact CD2-CE3 3.83Å; Y584-W587 HydrophobicContact CD2-CZ3 4.16Å; Y584-W587 AromaticContact CE2-CE3 3.67Å; Y584-W587 HydrophobicContact CE2-CE3 3.67Å; Y584-W587 AromaticContact CE2-CZ3 3.51Å; Y584-W587 HydrophobicContact CE2-CZ3 3.51Å; Y584-W587 PolarHBondContact O-N 3.33Å; Y584-K588 WeakPolarHBondContact O-CB 3.21Å; Y584-K588 PolarHBondContact O-N 3.41Å
585	A	90.2	Very high	85.2	Confident	50 Å²	50	56.4 Å²	56.4	41%	0.413	26%	0.262	S	S	.	.	H	α-helix	trans	-61.5	-41.9	174.8	0	0	0	0	0	111.6	K581 K588 L589	K581-A585 PolarHBondContact O-N 3.45Å; A585-K588 PolarHBondContact O-N 2.87Å; A585-L589 VanDerWaalsContact O-CG 3.31Å; A585-L589 WeakPolarHBondContact O-CG 3.44Å; A585-L589 PolarHBondContact O-N 3.19Å
586	F	93	Very high	84.6	Confident	16 Å²	16	52.2 Å²	52.2	7%	0.07	24%	0.242	C	C	.	.	H	α-helix	trans	-65.1	-46.4	175.5	178.7	-122.8	0	0	0	112.5	E267 D268 W271 M296 Q582 T583 Y584 K588 L589 K590	E267-F586 HydrophobicContact CG-CE2 4.27Å; E267-F586 HydrophobicContact CG-CZ 4.25Å; D268-F586 WeakPolarHBondContact OD1-CE1 3.4Å; D268-F586 WeakPolarHBondContact OD1-CZ 3.48Å; W271-F586 HydrophobicContact CB-CD1 4.48Å; W271-F586 HydrophobicContact CB-CE1 3.91Å; W271-F586 HydrophobicContact CB-CE2 3.97Å; W271-F586 HydrophobicContact CB-CZ 3.62Å; W271-F586 AromaticContact CD1-CD2 3.48Å; W271-F586 VanDerWaalsContact CD1-CD2 3.48Å; W271-F586 AromaticContact CD1-CE2 3.73Å; W271-F586 AromaticContact CD1-CG 3.69Å; W271-F586 HydrophobicContact CD2-CB 4.47Å; W271-F586 AromaticContact CD2-CD1 3.72Å; W271-F586 HydrophobicContact CD2-CD1 3.72Å; W271-F586 HydrophobicContact CD2-CD2 4.46Å; W271-F586 AromaticContact CD2-CE1 3.98Å; W271-F586 HydrophobicContact CD2-CE1 3.98Å; W271-F586 AromaticContact CD2-CG 3.98Å; W271-F586 HydrophobicContact CD2-CG 3.98Å; W271-F586 HydrophobicContact CD2-CZ 4.46Å; W271-F586 AromaticContact CE2-CD1 3.94Å; W271-F586 AromaticContact CE2-CG 3.8Å; W271-F586 HydrophobicContact CE3-CD1 4.1Å; W271-F586 HydrophobicContact CE3-CE1 4.28Å; W271-F586 AromaticContact CG-CD1 3.88Å; W271-F586 HydrophobicContact CG-CD1 3.88Å; W271-F586 AromaticContact CG-CD2 3.95Å; W271-F586 HydrophobicContact CG-CD2 3.95Å; W271-F586 AromaticContact CG-CE1 3.81Å; W271-F586 HydrophobicContact CG-CE1 3.81Å; W271-F586 AromaticContact CG-CE2 3.89Å; W271-F586 HydrophobicContact CG-CE2 3.89Å; W271-F586 AromaticContact CG-CG 3.94Å; W271-F586 HydrophobicContact CG-CG 3.94Å; W271-F586 AromaticContact CG-CZ 3.81Å; W271-F586 HydrophobicContact CG-CZ 3.81Å; W271-F586 HydrophobicContact CZ2-CB 4.04Å; W271-F586 HydrophobicContact CZ2-CD1 4.5Å; W271-F586 HydrophobicContact CZ2-CG 4.44Å; W271-F586 AromaticContact NE1-CD2 3.78Å; W271-F586 AromaticContact NE1-CG 3.6Å; M296-F586 HydrophobicContact CE-CD1 4.43Å; M296-F586 HydrophobicContact CE-CE1 4.43Å; Q582-F586 PolarHBondContact O-N 3.05Å; Q582-F586 VanDerWaalsContact O-N 3.12Å; T583-F586 PolarHBondContact O-N 3.3Å; Y584-F586 VanDerWaalsContact C-N 3.33Å; Y584-F586 PolarHBondContact O-N 3.1Å; F586-K588 VanDerWaalsContact C-N 3.34Å; F586-K588 PolarHBondContact O-N 2.94Å; F586-L589 PolarHBondContact O-N 3.1Å; F586-K590 HydrophobicContact CE1-CD 4.01Å; F586-K590 HydrophobicContact CE2-CD 4.1Å; F586-K590 HydrophobicContact CE2-CG 4.2Å; F586-K590 HydrophobicContact CZ-CD 3.72Å; F586-K590 HydrophobicContact CZ-CG 4.33Å; F586-K590 PolarHBondContact O-N 3.31Å
587	W	92.7	Very high	83.8	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-56.5	-45.7	173.3	169.2	84	0	0	0	112.2	M296 F299 E300 A303 P555 V557 T583 Y584 L589 K590 R591	M296-W587 HydrophobicContact CE-CB 4.22Å; M296-W587 HydrophobicContact SD-CB 3.88Å; F299-W587 HydrophobicContact CB-CD2 3.96Å; F299-W587 HydrophobicContact CB-CG 4.01Å; F299-W587 HydrophobicContact CD2-CB 4.04Å; F299-W587 HydrophobicContact CD2-CG 4.14Å; F299-W587 HydrophobicContact CG-CG 4.46Å; E300-W587 PolarHBondContact OE2-NE1 3.17Å; A303-W587 HydrophobicContact CB-CH2 3.54Å; A303-W587 HydrophobicContact CB-CZ2 3.54Å; P555-W587 VanDerWaalsContact O-CH2 3.25Å; P555-W587 WeakPolarHBondContact O-CH2 3.09Å; V557-W587 HydrophobicContact CG2-CH2 4.06Å; V557-W587 HydrophobicContact CG2-CZ3 4.16Å; T583-W587 WeakPolarHBondContact O-CB 3.46Å; T583-W587 PolarHBondContact O-N 3.42Å; Y584-W587 AromaticContact CD2-CE3 3.83Å; Y584-W587 HydrophobicContact CD2-CE3 3.83Å; Y584-W587 HydrophobicContact CD2-CZ3 4.16Å; Y584-W587 AromaticContact CE2-CE3 3.67Å; Y584-W587 HydrophobicContact CE2-CE3 3.67Å; Y584-W587 AromaticContact CE2-CZ3 3.51Å; Y584-W587 HydrophobicContact CE2-CZ3 3.51Å; Y584-W587 PolarHBondContact O-N 3.33Å; W587-L589 VanDerWaalsContact C-N 3.34Å; W587-L589 PolarHBondContact O-N 3.4Å; W587-K590 PolarHBondContact O-N 2.93Å; W587-R591 HydrophobicContact CZ2-CG 3.97Å; W587-R591 PolarHBondContact O-N 2.79Å
588	K	87.1	Confident	83.4	Confident	72 Å²	72	48.6 Å²	48.6	31%	0.313	23%	0.23	S	C	.	.	H	α-helix	trans	-60.5	-42.3	176.9	-178	174.8	178.7	-72.5	0	111.6	Y584 A585 F586 R591 E592	Y584-K588 WeakPolarHBondContact O-CB 3.21Å; Y584-K588 PolarHBondContact O-N 3.41Å; A585-K588 PolarHBondContact O-N 2.87Å; F586-K588 VanDerWaalsContact C-N 3.34Å; F586-K588 PolarHBondContact O-N 2.94Å; K588-R591 WeakPolarHBondContact O-CB 3.41Å; K588-R591 PolarHBondContact O-N 3.44Å; K588-E592 WeakPolarHBondContact CE-OE1 3.47Å; K588-E592 IonicContact NZ-OE1 3.63Å; K588-E592 PolarHBondContact NZ-OE1 2.9Å; K588-E592 WeakPolarHBondContact O-CB 3.11Å; K588-E592 WeakPolarHBondContact O-CG 3.44Å; K588-E592 PolarHBondContact O-N 2.75Å
589	L	87.6	Confident	83.4	Confident	106 Å²	106	45.9 Å²	45.9	56%	0.555	22%	0.218	S	C	*	.	H	α-helix	trans	-64.5	-41.3	175	-72.4	166.9	0	0	0	112.4	A585 F586 W587 R591 E592 F593	A585-L589 VanDerWaalsContact O-CG 3.31Å; A585-L589 WeakPolarHBondContact O-CG 3.44Å; A585-L589 PolarHBondContact O-N 3.19Å; F586-L589 PolarHBondContact O-N 3.1Å; W587-L589 VanDerWaalsContact C-N 3.34Å; W587-L589 PolarHBondContact O-N 3.4Å; L589-R591 VanDerWaalsContact C-N 3.34Å; L589-R591 PolarHBondContact O-N 3.16Å; L589-E592 PolarHBondContact O-N 3.01Å; L589-F593 WeakPolarHBondContact O-CB 3.45Å; L589-F593 PolarHBondContact O-N 2.91Å
590	K	88.9	Confident	83.2	Confident	13 Å²	13	45.7 Å²	45.7	6%	0.057	22%	0.217	C	C	.	.	H	α-helix	trans	-63.5	-38	174.2	-66.3	-167	77.8	161.8	0	111.9	D265 E267 D268 M296 F586 W587 R594 L599	D265-K590 IonicContact OD1-NZ 3.83Å; D265-K590 PolarHBondContact OD1-NZ 2.98Å; D265-K590 IonicContact OD2-NZ 2.96Å; D265-K590 PolarHBondContact OD2-NZ 3.37Å; E267-K590 IonicContact OE2-NZ 3.35Å; D268-K590 WeakPolarHBondContact OD1-CD 3.27Å; D268-K590 IonicContact OD1-NZ 2.93Å; D268-K590 PolarHBondContact OD1-NZ 3.16Å; D268-K590 IonicContact OD2-NZ 3.94Å; D268-K590 PolarHBondContact OD2-NZ 3.41Å; M296-K590 HydrophobicContact CE-CD 4.11Å; F586-K590 HydrophobicContact CE1-CD 4.01Å; F586-K590 HydrophobicContact CE2-CD 4.1Å; F586-K590 HydrophobicContact CE2-CG 4.2Å; F586-K590 HydrophobicContact CZ-CD 3.72Å; F586-K590 HydrophobicContact CZ-CG 4.33Å; F586-K590 PolarHBondContact O-N 3.31Å; W587-K590 PolarHBondContact O-N 2.93Å; K590-R594 WeakPolarHBondContact O-CB 3.26Å; K590-R594 WeakPolarHBondContact O-CG 3.37Å; K590-R594 PolarHBondContact O-N 3.28Å; K590-R594 VanDerWaalsContact O-N 3.09Å; K590-L599 HydrophobicContact CB-CD1 4.36Å; K590-L599 HydrophobicContact CB-CD2 4.33Å
591	R	79.8	Confident	82.6	Confident	8 Å²	8	52.2 Å²	52.2	3%	0.03	25%	0.245	C	C	.	.	H	α-helix	trans	-64.8	-44.4	171.5	-82.6	-70.3	-158.6	128.2	14.5	112.6	E300 V554 W587 K588 L589 R594 R595 G596 V597 L599	E300-R591 IonicContact OE1-CZ 3.2Å; E300-R591 IonicContact OE1-NE 3.2Å; E300-R591 PolarHBondContact OE1-NE 2.96Å; E300-R591 IonicContact OE1-NH2 3.85Å; E300-R591 PolarHBondContact OE1-NH2 3.12Å; E300-R591 IonicContact OE2-CZ 3.89Å; E300-R591 VanDerWaalsContact OE2-CZ 3.24Å; E300-R591 IonicContact OE2-NE 2.64Å; E300-R591 PolarHBondContact OE2-NE 2.8Å; E300-R591 IonicContact OE2-NH2 2.75Å; E300-R591 PolarHBondContact OE2-NH2 3.49Å; V554-R591 HydrophobicContact CG1-CB 3.88Å; W587-R591 HydrophobicContact CZ2-CG 3.97Å; W587-R591 PolarHBondContact O-N 2.79Å; K588-R591 WeakPolarHBondContact O-CB 3.41Å; K588-R591 PolarHBondContact O-N 3.44Å; L589-R591 VanDerWaalsContact C-N 3.34Å; L589-R591 PolarHBondContact O-N 3.16Å; R591-R594 CarbonylContact O-C 3.6Å; R591-R594 PolarHBondContact O-N 2.88Å; R591-R595 PolarHBondContact O-N 2.78Å; R591-R595 VanDerWaalsContact O-N 3.11Å; R591-G596 PolarHBondContact NH1-O 3.43Å; R591-G596 PolarHBondContact O-N 3.34Å; R591-V597 WeakPolarHBondContact CD-O 3.33Å; R591-L599 HydrophobicContact CG-CG 4.39Å
592	E	73.3	Confident	82.1	Confident	73 Å²	73	49.3 Å²	49.3	34%	0.341	23%	0.231	S	C	.	.	H	α-helix	trans	-62.1	-45.3	176.5	-80.4	170.7	-171.4	0	0	112.1	V554 K588 L589 R594 R595	V554-E592 HydrophobicContact CG1-CG 4.5Å; V554-E592 HydrophobicContact CG2-CG 3.67Å; K588-E592 WeakPolarHBondContact CE-OE1 3.47Å; K588-E592 IonicContact NZ-OE1 3.63Å; K588-E592 PolarHBondContact NZ-OE1 2.9Å; K588-E592 WeakPolarHBondContact O-CB 3.11Å; K588-E592 WeakPolarHBondContact O-CG 3.44Å; K588-E592 PolarHBondContact O-N 2.75Å; L589-E592 PolarHBondContact O-N 3.01Å; E592-R594 VanDerWaalsContact C-N 3.29Å; E592-R594 PolarHBondContact O-N 3.24Å; E592-R595 WeakPolarHBondContact O-CA 3.2Å; E592-R595 PolarHBondContact O-N 2.93Å
593	F	77.9	Confident	81.2	Confident	141 Å²	141	48.8 Å²	48.8	62%	0.618	23%	0.23	S	C	*	.	H	α-helix	trans	-61.1	-37.2	176.4	-174.3	-101.1	0	0	0	112.2	L589 R595	L589-F593 WeakPolarHBondContact O-CB 3.45Å; L589-F593 PolarHBondContact O-N 2.91Å; F593-R595 PolarHBondContact O-N 3.22Å
594	R	71.1	Confident	80.1	Confident	102 Å²	102	51 Å²	51	39%	0.385	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.9	13.8	172.2	-64	-175	67.8	-176.3	-4.4	113.6	K590 R591 E592 G596 V597	K590-R594 WeakPolarHBondContact O-CB 3.26Å; K590-R594 WeakPolarHBondContact O-CG 3.37Å; K590-R594 PolarHBondContact O-N 3.28Å; K590-R594 VanDerWaalsContact O-N 3.09Å; R591-R594 CarbonylContact O-C 3.6Å; R591-R594 PolarHBondContact O-N 2.88Å; E592-R594 VanDerWaalsContact C-N 3.29Å; E592-R594 PolarHBondContact O-N 3.24Å; R594-G596 VanDerWaalsContact C-N 3.35Å; R594-G596 PolarHBondContact O-N 2.95Å; R594-V597 HydrophobicContact CB-CB 4.43Å; R594-V597 VanDerWaalsContact O-CB 3.28Å; R594-V597 WeakPolarHBondContact O-CB 3.46Å; R594-V597 VanDerWaalsContact O-CG2 3.29Å; R594-V597 WeakPolarHBondContact O-CG2 3.49Å; R594-V597 PolarHBondContact O-N 2.9Å; R594-V597 VanDerWaalsContact O-N 3.17Å
595	R	64.4	Low	78.4	Confident	92 Å²	92	51.1 Å²	51.1	35%	0.347	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.9	47.7	178.2	-58.5	-173.7	-175.3	176.2	-1.3	113.4	S384 E385 V552 R591 E592 F593 V597	S384-R595 VanDerWaalsContact CB-O 3.26Å; S384-R595 WeakPolarHBondContact CB-O 3.44Å; S384-R595 WeakPolarHBondContact O-CD 3.15Å; S384-R595 PolarHBondContact O-NH1 2.85Å; E385-R595 IonicContact OE1-CZ 3.71Å; E385-R595 IonicContact OE1-NH1 2.64Å; E385-R595 PolarHBondContact OE1-NH1 3.15Å; V552-R595 HydrophobicContact CG1-CB 4.42Å; V552-R595 HydrophobicContact CG2-CB 4.31Å; R591-R595 PolarHBondContact O-N 2.78Å; R591-R595 VanDerWaalsContact O-N 3.11Å; E592-R595 WeakPolarHBondContact O-CA 3.2Å; E592-R595 PolarHBondContact O-N 2.93Å; F593-R595 PolarHBondContact O-N 3.22Å; R595-V597 PolarHBondContact O-N 2.92Å
596	G	65.5	Low	76.5	Confident	9 Å²	9	52.1 Å²	52.1	9%	0.093	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	81.5	-15.2	178.4	0	0	0	0	0	115	R591 R594	R591-G596 PolarHBondContact NH1-O 3.43Å; R591-G596 PolarHBondContact O-N 3.34Å; R594-G596 VanDerWaalsContact C-N 3.35Å; R594-G596 PolarHBondContact O-N 2.95Å
597	V	71.1	Confident	74.3	Confident	47 Å²	47	55.1 Å²	55.1	29%	0.285	28%	0.276	S	S	.	.			trans	-57.2	132	179.5	176.7	0	0	0	0	110.4	R591 R594 R595 Q604	R591-V597 WeakPolarHBondContact CD-O 3.33Å; R594-V597 HydrophobicContact CB-CB 4.43Å; R594-V597 VanDerWaalsContact O-CB 3.28Å; R594-V597 WeakPolarHBondContact O-CB 3.46Å; R594-V597 VanDerWaalsContact O-CG2 3.29Å; R594-V597 WeakPolarHBondContact O-CG2 3.49Å; R594-V597 PolarHBondContact O-N 2.9Å; R594-V597 VanDerWaalsContact O-N 3.17Å; R595-V597 PolarHBondContact O-N 2.92Å; V597-Q604 HydrophobicContact CG1-CG 3.98Å
598	P	77.6	Confident	71.9	Confident	14 Å²	14	61.2 Å²	61.2	9%	0.091	31%	0.307	C	S	.	.			trans	-55.3	149.3	179.4	-27.5	35.8	0	0	0	113.9	E300 L603 Q604	E300-P598 WeakPolarHBondContact OE1-CA 3.37Å; E300-P598 VanDerWaalsContact OE1-CB 3.23Å; E300-P598 WeakPolarHBondContact OE1-CB 3.24Å; P598-L603 HydrophobicContact CB-CB 3.59Å; P598-L603 HydrophobicContact CG-CB 4Å; P598-Q604 HydrophobicContact CB-CG 4.14Å; P598-Q604 WeakPolarHBondContact O-CG 3.29Å; P598-Q604 PolarHBondContact O-NE2 2.75Å
599	L	86	Confident	69.8	Low	15 Å²	15	63.6 Å²	63.6	8%	0.079	32%	0.319	C	S	.	.	S	Bend	trans	-78.3	-41.8	176.4	-51.6	-178.5	0	0	0	110.5	Y262 M296 E300 K590 R591 Q604	Y262-L599 HydrophobicContact CD2-CB 4.39Å; Y262-L599 HydrophobicContact CE2-CB 3.75Å; Y262-L599 HydrophobicContact CE2-CD1 3.81Å; Y262-L599 HydrophobicContact CE2-CG 4.42Å; M296-L599 HydrophobicContact CE-CD1 4.31Å; E300-L599 HydrophobicContact CG-CB 4.05Å; E300-L599 PolarHBondContact OE1-N 3.31Å; K590-L599 HydrophobicContact CB-CD1 4.36Å; K590-L599 HydrophobicContact CB-CD2 4.33Å; R591-L599 HydrophobicContact CG-CG 4.39Å; L599-Q604 PolarHBondContact O-NE2 3.33Å
600	L	86	Confident	67.7	Low	3 Å²	3	63.4 Å²	63.4	2%	0.016	31%	0.311	C	S	.	.	S	Bend	trans	-71.5	135	175.3	-68.9	-176.5	0	0	0	112.7	E261 Y262 E300 K301 R602 L603 Q604	E261-L600 HydrophobicContact CB-CD1 3.99Å; E261-L600 HydrophobicContact CB-CD2 3.51Å; E261-L600 HydrophobicContact CB-CG 4.29Å; E261-L600 VanDerWaalsContact O-CD2 3.31Å; E261-L600 WeakPolarHBondContact O-CD2 3.39Å; Y262-L600 HydrophobicContact CD2-CD2 4.21Å; E300-L600 HydrophobicContact CB-CD1 4.49Å; E300-L600 HydrophobicContact CB-CG 4.36Å; E300-L600 HydrophobicContact CG-CB 4.17Å; E300-L600 HydrophobicContact CG-CD1 4.07Å; E300-L600 HydrophobicContact CG-CG 3.63Å; K301-L600 HydrophobicContact CD-CD1 4.43Å; K301-L600 HydrophobicContact CG-CD1 3.83Å; L600-R602 PolarHBondContact O-N 2.64Å; L600-L603 HydrophobicContact CB-CB 4.35Å; L600-L603 HydrophobicContact CB-CD1 4.22Å; L600-L603 HydrophobicContact CB-CG 4.11Å; L600-L603 HydrophobicContact CD1-CD1 4.14Å; L600-L603 HydrophobicContact CD1-CG 4.48Å; L600-L603 PolarHBondContact O-N 3.06Å; L600-Q604 WeakPolarHBondContact O-CG 3.05Å; L600-Q604 PolarHBondContact O-N 2.75Å
601	K	78.5	Confident	65.6	Low	137 Å²	137	66.3 Å²	66.3	60%	0.596	33%	0.333	S	S	*	.	H	α-helix	trans	-63	-37.6	-178.6	-60.9	167.4	-165.4	134.9	0	112.4	D263 Q604 A605	D263-K601 IonicContact OD2-NZ 3.19Å; D263-K601 PolarHBondContact OD2-NZ 3.33Å; K601-Q604 WeakPolarHBondContact O-CB 3.42Å; K601-Q604 PolarHBondContact O-N 2.92Å; K601-A605 PolarHBondContact O-N 3Å
602	R	78.3	Confident	63.9	Low	47 Å²	47	68.1 Å²	68.1	18%	0.177	35%	0.35	C	S	.	.	H	α-helix	trans	-60.6	-48.9	174.3	179.5	173.3	62.7	109.1	-5.8	111.7	L256 D257 E261 L600 Q604 A605 C606	L256-R602 PolarHBondContact O-NH2 2.87Å; D257-R602 IonicContact OD1-NH2 3.24Å; D257-R602 PolarHBondContact OD1-NH2 3.38Å; E261-R602 VanDerWaalsContact CD-NE 3.32Å; E261-R602 WeakPolarHBondContact OE1-CB 3.46Å; E261-R602 WeakPolarHBondContact OE1-CD 3.44Å; E261-R602 IonicContact OE1-NE 2.66Å; E261-R602 PolarHBondContact OE1-NE 2.91Å; E261-R602 IonicContact OE2-CZ 2.7Å; E261-R602 VanDerWaalsContact OE2-CZ 3.22Å; E261-R602 IonicContact OE2-NE 2.66Å; E261-R602 PolarHBondContact OE2-NE 2.92Å; E261-R602 IonicContact OE2-NH2 2.81Å; E261-R602 PolarHBondContact OE2-NH2 2.85Å; L600-R602 PolarHBondContact O-N 2.64Å; R602-Q604 PolarHBondContact O-N 3.42Å; R602-A605 WeakPolarHBondContact O-CA 3.38Å; R602-A605 WeakPolarHBondContact O-CB 3.48Å; R602-A605 PolarHBondContact O-N 2.86Å; R602-A605 VanDerWaalsContact O-N 3.11Å; R602-C606 PolarHBondContact O-N 3.11Å; R602-C606 PolarHBondContact O-SG 2.87Å
603	L	71.5	Confident	62.6	Low	39 Å²	39	67.4 Å²	67.4	20%	0.204	36%	0.357	C	S	.	.	H	α-helix	trans	-69.1	-32.8	-179.7	-57.8	-177.6	0	0	0	112.4	E300 P598 L600 S607	E300-L603 HydrophobicContact CG-CD1 4.23Å; E300-L603 WeakPolarHBondContact O-CD1 3.37Å; P598-L603 HydrophobicContact CB-CB 3.59Å; P598-L603 HydrophobicContact CG-CB 4Å; L600-L603 HydrophobicContact CB-CB 4.35Å; L600-L603 HydrophobicContact CB-CD1 4.22Å; L600-L603 HydrophobicContact CB-CG 4.11Å; L600-L603 HydrophobicContact CD1-CD1 4.14Å; L600-L603 HydrophobicContact CD1-CG 4.48Å; L600-L603 PolarHBondContact O-N 3.06Å; L603-S607 WeakPolarHBondContact O-CB 3.23Å; L603-S607 PolarHBondContact O-N 3.18Å; L603-S607 PolarHBondContact O-OG 3.47Å
604	Q	69.5	Low	61.1	Low	47 Å²	47	65.6 Å²	65.6	22%	0.22	35%	0.354	C	S	.	.	H	α-helix	trans	-59.4	-47.6	167.5	-68.2	160	23.7	0	0	111	V597 P598 L599 L600 K601 R602 S607 L608	V597-Q604 HydrophobicContact CG1-CG 3.98Å; P598-Q604 HydrophobicContact CB-CG 4.14Å; P598-Q604 WeakPolarHBondContact O-CG 3.29Å; P598-Q604 PolarHBondContact O-NE2 2.75Å; L599-Q604 PolarHBondContact O-NE2 3.33Å; L600-Q604 WeakPolarHBondContact O-CG 3.05Å; L600-Q604 PolarHBondContact O-N 2.75Å; K601-Q604 WeakPolarHBondContact O-CB 3.42Å; K601-Q604 PolarHBondContact O-N 2.92Å; R602-Q604 PolarHBondContact O-N 3.42Å; Q604-S607 WeakPolarHBondContact O-CB 3.39Å; Q604-S607 PolarHBondContact O-N 3.27Å; Q604-L608 PolarHBondContact O-N 3.45Å
605	A	55.5	Low	59.9	Low	43 Å²	43	65 Å²	65	36%	0.355	35%	0.354	S	S	.	.	H	α-helix	trans	-60.9	-51.5	177.4	0	0	0	0	0	111	K601 R602 S607 L608 H609	K601-A605 PolarHBondContact O-N 3Å; R602-A605 WeakPolarHBondContact O-CA 3.38Å; R602-A605 WeakPolarHBondContact O-CB 3.48Å; R602-A605 PolarHBondContact O-N 2.86Å; R602-A605 VanDerWaalsContact O-N 3.11Å; A605-S607 PolarHBondContact O-N 3.29Å; A605-L608 CarbonylContact O-C 3.59Å; A605-L608 WeakPolarHBondContact O-CA 3.3Å; A605-L608 WeakPolarHBondContact O-CB 3.41Å; A605-L608 PolarHBondContact O-N 3.05Å; A605-H609 VanDerWaalsContact O-CB 3.27Å; A605-H609 WeakPolarHBondContact O-CB 3.23Å; A605-H609 PolarHBondContact O-N 2.74Å
606	C	51.2	Low	59.2	Low	71 Å²	71	63.8 Å²	63.8	48%	0.48	36%	0.364	S	S	.	.	H	α-helix	trans	-54.6	-35.5	176.3	-63.1	0	0	0	0	113.3	R602 L608 H609 R610	R602-C606 PolarHBondContact O-N 3.11Å; R602-C606 PolarHBondContact O-SG 2.87Å; C606-L608 PolarHBondContact O-N 3.26Å; C606-H609 PolarHBondContact O-N 3.18Å; C606-R610 PolarHBondContact O-N 2.96Å
607	S	47.1	Very low	58.4	Low	78 Å²	78	67.8 Å²	67.8	55%	0.545	39%	0.386	S	S	.	.	H	α-helix	trans	-66.5	-22.7	175.8	-56	0	0	0	0	113.5	L603 Q604 A605	L603-S607 WeakPolarHBondContact O-CB 3.23Å; L603-S607 PolarHBondContact O-N 3.18Å; L603-S607 PolarHBondContact O-OG 3.47Å; Q604-S607 WeakPolarHBondContact O-CB 3.39Å; Q604-S607 PolarHBondContact O-N 3.27Å; A605-S607 PolarHBondContact O-N 3.29Å
608	L	41.9	Very low	57.3	Low	128 Å²	128	66 Å²	66	67%	0.67	38%	0.377	S	S	*	.	H	α-helix	trans	-99.2	-22.1	172.3	-69.2	155.4	0	0	0	112.2	Q604 A605 C606 S611	Q604-L608 PolarHBondContact O-N 3.45Å; A605-L608 CarbonylContact O-C 3.59Å; A605-L608 WeakPolarHBondContact O-CA 3.3Å; A605-L608 WeakPolarHBondContact O-CB 3.41Å; A605-L608 PolarHBondContact O-N 3.05Å; C606-L608 PolarHBondContact O-N 3.26Å; L608-S611 WeakPolarHBondContact O-CB 3.47Å; L608-S611 PolarHBondContact O-OG 3.21Å
609	H	43.4	Very low	56.1	Low	122 Å²	122	68.8 Å²	68.8	57%	0.565	40%	0.401	S	S	*	.	H	α-helix	trans	-92.9	9.9	-174.2	-98.7	-110.4	0	0	0	115.4	A605 C606 S611 A612	A605-H609 VanDerWaalsContact O-CB 3.27Å; A605-H609 WeakPolarHBondContact O-CB 3.23Å; A605-H609 PolarHBondContact O-N 2.74Å; C606-H609 PolarHBondContact O-N 3.18Å; H609-S611 PolarHBondContact O-N 2.82Å; H609-A612 HydrophobicContact CB-CB 4.42Å; H609-A612 VanDerWaalsContact O-CB 3.32Å; H609-A612 WeakPolarHBondContact O-CB 3.36Å; H609-A612 PolarHBondContact O-N 3.36Å
610	R	42.4	Very low	54.7	Low	102 Å²	102	73.7 Å²	73.7	39%	0.385	43%	0.431	S	S	.	.	H	α-helix	trans	-54.5	-29.2	156.7	-84.8	-158.2	-172	-162.3	14.5	111.4	P373 C606 A612 A613 N614	P373-R610 VanDerWaalsContact CG-NH2 3.34Å; P373-R610 PolarHBondContact O-NH1 3.39Å; P373-R610 PolarHBondContact O-NH2 2.91Å; C606-R610 PolarHBondContact O-N 2.96Å; R610-A612 PolarHBondContact O-N 3.15Å; R610-A612 VanDerWaalsContact O-N 3.17Å; R610-A613 PolarHBondContact O-N 3.17Å; R610-A613 VanDerWaalsContact O-N 3.15Å; R610-N614 PolarHBondContact O-N 3.22Å; R610-N614 PolarHBondContact O-OD1 2.97Å
611	S	46	Very low	52.7	Low	74 Å²	74	77.1 Å²	77.1	52%	0.517	45%	0.453	S	S	.	.	H	α-helix	trans	-45.6	-38.8	165	-47.6	0	0	0	0	113.5	L608 H609 F615	L608-S611 WeakPolarHBondContact O-CB 3.47Å; L608-S611 PolarHBondContact O-OG 3.21Å; H609-S611 PolarHBondContact O-N 2.82Å; S611-F615 WeakPolarHBondContact O-CB 3.29Å; S611-F615 WeakPolarHBondContact O-CD2 3.29Å; S611-F615 PolarHBondContact O-N 3.12Å
612	A	43.4	Very low	51.3	Low	46 Å²	46	73.1 Å²	73.1	38%	0.38	45%	0.45	S	S	.	.	H	α-helix	trans	-75.1	-37.3	-179.2	0	0	0	0	0	113.3	H609 R610 F615 A616	H609-A612 HydrophobicContact CB-CB 4.42Å; H609-A612 VanDerWaalsContact O-CB 3.32Å; H609-A612 WeakPolarHBondContact O-CB 3.36Å; H609-A612 PolarHBondContact O-N 3.36Å; R610-A612 PolarHBondContact O-N 3.15Å; R610-A612 VanDerWaalsContact O-N 3.17Å; A612-F615 WeakPolarHBondContact O-CB 3.17Å; A612-F615 PolarHBondContact O-N 2.93Å; A612-A616 PolarHBondContact O-N 2.64Å; A612-A616 VanDerWaalsContact O-N 3.08Å
613	A	47.2	Very low	50.5	Low	59 Å²	59	76.7 Å²	76.7	49%	0.488	47%	0.473	S	S	.	.	H	α-helix	trans	-66	-44	172	0	0	0	0	0	110.7	R610 F615 A616 V617	R610-A613 PolarHBondContact O-N 3.17Å; R610-A613 VanDerWaalsContact O-N 3.15Å; A613-F615 VanDerWaalsContact C-N 3.28Å; A613-F615 PolarHBondContact O-N 3.38Å; A613-A616 WeakPolarHBondContact O-CB 3.28Å; A613-A616 PolarHBondContact O-N 3.11Å; A613-A616 VanDerWaalsContact O-N 3.12Å; A613-V617 PolarHBondContact O-N 3.21Å; A613-V617 VanDerWaalsContact O-N 3.11Å
614	N	46	Very low	50.1	Low	103 Å²	103	78.9 Å²	78.9	55%	0.551	50%	0.496	S	S	*	.	H	α-helix	trans	-62.1	-34.4	172.6	-69	28.9	0	0	0	112.1	R610 A616 V617 A618	R610-N614 PolarHBondContact O-N 3.22Å; R610-N614 PolarHBondContact O-OD1 2.97Å; N614-A616 VanDerWaalsContact C-N 3.34Å; N614-V617 PolarHBondContact O-N 2.93Å; N614-A618 WeakPolarHBondContact O-CB 3.49Å; N614-A618 PolarHBondContact O-N 2.89Å
615	F	44.6	Very low	49.2	Very low	89 Å²	89	81 Å²	81	39%	0.39	51%	0.506	S	S	.	.	H	α-helix	trans	-62.7	-37.9	172.7	-114.2	-95.9	0	0	0	112.3	S611 A612 A613 A619 M629	S611-F615 WeakPolarHBondContact O-CB 3.29Å; S611-F615 WeakPolarHBondContact O-CD2 3.29Å; S611-F615 PolarHBondContact O-N 3.12Å; A612-F615 WeakPolarHBondContact O-CB 3.17Å; A612-F615 PolarHBondContact O-N 2.93Å; A613-F615 VanDerWaalsContact C-N 3.28Å; A613-F615 PolarHBondContact O-N 3.38Å; F615-A619 WeakPolarHBondContact O-CB 3.44Å; F615-A619 PolarHBondContact O-N 3.41Å; F615-M629 HydrophobicContact CD1-CE 4.44Å; F615-M629 HydrophobicContact CD1-SD 3.68Å; F615-M629 HydrophobicContact CD2-CE 4.36Å; F615-M629 HydrophobicContact CE1-CB 4.36Å; F615-M629 HydrophobicContact CE1-CG 4.26Å; F615-M629 HydrophobicContact CE1-SD 3.56Å; F615-M629 VanDerWaalsContact CE1-SD 3.56Å; F615-M629 HydrophobicContact CE2-CE 4.47Å; F615-M629 HydrophobicContact CE2-SD 4.43Å; F615-M629 HydrophobicContact CG-CE 4.35Å; F615-M629 HydrophobicContact CG-SD 4.18Å; F615-M629 HydrophobicContact CZ-CG 4.29Å; F615-M629 HydrophobicContact CZ-SD 3.97Å
616	A	50.7	Low	49.2	Very low	67 Å²	67	80.2 Å²	80.2	55%	0.554	50%	0.498	S	S	*	.	H	α-helix	trans	-70.2	-39.4	177.4	0	0	0	0	0	112	A612 A613 N614	A612-A616 PolarHBondContact O-N 2.64Å; A612-A616 VanDerWaalsContact O-N 3.08Å; A613-A616 WeakPolarHBondContact O-CB 3.28Å; A613-A616 PolarHBondContact O-N 3.11Å; A613-A616 VanDerWaalsContact O-N 3.12Å; N614-A616 VanDerWaalsContact C-N 3.34Å
617	V	49.7	Very low	50	Low	92 Å²	92	82.5 Å²	82.5	56%	0.558	50%	0.502	S	S	*	.	H	α-helix	trans	-68.8	-45.9	175	177.3	0	0	0	0	110.7	A613 N614 A619 T620	A613-V617 PolarHBondContact O-N 3.21Å; A613-V617 VanDerWaalsContact O-N 3.11Å; N614-V617 PolarHBondContact O-N 2.93Å; V617-A619 PolarHBondContact O-N 3.42Å; V617-T620 PolarHBondContact O-N 3.49Å; V617-T620 PolarHBondContact O-OG1 3.24Å
618	A	47.3	Very low	51	Low	11 Å²	11	84.7 Å²	84.7	9%	0.091	50%	0.503	C	S	.	.	H	α-helix	trans	-64.7	-25.6	177.4	0	0	0	0	0	113.7	N614 T620 T621 M629	N614-A618 WeakPolarHBondContact O-CB 3.49Å; N614-A618 PolarHBondContact O-N 2.89Å; A618-T620 PolarHBondContact O-N 3.04Å; A618-T621 WeakPolarHBondContact CA-OG1 3.43Å; A618-T621 PolarHBondContact O-N 2.71Å; A618-T621 VanDerWaalsContact O-N 3.08Å; A618-T621 PolarHBondContact O-OG1 2.9Å; A618-M629 HydrophobicContact CB-CE 3.47Å; A618-M629 VanDerWaalsContact CB-CE 3.47Å; A618-M629 HydrophobicContact CB-SD 4.41Å
619	A	51.5	Low	51.8	Low	72 Å²	72	80.3 Å²	80.3	60%	0.595	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	-12.7	172.6	0	0	0	0	0	113.5	F615 V617	F615-A619 WeakPolarHBondContact O-CB 3.44Å; F615-A619 PolarHBondContact O-N 3.41Å; V617-A619 PolarHBondContact O-N 3.42Å
620	T	57.8	Low	53	Low	117 Å²	117	80.1 Å²	80.1	72%	0.718	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.3	-1.7	172.3	58.1	0	0	0	0	114.4	V617 A618	V617-T620 PolarHBondContact O-N 3.49Å; V617-T620 PolarHBondContact O-OG1 3.24Å; A618-T620 PolarHBondContact O-N 3.04Å
621	T	43.2	Very low	54.4	Low	76 Å²	76	78 Å²	78	47%	0.466	48%	0.478	S	S	.	.	S	Bend	trans	-121.8	72.3	-171.6	56.4	0	0	0	0	114.1	A618	A618-T621 WeakPolarHBondContact CA-OG1 3.43Å; A618-T621 PolarHBondContact O-N 2.71Å; A618-T621 VanDerWaalsContact O-N 3.08Å; A618-T621 PolarHBondContact O-OG1 2.9Å
622	G	49.6	Very low	55.7	Low	52 Å²	52	79.3 Å²	79.3	54%	0.536	48%	0.476	S	S	.	.			trans	84.5	154.5	158.4	0	0	0	0	0	117.8	A624 S626	G622-A624 PolarHBondContact O-N 2.82Å; G622-S626 PolarHBondContact O-N 3.19Å; G622-S626 PolarHBondContact O-OG 2.95Å
623	D	61	Low	57	Low	123 Å²	123	81.1 Å²	81.1	66%	0.658	48%	0.479	S	S	*	.	H	α-helix	trans	-69.8	-29.7	-173.2	-87.5	-57	0	0	0	114.7	S626 H627 R630	D623-S626 WeakPolarHBondContact O-CB 3.3Å; D623-H627 WeakPolarHBondContact O-CB 3.13Å; D623-H627 PolarHBondContact O-CD2 2.94Å; D623-H627 PolarHBondContact O-N 3.02Å; D623-R630 IonicContact OD1-NH2 2.9Å
624	A	62.4	Low	58.4	Low	85 Å²	85	85.6 Å²	85.6	70%	0.702	49%	0.487	S	S	*	.	H	α-helix	trans	-66.3	-50.6	-175.7	0	0	0	0	0	112	G622 S626 H627 Q628	G622-A624 PolarHBondContact O-N 2.82Å; A624-S626 VanDerWaalsContact C-N 3.35Å; A624-H627 WeakPolarHBondContact O-CB 3.23Å; A624-H627 PolarHBondContact O-N 2.95Å; A624-H627 VanDerWaalsContact O-N 3.14Å; A624-Q628 PolarHBondContact O-N 3.13Å; A624-Q628 VanDerWaalsContact O-N 3.11Å
625	E	52	Low	59.9	Low	90 Å²	90	86.8 Å²	86.8	42%	0.421	49%	0.488	S	S	.	.	H	α-helix	trans	-67.5	-38.7	177.7	-167.7	166.8	-157.5	0	0	110.7	H627 Q628 M629	E625-H627 VanDerWaalsContact C-N 3.28Å; E625-H627 PolarHBondContact O-N 3.18Å; E625-Q628 PolarHBondContact O-N 3.13Å; E625-Q628 VanDerWaalsContact O-N 3.1Å; E625-M629 HydrophobicContact CG-CE 4.26Å; E625-M629 WeakPolarHBondContact O-CG 3.15Å; E625-M629 PolarHBondContact O-N 2.7Å
626	S	56.1	Low	61.5	Low	28 Å²	28	90.1 Å²	90.1	20%	0.196	50%	0.498	C	S	.	.	H	α-helix	trans	-55.1	-39.1	169.3	-73.7	0	0	0	0	113.2	G622 D623 A624 R630	G622-S626 PolarHBondContact O-N 3.19Å; G622-S626 PolarHBondContact O-OG 2.95Å; D623-S626 WeakPolarHBondContact O-CB 3.3Å; A624-S626 VanDerWaalsContact C-N 3.35Å; S626-R630 WeakPolarHBondContact O-CB 3.15Å; S626-R630 VanDerWaalsContact O-CG 3.28Å; S626-R630 WeakPolarHBondContact O-CG 3.44Å; S626-R630 PolarHBondContact O-N 3.43Å
627	H	66.2	Low	62.8	Low	119 Å²	119	92.7 Å²	92.7	55%	0.551	50%	0.498	S	S	*	.	H	α-helix	trans	-67.8	-41	174.5	-100.4	-85.2	0	0	0	112.9	D623 A624 E625 R630 A631	D623-H627 WeakPolarHBondContact O-CB 3.13Å; D623-H627 PolarHBondContact O-CD2 2.94Å; D623-H627 PolarHBondContact O-N 3.02Å; A624-H627 WeakPolarHBondContact O-CB 3.23Å; A624-H627 PolarHBondContact O-N 2.95Å; A624-H627 VanDerWaalsContact O-N 3.14Å; E625-H627 VanDerWaalsContact C-N 3.28Å; E625-H627 PolarHBondContact O-N 3.18Å; H627-R630 PolarHBondContact CD2-NH2 3.19Å; H627-R630 PolarHBondContact NE2-NH2 3.47Å; H627-R630 PolarHBondContact O-N 3.35Å; H627-A631 PolarHBondContact O-N 3.36Å
628	Q	69.4	Low	64.3	Low	123 Å²	123	92.5 Å²	92.5	58%	0.575	49%	0.491	S	S	*	.	H	α-helix	trans	-66.7	-39.4	176.7	-167.1	167.5	3.3	0	0	111.7	A624 E625 A631 H632	A624-Q628 PolarHBondContact O-N 3.13Å; A624-Q628 VanDerWaalsContact O-N 3.11Å; E625-Q628 PolarHBondContact O-N 3.13Å; E625-Q628 VanDerWaalsContact O-N 3.1Å; Q628-A631 WeakPolarHBondContact O-CB 3.34Å; Q628-A631 PolarHBondContact O-N 3.02Å; Q628-H632 PolarHBondContact O-CD2 3.07Å; Q628-H632 VanDerWaalsContact O-CD2 3.28Å; Q628-H632 PolarHBondContact O-N 2.76Å
629	M	57.4	Low	65.8	Low	37 Å²	37	95 Å²	95	18%	0.182	50%	0.503	C	S	.	.	H	α-helix	trans	-63.3	-41.4	171.9	-70.5	-165.7	176.9	0	0	112.3	F615 A618 E625 A631 H632 L633	F615-M629 HydrophobicContact CD1-CE 4.44Å; F615-M629 HydrophobicContact CD1-SD 3.68Å; F615-M629 HydrophobicContact CD2-CE 4.36Å; F615-M629 HydrophobicContact CE1-CB 4.36Å; F615-M629 HydrophobicContact CE1-CG 4.26Å; F615-M629 HydrophobicContact CE1-SD 3.56Å; F615-M629 VanDerWaalsContact CE1-SD 3.56Å; F615-M629 HydrophobicContact CE2-CE 4.47Å; F615-M629 HydrophobicContact CE2-SD 4.43Å; F615-M629 HydrophobicContact CG-CE 4.35Å; F615-M629 HydrophobicContact CG-SD 4.18Å; F615-M629 HydrophobicContact CZ-CG 4.29Å; F615-M629 HydrophobicContact CZ-SD 3.97Å; A618-M629 HydrophobicContact CB-CE 3.47Å; A618-M629 VanDerWaalsContact CB-CE 3.47Å; A618-M629 HydrophobicContact CB-SD 4.41Å; E625-M629 HydrophobicContact CG-CE 4.26Å; E625-M629 WeakPolarHBondContact O-CG 3.15Å; E625-M629 PolarHBondContact O-N 2.7Å; M629-A631 VanDerWaalsContact C-N 3.27Å; M629-A631 PolarHBondContact O-N 3.17Å; M629-H632 PolarHBondContact O-N 3.48Å; M629-L633 WeakPolarHBondContact O-CB 3.48Å; M629-L633 WeakPolarHBondContact O-CG 3.27Å; M629-L633 PolarHBondContact O-N 2.97Å
630	R	70.3	Confident	67.1	Low	117 Å²	117	101.1 Å²	101.1	44%	0.442	51%	0.511	S	S	.	.	H	α-helix	trans	-60.2	-34.6	172.6	-75.8	-174.3	-77	-103.3	17	112.2	D623 S626 H627 K634	D623-R630 IonicContact OD1-NH2 2.9Å; S626-R630 WeakPolarHBondContact O-CB 3.15Å; S626-R630 VanDerWaalsContact O-CG 3.28Å; S626-R630 WeakPolarHBondContact O-CG 3.44Å; S626-R630 PolarHBondContact O-N 3.43Å; H627-R630 PolarHBondContact CD2-NH2 3.19Å; H627-R630 PolarHBondContact NE2-NH2 3.47Å; H627-R630 PolarHBondContact O-N 3.35Å; R630-K634 WeakPolarHBondContact O-CG 3.39Å; R630-K634 PolarHBondContact O-N 3.42Å
631	A	72	Confident	68.3	Low	57 Å²	57	99.9 Å²	99.9	47%	0.471	50%	0.497	S	S	.	.	H	α-helix	trans	-71.6	-45.7	173.7	0	0	0	0	0	112.4	H627 Q628 M629 L633 K634 F635	H627-A631 PolarHBondContact O-N 3.36Å; Q628-A631 WeakPolarHBondContact O-CB 3.34Å; Q628-A631 PolarHBondContact O-N 3.02Å; M629-A631 VanDerWaalsContact C-N 3.27Å; M629-A631 PolarHBondContact O-N 3.17Å; A631-L633 VanDerWaalsContact C-N 3.35Å; A631-L633 PolarHBondContact O-N 3.25Å; A631-K634 PolarHBondContact O-N 2.93Å; A631-F635 PolarHBondContact O-N 3.21Å
632	H	71.7	Confident	70.2	Confident	102 Å²	102	99.5 Å²	99.5	47%	0.472	49%	0.492	S	S	.	.	H	α-helix	trans	-60.7	-41.9	177.1	-79.3	-144.7	0	0	0	111.8	Q628 M629 K634 F635 W636	Q628-H632 PolarHBondContact O-CD2 3.07Å; Q628-H632 VanDerWaalsContact O-CD2 3.28Å; Q628-H632 PolarHBondContact O-N 2.76Å; M629-H632 PolarHBondContact O-N 3.48Å; H632-K634 PolarHBondContact O-N 2.87Å; H632-F635 WeakPolarHBondContact O-CB 3.47Å; H632-F635 PolarHBondContact O-N 2.57Å; H632-W636 PolarHBondContact O-N 3.29Å
633	L	71	Confident	71.6	Confident	85 Å²	85	102.8 Å²	102.8	45%	0.445	50%	0.496	S	S	.	.	H	α-helix	trans	-60.9	-41.1	176	-77.9	167	0	0	0	112.5	M629 A631 W636 Q637	M629-L633 WeakPolarHBondContact O-CB 3.48Å; M629-L633 WeakPolarHBondContact O-CG 3.27Å; M629-L633 PolarHBondContact O-N 2.97Å; A631-L633 VanDerWaalsContact C-N 3.35Å; A631-L633 PolarHBondContact O-N 3.25Å; L633-W636 PolarHBondContact O-N 2.84Å; L633-Q637 WeakPolarHBondContact O-CB 3.27Å; L633-Q637 VanDerWaalsContact O-CG 3.29Å; L633-Q637 WeakPolarHBondContact O-CG 3.08Å; L633-Q637 PolarHBondContact O-N 3.43Å
634	K	76.5	Confident	72.6	Confident	152 Å²	152	100.8 Å²	100.8	66%	0.661	48%	0.483	S	S	*	.	H	α-helix	trans	-62.6	-42.2	173.4	-74.3	177.4	177.5	-177.8	0	111.9	R630 A631 H632 Q637 Q638	R630-K634 WeakPolarHBondContact O-CG 3.39Å; R630-K634 PolarHBondContact O-N 3.42Å; A631-K634 PolarHBondContact O-N 2.93Å; H632-K634 PolarHBondContact O-N 2.87Å; K634-Q637 PolarHBondContact O-N 3.18Å; K634-Q638 WeakPolarHBondContact O-CB 3.45Å; K634-Q638 PolarHBondContact O-N 3.08Å
635	F	77.9	Confident	73.4	Confident	128 Å²	128	98.9 Å²	98.9	56%	0.561	46%	0.458	S	S	*	.	H	α-helix	trans	-61.2	-46.4	175.7	175.7	-97.1	0	0	0	112.2	A631 H632 Q637 Q638 L639	A631-F635 PolarHBondContact O-N 3.21Å; H632-F635 WeakPolarHBondContact O-CB 3.47Å; H632-F635 PolarHBondContact O-N 2.57Å; F635-Q637 VanDerWaalsContact C-N 3.34Å; F635-Q637 PolarHBondContact O-N 3.08Å; F635-Q638 PolarHBondContact O-N 3.02Å; F635-L639 HydrophobicContact CE1-CD2 4.38Å; F635-L639 WeakPolarHBondContact O-CB 3.48Å; F635-L639 PolarHBondContact O-N 3Å
636	W	78.2	Confident	74.7	Confident	160 Å²	160	96.2 Å²	96.2	61%	0.606	45%	0.454	S	S	*	.	H	α-helix	trans	-64.3	-36.6	176.5	-70.9	116.9	0	0	0	113	H632 L633 L639 R640	H632-W636 PolarHBondContact O-N 3.29Å; L633-W636 PolarHBondContact O-N 2.84Å; W636-L639 HydrophobicContact CE3-CD2 3.98Å; W636-L639 HydrophobicContact CZ3-CD2 3.86Å; W636-R640 WeakPolarHBondContact O-CB 3.31Å; W636-R640 PolarHBondContact O-N 2.67Å
637	Q	78.6	Confident	76.1	Confident	120 Å²	120	100.6 Å²	100.6	56%	0.561	47%	0.467	S	S	*	.	H	α-helix	trans	-64.5	-44.4	173.3	-74.1	174.6	3.8	0	0	111.9	L633 K634 F635 R640 Q641	L633-Q637 WeakPolarHBondContact O-CB 3.27Å; L633-Q637 VanDerWaalsContact O-CG 3.29Å; L633-Q637 WeakPolarHBondContact O-CG 3.08Å; L633-Q637 PolarHBondContact O-N 3.43Å; K634-Q637 PolarHBondContact O-N 3.18Å; F635-Q637 VanDerWaalsContact C-N 3.34Å; F635-Q637 PolarHBondContact O-N 3.08Å; Q637-R640 PolarHBondContact O-N 3.02Å; Q637-Q641 WeakPolarHBondContact O-CG 3.29Å; Q637-Q641 PolarHBondContact O-N 3.35Å; Q637-Q641 VanDerWaalsContact O-N 3.14Å
638	Q	80.6	Confident	76.9	Confident	88 Å²	88	98.2 Å²	98.2	41%	0.411	46%	0.458	S	S	.	.	H	α-helix	trans	-61.7	-50.4	176	177.1	60.6	31.5	0	0	111.2	K634 F635 R640 Q641 D642	K634-Q638 WeakPolarHBondContact O-CB 3.45Å; K634-Q638 PolarHBondContact O-N 3.08Å; F635-Q638 PolarHBondContact O-N 3.02Å; Q638-R640 VanDerWaalsContact C-N 3.26Å; Q638-R640 PolarHBondContact O-N 3.09Å; Q638-Q641 CarbonylContact O-C 3.49Å; Q638-Q641 WeakPolarHBondContact O-CA 3.5Å; Q638-Q641 WeakPolarHBondContact O-CB 3.37Å; Q638-Q641 PolarHBondContact O-N 3.19Å; Q638-D642 WeakPolarHBondContact CG-OD2 3.47Å; Q638-D642 PolarHBondContact NE2-OD1 3.49Å; Q638-D642 PolarHBondContact NE2-OD2 2.9Å; Q638-D642 PolarHBondContact O-N 3.22Å
639	L	79	Confident	77.5	Confident	63 Å²	63	97.3 Å²	97.3	33%	0.33	46%	0.456	S	S	.	.	H	α-helix	trans	-58.4	-37	177.9	-179.3	61.9	0	0	0	112.3	F635 W636 D642 L643	F635-L639 HydrophobicContact CE1-CD2 4.38Å; F635-L639 WeakPolarHBondContact O-CB 3.48Å; F635-L639 PolarHBondContact O-N 3Å; W636-L639 HydrophobicContact CE3-CD2 3.98Å; W636-L639 HydrophobicContact CZ3-CD2 3.86Å; L639-D642 PolarHBondContact O-N 3.27Å; L639-L643 HydrophobicContact CD1-CG 4.45Å; L639-L643 HydrophobicContact CG-CD1 4.33Å; L639-L643 WeakPolarHBondContact O-CG 3.39Å; L639-L643 PolarHBondContact O-N 3.04Å
640	R	78.5	Confident	78.3	Confident	202 Å²	202	98.5 Å²	98.5	76%	0.762	47%	0.468	S	S	*	.	H	α-helix	trans	-63.9	-40.1	173.7	-174.1	-178	179.5	-153.9	0.3	112	W636 Q637 Q638 E644	W636-R640 WeakPolarHBondContact O-CB 3.31Å; W636-R640 PolarHBondContact O-N 2.67Å; Q637-R640 PolarHBondContact O-N 3.02Å; Q638-R640 VanDerWaalsContact C-N 3.26Å; Q638-R640 PolarHBondContact O-N 3.09Å; R640-E644 PolarHBondContact O-N 3.07Å
641	Q	83.4	Confident	78.7	Confident	90 Å²	90	97 Å²	97	42%	0.421	47%	0.466	S	S	.	.	H	α-helix	trans	-66.5	-40.3	174	-64.1	173.7	28	0	0	111.2	Q637 Q638 E644 R645	Q637-Q641 WeakPolarHBondContact O-CG 3.29Å; Q637-Q641 PolarHBondContact O-N 3.35Å; Q637-Q641 VanDerWaalsContact O-N 3.14Å; Q638-Q641 CarbonylContact O-C 3.49Å; Q638-Q641 WeakPolarHBondContact O-CA 3.5Å; Q638-Q641 WeakPolarHBondContact O-CB 3.37Å; Q638-Q641 PolarHBondContact O-N 3.19Å; Q641-E644 PolarHBondContact O-N 2.99Å; Q641-R645 VanDerWaalsContact CB-NH1 3.26Å; Q641-R645 VanDerWaalsContact O-CG 3.24Å; Q641-R645 WeakPolarHBondContact O-CG 3.37Å; Q641-R645 PolarHBondContact O-N 3.38Å
642	D	82.5	Confident	79.1	Confident	68 Å²	68	99.5 Å²	99.5	36%	0.364	47%	0.471	S	S	.	.	H	α-helix	trans	-66.3	-38	178.7	-68.3	-37.5	0	0	0	113.5	Q638 L639 E644 R645 G646	Q638-D642 WeakPolarHBondContact CG-OD2 3.47Å; Q638-D642 PolarHBondContact NE2-OD1 3.49Å; Q638-D642 PolarHBondContact NE2-OD2 2.9Å; Q638-D642 PolarHBondContact O-N 3.22Å; L639-D642 PolarHBondContact O-N 3.27Å; D642-E644 VanDerWaalsContact C-N 3.34Å; D642-R645 PolarHBondContact O-N 3.13Å; D642-R645 WeakPolarHBondContact OD1-CD 3.3Å; D642-R645 IonicContact OD1-CZ 2.64Å; D642-R645 IonicContact OD1-NE 3.32Å; D642-R645 IonicContact OD1-NH1 3.14Å; D642-R645 PolarHBondContact OD1-NH1 3.02Å; D642-R645 IonicContact OD2-NH1 2.69Å; D642-G646 PolarHBondContact O-N 3Å
643	L	79.9	Confident	79.4	Confident	121 Å²	121	98 Å²	98	63%	0.634	47%	0.465	S	S	*	.	H	α-helix	trans	-65.3	-36.8	171.5	-69.9	171	0	0	0	112.2	L639 G646 R647	L639-L643 HydrophobicContact CD1-CG 4.45Å; L639-L643 HydrophobicContact CG-CD1 4.33Å; L639-L643 WeakPolarHBondContact O-CG 3.39Å; L639-L643 PolarHBondContact O-N 3.04Å; L643-G646 PolarHBondContact O-N 2.99Å; L643-R647 WeakPolarHBondContact O-CB 3.47Å; L643-R647 PolarHBondContact O-N 3.28Å
644	E	81.9	Confident	79.6	Confident	82 Å²	82	100.7 Å²	100.7	38%	0.383	47%	0.47	S	S	.	.	H	α-helix	trans	-73.1	-37.8	176	-176.2	61.6	-173.2	0	0	112.3	R640 Q641 D642 G646 R647 L648	R640-E644 PolarHBondContact O-N 3.07Å; Q641-E644 PolarHBondContact O-N 2.99Å; D642-E644 VanDerWaalsContact C-N 3.34Å; E644-G646 VanDerWaalsContact C-N 3.35Å; E644-G646 PolarHBondContact O-N 2.61Å; E644-R647 VanDerWaalsContact CD-NE 3.31Å; E644-R647 WeakPolarHBondContact O-CB 3.23Å; E644-R647 PolarHBondContact O-N 3.27Å; E644-R647 IonicContact OE1-CZ 2.68Å; E644-R647 VanDerWaalsContact OE1-CZ 3.32Å; E644-R647 IonicContact OE1-NE 3.87Å; E644-R647 PolarHBondContact OE1-NE 2.9Å; E644-R647 VanDerWaalsContact OE1-NE 3.16Å; E644-R647 IonicContact OE1-NH2 2.93Å; E644-R647 PolarHBondContact OE1-NH2 3.18Å; E644-R647 WeakPolarHBondContact OE2-CD 3.47Å; E644-R647 IonicContact OE2-CZ 2.95Å; E644-R647 IonicContact OE2-NE 3.01Å; E644-R647 PolarHBondContact OE2-NE 3.36Å; E644-R647 IonicContact OE2-NH2 2.71Å; E644-L648 HydrophobicContact CG-CD1 4.43Å; E644-L648 WeakPolarHBondContact O-CG 3.36Å; E644-L648 PolarHBondContact O-N 2.85Å
645	R	79.2	Confident	79.7	Confident	45 Å²	45	99.1 Å²	99.1	17%	0.17	46%	0.463	C	S	.	.	H	α-helix	trans	-56.3	-48.6	168.5	-70.9	162.6	-175.9	129.6	5.9	110.4	F107 Q641 D642 R647 L648 L649	F107-R645 VanDerWaalsContact CD1-NH2 3.31Å; F107-R645 HydrophobicContact CE2-CG 4.09Å; F107-R645 HydrophobicContact CZ-CG 4.12Å; Q641-R645 VanDerWaalsContact CB-NH1 3.26Å; Q641-R645 VanDerWaalsContact O-CG 3.24Å; Q641-R645 WeakPolarHBondContact O-CG 3.37Å; Q641-R645 PolarHBondContact O-N 3.38Å; D642-R645 PolarHBondContact O-N 3.13Å; D642-R645 WeakPolarHBondContact OD1-CD 3.3Å; D642-R645 IonicContact OD1-CZ 2.64Å; D642-R645 IonicContact OD1-NE 3.32Å; D642-R645 IonicContact OD1-NH1 3.14Å; D642-R645 PolarHBondContact OD1-NH1 3.02Å; D642-R645 IonicContact OD2-NH1 2.69Å; R645-R647 VanDerWaalsContact C-N 3.34Å; R645-R647 PolarHBondContact O-N 3.02Å; R645-L648 PolarHBondContact O-N 3.26Å; R645-L649 WeakPolarHBondContact O-CB 3.47Å; R645-L649 PolarHBondContact O-N 3.43Å
646	G	78	Confident	79.8	Confident	33 Å²	33	100.5 Å²	100.5	34%	0.34	46%	0.464	S	S	.	.	H	α-helix	trans	-61.7	-36.7	175.6	0	0	0	0	0	113.7	D642 L643 E644 S650	D642-G646 PolarHBondContact O-N 3Å; L643-G646 PolarHBondContact O-N 2.99Å; E644-G646 VanDerWaalsContact C-N 3.35Å; E644-G646 PolarHBondContact O-N 2.61Å; G646-S650 WeakPolarHBondContact O-CB 3.38Å; G646-S650 PolarHBondContact O-N 3.11Å; G646-S650 PolarHBondContact O-OG 2.99Å
647	R	85.9	Confident	79.6	Confident	121 Å²	121	95.4 Å²	95.4	46%	0.457	45%	0.447	S	S	.	.	H	α-helix	trans	-65.6	-46.1	173.8	-166.6	-166.5	68.6	72.6	-1.8	111.8	L643 E644 R645 S650 E651	L643-R647 WeakPolarHBondContact O-CB 3.47Å; L643-R647 PolarHBondContact O-N 3.28Å; E644-R647 VanDerWaalsContact CD-NE 3.31Å; E644-R647 WeakPolarHBondContact O-CB 3.23Å; E644-R647 PolarHBondContact O-N 3.27Å; E644-R647 IonicContact OE1-CZ 2.68Å; E644-R647 VanDerWaalsContact OE1-CZ 3.32Å; E644-R647 IonicContact OE1-NE 3.87Å; E644-R647 PolarHBondContact OE1-NE 2.9Å; E644-R647 VanDerWaalsContact OE1-NE 3.16Å; E644-R647 IonicContact OE1-NH2 2.93Å; E644-R647 PolarHBondContact OE1-NH2 3.18Å; E644-R647 WeakPolarHBondContact OE2-CD 3.47Å; E644-R647 IonicContact OE2-CZ 2.95Å; E644-R647 IonicContact OE2-NE 3.01Å; E644-R647 PolarHBondContact OE2-NE 3.36Å; E644-R647 IonicContact OE2-NH2 2.71Å; R645-R647 VanDerWaalsContact C-N 3.34Å; R645-R647 PolarHBondContact O-N 3.02Å; R647-S650 WeakPolarHBondContact O-CB 3.38Å; R647-S650 PolarHBondContact O-N 3.3Å; R647-E651 PolarHBondContact O-N 2.9Å
648	L	84	Confident	79.5	Confident	69 Å²	69	96.7 Å²	96.7	36%	0.361	45%	0.447	S	S	.	.	H	α-helix	trans	-64.4	-46	177.9	-70.7	169.8	0	0	0	111.5	E644 R645 S650 E651 L652	E644-L648 HydrophobicContact CG-CD1 4.43Å; E644-L648 WeakPolarHBondContact O-CG 3.36Å; E644-L648 PolarHBondContact O-N 2.85Å; R645-L648 PolarHBondContact O-N 3.26Å; L648-S650 VanDerWaalsContact C-N 3.29Å; L648-S650 PolarHBondContact O-N 3.14Å; L648-E651 PolarHBondContact O-N 3.42Å; L648-E651 VanDerWaalsContact O-N 3.13Å; L648-L652 WeakPolarHBondContact O-CG 3.4Å; L648-L652 PolarHBondContact O-N 3.45Å
649	L	80.9	Confident	78.9	Confident	103 Å²	103	96.4 Å²	96.4	54%	0.539	45%	0.448	S	S	.	.	H	α-helix	trans	-58.6	-40.5	175.1	-178	60.4	0	0	0	111.8	R645 E651 L652 I653	R645-L649 WeakPolarHBondContact O-CB 3.47Å; R645-L649 PolarHBondContact O-N 3.43Å; L649-E651 VanDerWaalsContact C-N 3.34Å; L649-E651 PolarHBondContact O-N 3.1Å; L649-L652 PolarHBondContact O-N 3.4Å; L649-I653 HydrophobicContact CD1-CD1 4.24Å; L649-I653 HydrophobicContact CD1-CG1 4.39Å; L649-I653 HydrophobicContact CG-CD1 3.99Å; L649-I653 VanDerWaalsContact O-CG1 3.31Å; L649-I653 WeakPolarHBondContact O-CG1 3.42Å; L649-I653 PolarHBondContact O-N 3.48Å
650	S	75	Confident	78.5	Confident	62 Å²	62	100.2 Å²	100.2	43%	0.434	46%	0.461	S	S	.	.	H	α-helix	trans	-61.2	-38.6	175.6	-62.3	0	0	0	0	112.9	G646 R647 L648 R654	G646-S650 WeakPolarHBondContact O-CB 3.38Å; G646-S650 PolarHBondContact O-N 3.11Å; G646-S650 PolarHBondContact O-OG 2.99Å; R647-S650 WeakPolarHBondContact O-CB 3.38Å; R647-S650 PolarHBondContact O-N 3.3Å; L648-S650 VanDerWaalsContact C-N 3.29Å; L648-S650 PolarHBondContact O-N 3.14Å; S650-R654 WeakPolarHBondContact O-CB 3.47Å; S650-R654 VanDerWaalsContact O-CG 3.27Å; S650-R654 WeakPolarHBondContact O-CG 3.47Å; S650-R654 PolarHBondContact O-N 2.87Å
651	E	78.7	Confident	78	Confident	85 Å²	85	97.4 Å²	97.4	40%	0.397	45%	0.451	S	S	.	.	H	α-helix	trans	-74.7	-34.1	175	-69.4	-53.9	131.1	0	0	112.8	R647 L648 L649 R654 K655	R647-E651 PolarHBondContact O-N 2.9Å; L648-E651 PolarHBondContact O-N 3.42Å; L648-E651 VanDerWaalsContact O-N 3.13Å; L649-E651 VanDerWaalsContact C-N 3.34Å; L649-E651 PolarHBondContact O-N 3.1Å; E651-R654 WeakPolarHBondContact O-CB 3.33Å; E651-R654 PolarHBondContact O-N 2.76Å; E651-R654 WeakPolarHBondContact OE1-CD 3.49Å; E651-R654 IonicContact OE1-CZ 2.69Å; E651-R654 IonicContact OE1-NE 3.21Å; E651-R654 IonicContact OE1-NH1 2.66Å; E651-R654 PolarHBondContact OE1-NH1 3.13Å; E651-K655 WeakPolarHBondContact O-CB 3.38Å; E651-K655 PolarHBondContact O-N 2.95Å
652	L	80.4	Confident	77.3	Confident	111 Å²	111	96.9 Å²	96.9	58%	0.581	45%	0.451	S	S	*	.	H	α-helix	trans	-65.1	-42.3	172.9	-70.2	173.6	0	0	0	111.8	L648 L649 K655 R656	L648-L652 WeakPolarHBondContact O-CG 3.4Å; L648-L652 PolarHBondContact O-N 3.45Å; L649-L652 PolarHBondContact O-N 3.4Å; L652-K655 WeakPolarHBondContact O-CB 3.48Å; L652-K655 PolarHBondContact O-N 2.79Å; L652-R656 PolarHBondContact O-N 3.19Å
653	I	78.4	Confident	76.7	Confident	69 Å²	69	98.7 Å²	98.7	35%	0.354	46%	0.459	S	S	.	.	H	α-helix	trans	-61.6	-46	172.5	-68.1	165.5	0	0	0	110.3	L649 K655 R656 E657	L649-I653 HydrophobicContact CD1-CD1 4.24Å; L649-I653 HydrophobicContact CD1-CG1 4.39Å; L649-I653 HydrophobicContact CG-CD1 3.99Å; L649-I653 VanDerWaalsContact O-CG1 3.31Å; L649-I653 WeakPolarHBondContact O-CG1 3.42Å; L649-I653 PolarHBondContact O-N 3.48Å; I653-K655 VanDerWaalsContact C-N 3.26Å; I653-K655 PolarHBondContact O-N 2.78Å; I653-R656 PolarHBondContact O-N 3.24Å; I653-R656 VanDerWaalsContact O-N 3.13Å; I653-E657 HydrophobicContact CG2-CG 4.31Å; I653-E657 PolarHBondContact O-N 3.25Å
654	R	73.8	Confident	76.2	Confident	142 Å²	142	98.1 Å²	98.1	54%	0.536	45%	0.452	S	S	.	.	H	α-helix	trans	-58	-35.8	174.1	-78.2	168.5	164.4	-174.3	-5.7	113.2	S650 E651 R658	S650-R654 WeakPolarHBondContact O-CB 3.47Å; S650-R654 VanDerWaalsContact O-CG 3.27Å; S650-R654 WeakPolarHBondContact O-CG 3.47Å; S650-R654 PolarHBondContact O-N 2.87Å; E651-R654 WeakPolarHBondContact O-CB 3.33Å; E651-R654 PolarHBondContact O-N 2.76Å; E651-R654 WeakPolarHBondContact OE1-CD 3.49Å; E651-R654 IonicContact OE1-CZ 2.69Å; E651-R654 IonicContact OE1-NE 3.21Å; E651-R654 IonicContact OE1-NH1 2.66Å; E651-R654 PolarHBondContact OE1-NH1 3.13Å; R654-R658 WeakPolarHBondContact O-CB 3.27Å; R654-R658 PolarHBondContact O-N 2.92Å
655	K	79.4	Confident	75.6	Confident	119 Å²	119	103.1 Å²	103.1	52%	0.517	47%	0.467	S	S	.	.	H	α-helix	trans	-70.7	-43.3	174.7	-171.2	-179.1	176.6	-172.1	0	111.2	E651 L652 I653 R658 I659	E651-K655 WeakPolarHBondContact O-CB 3.38Å; E651-K655 PolarHBondContact O-N 2.95Å; L652-K655 WeakPolarHBondContact O-CB 3.48Å; L652-K655 PolarHBondContact O-N 2.79Å; I653-K655 VanDerWaalsContact C-N 3.26Å; I653-K655 PolarHBondContact O-N 2.78Å; K655-R658 PolarHBondContact O-N 3.17Å; K655-I659 HydrophobicContact CG-CD1 4.02Å; K655-I659 WeakPolarHBondContact O-CG1 3.12Å; K655-I659 PolarHBondContact O-N 3.44Å
656	R	78.8	Confident	75.1	Confident	157 Å²	157	106.5 Å²	106.5	59%	0.592	49%	0.488	S	S	*	.	H	α-helix	trans	-60.3	-52	176.5	-166.5	-173.9	77.3	173.6	4.5	111.8	L652 I653 R658 I659 K660	L652-R656 PolarHBondContact O-N 3.19Å; I653-R656 PolarHBondContact O-N 3.24Å; I653-R656 VanDerWaalsContact O-N 3.13Å; R656-R658 PolarHBondContact O-N 2.92Å; R656-I659 PolarHBondContact O-N 3.26Å; R656-K660 WeakPolarHBondContact O-CB 3.31Å; R656-K660 PolarHBondContact O-N 3.16Å
657	E	74.6	Confident	74.8	Confident	53 Å²	53	110.5 Å²	110.5	25%	0.248	50%	0.497	C	S	.	.	H	α-helix	trans	-71.8	-14.5	179.7	-56.9	-43.4	131.8	0	0	113.3	I653 R661	I653-E657 HydrophobicContact CG2-CG 4.31Å; I653-E657 PolarHBondContact O-N 3.25Å; E657-R661 PolarHBondContact O-NH1 3.44Å
658	R	75.8	Confident	74.1	Confident	147 Å²	147	106 Å²	106	56%	0.555	48%	0.483	S	S	*	.	H	α-helix	trans	-74.4	-55.5	164.7	-169	-177.2	-58	-177	3.3	110.7	R654 K655 R656 K660 R661 D662	R654-R658 WeakPolarHBondContact O-CB 3.27Å; R654-R658 PolarHBondContact O-N 2.92Å; K655-R658 PolarHBondContact O-N 3.17Å; R656-R658 PolarHBondContact O-N 2.92Å; R658-K660 VanDerWaalsContact C-N 3.29Å; R658-K660 PolarHBondContact O-N 3.07Å; R658-R661 WeakPolarHBondContact O-CB 3.43Å; R658-R661 PolarHBondContact O-N 3.29Å; R658-D662 PolarHBondContact O-N 3.25Å
659	I	69.9	Low	73.5	Confident	83 Å²	83	105 Å²	105	43%	0.426	48%	0.479	S	S	.	.	H	α-helix	trans	-58.2	-41	-179.5	-66.9	165.8	0	0	0	111.2	K655 R656 R661 D662 I663	K655-I659 HydrophobicContact CG-CD1 4.02Å; K655-I659 WeakPolarHBondContact O-CG1 3.12Å; K655-I659 PolarHBondContact O-N 3.44Å; R656-I659 PolarHBondContact O-N 3.26Å; I659-R661 PolarHBondContact O-N 3.33Å; I659-D662 PolarHBondContact O-N 2.76Å; I659-I663 HydrophobicContact CG2-CD1 3.72Å; I659-I663 HydrophobicContact CG2-CG1 4.34Å; I659-I663 WeakPolarHBondContact O-CB 3.32Å; I659-I663 VanDerWaalsContact O-CG1 3.29Å; I659-I663 WeakPolarHBondContact O-CG1 3.49Å; I659-I663 PolarHBondContact O-N 3Å
660	K	70.5	Confident	73.2	Confident	142 Å²	142	104.5 Å²	104.5	62%	0.617	47%	0.474	S	S	*	.	H	α-helix	trans	-59.8	-43.1	175.4	-171.3	-179.4	177.6	-174.3	0	112.3	R656 R658 F664	R656-K660 WeakPolarHBondContact O-CB 3.31Å; R656-K660 PolarHBondContact O-N 3.16Å; R658-K660 VanDerWaalsContact C-N 3.29Å; R658-K660 PolarHBondContact O-N 3.07Å; K660-F664 WeakPolarHBondContact O-CB 3.19Å; K660-F664 PolarHBondContact O-N 2.76Å
661	R	67.4	Low	73.2	Confident	143 Å²	143	104.7 Å²	104.7	54%	0.54	47%	0.47	S	S	.	.	H	α-helix	trans	-66.9	-42.1	174.9	-170.6	-165.7	-62.6	85.7	8.3	111.8	E657 R658 I659 I663 F664 R665	E657-R661 PolarHBondContact O-NH1 3.44Å; R658-R661 WeakPolarHBondContact O-CB 3.43Å; R658-R661 PolarHBondContact O-N 3.29Å; I659-R661 PolarHBondContact O-N 3.33Å; R661-I663 VanDerWaalsContact C-N 3.35Å; R661-F664 PolarHBondContact O-N 2.78Å; R661-R665 WeakPolarHBondContact O-CB 3.17Å; R661-R665 PolarHBondContact O-N 3.27Å
662	D	68.1	Low	73.1	Confident	79 Å²	79	102 Å²	102	42%	0.422	46%	0.458	S	S	.	.	H	α-helix	trans	-65.3	-40.3	-178.6	-61	-17.7	0	0	0	110.7	R658 I659 L666	R658-D662 PolarHBondContact O-N 3.25Å; I659-D662 PolarHBondContact O-N 2.76Å; D662-L666 WeakPolarHBondContact O-CG 3.45Å; D662-L666 PolarHBondContact O-N 3.01Å; D662-L666 VanDerWaalsContact O-N 3.14Å
663	I	70.7	Confident	73.1	Confident	106 Å²	106	97.6 Å²	97.6	54%	0.544	43%	0.434	S	S	.	.	H	α-helix	trans	-64.2	-47.7	171.6	-68.3	168	0	0	0	111.1	I659 R661 R665 L666 F667	I659-I663 HydrophobicContact CG2-CD1 3.72Å; I659-I663 HydrophobicContact CG2-CG1 4.34Å; I659-I663 WeakPolarHBondContact O-CB 3.32Å; I659-I663 VanDerWaalsContact O-CG1 3.29Å; I659-I663 WeakPolarHBondContact O-CG1 3.49Å; I659-I663 PolarHBondContact O-N 3Å; R661-I663 VanDerWaalsContact C-N 3.35Å; I663-R665 VanDerWaalsContact C-N 3.33Å; I663-R665 PolarHBondContact O-N 2.81Å; I663-L666 PolarHBondContact O-N 3.29Å; I663-F667 PolarHBondContact O-N 3.21Å
664	F	68.8	Low	72.9	Confident	109 Å²	109	99.3 Å²	99.3	48%	0.478	44%	0.439	S	S	.	.	H	α-helix	trans	-61.6	-40.7	179.8	-173.5	-97.6	0	0	0	112.1	K660 R661 L666 F667 V668 I1038	K660-F664 WeakPolarHBondContact O-CB 3.19Å; K660-F664 PolarHBondContact O-N 2.76Å; R661-F664 PolarHBondContact O-N 2.78Å; F664-L666 PolarHBondContact O-N 3.43Å; F664-F667 PolarHBondContact O-N 3.4Å; F664-V668 HydrophobicContact CD1-CG2 4.07Å; F664-V668 HydrophobicContact CE1-CG2 3.7Å; F664-V668 HydrophobicContact CZ-CG2 4.04Å; F664-V668 WeakPolarHBondContact O-CG2 3.44Å; F664-V668 PolarHBondContact O-N 3.31Å; F664-I1038 HydrophobicContact CE1-CG2 4.26Å
665	R	69	Low	73.4	Confident	187 Å²	187	95 Å²	95	71%	0.706	43%	0.426	S	S	*	.	H	α-helix	trans	-61.5	-43.2	174.3	-180	176.6	172.5	171.6	-0.5	111.9	R661 I663 F667 V668 T669	R661-R665 WeakPolarHBondContact O-CB 3.17Å; R661-R665 PolarHBondContact O-N 3.27Å; I663-R665 VanDerWaalsContact C-N 3.33Å; I663-R665 PolarHBondContact O-N 2.81Å; R665-F667 VanDerWaalsContact C-N 3.32Å; R665-V668 PolarHBondContact O-N 3.26Å; R665-T669 PolarHBondContact O-N 3.27Å; R665-T669 PolarHBondContact O-OG1 3.39Å
666	L	69.7	Low	73.6	Confident	117 Å²	117	90.2 Å²	90.2	61%	0.613	41%	0.405	S	S	*	.	H	α-helix	trans	-61.9	-41.8	176.5	-73.1	168.4	0	0	0	111.4	D662 I663 F664 T669 E670	D662-L666 WeakPolarHBondContact O-CG 3.45Å; D662-L666 PolarHBondContact O-N 3.01Å; D662-L666 VanDerWaalsContact O-N 3.14Å; I663-L666 PolarHBondContact O-N 3.29Å; F664-L666 PolarHBondContact O-N 3.43Å; L666-T669 WeakPolarHBondContact CA-OG1 3.37Å; L666-T669 PolarHBondContact O-N 3.44Å; L666-T669 PolarHBondContact O-OG1 3.43Å; L666-E670 WeakPolarHBondContact O-CB 3.5Å; L666-E670 PolarHBondContact O-N 2.94Å
667	F	71.6	Confident	74	Confident	117 Å²	117	82.8 Å²	82.8	51%	0.513	38%	0.377	S	S	.	.	H	α-helix	trans	-63.4	-44.4	176.5	-175.1	-113.1	0	0	0	112.5	I663 F664 R665 T669 E670 I671	I663-F667 PolarHBondContact O-N 3.21Å; F664-F667 PolarHBondContact O-N 3.4Å; R665-F667 VanDerWaalsContact C-N 3.32Å; F667-T669 PolarHBondContact O-N 2.95Å; F667-E670 PolarHBondContact O-N 3.19Å; F667-I671 HydrophobicContact CD1-CD1 3.95Å; F667-I671 HydrophobicContact CE1-CD1 3.54Å; F667-I671 HydrophobicContact CE2-CD1 4.37Å; F667-I671 HydrophobicContact CZ-CD1 3.78Å; F667-I671 WeakPolarHBondContact O-CG1 3.37Å; F667-I671 PolarHBondContact O-N 3.04Å
668	V	70.6	Confident	74.7	Confident	27 Å²	27	80.8 Å²	80.8	16%	0.164	37%	0.368	C	S	.	.	H	α-helix	trans	-59.5	-46.6	173.4	172.2	0	0	0	0	111	F664 R665 E670 I671 D672	F664-V668 HydrophobicContact CD1-CG2 4.07Å; F664-V668 HydrophobicContact CE1-CG2 3.7Å; F664-V668 HydrophobicContact CZ-CG2 4.04Å; F664-V668 WeakPolarHBondContact O-CG2 3.44Å; F664-V668 PolarHBondContact O-N 3.31Å; R665-V668 PolarHBondContact O-N 3.26Å; V668-E670 VanDerWaalsContact C-N 3.32Å; V668-E670 PolarHBondContact O-N 3.39Å; V668-I671 PolarHBondContact O-N 3.03Å; V668-D672 PolarHBondContact O-N 2.89Å
669	T	71.9	Confident	75.3	Confident	48 Å²	48	74.2 Å²	74.2	29%	0.294	34%	0.344	S	S	.	.	H	α-helix	trans	-64	-35.1	176.7	50.1	0	0	0	0	112.9	R665 L666 F667 I671 D672 F673	R665-T669 PolarHBondContact O-N 3.27Å; R665-T669 PolarHBondContact O-OG1 3.39Å; L666-T669 WeakPolarHBondContact CA-OG1 3.37Å; L666-T669 PolarHBondContact O-N 3.44Å; L666-T669 PolarHBondContact O-OG1 3.43Å; F667-T669 PolarHBondContact O-N 2.95Å; T669-I671 VanDerWaalsContact C-N 3.35Å; T669-D672 PolarHBondContact O-N 2.92Å; T669-F673 WeakPolarHBondContact O-CD2 3.39Å; T669-F673 WeakPolarHBondContact O-CG 3.21Å; T669-F673 PolarHBondContact O-N 3.34Å
670	E	74.4	Confident	76.2	Confident	91 Å²	91	71.9 Å²	71.9	43%	0.425	33%	0.334	S	S	.	.	H	α-helix	trans	-68.5	-34.1	175.7	-169	-176.3	153	0	0	112.1	L666 F667 V668 K674	L666-E670 WeakPolarHBondContact O-CB 3.5Å; L666-E670 PolarHBondContact O-N 2.94Å; F667-E670 PolarHBondContact O-N 3.19Å; V668-E670 VanDerWaalsContact C-N 3.32Å; V668-E670 PolarHBondContact O-N 3.39Å; E670-K674 WeakPolarHBondContact O-CG 3.47Å; E670-K674 PolarHBondContact O-N 3.22Å; E670-K674 WeakPolarHBondContact OE1-CE 3.35Å; E670-K674 IonicContact OE1-NZ 3.22Å; E670-K674 PolarHBondContact OE1-NZ 3.37Å
671	I	75.1	Confident	77.1	Confident	66 Å²	66	65.8 Å²	65.8	34%	0.338	31%	0.307	S	S	.	.	H	α-helix	trans	-67.3	-50.1	171.6	-71.4	176.8	0	0	0	110.5	F667 V668 T669 F673 K674 I675	F667-I671 HydrophobicContact CD1-CD1 3.95Å; F667-I671 HydrophobicContact CE1-CD1 3.54Å; F667-I671 HydrophobicContact CE2-CD1 4.37Å; F667-I671 HydrophobicContact CZ-CD1 3.78Å; F667-I671 WeakPolarHBondContact O-CG1 3.37Å; F667-I671 PolarHBondContact O-N 3.04Å; V668-I671 PolarHBondContact O-N 3.03Å; T669-I671 VanDerWaalsContact C-N 3.35Å; I671-F673 VanDerWaalsContact C-N 3.29Å; I671-F673 PolarHBondContact O-N 3.43Å; I671-K674 WeakPolarHBondContact O-CA 3.36Å; I671-K674 PolarHBondContact O-N 2.98Å; I671-I675 HydrophobicContact CG2-CD1 3.88Å; I671-I675 HydrophobicContact CG2-CG1 4.36Å; I671-I675 HydrophobicContact CG2-CG2 4.11Å; I671-I675 WeakPolarHBondContact O-CG1 3.49Å; I671-I675 PolarHBondContact O-N 3.03Å
672	D	77.1	Confident	78.3	Confident	29 Å²	29	59 Å²	59	16%	0.155	28%	0.282	C	S	.	.	H	α-helix	trans	-56.3	-42.6	179	-77.3	-24	0	0	0	111.8	V668 T669 K674 K676 V680 N1035	V668-D672 PolarHBondContact O-N 2.89Å; T669-D672 PolarHBondContact O-N 2.92Å; D672-K674 PolarHBondContact O-N 3.44Å; D672-K676 CarbonylContact O-C 3.46Å; D672-K676 WeakPolarHBondContact O-CG 3.2Å; D672-K676 PolarHBondContact O-N 3.31Å; D672-K676 WeakPolarHBondContact OD1-CE 3.48Å; D672-K676 IonicContact OD1-NZ 3.82Å; D672-K676 PolarHBondContact OD1-NZ 3.01Å; D672-K676 VanDerWaalsContact OD1-NZ 3.11Å; D672-V680 HydrophobicContact CB-CG2 4.18Å; D672-N1035 PolarHBondContact OD1-ND2 2.85Å
673	F	78.7	Confident	79.4	Confident	19 Å²	19	57.1 Å²	57.1	8%	0.083	27%	0.272	C	S	.	.	H	α-helix	trans	-66.2	-17.7	174.1	-77.1	-55.2	0	0	0	114.5	T669 I671 P677 V680 L871 L874 I875	T669-F673 WeakPolarHBondContact O-CD2 3.39Å; T669-F673 WeakPolarHBondContact O-CG 3.21Å; T669-F673 PolarHBondContact O-N 3.34Å; I671-F673 VanDerWaalsContact C-N 3.29Å; I671-F673 PolarHBondContact O-N 3.43Å; F673-P677 WeakPolarHBondContact O-CB 3.47Å; F673-V680 HydrophobicContact CD1-CB 4.36Å; F673-V680 HydrophobicContact CD1-CG1 3.88Å; F673-V680 HydrophobicContact CE1-CB 4.37Å; F673-V680 HydrophobicContact CE1-CG1 3.46Å; F673-V680 VanDerWaalsContact CE1-CG1 3.46Å; F673-V680 HydrophobicContact CZ-CG1 4.18Å; F673-L871 HydrophobicContact CB-CD2 3.78Å; F673-L871 HydrophobicContact CG-CD2 4.39Å; F673-L874 HydrophobicContact CD1-CB 3.88Å; F673-L874 HydrophobicContact CD1-CD1 4.11Å; F673-L874 HydrophobicContact CE1-CB 3.71Å; F673-L874 HydrophobicContact CZ-CB 4.45Å; F673-I875 HydrophobicContact CD2-CD1 4.44Å; F673-I875 HydrophobicContact CD2-CG1 3.87Å; F673-I875 HydrophobicContact CE2-CG1 3.68Å; F673-I875 HydrophobicContact CZ-CG1 4.31Å
674	K	76.1	Confident	80.3	Confident	104 Å²	104	54.7 Å²	54.7	45%	0.452	26%	0.256	S	S	.	.	H	α-helix	trans	-94.6	-41.1	175.9	-72.4	172.2	-171.5	172.9	0	112.5	E670 I671 D672 L792 L871	E670-K674 WeakPolarHBondContact O-CG 3.47Å; E670-K674 PolarHBondContact O-N 3.22Å; E670-K674 WeakPolarHBondContact OE1-CE 3.35Å; E670-K674 IonicContact OE1-NZ 3.22Å; E670-K674 PolarHBondContact OE1-NZ 3.37Å; I671-K674 WeakPolarHBondContact O-CA 3.36Å; I671-K674 PolarHBondContact O-N 2.98Å; D672-K674 PolarHBondContact O-N 3.44Å; K674-L792 WeakPolarHBondContact O-CD2 3.36Å; K674-L871 HydrophobicContact CG-CD1 4.09Å
675	I	82.4	Confident	81.5	Confident	51 Å²	51	49.6 Å²	49.6	26%	0.262	23%	0.234	S	C	.	.	H	α-helix	trans	-89	-27.3	-173.2	72.7	179	0	0	0	113.9	I671 L792 T1031	I671-I675 HydrophobicContact CG2-CD1 3.88Å; I671-I675 HydrophobicContact CG2-CG1 4.36Å; I671-I675 HydrophobicContact CG2-CG2 4.11Å; I671-I675 WeakPolarHBondContact O-CG1 3.49Å; I671-I675 PolarHBondContact O-N 3.03Å; I675-L792 WeakPolarHBondContact O-CD2 3.32Å; I675-T1031 HydrophobicContact CD1-CG2 4.09Å
676	K	85.4	Confident	82.7	Confident	20 Å²	20	40.8 Å²	40.8	9%	0.087	20%	0.2	C	C	.	.			trans	-142	47.3	-177.4	61.4	178.9	168	-177.9	0	114	D672 L678 V679 V680 F730 N1032 N1035	D672-K676 CarbonylContact O-C 3.46Å; D672-K676 WeakPolarHBondContact O-CG 3.2Å; D672-K676 PolarHBondContact O-N 3.31Å; D672-K676 WeakPolarHBondContact OD1-CE 3.48Å; D672-K676 IonicContact OD1-NZ 3.82Å; D672-K676 PolarHBondContact OD1-NZ 3.01Å; D672-K676 VanDerWaalsContact OD1-NZ 3.11Å; K676-L678 PolarHBondContact O-N 2.93Å; K676-V679 HydrophobicContact CB-CB 4.1Å; K676-V679 HydrophobicContact CD-CG1 4.19Å; K676-V679 HydrophobicContact CG-CB 4.5Å; K676-V679 WeakPolarHBondContact O-CB 3.43Å; K676-V679 PolarHBondContact O-N 2.83Å; K676-V680 HydrophobicContact CG-CG2 4.18Å; K676-V680 PolarHBondContact O-N 3.02Å; K676-F730 HydrophobicContact CB-CE1 4.33Å; K676-N1032 PolarHBondContact NZ-OD1 3.04Å; K676-N1035 PolarHBondContact NZ-ND2 3.26Å
677	P	87.1	Confident	83.8	Confident	0 Å²	0	39 Å²	39	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-59.7	-37.8	-171.9	19.1	-27.1	0	0	0	114.2	F673 V680 F681 F786 G791 L793 L874	F673-P677 WeakPolarHBondContact O-CB 3.47Å; P677-V680 PolarHBondContact O-N 2.74Å; P677-F681 WeakPolarHBondContact O-CB 3.39Å; P677-F681 PolarHBondContact O-N 2.74Å; P677-F786 HydrophobicContact CB-CE1 4.19Å; P677-G791 WeakPolarHBondContact CG-O 3.25Å; P677-L793 HydrophobicContact CB-CD2 4.3Å; P677-L793 HydrophobicContact CB-CG 4.06Å; P677-L793 HydrophobicContact CG-CD2 4.49Å; P677-L793 HydrophobicContact CG-CG 3.9Å; P677-L874 HydrophobicContact CB-CD1 4.12Å
678	L	88.1	Confident	84.9	Confident	11 Å²	11	36.3 Å²	36.3	6%	0.058	18%	0.18	C	C	.	.	H	α-helix	trans	-62.7	-41.7	174.6	178.7	62.2	0	0	0	112.4	K676 F681 Q682 C733 I735 F786 G791	K676-L678 PolarHBondContact O-N 2.93Å; L678-F681 WeakPolarHBondContact O-CB 3.25Å; L678-F681 PolarHBondContact O-N 3.36Å; L678-Q682 HydrophobicContact CD1-CG 4.07Å; L678-Q682 HydrophobicContact CG-CG 4.3Å; L678-Q682 WeakPolarHBondContact O-CB 3.38Å; L678-Q682 VanDerWaalsContact O-CG 3.26Å; L678-Q682 WeakPolarHBondContact O-CG 3.42Å; L678-Q682 PolarHBondContact O-N 3.43Å; L678-C733 WeakPolarHBondContact CD2-O 3.48Å; L678-I735 HydrophobicContact CD1-CD1 4.4Å; L678-I735 HydrophobicContact CD1-CG1 4.37Å; L678-F786 HydrophobicContact CB-CD1 3.89Å; L678-F786 HydrophobicContact CB-CE1 4.24Å; L678-F786 HydrophobicContact CB-CG 4.33Å; L678-F786 HydrophobicContact CD1-CB 4.43Å; L678-F786 HydrophobicContact CD1-CD1 4.26Å; L678-F786 HydrophobicContact CD1-CD2 4.01Å; L678-F786 HydrophobicContact CD1-CE2 4.27Å; L678-F786 HydrophobicContact CD1-CG 4Å; L678-G791 VanDerWaalsContact CB-O 3.24Å; L678-G791 WeakPolarHBondContact CB-O 3.3Å; L678-G791 PolarHBondContact N-O 3.39Å; L678-G791 VanDerWaalsContact N-O 3.17Å
679	V	89	Confident	86	Confident	9 Å²	9	35.1 Å²	35.1	6%	0.055	17%	0.173	C	C	.	.	H	α-helix	trans	-64.4	-45	177.6	161.7	0	0	0	0	111	K676 F681 Q682 L683 I727 F730	K676-V679 HydrophobicContact CB-CB 4.1Å; K676-V679 HydrophobicContact CD-CG1 4.19Å; K676-V679 HydrophobicContact CG-CB 4.5Å; K676-V679 WeakPolarHBondContact O-CB 3.43Å; K676-V679 PolarHBondContact O-N 2.83Å; V679-F681 VanDerWaalsContact C-N 3.29Å; V679-F681 PolarHBondContact O-N 3.43Å; V679-Q682 PolarHBondContact O-N 3.17Å; V679-L683 HydrophobicContact CG1-CD1 4.02Å; V679-L683 HydrophobicContact CG1-CG 4.43Å; V679-L683 WeakPolarHBondContact O-CB 3.45Å; V679-L683 WeakPolarHBondContact O-CG 3.22Å; V679-L683 PolarHBondContact O-N 2.91Å; V679-I727 HydrophobicContact CB-CG2 4.21Å; V679-I727 HydrophobicContact CG1-CG2 3.88Å; V679-I727 HydrophobicContact CG2-CG2 4.19Å; V679-F730 HydrophobicContact CG2-CD1 3.69Å; V679-F730 HydrophobicContact CG2-CE1 3.6Å; V679-F730 HydrophobicContact CG2-CG 4.45Å; V679-F730 HydrophobicContact CG2-CZ 4.28Å
680	V	87.8	Confident	87.1	Confident	35 Å²	35	34.2 Å²	34.2	21%	0.212	17%	0.166	C	C	.	.	H	α-helix	trans	-62	-39.9	176.1	-178.8	0	0	0	0	110.8	D672 F673 K676 P677 R684	D672-V680 HydrophobicContact CB-CG2 4.18Å; F673-V680 HydrophobicContact CD1-CB 4.36Å; F673-V680 HydrophobicContact CD1-CG1 3.88Å; F673-V680 HydrophobicContact CE1-CB 4.37Å; F673-V680 HydrophobicContact CE1-CG1 3.46Å; F673-V680 VanDerWaalsContact CE1-CG1 3.46Å; F673-V680 HydrophobicContact CZ-CG1 4.18Å; K676-V680 HydrophobicContact CG-CG2 4.18Å; K676-V680 PolarHBondContact O-N 3.02Å; P677-V680 PolarHBondContact O-N 2.74Å; V680-R684 WeakPolarHBondContact O-CB 3.39Å; V680-R684 PolarHBondContact O-N 3.4Å
681	F	90.8	Very high	87.9	Confident	13 Å²	13	33.5 Å²	33.5	6%	0.057	18%	0.175	C	C	.	.	H	α-helix	trans	-64.4	-47.3	174.8	-175.3	-86.9	0	0	0	112.4	P677 L678 V679 R684 F685 I735 A777 I780 A781 F786 L874	P677-F681 WeakPolarHBondContact O-CB 3.39Å; P677-F681 PolarHBondContact O-N 2.74Å; L678-F681 WeakPolarHBondContact O-CB 3.25Å; L678-F681 PolarHBondContact O-N 3.36Å; V679-F681 VanDerWaalsContact C-N 3.29Å; V679-F681 PolarHBondContact O-N 3.43Å; F681-R684 PolarHBondContact O-N 3.2Å; F681-F685 WeakPolarHBondContact O-CB 3.43Å; F681-F685 PolarHBondContact O-N 3.07Å; F681-I735 HydrophobicContact CD1-CD1 3.73Å; F681-I735 HydrophobicContact CD1-CG1 4.24Å; F681-I735 HydrophobicContact CE1-CD1 3.42Å; F681-I735 VanDerWaalsContact CE1-CD1 3.42Å; F681-I735 HydrophobicContact CE1-CG1 4.12Å; F681-I735 HydrophobicContact CZ-CD1 4.42Å; F681-A777 HydrophobicContact CE1-CB 4.38Å; F681-A777 HydrophobicContact CZ-CB 4.11Å; F681-I780 HydrophobicContact CE2-CB 4.26Å; F681-I780 HydrophobicContact CE2-CG2 3.71Å; F681-I780 HydrophobicContact CZ-CB 4.43Å; F681-I780 HydrophobicContact CZ-CG2 4.33Å; F681-A781 HydrophobicContact CE1-CB 4.44Å; F681-A781 HydrophobicContact CZ-CB 4.42Å; F681-F786 HydrophobicContact CB-CE1 4.39Å; F681-F786 HydrophobicContact CB-CZ 3.76Å; F681-F786 HydrophobicContact CD1-CE2 4.32Å; F681-F786 HydrophobicContact CD1-CZ 4.32Å; F681-F786 HydrophobicContact CD2-CE2 4.46Å; F681-F786 HydrophobicContact CD2-CZ 4.01Å; F681-F786 HydrophobicContact CG-CE2 4.18Å; F681-F786 AromaticContact CG-CZ 3.76Å; F681-F786 HydrophobicContact CG-CZ 3.76Å; F681-L874 HydrophobicContact CB-CD2 4.44Å; F681-L874 HydrophobicContact CD2-CD2 3.94Å
682	Q	91.8	Very high	88.8	Confident	1 Å²	1	32.4 Å²	32.4	1%	0.005	17%	0.17	C	C	.	.	H	α-helix	trans	-64.3	-46.7	-179.4	-75.4	169.7	-17.7	0	0	112.6	L678 V679 R684 F685 I686 I727 Y732 I735 L738	L678-Q682 HydrophobicContact CD1-CG 4.07Å; L678-Q682 HydrophobicContact CG-CG 4.3Å; L678-Q682 WeakPolarHBondContact O-CB 3.38Å; L678-Q682 VanDerWaalsContact O-CG 3.26Å; L678-Q682 WeakPolarHBondContact O-CG 3.42Å; L678-Q682 PolarHBondContact O-N 3.43Å; V679-Q682 PolarHBondContact O-N 3.17Å; Q682-R684 VanDerWaalsContact C-N 3.32Å; Q682-R684 PolarHBondContact O-N 3.35Å; Q682-F685 PolarHBondContact O-N 3.5Å; Q682-I686 PolarHBondContact O-N 2.9Å; Q682-I727 HydrophobicContact CB-CD1 3.72Å; Q682-I727 HydrophobicContact CB-CG1 3.88Å; Q682-I727 HydrophobicContact CB-CG2 3.89Å; Q682-Y732 PolarHBondContact NE2-O 2.93Å; Q682-I735 HydrophobicContact CG-CG1 4.38Å; Q682-L738 HydrophobicContact CB-CD2 4.06Å; Q682-L738 HydrophobicContact CG-CD2 4.08Å
683	L	92.4	Very high	89.6	Confident	40 Å²	40	31.4 Å²	31.4	21%	0.209	16%	0.164	C	C	.	.	H	α-helix	trans	-59.5	-45.9	177.8	-74	174.4	0	0	0	111.1	V679 F685 I686 D687 R724 I727 E728	V679-L683 HydrophobicContact CG1-CD1 4.02Å; V679-L683 HydrophobicContact CG1-CG 4.43Å; V679-L683 WeakPolarHBondContact O-CB 3.45Å; V679-L683 WeakPolarHBondContact O-CG 3.22Å; V679-L683 PolarHBondContact O-N 2.91Å; L683-F685 VanDerWaalsContact C-N 3.31Å; L683-F685 PolarHBondContact O-N 3.09Å; L683-I686 WeakPolarHBondContact O-CB 3.46Å; L683-I686 PolarHBondContact O-N 3.5Å; L683-D687 PolarHBondContact O-N 3.07Å; L683-R724 HydrophobicContact CD2-CB 4.43Å; L683-R724 HydrophobicContact CD2-CG 4.25Å; L683-I727 HydrophobicContact CD2-CB 4.09Å; L683-I727 HydrophobicContact CD2-CD1 4.06Å; L683-I727 HydrophobicContact CD2-CG2 3.9Å; L683-I727 HydrophobicContact CG-CB 4.48Å; L683-I727 HydrophobicContact CG-CG2 3.75Å; L683-E728 HydrophobicContact CD2-CG 4.31Å
684	R	89.4	Confident	90.2	Very high	55 Å²	55	34.4 Å²	34.4	21%	0.208	18%	0.184	C	C	.	.	H	α-helix	trans	-66	-32.1	178.1	177.6	-105.4	164.2	59.8	7.6	112.6	V680 F681 Q682 D687 Q688 C877	V680-R684 WeakPolarHBondContact O-CB 3.39Å; V680-R684 PolarHBondContact O-N 3.4Å; F681-R684 PolarHBondContact O-N 3.2Å; Q682-R684 VanDerWaalsContact C-N 3.32Å; Q682-R684 PolarHBondContact O-N 3.35Å; R684-D687 PolarHBondContact O-N 3.36Å; R684-Q688 WeakPolarHBondContact O-CG 3.23Å; R684-Q688 PolarHBondContact O-N 3.02Å; R684-C877 PolarHBondContact NH1-O 3.47Å; R684-C877 PolarHBondContact NH2-O 2.75Å
685	F	93.3	Very high	90.9	Very high	2 Å²	2	33.3 Å²	33.3	1%	0.009	18%	0.183	C	C	.	.	H	α-helix	trans	-70.2	-40.8	171.8	179.1	-133.2	0	0	0	111.7	F681 Q682 L683 D687 Q688 L689 I735 L738 L739 I773 I774 A777	F681-F685 WeakPolarHBondContact O-CB 3.43Å; F681-F685 PolarHBondContact O-N 3.07Å; Q682-F685 PolarHBondContact O-N 3.5Å; L683-F685 VanDerWaalsContact C-N 3.31Å; L683-F685 PolarHBondContact O-N 3.09Å; F685-D687 VanDerWaalsContact C-N 3.33Å; F685-D687 PolarHBondContact O-N 3.1Å; F685-Q688 PolarHBondContact O-N 2.85Å; F685-L689 HydrophobicContact CD1-CD1 4.41Å; F685-L689 HydrophobicContact CD2-CD1 4.48Å; F685-L689 HydrophobicContact CD2-CG 4.47Å; F685-L689 HydrophobicContact CE1-CD1 4.07Å; F685-L689 HydrophobicContact CE2-CD1 4.14Å; F685-L689 HydrophobicContact CE2-CD2 4.38Å; F685-L689 HydrophobicContact CE2-CG 4.22Å; F685-L689 HydrophobicContact CZ-CD1 3.94Å; F685-L689 HydrophobicContact CZ-CG 4.49Å; F685-L689 WeakPolarHBondContact O-CG 3.28Å; F685-L689 PolarHBondContact O-N 3.4Å; F685-L689 VanDerWaalsContact O-N 3.11Å; F685-I735 HydrophobicContact CD1-CG2 4.26Å; F685-I735 HydrophobicContact CE1-CG2 3.89Å; F685-L738 HydrophobicContact CD1-CD2 3.91Å; F685-L738 HydrophobicContact CE1-CD2 4.48Å; F685-L739 HydrophobicContact CE1-CD2 3.96Å; F685-L739 HydrophobicContact CE1-CG 4.31Å; F685-L739 HydrophobicContact CZ-CD2 3.94Å; F685-I773 HydrophobicContact CD2-CG2 4.25Å; F685-I773 HydrophobicContact CE2-CG2 4.04Å; F685-I774 HydrophobicContact CE2-CG1 4.48Å; F685-I774 HydrophobicContact CZ-CB 4.47Å; F685-I774 HydrophobicContact CZ-CG1 4.04Å; F685-A777 HydrophobicContact CD2-CB 3.5Å; F685-A777 HydrophobicContact CE1-CB 4.4Å; F685-A777 HydrophobicContact CE2-CB 3.34Å; F685-A777 HydrophobicContact CG-CB 4.12Å; F685-A777 HydrophobicContact CZ-CB 3.81Å
686	I	94.2	Very high	91.3	Very high	1 Å²	1	34.4 Å²	34.4	1%	0.005	19%	0.187	C	C	.	.	H	α-helix	trans	-58.6	-43.4	169	-71.7	-166.2	0	0	0	111.3	Q682 L683 Q688 L689 Q690 F720 M723 R724 I727 L738	Q682-I686 PolarHBondContact O-N 2.9Å; L683-I686 WeakPolarHBondContact O-CB 3.46Å; L683-I686 PolarHBondContact O-N 3.5Å; I686-Q688 PolarHBondContact O-N 3.39Å; I686-L689 PolarHBondContact O-N 3.32Å; I686-Q690 WeakPolarHBondContact O-CB 3.47Å; I686-Q690 PolarHBondContact O-N 3.47Å; I686-F720 HydrophobicContact CG2-CD1 3.86Å; I686-M723 HydrophobicContact CD1-CB 3.5Å; I686-M723 VanDerWaalsContact CD1-CB 3.5Å; I686-R724 HydrophobicContact CD1-CG 4.23Å; I686-R724 HydrophobicContact CG2-CG 4.13Å; I686-I727 HydrophobicContact CD1-CD1 3.33Å; I686-I727 HydrophobicContact CD1-CG1 4.49Å; I686-I727 HydrophobicContact CG1-CD1 3.82Å; I686-L738 HydrophobicContact CD1-CD1 3.82Å; I686-L738 HydrophobicContact CG1-CD1 4.03Å; I686-L738 HydrophobicContact CG1-CD2 4.29Å
687	D	93.3	Very high	91.6	Very high	80 Å²	80	36.4 Å²	36.4	43%	0.428	20%	0.196	S	C	.	.	H	α-helix	trans	-56.9	-39.9	178	-70.3	-35.6	0	0	0	112	L683 R684 F685 A691 R724	L683-D687 PolarHBondContact O-N 3.07Å; R684-D687 PolarHBondContact O-N 3.36Å; F685-D687 VanDerWaalsContact C-N 3.33Å; F685-D687 PolarHBondContact O-N 3.1Å; D687-A691 VanDerWaalsContact O-CB 3.26Å; D687-A691 WeakPolarHBondContact O-CB 3.43Å; D687-A691 PolarHBondContact O-N 3.41Å; D687-A691 VanDerWaalsContact O-N 3.08Å; D687-R724 IonicContact OD1-CZ 2.78Å; D687-R724 IonicContact OD1-NH1 2.93Å; D687-R724 PolarHBondContact OD1-NH1 2.89Å; D687-R724 IonicContact OD1-NH2 2.64Å; D687-R724 PolarHBondContact OD1-NH2 2.81Å
688	Q	93.5	Very high	92	Very high	60 Å²	60	37.3 Å²	37.3	28%	0.28	20%	0.2	S	C	.	.	H	α-helix	trans	-68.7	-33.3	176.3	-66.7	178.9	-98.1	0	0	112.7	R684 F685 I686 I773	R684-Q688 WeakPolarHBondContact O-CG 3.23Å; R684-Q688 PolarHBondContact O-N 3.02Å; F685-Q688 PolarHBondContact O-N 2.85Å; I686-Q688 PolarHBondContact O-N 3.39Å; Q688-I773 HydrophobicContact CB-CD1 4.48Å; Q688-I773 HydrophobicContact CB-CG2 3.78Å
689	L	94.4	Very high	92.3	Very high	3 Å²	3	37.2 Å²	37.2	2%	0.016	20%	0.201	C	C	.	.	H	α-helix	trans	-76.9	-45.8	176.4	-66	173.7	0	0	0	112.3	F685 I686 A691 L692 F720 F742 I774	F685-L689 HydrophobicContact CD1-CD1 4.41Å; F685-L689 HydrophobicContact CD2-CD1 4.48Å; F685-L689 HydrophobicContact CD2-CG 4.47Å; F685-L689 HydrophobicContact CE1-CD1 4.07Å; F685-L689 HydrophobicContact CE2-CD1 4.14Å; F685-L689 HydrophobicContact CE2-CD2 4.38Å; F685-L689 HydrophobicContact CE2-CG 4.22Å; F685-L689 HydrophobicContact CZ-CD1 3.94Å; F685-L689 HydrophobicContact CZ-CG 4.49Å; F685-L689 WeakPolarHBondContact O-CG 3.28Å; F685-L689 PolarHBondContact O-N 3.4Å; F685-L689 VanDerWaalsContact O-N 3.11Å; I686-L689 PolarHBondContact O-N 3.32Å; L689-A691 VanDerWaalsContact C-N 3.27Å; L689-A691 PolarHBondContact O-N 2.87Å; L689-L692 WeakPolarHBondContact O-CB 3.45Å; L689-L692 PolarHBondContact O-N 3.27Å; L689-L692 VanDerWaalsContact O-N 3.08Å; L689-F720 HydrophobicContact CB-CE1 3.84Å; L689-F720 HydrophobicContact CB-CZ 4.12Å; L689-F742 HydrophobicContact CB-CE2 4.29Å; L689-F742 HydrophobicContact CD1-CD2 3.99Å; L689-F742 HydrophobicContact CD1-CE2 4.19Å; L689-F742 HydrophobicContact CD1-CG 4.36Å; L689-F742 HydrophobicContact CD2-CE2 4.29Å; L689-F742 HydrophobicContact CD2-CZ 4.28Å; L689-I774 HydrophobicContact CD2-CG1 4.26Å
690	Q	94	Very high	92.5	Very high	29 Å²	29	42.3 Å²	42.3	14%	0.136	22%	0.224	C	C	.	.	H	α-helix	trans	-66.9	-28	179	-173.1	174.8	1.8	0	0	112	I686 L692 D693 F720	I686-Q690 WeakPolarHBondContact O-CB 3.47Å; I686-Q690 PolarHBondContact O-N 3.47Å; Q690-L692 PolarHBondContact O-N 3.46Å; Q690-D693 PolarHBondContact O-N 3.21Å; Q690-F720 HydrophobicContact CB-CD1 4.09Å; Q690-F720 HydrophobicContact CB-CD2 3.91Å; Q690-F720 HydrophobicContact CB-CE1 4.19Å; Q690-F720 HydrophobicContact CB-CE2 4.01Å; Q690-F720 HydrophobicContact CB-CG 3.96Å; Q690-F720 HydrophobicContact CB-CZ 4.14Å; Q690-F720 HydrophobicContact CG-CB 4.34Å; Q690-F720 HydrophobicContact CG-CD2 3.73Å; Q690-F720 HydrophobicContact CG-CE2 4.14Å; Q690-F720 HydrophobicContact CG-CG 4.03Å
691	A	92.8	Very high	92.8	Very high	76 Å²	76	44 Å²	44	63%	0.628	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-18.4	172	0	0	0	0	0	114	D687 L689	D687-A691 VanDerWaalsContact O-CB 3.26Å; D687-A691 WeakPolarHBondContact O-CB 3.43Å; D687-A691 PolarHBondContact O-N 3.41Å; D687-A691 VanDerWaalsContact O-N 3.08Å; L689-A691 VanDerWaalsContact C-N 3.27Å; L689-A691 PolarHBondContact O-N 2.87Å
692	L	93.6	Very high	92.8	Very high	43 Å²	43	46.7 Å²	46.7	23%	0.225	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82	-21.5	173.2	-61.8	176.9	0	0	0	113.1	L689 Q690 T694 L766 R769 I773	L689-L692 WeakPolarHBondContact O-CB 3.45Å; L689-L692 PolarHBondContact O-N 3.27Å; L689-L692 VanDerWaalsContact O-N 3.08Å; Q690-L692 PolarHBondContact O-N 3.46Å; L692-T694 VanDerWaalsContact C-N 3.32Å; L692-T694 PolarHBondContact O-N 3.49Å; L692-L766 HydrophobicContact CB-CD1 3.54Å; L692-L766 HydrophobicContact CD1-CD1 4.14Å; L692-L766 HydrophobicContact CG-CD1 4.49Å; L692-R769 HydrophobicContact CD1-CB 3.84Å; L692-R769 HydrophobicContact CD2-CB 4.16Å; L692-I773 HydrophobicContact CD1-CD1 3.77Å; L692-I773 HydrophobicContact CD2-CD1 4.44Å; L692-I773 HydrophobicContact CG-CD1 4.19Å
693	D	93.9	Very high	92.6	Very high	7 Å²	7	52.3 Å²	52.3	4%	0.037	28%	0.28	C	S	.	.			trans	-81	77.8	173.5	-178.5	8.4	0	0	0	110.5	Q690 N695 Q696 F697 F698 F720	Q690-D693 PolarHBondContact O-N 3.21Å; D693-N695 PolarHBondContact O-N 2.81Å; D693-N695 PolarHBondContact OD1-N 3.03Å; D693-Q696 PolarHBondContact O-N 3.13Å; D693-Q696 PolarHBondContact O-NE2 3.4Å; D693-Q696 PolarHBondContact OD1-N 3.08Å; D693-Q696 VanDerWaalsContact OD2-C 3.24Å; D693-Q696 WeakPolarHBondContact OD2-CA 3.48Å; D693-F697 PolarHBondContact OD1-N 3.43Å; D693-F697 VanDerWaalsContact OD1-N 3.12Å; D693-F697 PolarHBondContact OD2-N 2.85Å; D693-F698 HydrophobicContact CB-CD2 4.44Å; D693-F698 PolarHBondContact OD2-N 3.19Å; D693-F720 HydrophobicContact CB-CE2 4.27Å
694	T	90	Very high	92.3	Very high	82 Å²	82	55.3 Å²	55.3	50%	0.503	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-13.2	-177.6	61.9	0	0	0	0	114.1	L692	L692-T694 VanDerWaalsContact C-N 3.32Å; L692-T694 PolarHBondContact O-N 3.49Å
695	N	90.8	Very high	92.2	Very high	81 Å²	81	56.8 Å²	56.8	43%	0.433	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.7	-10.5	-177	-63.2	-11.9	0	0	0	112.9	D693 F697	D693-N695 PolarHBondContact O-N 2.81Å; D693-N695 PolarHBondContact OD1-N 3.03Å; N695-F697 VanDerWaalsContact C-N 3.32Å; N695-F697 HydrophobicContact CB-CD1 3.67Å; N695-F697 HydrophobicContact CB-CD2 4.02Å; N695-F697 HydrophobicContact CB-CE1 3.6Å; N695-F697 HydrophobicContact CB-CE2 3.97Å; N695-F697 HydrophobicContact CB-CG 3.89Å; N695-F697 HydrophobicContact CB-CZ 3.76Å; N695-F697 VanDerWaalsContact ND2-CE2 3.28Å; N695-F697 WeakPolarHBondContact ND2-CE2 3.47Å; N695-F697 VanDerWaalsContact ND2-CZ 3.29Å; N695-F697 WeakPolarHBondContact ND2-CZ 3.34Å
696	Q	92.2	Very high	91.9	Very high	74 Å²	74	62.2 Å²	62.2	35%	0.346	35%	0.349	S	S	.	.			trans	57.9	41.8	-172.6	-54.1	-64.9	-61.4	0	0	112.1	D693 A699	D693-Q696 PolarHBondContact O-N 3.13Å; D693-Q696 PolarHBondContact O-NE2 3.4Å; D693-Q696 PolarHBondContact OD1-N 3.08Å; D693-Q696 VanDerWaalsContact OD2-C 3.24Å; D693-Q696 WeakPolarHBondContact OD2-CA 3.48Å; Q696-A699 HydrophobicContact CB-CB 3.75Å; Q696-A699 HydrophobicContact CG-CB 4.41Å; Q696-A699 VanDerWaalsContact OE1-CB 3.25Å
697	F	92	Very high	91.5	Very high	63 Å²	63	62.6 Å²	62.6	28%	0.276	35%	0.352	S	S	.	.	S	Bend	trans	-74.8	-23.3	175.7	-70.4	-19	0	0	0	113.8	D693 N695 I758 Y759 A762	D693-F697 PolarHBondContact OD1-N 3.43Å; D693-F697 VanDerWaalsContact OD1-N 3.12Å; D693-F697 PolarHBondContact OD2-N 2.85Å; N695-F697 VanDerWaalsContact C-N 3.32Å; N695-F697 HydrophobicContact CB-CD1 3.67Å; N695-F697 HydrophobicContact CB-CD2 4.02Å; N695-F697 HydrophobicContact CB-CE1 3.6Å; N695-F697 HydrophobicContact CB-CE2 3.97Å; N695-F697 HydrophobicContact CB-CG 3.89Å; N695-F697 HydrophobicContact CB-CZ 3.76Å; N695-F697 VanDerWaalsContact ND2-CE2 3.28Å; N695-F697 WeakPolarHBondContact ND2-CE2 3.47Å; N695-F697 VanDerWaalsContact ND2-CZ 3.29Å; N695-F697 WeakPolarHBondContact ND2-CZ 3.34Å; F697-I758 HydrophobicContact CZ-CD1 4.07Å; F697-I758 HydrophobicContact CZ-CG1 4.4Å; F697-Y759 HydrophobicContact CB-CD1 4.33Å; F697-Y759 HydrophobicContact CD1-CD1 4.16Å; F697-Y759 AromaticContact CD1-CE1 3.91Å; F697-Y759 HydrophobicContact CD1-CE1 3.91Å; F697-Y759 AromaticContact CD2-CD1 3.75Å; F697-Y759 HydrophobicContact CD2-CD1 3.75Å; F697-Y759 HydrophobicContact CD2-CE1 4.29Å; F697-Y759 HydrophobicContact CE1-CD1 4.35Å; F697-Y759 AromaticContact CE1-CE1 3.93Å; F697-Y759 HydrophobicContact CE1-CE1 3.93Å; F697-Y759 AromaticContact CE2-CD1 3.96Å; F697-Y759 HydrophobicContact CE2-CD1 3.96Å; F697-Y759 HydrophobicContact CE2-CE1 4.3Å; F697-Y759 AromaticContact CG-CD1 3.86Å; F697-Y759 HydrophobicContact CG-CD1 3.86Å; F697-Y759 HydrophobicContact CG-CE1 4.1Å; F697-Y759 HydrophobicContact CZ-CD1 4.25Å; F697-Y759 HydrophobicContact CZ-CE1 4.12Å; F697-A762 HydrophobicContact CD2-CB 3.64Å; F697-A762 HydrophobicContact CE2-CB 3.91Å
698	F	95.6	Very high	91.3	Very high	18 Å²	18	63.3 Å²	63.3	8%	0.079	36%	0.361	C	S	.	.	S	Bend	trans	-118.9	12.3	-177	-49.7	-78.2	0	0	0	112.3	D693 F720 M745 C749 A762 A763 L766	D693-F698 HydrophobicContact CB-CD2 4.44Å; D693-F698 PolarHBondContact OD2-N 3.19Å; F698-F720 HydrophobicContact CB-CD2 3.99Å; F698-F720 HydrophobicContact CB-CE2 4Å; F698-F720 VanDerWaalsContact O-CD2 3.23Å; F698-F720 WeakPolarHBondContact O-CD2 3.26Å; F698-F720 PolarHBondContact O-N 3.25Å; F698-M745 HydrophobicContact CB-CE 4.24Å; F698-M745 HydrophobicContact CB-CG 4.35Å; F698-M745 HydrophobicContact CB-SD 3.7Å; F698-M745 HydrophobicContact CD1-CG 4.15Å; F698-M745 HydrophobicContact CG-CE 4.46Å; F698-M745 HydrophobicContact CG-SD 4.33Å; F698-C749 HydrophobicContact CE1-CB 3.96Å; F698-A762 HydrophobicContact CE2-CB 4.3Å; F698-A763 HydrophobicContact CE1-CB 4.38Å; F698-A763 HydrophobicContact CZ-CB 3.81Å; F698-L766 HydrophobicContact CD2-CD2 3.72Å; F698-L766 HydrophobicContact CE2-CD2 3.98Å; F698-L766 HydrophobicContact CG-CD2 4.43Å
699	A	93.8	Very high	91.3	Very high	9 Å²	9	64 Å²	64	7%	0.074	37%	0.367	C	S	.	.	S	Bend	trans	-78	-30.6	-168.1	0	0	0	0	0	114.6	Q696 S721	Q696-A699 HydrophobicContact CB-CB 3.75Å; Q696-A699 HydrophobicContact CG-CB 4.41Å; Q696-A699 VanDerWaalsContact OE1-CB 3.25Å; A699-S721 PolarHBondContact O-N 2.8Å
700	E	93.4	Very high	91.2	Very high	117 Å²	117	65.2 Å²	65.2	55%	0.547	37%	0.371	S	S	.	.	S	Bend	trans	-139.8	164.5	-177.2	-60.1	-80.6	-179.3	0	0	107.2
701	P	92.9	Very high	90.9	Very high	70 Å²	70	68.4 Å²	68.4	46%	0.455	40%	0.397	S	S	.	.	P	Polyproline II helix	trans	-61.7	149.9	179.7	-20	31.3	0	0	0	112.9	E703 D719	P701-E703 PolarHBondContact O-N 2.93Å; P701-D719 WeakPolarHBondContact CG-OD2 3.16Å
702	V	91.3	Very high	90.8	Very high	69 Å²	69	71.5 Å²	71.5	42%	0.418	40%	0.402	S	S	.	.	P	Polyproline II helix	trans	-64.2	117.2	177.8	-178.5	0	0	0	0	110.4	A707 Y710	V702-A707 HydrophobicContact CG1-CB 3.95Å; V702-Y710 HydrophobicContact CB-CD1 4.06Å; V702-Y710 HydrophobicContact CB-CE1 4.09Å; V702-Y710 HydrophobicContact CB-CG 4.45Å; V702-Y710 HydrophobicContact CG1-CD1 4.28Å; V702-Y710 HydrophobicContact CG1-CD2 4.42Å; V702-Y710 HydrophobicContact CG1-CG 4.17Å; V702-Y710 HydrophobicContact CG2-CD1 4.34Å; V702-Y710 HydrophobicContact CG2-CE1 3.9Å; V702-Y710 HydrophobicContact CG2-CE2 4.34Å
703	E	87.8	Confident	90.7	Very high	120 Å²	120	73.1 Å²	73.1	56%	0.561	41%	0.41	S	S	*	.	P	Polyproline II helix	trans	-66.1	137.1	174.8	-70.7	-173.4	-161.9	0	0	111.4	P701 S705 L706 A707	P701-E703 PolarHBondContact O-N 2.93Å; E703-S705 VanDerWaalsContact CB-OG 3.23Å; E703-S705 WeakPolarHBondContact CB-OG 3.49Å; E703-S705 PolarHBondContact O-N 3.31Å; E703-S705 PolarHBondContact OE2-OG 3.05Å; E703-L706 HydrophobicContact CB-CD1 4.22Å; E703-L706 PolarHBondContact O-N 2.88Å; E703-A707 PolarHBondContact O-N 2.91Å
704	P	86.8	Confident	90.7	Very high	102 Å²	102	72.9 Å²	72.9	66%	0.662	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-13.9	169.9	-25.1	34.8	0	0	0	114.4	L706 P708	P704-L706 VanDerWaalsContact C-N 3.34Å; P704-P708 WeakPolarHBondContact O-CA 3.49Å; P704-P708 WeakPolarHBondContact O-CG 3.48Å
705	S	87.2	Confident	90.8	Very high	87 Å²	87	78.1 Å²	78.1	61%	0.608	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.4	-28.9	173.7	70	0	0	0	0	113.3	E703	E703-S705 VanDerWaalsContact CB-OG 3.23Å; E703-S705 WeakPolarHBondContact CB-OG 3.49Å; E703-S705 PolarHBondContact O-N 3.31Å; E703-S705 PolarHBondContact OE2-OG 3.05Å
706	L	86.2	Confident	91	Very high	115 Å²	115	81.2 Å²	81.2	60%	0.602	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.7	-30.9	-178.6	-87.8	124.3	0	0	0	112.8	E703 P704	E703-L706 HydrophobicContact CB-CD1 4.22Å; E703-L706 PolarHBondContact O-N 2.88Å; P704-L706 VanDerWaalsContact C-N 3.34Å
707	A	86.5	Confident	91	Very high	10 Å²	10	81.6 Å²	81.6	8%	0.083	44%	0.443	C	S	.	.			trans	-149.9	80.2	-173.6	0	0	0	0	0	110.2	V702 E703 D709 Y710 Y752	V702-A707 HydrophobicContact CG1-CB 3.95Å; E703-A707 PolarHBondContact O-N 2.91Å; A707-D709 PolarHBondContact O-N 2.73Å; A707-Y710 HydrophobicContact CB-CD2 4.41Å; A707-Y710 HydrophobicContact CB-CG 4.41Å; A707-Y710 VanDerWaalsContact O-CB 3.22Å; A707-Y710 WeakPolarHBondContact O-CB 3.21Å; A707-Y710 PolarHBondContact O-N 2.9Å; A707-Y710 VanDerWaalsContact O-N 3.13Å; A707-Y752 HydrophobicContact CB-CE1 4.04Å
708	P	89.5	Confident	91.2	Very high	94 Å²	94	79.8 Å²	79.8	61%	0.61	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-30.8	-172.7	-22.8	33.8	0	0	0	113.9	P704	P704-P708 WeakPolarHBondContact O-CA 3.49Å; P704-P708 WeakPolarHBondContact O-CG 3.48Å
709	D	92.5	Very high	91.3	Very high	75 Å²	75	79.2 Å²	79.2	40%	0.401	43%	0.433	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.6	-0.7	179.9	51.2	-48.8	0	0	0	113.8	A707 S711 L712 I713 Y752	A707-D709 PolarHBondContact O-N 2.73Å; D709-S711 VanDerWaalsContact C-N 3.32Å; D709-S711 PolarHBondContact O-N 3.43Å; D709-L712 HydrophobicContact CB-CD1 4.43Å; D709-L712 WeakPolarHBondContact O-CB 3.35Å; D709-L712 PolarHBondContact O-N 3.36Å; D709-I713 PolarHBondContact O-N 2.58Å; D709-Y752 VanDerWaalsContact CG-OH 3.26Å; D709-Y752 PolarHBondContact OD1-OH 3.32Å; D709-Y752 PolarHBondContact OD2-OH 3.47Å
710	Y	91.7	Very high	91.4	Very high	29 Å²	29	78.8 Å²	78.8	11%	0.114	43%	0.43	C	S	.	.	H	α-helix	trans	-56.6	-42.5	-179.1	-166.9	-101.5	0	0	0	113.3	V702 A707 L712 I713 I714 P717 Y752	V702-Y710 HydrophobicContact CB-CD1 4.06Å; V702-Y710 HydrophobicContact CB-CE1 4.09Å; V702-Y710 HydrophobicContact CB-CG 4.45Å; V702-Y710 HydrophobicContact CG1-CD1 4.28Å; V702-Y710 HydrophobicContact CG1-CD2 4.42Å; V702-Y710 HydrophobicContact CG1-CG 4.17Å; V702-Y710 HydrophobicContact CG2-CD1 4.34Å; V702-Y710 HydrophobicContact CG2-CE1 3.9Å; V702-Y710 HydrophobicContact CG2-CE2 4.34Å; A707-Y710 HydrophobicContact CB-CD2 4.41Å; A707-Y710 HydrophobicContact CB-CG 4.41Å; A707-Y710 VanDerWaalsContact O-CB 3.22Å; A707-Y710 WeakPolarHBondContact O-CB 3.21Å; A707-Y710 PolarHBondContact O-N 2.9Å; A707-Y710 VanDerWaalsContact O-N 3.13Å; Y710-L712 VanDerWaalsContact C-N 3.27Å; Y710-L712 PolarHBondContact O-N 2.78Å; Y710-I713 PolarHBondContact O-N 3.1Å; Y710-I714 HydrophobicContact CD1-CB 4.29Å; Y710-I714 HydrophobicContact CD2-CG1 4.12Å; Y710-I714 HydrophobicContact CE1-CB 3.96Å; Y710-I714 HydrophobicContact CE1-CG1 4.27Å; Y710-I714 HydrophobicContact CE1-CG2 3.98Å; Y710-I714 HydrophobicContact CE2-CB 4.3Å; Y710-I714 HydrophobicContact CE2-CG1 3.69Å; Y710-I714 WeakPolarHBondContact O-CB 3.45Å; Y710-I714 PolarHBondContact O-N 3.2Å; Y710-P717 HydrophobicContact CE1-CB 4.2Å; Y710-Y752 AromaticContact CD2-CD1 3.81Å; Y710-Y752 HydrophobicContact CD2-CD1 3.81Å; Y710-Y752 AromaticContact CD2-CD2 3.54Å; Y710-Y752 HydrophobicContact CD2-CD2 3.54Å; Y710-Y752 AromaticContact CD2-CE1 3.99Å; Y710-Y752 HydrophobicContact CD2-CE1 3.99Å; Y710-Y752 AromaticContact CD2-CE2 3.73Å; Y710-Y752 HydrophobicContact CD2-CE2 3.73Å; Y710-Y752 AromaticContact CD2-CG 3.58Å; Y710-Y752 HydrophobicContact CD2-CG 3.58Å; Y710-Y752 AromaticContact CD2-CZ 3.95Å; Y710-Y752 HydrophobicContact CE2-CD1 4.12Å; Y710-Y752 HydrophobicContact CE2-CD2 4.08Å; Y710-Y752 AromaticContact CE2-CG 3.77Å; Y710-Y752 HydrophobicContact CE2-CG 3.77Å; Y710-Y752 HydrophobicContact CG-CD2 4.45Å; Y710-Y752 HydrophobicContact CG-CE2 4.36Å
711	S	87.6	Confident	91.5	Very high	95 Å²	95	73.9 Å²	73.9	66%	0.664	41%	0.409	S	S	*	.	H	α-helix	trans	-75.2	-11.3	178.9	54.3	0	0	0	0	114.4	D709	D709-S711 VanDerWaalsContact C-N 3.32Å; D709-S711 PolarHBondContact O-N 3.43Å
712	L	90.6	Very high	91.7	Very high	142 Å²	142	72.4 Å²	72.4	74%	0.743	40%	0.399	S	S	*	.	H	α-helix	trans	-86.4	-31.5	173.7	-57.5	177.3	0	0	0	111.5	D709 Y710	D709-L712 HydrophobicContact CB-CD1 4.43Å; D709-L712 WeakPolarHBondContact O-CB 3.35Å; D709-L712 PolarHBondContact O-N 3.36Å; Y710-L712 VanDerWaalsContact C-N 3.27Å; Y710-L712 PolarHBondContact O-N 2.78Å
713	I	92.1	Very high	91.9	Very high	76 Å²	76	69.2 Å²	69.2	39%	0.39	38%	0.379	S	S	.	.	H	α-helix	trans	-91.7	-57.2	179.8	-59.4	-178.2	0	0	0	110.3	D709 Y710 K715 Y752	D709-I713 PolarHBondContact O-N 2.58Å; Y710-I713 PolarHBondContact O-N 3.1Å; I713-K715 PolarHBondContact O-N 3.01Å; I713-Y752 HydrophobicContact CB-CD2 4.13Å; I713-Y752 HydrophobicContact CB-CE2 4.37Å; I713-Y752 HydrophobicContact CD1-CD2 4.1Å; I713-Y752 HydrophobicContact CD1-CE2 3.88Å; I713-Y752 HydrophobicContact CG1-CE2 4.49Å; I713-Y752 HydrophobicContact CG2-CD2 4.22Å
714	I	94.3	Very high	92.3	Very high	3 Å²	3	66.1 Å²	66.1	2%	0.015	36%	0.362	C	S	.	.			trans	-88.1	102.7	-174.3	-59.5	-54.6	0	0	0	111	Y710 K716 N748 E751 Y752	Y710-I714 HydrophobicContact CD1-CB 4.29Å; Y710-I714 HydrophobicContact CD2-CG1 4.12Å; Y710-I714 HydrophobicContact CE1-CB 3.96Å; Y710-I714 HydrophobicContact CE1-CG1 4.27Å; Y710-I714 HydrophobicContact CE1-CG2 3.98Å; Y710-I714 HydrophobicContact CE2-CB 4.3Å; Y710-I714 HydrophobicContact CE2-CG1 3.69Å; Y710-I714 WeakPolarHBondContact O-CB 3.45Å; Y710-I714 PolarHBondContact O-N 3.2Å; I714-K716 VanDerWaalsContact C-N 3.35Å; I714-K716 PolarHBondContact O-N 3.11Å; I714-N748 HydrophobicContact CD1-CB 4.25Å; I714-N748 HydrophobicContact CG1-CB 4.5Å; I714-N748 HydrophobicContact CG2-CB 3.87Å; I714-N748 VanDerWaalsContact CG2-CG 3.44Å; I714-N748 WeakPolarHBondContact CG2-OD1 3.36Å; I714-E751 HydrophobicContact CD1-CB 4.01Å; I714-E751 HydrophobicContact CD1-CG 4.04Å; I714-Y752 HydrophobicContact CG1-CD2 4.21Å
715	K	92.6	Very high	92.6	Very high	191 Å²	191	66.2 Å²	66.2	83%	0.83	35%	0.352	S	S	*	.	S	Bend	trans	-75.2	-17.1	-175.3	-62.9	173.9	-175.4	169.8	0	114.8	I713	I713-K715 PolarHBondContact O-N 3.01Å
716	K	93.5	Very high	93	Very high	146 Å²	146	64.2 Å²	64.2	64%	0.635	33%	0.333	S	S	*	.	S	Bend	trans	-138.5	72.9	-177.5	-67.8	-173.9	178.2	-179.3	0	110.8	I714 L744 N748	I714-K716 VanDerWaalsContact C-N 3.35Å; I714-K716 PolarHBondContact O-N 3.11Å; K716-L744 HydrophobicContact CB-CD1 4.49Å; K716-L744 HydrophobicContact CB-CD2 4.09Å; K716-N748 PolarHBondContact O-ND2 3.38Å
717	P	94	Very high	93.3	Very high	82 Å²	82	58.8 Å²	58.8	53%	0.532	30%	0.304	S	S	.	.			trans	-58.6	146	177.9	26.4	-35.8	0	0	0	111.5	Y710	Y710-P717 HydrophobicContact CE1-CB 4.2Å
718	M	96.3	Very high	93.4	Very high	25 Å²	25	62.3 Å²	62.3	12%	0.123	32%	0.319	C	S	.	.			trans	-151.3	144.3	179.6	-170.2	53.9	61.4	0	0	110.7	T722 M723 K726 D741 L744 M745	M718-T722 HydrophobicContact CE-CG2 4.07Å; M718-T722 HydrophobicContact SD-CG2 3.73Å; M718-M723 HydrophobicContact CG-CG 4.01Å; M718-M723 HydrophobicContact CG-SD 4.33Å; M718-M723 HydrophobicContact SD-CG 3.5Å; M718-M723 WeakPolarHBondContact SD-CG 3.42Å; M718-K726 HydrophobicContact CE-CD 4.4Å; M718-D741 HydrophobicContact CE-CB 4.2Å; M718-D741 HydrophobicContact CG-CB 3.98Å; M718-D741 WeakPolarHBondContact CG-O 3.38Å; M718-D741 HydrophobicContact SD-CB 4.11Å; M718-L744 HydrophobicContact CB-CD2 4.43Å; M718-L744 HydrophobicContact CB-CG 4.45Å; M718-M745 HydrophobicContact CB-CB 4.13Å; M718-M745 HydrophobicContact CG-CB 4.17Å; M718-M745 WeakPolarHBondContact O-CG 3.28Å
719	D	96.1	Very high	93.3	Very high	6 Å²	6	61.5 Å²	61.5	3%	0.032	31%	0.309	C	S	.	.			trans	-157.6	165.8	-175.4	68	95.2	0	0	0	110.5	P701 S721 T722 M723	P701-D719 WeakPolarHBondContact CG-OD2 3.16Å; D719-S721 VanDerWaalsContact C-N 3.32Å; D719-S721 PolarHBondContact O-N 2.62Å; D719-S721 VanDerWaalsContact OD1-CA 3.3Å; D719-S721 WeakPolarHBondContact OD1-CA 3.34Å; D719-S721 WeakPolarHBondContact OD1-CB 3.44Å; D719-S721 PolarHBondContact OD1-N 2.85Å; D719-S721 PolarHBondContact OD1-OG 3.06Å; D719-T722 PolarHBondContact O-N 2.75Å; D719-T722 PolarHBondContact OD1-N 3.02Å; D719-T722 WeakPolarHBondContact OD2-CB 3.47Å; D719-T722 PolarHBondContact OD2-OG1 3.37Å; D719-M723 WeakPolarHBondContact O-CG 3.39Å; D719-M723 PolarHBondContact O-N 3.36Å
720	F	96.9	Very high	93.1	Very high	0 Å²	0	59.2 Å²	59.2	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-63.6	-29.5	-178.4	-72.9	-63.5	0	0	0	114.1	I686 L689 Q690 D693 F698 M723 R724 F742 M745 L766	I686-F720 HydrophobicContact CG2-CD1 3.86Å; L689-F720 HydrophobicContact CB-CE1 3.84Å; L689-F720 HydrophobicContact CB-CZ 4.12Å; Q690-F720 HydrophobicContact CB-CD1 4.09Å; Q690-F720 HydrophobicContact CB-CD2 3.91Å; Q690-F720 HydrophobicContact CB-CE1 4.19Å; Q690-F720 HydrophobicContact CB-CE2 4.01Å; Q690-F720 HydrophobicContact CB-CG 3.96Å; Q690-F720 HydrophobicContact CB-CZ 4.14Å; Q690-F720 HydrophobicContact CG-CB 4.34Å; Q690-F720 HydrophobicContact CG-CD2 3.73Å; Q690-F720 HydrophobicContact CG-CE2 4.14Å; Q690-F720 HydrophobicContact CG-CG 4.03Å; D693-F720 HydrophobicContact CB-CE2 4.27Å; F698-F720 HydrophobicContact CB-CD2 3.99Å; F698-F720 HydrophobicContact CB-CE2 4Å; F698-F720 VanDerWaalsContact O-CD2 3.23Å; F698-F720 WeakPolarHBondContact O-CD2 3.26Å; F698-F720 PolarHBondContact O-N 3.25Å; F720-M723 HydrophobicContact CD1-CE 3.58Å; F720-M723 HydrophobicContact CE1-CE 3.96Å; F720-M723 HydrophobicContact CG-CE 4.23Å; F720-R724 WeakPolarHBondContact O-CG 3.46Å; F720-R724 PolarHBondContact O-N 3.28Å; F720-R724 VanDerWaalsContact O-N 3.08Å; F720-F742 HydrophobicContact CE1-CD2 4.15Å; F720-F742 HydrophobicContact CE1-CE2 4.29Å; F720-F742 HydrophobicContact CZ-CD2 4.36Å; F720-F742 HydrophobicContact CZ-CE2 4.09Å; F720-M745 HydrophobicContact CD2-SD 4.35Å; F720-M745 HydrophobicContact CE1-CE 4.25Å; F720-M745 HydrophobicContact CE2-CE 4.07Å; F720-M745 HydrophobicContact CE2-SD 4.32Å; F720-M745 HydrophobicContact CZ-CE 3.85Å; F720-M745 HydrophobicContact CZ-SD 4.46Å; F720-L766 HydrophobicContact CE2-CD2 4.43Å; F720-L766 HydrophobicContact CZ-CD2 4.4Å
721	S	95.8	Very high	93	Very high	15 Å²	15	62.2 Å²	62.2	11%	0.105	31%	0.311	C	S	.	.	H	α-helix	trans	-70.2	-39.6	174.8	90.6	0	0	0	0	111.3	A699 D719 R724 K725	A699-S721 PolarHBondContact O-N 2.8Å; D719-S721 VanDerWaalsContact C-N 3.32Å; D719-S721 PolarHBondContact O-N 2.62Å; D719-S721 VanDerWaalsContact OD1-CA 3.3Å; D719-S721 WeakPolarHBondContact OD1-CA 3.34Å; D719-S721 WeakPolarHBondContact OD1-CB 3.44Å; D719-S721 PolarHBondContact OD1-N 2.85Å; D719-S721 PolarHBondContact OD1-OG 3.06Å; S721-R724 PolarHBondContact O-N 3.23Å; S721-K725 WeakPolarHBondContact O-CG 3.42Å; S721-K725 PolarHBondContact O-N 3.33Å; S721-K725 VanDerWaalsContact O-N 3.11Å; S721-K725 PolarHBondContact OG-NZ 2.83Å; S721-K725 VanDerWaalsContact OG-NZ 3.1Å
722	T	95.8	Very high	93.1	Very high	39 Å²	39	58 Å²	58	24%	0.239	28%	0.281	C	S	.	.	H	α-helix	trans	-68.1	-43.6	177.6	-63.7	0	0	0	0	110.5	M718 D719 R724 K725 K726	M718-T722 HydrophobicContact CE-CG2 4.07Å; M718-T722 HydrophobicContact SD-CG2 3.73Å; D719-T722 PolarHBondContact O-N 2.75Å; D719-T722 PolarHBondContact OD1-N 3.02Å; D719-T722 WeakPolarHBondContact OD2-CB 3.47Å; D719-T722 PolarHBondContact OD2-OG1 3.37Å; T722-R724 VanDerWaalsContact C-N 3.32Å; T722-R724 PolarHBondContact O-N 3.42Å; T722-K725 PolarHBondContact O-N 3.23Å; T722-K726 WeakPolarHBondContact O-CG 3.49Å; T722-K726 PolarHBondContact O-N 2.65Å
723	M	96.7	Very high	92.9	Very high	1 Å²	1	53.2 Å²	53.2	1%	0.005	26%	0.258	C	S	.	.	H	α-helix	trans	-61.7	-35.9	174.1	-66.5	-170.5	-80	0	0	112.6	I686 M718 D719 F720 K726 I727 Y732 L738 D741 F742 M745	I686-M723 HydrophobicContact CD1-CB 3.5Å; I686-M723 VanDerWaalsContact CD1-CB 3.5Å; M718-M723 HydrophobicContact CG-CG 4.01Å; M718-M723 HydrophobicContact CG-SD 4.33Å; M718-M723 HydrophobicContact SD-CG 3.5Å; M718-M723 WeakPolarHBondContact SD-CG 3.42Å; D719-M723 WeakPolarHBondContact O-CG 3.39Å; D719-M723 PolarHBondContact O-N 3.36Å; F720-M723 HydrophobicContact CD1-CE 3.58Å; F720-M723 HydrophobicContact CE1-CE 3.96Å; F720-M723 HydrophobicContact CG-CE 4.23Å; M723-K726 PolarHBondContact O-N 3.19Å; M723-I727 WeakPolarHBondContact O-CG1 3.45Å; M723-I727 PolarHBondContact O-N 3.5Å; M723-I727 VanDerWaalsContact O-N 3.09Å; M723-Y732 WeakPolarHBondContact CG-OH 3.49Å; M723-Y732 WeakPolarHBondContact O-CE2 3.45Å; M723-L738 HydrophobicContact CB-CD1 4.2Å; M723-L738 HydrophobicContact CG-CD1 4.5Å; M723-L738 HydrophobicContact SD-CD1 4.11Å; M723-D741 HydrophobicContact CG-CB 4.11Å; M723-D741 HydrophobicContact SD-CB 3.91Å; M723-F742 HydrophobicContact SD-CB 4.17Å; M723-M745 HydrophobicContact CE-CE 4.17Å; M723-M745 HydrophobicContact CE-SD 3.55Å; M723-M745 VanDerWaalsContact CE-SD 3.55Å
724	R	95.8	Very high	92.6	Very high	56 Å²	56	51.7 Å²	51.7	21%	0.211	25%	0.253	C	S	.	.	H	α-helix	trans	-62.9	-48.4	172.4	-74.4	174.7	-166.3	-87.3	3.5	112.5	L683 I686 D687 F720 S721 T722 K726 I727 E728	L683-R724 HydrophobicContact CD2-CB 4.43Å; L683-R724 HydrophobicContact CD2-CG 4.25Å; I686-R724 HydrophobicContact CD1-CG 4.23Å; I686-R724 HydrophobicContact CG2-CG 4.13Å; D687-R724 IonicContact OD1-CZ 2.78Å; D687-R724 IonicContact OD1-NH1 2.93Å; D687-R724 PolarHBondContact OD1-NH1 2.89Å; D687-R724 IonicContact OD1-NH2 2.64Å; D687-R724 PolarHBondContact OD1-NH2 2.81Å; F720-R724 WeakPolarHBondContact O-CG 3.46Å; F720-R724 PolarHBondContact O-N 3.28Å; F720-R724 VanDerWaalsContact O-N 3.08Å; S721-R724 PolarHBondContact O-N 3.23Å; T722-R724 VanDerWaalsContact C-N 3.32Å; T722-R724 PolarHBondContact O-N 3.42Å; R724-K726 VanDerWaalsContact C-N 3.27Å; R724-K726 PolarHBondContact O-N 2.89Å; R724-I727 WeakPolarHBondContact O-CB 3.37Å; R724-I727 PolarHBondContact O-N 3.47Å; R724-E728 WeakPolarHBondContact O-CG 3.43Å; R724-E728 PolarHBondContact O-N 3.45Å
725	K	93.4	Very high	92.4	Very high	103 Å²	103	52 Å²	52	45%	0.448	25%	0.254	S	S	.	.	H	α-helix	trans	-56.6	-41.8	176.5	-67.2	159.9	-169.5	149.3	0	111.4	S721 T722 I727 E728 N729	S721-K725 WeakPolarHBondContact O-CG 3.42Å; S721-K725 PolarHBondContact O-N 3.33Å; S721-K725 VanDerWaalsContact O-N 3.11Å; S721-K725 PolarHBondContact OG-NZ 2.83Å; S721-K725 VanDerWaalsContact OG-NZ 3.1Å; T722-K725 PolarHBondContact O-N 3.23Å; K725-I727 PolarHBondContact O-N 2.92Å; K725-E728 PolarHBondContact O-N 2.7Å; K725-N729 VanDerWaalsContact O-CB 3.25Å; K725-N729 WeakPolarHBondContact O-CB 2.98Å; K725-N729 PolarHBondContact O-N 3.19Å; K725-N729 PolarHBondContact O-ND2 2.89Å
726	K	94.7	Very high	92.3	Very high	46 Å²	46	48 Å²	48	20%	0.2	24%	0.242	C	C	.	.	H	α-helix	trans	-64	-36.3	175.6	-69.9	-170.1	62.6	177.1	0	113.3	M718 T722 M723 R724 F730 E731 Y732 D741	M718-K726 HydrophobicContact CE-CD 4.4Å; T722-K726 WeakPolarHBondContact O-CG 3.49Å; T722-K726 PolarHBondContact O-N 2.65Å; M723-K726 PolarHBondContact O-N 3.19Å; R724-K726 VanDerWaalsContact C-N 3.27Å; R724-K726 PolarHBondContact O-N 2.89Å; K726-F730 PolarHBondContact O-N 3.14Å; K726-E731 HydrophobicContact CB-CB 4.19Å; K726-E731 WeakPolarHBondContact CE-OE2 3.5Å; K726-E731 WeakPolarHBondContact CG-OE2 3.49Å; K726-E731 WeakPolarHBondContact O-CB 3.29Å; K726-E731 PolarHBondContact O-N 3.21Å; K726-Y732 HydrophobicContact CB-CD2 4.1Å; K726-Y732 HydrophobicContact CB-CE2 3.45Å; K726-Y732 VanDerWaalsContact CB-CE2 3.45Å; K726-Y732 HydrophobicContact CD-CE1 4.47Å; K726-D741 WeakPolarHBondContact CE-OD2 3.45Å; K726-D741 IonicContact NZ-OD2 2.9Å; K726-D741 PolarHBondContact NZ-OD2 2.94Å
727	I	93	Very high	92.2	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-66	-48.3	170.9	-64.9	162.7	0	0	0	110.8	V679 Q682 L683 I686 M723 R724 K725 N729 F730 Y732 L738	V679-I727 HydrophobicContact CB-CG2 4.21Å; V679-I727 HydrophobicContact CG1-CG2 3.88Å; V679-I727 HydrophobicContact CG2-CG2 4.19Å; Q682-I727 HydrophobicContact CB-CD1 3.72Å; Q682-I727 HydrophobicContact CB-CG1 3.88Å; Q682-I727 HydrophobicContact CB-CG2 3.89Å; L683-I727 HydrophobicContact CD2-CB 4.09Å; L683-I727 HydrophobicContact CD2-CD1 4.06Å; L683-I727 HydrophobicContact CD2-CG2 3.9Å; L683-I727 HydrophobicContact CG-CB 4.48Å; L683-I727 HydrophobicContact CG-CG2 3.75Å; I686-I727 HydrophobicContact CD1-CD1 3.33Å; I686-I727 HydrophobicContact CD1-CG1 4.49Å; I686-I727 HydrophobicContact CG1-CD1 3.82Å; M723-I727 WeakPolarHBondContact O-CG1 3.45Å; M723-I727 PolarHBondContact O-N 3.5Å; M723-I727 VanDerWaalsContact O-N 3.09Å; R724-I727 WeakPolarHBondContact O-CB 3.37Å; R724-I727 PolarHBondContact O-N 3.47Å; K725-I727 PolarHBondContact O-N 2.92Å; I727-N729 VanDerWaalsContact C-N 3.26Å; I727-N729 PolarHBondContact O-N 3.2Å; I727-F730 WeakPolarHBondContact O-CA 3.4Å; I727-F730 PolarHBondContact O-N 2.96Å; I727-Y732 HydrophobicContact CB-CD2 4.46Å; I727-Y732 HydrophobicContact CG1-CD2 3.54Å; I727-Y732 HydrophobicContact CG1-CE2 3.86Å; I727-L738 HydrophobicContact CD1-CD1 4.4Å; I727-L738 HydrophobicContact CD1-CD2 4.27Å
728	E	87.9	Confident	92.2	Very high	85 Å²	85	40.5 Å²	40.5	40%	0.397	20%	0.202	S	C	.	.	H	α-helix	trans	-64.4	-30.9	-177.4	-70.9	159.3	176.5	0	0	112.4	L683 R724 K725 F730 N1032	L683-E728 HydrophobicContact CD2-CG 4.31Å; R724-E728 WeakPolarHBondContact O-CG 3.43Å; R724-E728 PolarHBondContact O-N 3.45Å; K725-E728 PolarHBondContact O-N 2.7Å; E728-F730 VanDerWaalsContact C-N 3.31Å; E728-F730 WeakPolarHBondContact O-CD2 2.95Å; E728-F730 WeakPolarHBondContact O-CE2 3.37Å; E728-N1032 PolarHBondContact O-ND2 2.8Å
729	N	88.4	Confident	92.2	Very high	77 Å²	77	40 Å²	40	41%	0.412	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-7.6	171	-73.1	-13.6	0	0	0	114.2	K725 I727 E731 R1029	K725-N729 VanDerWaalsContact O-CB 3.25Å; K725-N729 WeakPolarHBondContact O-CB 2.98Å; K725-N729 PolarHBondContact O-N 3.19Å; K725-N729 PolarHBondContact O-ND2 2.89Å; I727-N729 VanDerWaalsContact C-N 3.26Å; I727-N729 PolarHBondContact O-N 3.2Å; N729-E731 HydrophobicContact CB-CG 3.83Å; N729-E731 VanDerWaalsContact CB-OE1 3.25Å; N729-E731 WeakPolarHBondContact CB-OE1 3.12Å; N729-E731 PolarHBondContact ND2-OE1 2.77Å; N729-R1029 PolarHBondContact O-NE 3.2Å; N729-R1029 VanDerWaalsContact O-NE 3.14Å; N729-R1029 PolarHBondContact O-NH2 3.32Å
730	F	87.4	Confident	92.2	Very high	27 Å²	27	43.2 Å²	43.2	12%	0.118	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	62.6	36.1	-173	-53.5	-104.5	0	0	0	114	K676 V679 K726 I727 E728 A1028 R1029	K676-F730 HydrophobicContact CB-CE1 4.33Å; V679-F730 HydrophobicContact CG2-CD1 3.69Å; V679-F730 HydrophobicContact CG2-CE1 3.6Å; V679-F730 HydrophobicContact CG2-CG 4.45Å; V679-F730 HydrophobicContact CG2-CZ 4.28Å; K726-F730 PolarHBondContact O-N 3.14Å; I727-F730 WeakPolarHBondContact O-CA 3.4Å; I727-F730 PolarHBondContact O-N 2.96Å; E728-F730 VanDerWaalsContact C-N 3.31Å; E728-F730 WeakPolarHBondContact O-CD2 2.95Å; E728-F730 WeakPolarHBondContact O-CE2 3.37Å; F730-A1028 HydrophobicContact CE1-CB 3.7Å; F730-A1028 HydrophobicContact CE2-CB 4.18Å; F730-A1028 HydrophobicContact CZ-CB 3.41Å; F730-A1028 VanDerWaalsContact CZ-CB 3.41Å; F730-R1029 HydrophobicContact CD2-CG 3.64Å; F730-R1029 HydrophobicContact CE2-CB 4.46Å; F730-R1029 HydrophobicContact CE2-CG 3.68Å
731	E	90	Very high	92.2	Very high	91 Å²	91	44.2 Å²	44.2	43%	0.425	23%	0.228	S	C	.	.			trans	-81.8	-25.8	179.4	-66.3	173.9	-132.2	0	0	113.6	K726 N729	K726-E731 HydrophobicContact CB-CB 4.19Å; K726-E731 WeakPolarHBondContact CE-OE2 3.5Å; K726-E731 WeakPolarHBondContact CG-OE2 3.49Å; K726-E731 WeakPolarHBondContact O-CB 3.29Å; K726-E731 PolarHBondContact O-N 3.21Å; N729-E731 HydrophobicContact CB-CG 3.83Å; N729-E731 VanDerWaalsContact CB-OE1 3.25Å; N729-E731 WeakPolarHBondContact CB-OE1 3.12Å; N729-E731 PolarHBondContact ND2-OE1 2.77Å
732	Y	90.1	Very high	92.2	Very high	8 Å²	8	43.6 Å²	43.6	3%	0.031	22%	0.223	C	C	.	.			trans	-93.4	104.1	175.5	-58.2	-58.9	0	0	0	111.3	Q682 M723 K726 I727 E737 L738 D741	Q682-Y732 PolarHBondContact NE2-O 2.93Å; M723-Y732 WeakPolarHBondContact CG-OH 3.49Å; M723-Y732 WeakPolarHBondContact O-CE2 3.45Å; K726-Y732 HydrophobicContact CB-CD2 4.1Å; K726-Y732 HydrophobicContact CB-CE2 3.45Å; K726-Y732 VanDerWaalsContact CB-CE2 3.45Å; K726-Y732 HydrophobicContact CD-CE1 4.47Å; I727-Y732 HydrophobicContact CB-CD2 4.46Å; I727-Y732 HydrophobicContact CG1-CD2 3.54Å; I727-Y732 HydrophobicContact CG1-CE2 3.86Å; Y732-E737 WeakPolarHBondContact CA-OE2 3.36Å; Y732-E737 HydrophobicContact CD1-CB 3.72Å; Y732-E737 HydrophobicContact CE1-CB 4.46Å; Y732-L738 HydrophobicContact CD1-CB 4.25Å; Y732-L738 HydrophobicContact CD2-CB 4.14Å; Y732-L738 HydrophobicContact CD2-CD1 4.18Å; Y732-L738 HydrophobicContact CE1-CB 4.42Å; Y732-L738 HydrophobicContact CE2-CB 4.32Å; Y732-L738 HydrophobicContact CE2-CD1 3.68Å; Y732-L738 HydrophobicContact CG-CB 4.09Å; Y732-D741 HydrophobicContact CE1-CB 4.37Å; Y732-D741 WeakPolarHBondContact CE1-OD2 3.48Å; Y732-D741 VanDerWaalsContact CZ-OD2 3.29Å; Y732-D741 WeakPolarHBondContact OH-CB 3.4Å; Y732-D741 PolarHBondContact OH-OD2 2.94Å
733	C	85.7	Confident	92.2	Very high	40 Å²	40	44.9 Å²	44.9	27%	0.27	23%	0.229	S	C	.	.	S	Bend	trans	-77	-24	174.3	-61	0	0	0	0	112.1	L678 E737 R1025	L678-C733 WeakPolarHBondContact CD2-O 3.48Å; C733-E737 PolarHBondContact N-OE2 2.76Å; C733-R1025 PolarHBondContact SG-NH2 3.01Å
734	T	86.6	Confident	92.2	Very high	45 Å²	45	46.5 Å²	46.5	28%	0.276	24%	0.237	S	C	.	.	S	Bend	trans	-134.3	162	173.4	74.5	0	0	0	0	112.8	N736 E737	T734-N736 PolarHBondContact O-N 2.83Å; T734-N736 PolarHBondContact OG1-N 3.02Å; T734-E737 VanDerWaalsContact CB-OE1 3.23Å; T734-E737 WeakPolarHBondContact CB-OE1 3.19Å; T734-E737 VanDerWaalsContact CG2-OE1 3.32Å; T734-E737 WeakPolarHBondContact CG2-OE1 3.33Å; T734-E737 PolarHBondContact N-OE1 2.85Å; T734-E737 PolarHBondContact N-OE2 2.88Å; T734-E737 PolarHBondContact O-N 3.12Å; T734-E737 PolarHBondContact OG1-OE1 3.16Å
735	I	89.3	Confident	92.3	Very high	10 Å²	10	44 Å²	44	5%	0.051	23%	0.228	C	C	.	.	H	α-helix	trans	-69.8	-21.1	174.3	-66.5	145.2	0	0	0	111.7	L678 F681 Q682 F685 L738 L739 L778 A781 F786	L678-I735 HydrophobicContact CD1-CD1 4.4Å; L678-I735 HydrophobicContact CD1-CG1 4.37Å; F681-I735 HydrophobicContact CD1-CD1 3.73Å; F681-I735 HydrophobicContact CD1-CG1 4.24Å; F681-I735 HydrophobicContact CE1-CD1 3.42Å; F681-I735 VanDerWaalsContact CE1-CD1 3.42Å; F681-I735 HydrophobicContact CE1-CG1 4.12Å; F681-I735 HydrophobicContact CZ-CD1 4.42Å; Q682-I735 HydrophobicContact CG-CG1 4.38Å; F685-I735 HydrophobicContact CD1-CG2 4.26Å; F685-I735 HydrophobicContact CE1-CG2 3.89Å; I735-L738 PolarHBondContact O-N 3.24Å; I735-L739 HydrophobicContact CG2-CD1 4.12Å; I735-L739 HydrophobicContact CG2-CG 4.31Å; I735-L739 WeakPolarHBondContact O-CB 3.18Å; I735-L739 VanDerWaalsContact O-CG 3.3Å; I735-L739 WeakPolarHBondContact O-CG 3.46Å; I735-L739 PolarHBondContact O-N 3.01Å; I735-L778 HydrophobicContact CG2-CD2 4.11Å; I735-A781 HydrophobicContact CD1-CB 3.3Å; I735-F786 HydrophobicContact CD1-CE2 4.44Å
736	N	91	Very high	92.4	Very high	105 Å²	105	39.2 Å²	39.2	56%	0.561	21%	0.207	S	C	*	.	H	α-helix	trans	-68.5	-35	176.3	-63.5	-31.1	0	0	0	111.7	T734 L739 S740	T734-N736 PolarHBondContact O-N 2.83Å; T734-N736 PolarHBondContact OG1-N 3.02Å; N736-L739 PolarHBondContact O-N 3.42Å; N736-S740 PolarHBondContact O-N 3.03Å
737	E	92.2	Very high	92.5	Very high	70 Å²	70	42.5 Å²	42.5	33%	0.327	22%	0.223	S	C	.	.	H	α-helix	trans	-67.1	-42.8	174.3	-64.2	140.8	-125.4	0	0	111.3	Y732 C733 T734 L739 S740 D741	Y732-E737 WeakPolarHBondContact CA-OE2 3.36Å; Y732-E737 HydrophobicContact CD1-CB 3.72Å; Y732-E737 HydrophobicContact CE1-CB 4.46Å; C733-E737 PolarHBondContact N-OE2 2.76Å; T734-E737 VanDerWaalsContact CB-OE1 3.23Å; T734-E737 WeakPolarHBondContact CB-OE1 3.19Å; T734-E737 VanDerWaalsContact CG2-OE1 3.32Å; T734-E737 WeakPolarHBondContact CG2-OE1 3.33Å; T734-E737 PolarHBondContact N-OE1 2.85Å; T734-E737 PolarHBondContact N-OE2 2.88Å; T734-E737 PolarHBondContact O-N 3.12Å; T734-E737 PolarHBondContact OG1-OE1 3.16Å; E737-L739 VanDerWaalsContact C-N 3.33Å; E737-L739 PolarHBondContact O-N 2.93Å; E737-S740 VanDerWaalsContact O-CB 3.29Å; E737-S740 WeakPolarHBondContact O-CB 3.35Å; E737-S740 PolarHBondContact O-N 3.2Å; E737-S740 VanDerWaalsContact O-N 3.14Å; E737-D741 PolarHBondContact O-N 3.34Å
738	L	94	Very high	92.7	Very high	2 Å²	2	42.8 Å²	42.8	1%	0.01	23%	0.225	C	C	.	.	H	α-helix	trans	-61.9	-39.6	173.2	172.2	59.9	0	0	0	111.8	Q682 F685 I686 M723 I727 Y732 I735 S740 D741 F742	Q682-L738 HydrophobicContact CB-CD2 4.06Å; Q682-L738 HydrophobicContact CG-CD2 4.08Å; F685-L738 HydrophobicContact CD1-CD2 3.91Å; F685-L738 HydrophobicContact CE1-CD2 4.48Å; I686-L738 HydrophobicContact CD1-CD1 3.82Å; I686-L738 HydrophobicContact CG1-CD1 4.03Å; I686-L738 HydrophobicContact CG1-CD2 4.29Å; M723-L738 HydrophobicContact CB-CD1 4.2Å; M723-L738 HydrophobicContact CG-CD1 4.5Å; M723-L738 HydrophobicContact SD-CD1 4.11Å; I727-L738 HydrophobicContact CD1-CD1 4.4Å; I727-L738 HydrophobicContact CD1-CD2 4.27Å; Y732-L738 HydrophobicContact CD1-CB 4.25Å; Y732-L738 HydrophobicContact CD2-CB 4.14Å; Y732-L738 HydrophobicContact CD2-CD1 4.18Å; Y732-L738 HydrophobicContact CE1-CB 4.42Å; Y732-L738 HydrophobicContact CE2-CB 4.32Å; Y732-L738 HydrophobicContact CE2-CD1 3.68Å; Y732-L738 HydrophobicContact CG-CB 4.09Å; I735-L738 PolarHBondContact O-N 3.24Å; L738-S740 VanDerWaalsContact C-N 3.32Å; L738-D741 PolarHBondContact O-N 3.04Å; L738-F742 PolarHBondContact O-N 2.91Å
739	L	95.3	Very high	93	Very high	15 Å²	15	39.1 Å²	39.1	8%	0.079	21%	0.209	C	C	.	.	H	α-helix	trans	-67.4	-31.3	173.6	-74.4	170.9	0	0	0	112.8	F685 I735 N736 E737 F742 N743 I774 L778	F685-L739 HydrophobicContact CE1-CD2 3.96Å; F685-L739 HydrophobicContact CE1-CG 4.31Å; F685-L739 HydrophobicContact CZ-CD2 3.94Å; I735-L739 HydrophobicContact CG2-CD1 4.12Å; I735-L739 HydrophobicContact CG2-CG 4.31Å; I735-L739 WeakPolarHBondContact O-CB 3.18Å; I735-L739 VanDerWaalsContact O-CG 3.3Å; I735-L739 WeakPolarHBondContact O-CG 3.46Å; I735-L739 PolarHBondContact O-N 3.01Å; N736-L739 PolarHBondContact O-N 3.42Å; E737-L739 VanDerWaalsContact C-N 3.33Å; E737-L739 PolarHBondContact O-N 2.93Å; L739-F742 PolarHBondContact O-N 3.26Å; L739-N743 WeakPolarHBondContact O-CB 3.46Å; L739-N743 VanDerWaalsContact O-CG 3.27Å; L739-N743 PolarHBondContact O-N 3.19Å; L739-N743 PolarHBondContact O-ND2 3.01Å; L739-N743 VanDerWaalsContact O-ND2 3.13Å; L739-I774 HydrophobicContact CD1-CG2 3.93Å; L739-I774 HydrophobicContact CD2-CB 4.44Å; L739-I774 HydrophobicContact CD2-CD1 4.03Å; L739-I774 HydrophobicContact CD2-CG1 3.87Å; L739-I774 HydrophobicContact CD2-CG2 3.79Å; L739-L778 HydrophobicContact CD1-CD1 3.93Å; L739-L778 HydrophobicContact CD1-CD2 3.87Å; L739-L778 HydrophobicContact CD1-CG 4.05Å
740	S	95.4	Very high	93.3	Very high	73 Å²	73	37.2 Å²	37.2	51%	0.51	20%	0.197	S	C	.	.	H	α-helix	trans	-63	-44.2	173.6	-165.9	0	0	0	0	111.3	N736 E737 L738 N743 L744	N736-S740 PolarHBondContact O-N 3.03Å; E737-S740 VanDerWaalsContact O-CB 3.29Å; E737-S740 WeakPolarHBondContact O-CB 3.35Å; E737-S740 PolarHBondContact O-N 3.2Å; E737-S740 VanDerWaalsContact O-N 3.14Å; L738-S740 VanDerWaalsContact C-N 3.32Å; S740-N743 PolarHBondContact O-N 3.27Å; S740-L744 WeakPolarHBondContact O-CB 3.41Å; S740-L744 PolarHBondContact O-N 3.31Å
741	D	96.9	Very high	93.7	Very high	20 Å²	20	42.3 Å²	42.3	11%	0.107	22%	0.221	C	C	.	.	H	α-helix	trans	-71.5	-34.3	177.1	-80	-7.9	0	0	0	112.6	M718 M723 K726 Y732 E737 L738 L744 M745	M718-D741 HydrophobicContact CE-CB 4.2Å; M718-D741 HydrophobicContact CG-CB 3.98Å; M718-D741 WeakPolarHBondContact CG-O 3.38Å; M718-D741 HydrophobicContact SD-CB 4.11Å; M723-D741 HydrophobicContact CG-CB 4.11Å; M723-D741 HydrophobicContact SD-CB 3.91Å; K726-D741 WeakPolarHBondContact CE-OD2 3.45Å; K726-D741 IonicContact NZ-OD2 2.9Å; K726-D741 PolarHBondContact NZ-OD2 2.94Å; Y732-D741 HydrophobicContact CE1-CB 4.37Å; Y732-D741 WeakPolarHBondContact CE1-OD2 3.48Å; Y732-D741 VanDerWaalsContact CZ-OD2 3.29Å; Y732-D741 WeakPolarHBondContact OH-CB 3.4Å; Y732-D741 PolarHBondContact OH-OD2 2.94Å; E737-D741 PolarHBondContact O-N 3.34Å; L738-D741 PolarHBondContact O-N 3.04Å; D741-L744 PolarHBondContact O-N 3.08Å; D741-M745 WeakPolarHBondContact O-CB 3.18Å; D741-M745 PolarHBondContact O-N 3.05Å
742	F	96.6	Very high	93.9	Very high	3 Å²	3	40.7 Å²	40.7	1%	0.013	21%	0.211	C	C	.	.	H	α-helix	trans	-63.7	-39.1	171.3	173.8	-95.8	0	0	0	112.3	L689 F720 M723 L738 L739 M745 L746 L766 I774	L689-F742 HydrophobicContact CB-CE2 4.29Å; L689-F742 HydrophobicContact CD1-CD2 3.99Å; L689-F742 HydrophobicContact CD1-CE2 4.19Å; L689-F742 HydrophobicContact CD1-CG 4.36Å; L689-F742 HydrophobicContact CD2-CE2 4.29Å; L689-F742 HydrophobicContact CD2-CZ 4.28Å; F720-F742 HydrophobicContact CE1-CD2 4.15Å; F720-F742 HydrophobicContact CE1-CE2 4.29Å; F720-F742 HydrophobicContact CZ-CD2 4.36Å; F720-F742 HydrophobicContact CZ-CE2 4.09Å; M723-F742 HydrophobicContact SD-CB 4.17Å; L738-F742 PolarHBondContact O-N 2.91Å; L739-F742 PolarHBondContact O-N 3.26Å; F742-M745 HydrophobicContact CD2-CE 3.6Å; F742-M745 HydrophobicContact CE2-CE 3.73Å; F742-L746 HydrophobicContact CD1-CD1 4.13Å; F742-L746 HydrophobicContact CE1-CD1 3.56Å; F742-L746 HydrophobicContact CZ-CD1 3.84Å; F742-L746 WeakPolarHBondContact O-CG 3.27Å; F742-L746 PolarHBondContact O-N 3.23Å; F742-L766 HydrophobicContact CE2-CD2 4.38Å; F742-L766 HydrophobicContact CE2-CG 4.28Å; F742-L766 HydrophobicContact CZ-CD1 4.48Å; F742-L766 HydrophobicContact CZ-CG 4.15Å; F742-I774 HydrophobicContact CD1-CD1 4.43Å; F742-I774 HydrophobicContact CE1-CD1 4.02Å
743	N	96.3	Very high	94.1	Very high	65 Å²	65	41.7 Å²	41.7	35%	0.348	22%	0.217	S	C	.	.	H	α-helix	trans	-70.1	-42.8	174.2	-71	-33.6	0	0	0	111.3	L739 S740 M745 L746 E747	L739-N743 WeakPolarHBondContact O-CB 3.46Å; L739-N743 VanDerWaalsContact O-CG 3.27Å; L739-N743 PolarHBondContact O-N 3.19Å; L739-N743 PolarHBondContact O-ND2 3.01Å; L739-N743 VanDerWaalsContact O-ND2 3.13Å; S740-N743 PolarHBondContact O-N 3.27Å; N743-M745 VanDerWaalsContact C-N 3.32Å; N743-M745 PolarHBondContact O-N 2.87Å; N743-L746 CarbonylContact O-C 3.47Å; N743-L746 WeakPolarHBondContact O-CA 3.36Å; N743-L746 WeakPolarHBondContact O-CB 3.41Å; N743-L746 PolarHBondContact O-N 3.47Å; N743-E747 WeakPolarHBondContact O-CG 3.49Å; N743-E747 PolarHBondContact O-N 2.84Å
744	L	97	Very high	94.3	Very high	36 Å²	36	50 Å²	50	19%	0.188	24%	0.243	C	C	.	.	H	α-helix	trans	-56.4	-43.1	174.4	176.1	62.7	0	0	0	112.1	K716 M718 S740 D741 L746 E747 N748	K716-L744 HydrophobicContact CB-CD1 4.49Å; K716-L744 HydrophobicContact CB-CD2 4.09Å; M718-L744 HydrophobicContact CB-CD2 4.43Å; M718-L744 HydrophobicContact CB-CG 4.45Å; S740-L744 WeakPolarHBondContact O-CB 3.41Å; S740-L744 PolarHBondContact O-N 3.31Å; D741-L744 PolarHBondContact O-N 3.08Å; L744-L746 VanDerWaalsContact C-N 3.26Å; L744-L746 PolarHBondContact O-N 3.21Å; L744-E747 PolarHBondContact O-N 2.93Å; L744-N748 WeakPolarHBondContact CD1-OD1 3.46Å; L744-N748 VanDerWaalsContact O-CB 3.25Å; L744-N748 WeakPolarHBondContact O-CB 3.39Å; L744-N748 PolarHBondContact O-N 3.19Å; L744-N748 PolarHBondContact O-ND2 2.65Å
745	M	96.8	Very high	94.6	Very high	4 Å²	4	54.3 Å²	54.3	2%	0.02	26%	0.26	C	S	.	.	H	α-helix	trans	-57.1	-37.2	173.6	177.3	-172	76.6	0	0	112.7	F698 M718 F720 M723 D741 F742 N743 C749 L766	F698-M745 HydrophobicContact CB-CE 4.24Å; F698-M745 HydrophobicContact CB-CG 4.35Å; F698-M745 HydrophobicContact CB-SD 3.7Å; F698-M745 HydrophobicContact CD1-CG 4.15Å; F698-M745 HydrophobicContact CG-CE 4.46Å; F698-M745 HydrophobicContact CG-SD 4.33Å; M718-M745 HydrophobicContact CB-CB 4.13Å; M718-M745 HydrophobicContact CG-CB 4.17Å; M718-M745 WeakPolarHBondContact O-CG 3.28Å; F720-M745 HydrophobicContact CD2-SD 4.35Å; F720-M745 HydrophobicContact CE1-CE 4.25Å; F720-M745 HydrophobicContact CE2-CE 4.07Å; F720-M745 HydrophobicContact CE2-SD 4.32Å; F720-M745 HydrophobicContact CZ-CE 3.85Å; F720-M745 HydrophobicContact CZ-SD 4.46Å; M723-M745 HydrophobicContact CE-CE 4.17Å; M723-M745 HydrophobicContact CE-SD 3.55Å; M723-M745 VanDerWaalsContact CE-SD 3.55Å; D741-M745 WeakPolarHBondContact O-CB 3.18Å; D741-M745 PolarHBondContact O-N 3.05Å; F742-M745 HydrophobicContact CD2-CE 3.6Å; F742-M745 HydrophobicContact CE2-CE 3.73Å; N743-M745 VanDerWaalsContact C-N 3.32Å; N743-M745 PolarHBondContact O-N 2.87Å; M745-C749 PolarHBondContact O-N 2.78Å; M745-L766 HydrophobicContact CE-CD2 4.08Å
746	L	96.5	Very high	94.6	Very high	2 Å²	2	60.1 Å²	60.1	1%	0.01	30%	0.296	C	S	.	.	H	α-helix	trans	-77.4	-42.9	176.5	-65	169.3	0	0	0	111.8	F742 N743 L744 C749 F750 A763 L766 R767	F742-L746 HydrophobicContact CD1-CD1 4.13Å; F742-L746 HydrophobicContact CE1-CD1 3.56Å; F742-L746 HydrophobicContact CZ-CD1 3.84Å; F742-L746 WeakPolarHBondContact O-CG 3.27Å; F742-L746 PolarHBondContact O-N 3.23Å; N743-L746 CarbonylContact O-C 3.47Å; N743-L746 WeakPolarHBondContact O-CA 3.36Å; N743-L746 WeakPolarHBondContact O-CB 3.41Å; N743-L746 PolarHBondContact O-N 3.47Å; L744-L746 VanDerWaalsContact C-N 3.26Å; L744-L746 PolarHBondContact O-N 3.21Å; L746-C749 WeakPolarHBondContact O-CA 3.39Å; L746-C749 VanDerWaalsContact O-CB 3.26Å; L746-C749 WeakPolarHBondContact O-CB 3.49Å; L746-C749 PolarHBondContact O-N 2.96Å; L746-C749 VanDerWaalsContact O-N 3.08Å; L746-F750 HydrophobicContact CB-CE2 3.83Å; L746-F750 HydrophobicContact CB-CZ 4.23Å; L746-F750 WeakPolarHBondContact O-CD2 3.16Å; L746-F750 WeakPolarHBondContact O-CE2 3.3Å; L746-F750 VanDerWaalsContact O-CG 3.27Å; L746-F750 WeakPolarHBondContact O-CG 3.46Å; L746-F750 PolarHBondContact O-N 2.82Å; L746-A763 HydrophobicContact CD2-CB 3.76Å; L746-L766 HydrophobicContact CD2-CB 4.24Å; L746-L766 HydrophobicContact CD2-CD2 4.02Å; L746-L766 HydrophobicContact CD2-CG 4.2Å; L746-R767 HydrophobicContact CD1-CB 3.99Å; L746-R767 HydrophobicContact CD1-CG 4.32Å
747	E	96.7	Very high	94.7	Very high	114 Å²	114	56.2 Å²	56.2	53%	0.533	28%	0.277	S	S	.	.	H	α-helix	trans	-63.5	-46	179	-73.4	167.5	-174.1	0	0	111.5	N743 L744 C749 F750 E751	N743-E747 WeakPolarHBondContact O-CG 3.49Å; N743-E747 PolarHBondContact O-N 2.84Å; L744-E747 PolarHBondContact O-N 2.93Å; E747-C749 PolarHBondContact O-N 2.95Å; E747-F750 CarbonylContact O-C 3.54Å; E747-F750 PolarHBondContact O-N 3.44Å; E747-E751 PolarHBondContact O-N 2.73Å
748	N	95.8	Very high	94.8	Very high	7 Å²	7	58 Å²	58	4%	0.037	29%	0.288	C	S	.	.	H	α-helix	trans	-54.2	-36.5	169.8	-71.2	-22.6	0	0	0	112.5	I714 K716 L744 Y752	I714-N748 HydrophobicContact CD1-CB 4.25Å; I714-N748 HydrophobicContact CG1-CB 4.5Å; I714-N748 HydrophobicContact CG2-CB 3.87Å; I714-N748 VanDerWaalsContact CG2-CG 3.44Å; I714-N748 WeakPolarHBondContact CG2-OD1 3.36Å; K716-N748 PolarHBondContact O-ND2 3.38Å; L744-N748 WeakPolarHBondContact CD1-OD1 3.46Å; L744-N748 VanDerWaalsContact O-CB 3.25Å; L744-N748 WeakPolarHBondContact O-CB 3.39Å; L744-N748 PolarHBondContact O-N 3.19Å; L744-N748 PolarHBondContact O-ND2 2.65Å; N748-Y752 WeakPolarHBondContact O-CB 3.39Å; N748-Y752 PolarHBondContact O-N 2.88Å
749	C	94.8	Very high	94.8	Very high	8 Å²	8	61.9 Å²	61.9	5%	0.054	30%	0.303	C	S	.	.	H	α-helix	trans	-70.2	-40.7	176.8	-171.8	0	0	0	0	111.3	F698 M745 L746 E747 N753 A763	F698-C749 HydrophobicContact CE1-CB 3.96Å; M745-C749 PolarHBondContact O-N 2.78Å; L746-C749 WeakPolarHBondContact O-CA 3.39Å; L746-C749 VanDerWaalsContact O-CB 3.26Å; L746-C749 WeakPolarHBondContact O-CB 3.49Å; L746-C749 PolarHBondContact O-N 2.96Å; L746-C749 VanDerWaalsContact O-N 3.08Å; E747-C749 PolarHBondContact O-N 2.95Å; C749-N753 WeakPolarHBondContact O-CB 3.36Å; C749-N753 PolarHBondContact O-N 3.21Å; C749-N753 PolarHBondContact O-ND2 2.98Å; C749-A763 HydrophobicContact CB-CB 4.03Å
750	F	95.7	Very high	94.8	Very high	36 Å²	36	63 Å²	63	16%	0.158	31%	0.306	C	S	.	.	H	α-helix	trans	-71.8	-35.2	178.1	-55.4	-43.8	0	0	0	113.2	L746 E747 Y760 A763 M764	L746-F750 HydrophobicContact CB-CE2 3.83Å; L746-F750 HydrophobicContact CB-CZ 4.23Å; L746-F750 WeakPolarHBondContact O-CD2 3.16Å; L746-F750 WeakPolarHBondContact O-CE2 3.3Å; L746-F750 VanDerWaalsContact O-CG 3.27Å; L746-F750 WeakPolarHBondContact O-CG 3.46Å; L746-F750 PolarHBondContact O-N 2.82Å; E747-F750 CarbonylContact O-C 3.54Å; E747-F750 PolarHBondContact O-N 3.44Å; F750-Y760 HydrophobicContact CB-CD2 4.24Å; F750-Y760 HydrophobicContact CB-CE2 3.81Å; F750-Y760 HydrophobicContact CD1-CD1 4.44Å; F750-Y760 AromaticContact CD1-CD2 3.59Å; F750-Y760 HydrophobicContact CD1-CD2 3.59Å; F750-Y760 HydrophobicContact CD1-CE1 4.44Å; F750-Y760 AromaticContact CD1-CE2 3.54Å; F750-Y760 HydrophobicContact CD1-CE2 3.54Å; F750-Y760 HydrophobicContact CD1-CG 4.05Å; F750-Y760 HydrophobicContact CE1-CD2 4.5Å; F750-Y760 HydrophobicContact CG-CD2 4.38Å; F750-Y760 HydrophobicContact CG-CE2 4.04Å; F750-A763 HydrophobicContact CD1-CB 4.15Å; F750-A763 HydrophobicContact CE1-CB 3.35Å; F750-A763 HydrophobicContact CZ-CB 3.68Å; F750-M764 HydrophobicContact CD1-CE 4.34Å; F750-M764 HydrophobicContact CE1-CE 3.6Å; F750-M764 HydrophobicContact CE1-CG 3.93Å; F750-M764 HydrophobicContact CE2-CE 3.83Å; F750-M764 HydrophobicContact CZ-CE 3.33Å; F750-M764 HydrophobicContact CZ-CG 4.39Å
751	E	94.9	Very high	94.7	Very high	135 Å²	135	62.2 Å²	62.2	63%	0.631	30%	0.298	S	S	*	.	H	α-helix	trans	-69	-42.9	176.2	-177.6	173.6	-158	0	0	111.6	I714 E747	I714-E751 HydrophobicContact CD1-CB 4.01Å; I714-E751 HydrophobicContact CD1-CG 4.04Å; E747-E751 PolarHBondContact O-N 2.73Å
752	Y	94.6	Very high	94.6	Very high	57 Å²	57	62.1 Å²	62.1	22%	0.224	30%	0.3	C	S	.	.	H	α-helix	trans	-78.5	-31.7	-179.5	-166.7	-96.3	0	0	0	114	A707 D709 Y710 I713 I714 N748	A707-Y752 HydrophobicContact CB-CE1 4.04Å; D709-Y752 VanDerWaalsContact CG-OH 3.26Å; D709-Y752 PolarHBondContact OD1-OH 3.32Å; D709-Y752 PolarHBondContact OD2-OH 3.47Å; Y710-Y752 AromaticContact CD2-CD1 3.81Å; Y710-Y752 HydrophobicContact CD2-CD1 3.81Å; Y710-Y752 AromaticContact CD2-CD2 3.54Å; Y710-Y752 HydrophobicContact CD2-CD2 3.54Å; Y710-Y752 AromaticContact CD2-CE1 3.99Å; Y710-Y752 HydrophobicContact CD2-CE1 3.99Å; Y710-Y752 AromaticContact CD2-CE2 3.73Å; Y710-Y752 HydrophobicContact CD2-CE2 3.73Å; Y710-Y752 AromaticContact CD2-CG 3.58Å; Y710-Y752 HydrophobicContact CD2-CG 3.58Å; Y710-Y752 AromaticContact CD2-CZ 3.95Å; Y710-Y752 HydrophobicContact CE2-CD1 4.12Å; Y710-Y752 HydrophobicContact CE2-CD2 4.08Å; Y710-Y752 AromaticContact CE2-CG 3.77Å; Y710-Y752 HydrophobicContact CE2-CG 3.77Å; Y710-Y752 HydrophobicContact CG-CD2 4.45Å; Y710-Y752 HydrophobicContact CG-CE2 4.36Å; I713-Y752 HydrophobicContact CB-CD2 4.13Å; I713-Y752 HydrophobicContact CB-CE2 4.37Å; I713-Y752 HydrophobicContact CD1-CD2 4.1Å; I713-Y752 HydrophobicContact CD1-CE2 3.88Å; I713-Y752 HydrophobicContact CG1-CE2 4.49Å; I713-Y752 HydrophobicContact CG2-CD2 4.22Å; I714-Y752 HydrophobicContact CG1-CD2 4.21Å; N748-Y752 WeakPolarHBondContact O-CB 3.39Å; N748-Y752 PolarHBondContact O-N 2.88Å
753	N	92.9	Very high	94.5	Very high	28 Å²	28	62 Å²	62	15%	0.15	30%	0.3	C	S	.	.	S	Bend	trans	-104.2	132.8	-173.2	-70.3	-97.5	0	0	0	113	C749 S757 Y759 Y760	C749-N753 WeakPolarHBondContact O-CB 3.36Å; C749-N753 PolarHBondContact O-N 3.21Å; C749-N753 PolarHBondContact O-ND2 2.98Å; N753-S757 PolarHBondContact OD1-OG 3.1Å; N753-Y759 WeakPolarHBondContact OD1-CD2 3.24Å; N753-Y760 HydrophobicContact CB-CD2 4.39Å; N753-Y760 VanDerWaalsContact O-CD2 3.25Å; N753-Y760 WeakPolarHBondContact O-CD2 3.23Å
754	R	91.2	Very high	94.4	Very high	215 Å²	215	61.9 Å²	61.9	81%	0.811	30%	0.298	S	S	*	.			trans	-58.6	147.5	162.6	-58.9	-177.1	-175	-175.9	1	110.7	T756 S757	R754-T756 PolarHBondContact O-N 3.45Å; R754-S757 WeakPolarHBondContact O-CB 3.35Å; R754-S757 PolarHBondContact O-N 2.94Å
755	E	92.5	Very high	94.3	Very high	136 Å²	136	65.8 Å²	65.8	64%	0.636	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55	-30.8	-175.1	-52.3	-155.5	108.7	0	0	114.5	S757 Y760	E755-S757 PolarHBondContact O-N 2.77Å; E755-Y760 VanDerWaalsContact CA-CD1 3.5Å; E755-Y760 HydrophobicContact CB-CD1 4.1Å; E755-Y760 HydrophobicContact CB-CE1 3.8Å; E755-Y760 HydrophobicContact CG-CE1 3.92Å; E755-Y760 HydrophobicContact CG-CE2 4.1Å; E755-Y760 WeakPolarHBondContact O-CD1 3.25Å; E755-Y760 PolarHBondContact OE1-OH 3.09Å
756	T	89.5	Confident	94.3	Very high	132 Å²	132	65.8 Å²	65.8	81%	0.81	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73	-3.2	178.3	60.2	0	0	0	0	114.3	R754	R754-T756 PolarHBondContact O-N 3.45Å
757	S	93	Very high	94.2	Very high	22 Å²	22	71.2 Å²	71.2	15%	0.154	33%	0.334	C	S	.	.	S	Bend	trans	-72.4	146.2	-178.9	167.9	0	0	0	0	112.6	N753 R754 E755 Y759 Y760 T761	N753-S757 PolarHBondContact OD1-OG 3.1Å; R754-S757 WeakPolarHBondContact O-CB 3.35Å; R754-S757 PolarHBondContact O-N 2.94Å; E755-S757 PolarHBondContact O-N 2.77Å; S757-Y759 PolarHBondContact O-N 3.37Å; S757-Y759 WeakPolarHBondContact OG-CD2 3.44Å; S757-Y759 PolarHBondContact OG-N 3.09Å; S757-Y760 PolarHBondContact O-N 3.28Å; S757-T761 VanDerWaalsContact O-CB 3.3Å; S757-T761 WeakPolarHBondContact O-CB 3.44Å; S757-T761 PolarHBondContact O-N 2.96Å; S757-T761 PolarHBondContact O-OG1 3.4Å
758	I	93.6	Very high	94.1	Very high	109 Å²	109	70.5 Å²	70.5	56%	0.559	33%	0.33	S	S	*	.	H	α-helix	trans	-62.9	-28.5	170.9	62.6	176.2	0	0	0	112.2	F697 A762	F697-I758 HydrophobicContact CZ-CD1 4.07Å; F697-I758 HydrophobicContact CZ-CG1 4.4Å; I758-A762 VanDerWaalsContact O-CB 3.27Å; I758-A762 WeakPolarHBondContact O-CB 3.5Å; I758-A762 PolarHBondContact O-N 3.31Å
759	Y	93.7	Very high	94.1	Very high	82 Å²	82	77 Å²	77	32%	0.322	35%	0.354	S	S	.	.	H	α-helix	trans	-77.6	-44.7	178.3	-51.5	-69.9	0	0	0	110.8	F697 N753 S757 T761 A762 A763	F697-Y759 HydrophobicContact CB-CD1 4.33Å; F697-Y759 HydrophobicContact CD1-CD1 4.16Å; F697-Y759 AromaticContact CD1-CE1 3.91Å; F697-Y759 HydrophobicContact CD1-CE1 3.91Å; F697-Y759 AromaticContact CD2-CD1 3.75Å; F697-Y759 HydrophobicContact CD2-CD1 3.75Å; F697-Y759 HydrophobicContact CD2-CE1 4.29Å; F697-Y759 HydrophobicContact CE1-CD1 4.35Å; F697-Y759 AromaticContact CE1-CE1 3.93Å; F697-Y759 HydrophobicContact CE1-CE1 3.93Å; F697-Y759 AromaticContact CE2-CD1 3.96Å; F697-Y759 HydrophobicContact CE2-CD1 3.96Å; F697-Y759 HydrophobicContact CE2-CE1 4.3Å; F697-Y759 AromaticContact CG-CD1 3.86Å; F697-Y759 HydrophobicContact CG-CD1 3.86Å; F697-Y759 HydrophobicContact CG-CE1 4.1Å; F697-Y759 HydrophobicContact CZ-CD1 4.25Å; F697-Y759 HydrophobicContact CZ-CE1 4.12Å; N753-Y759 WeakPolarHBondContact OD1-CD2 3.24Å; S757-Y759 PolarHBondContact O-N 3.37Å; S757-Y759 WeakPolarHBondContact OG-CD2 3.44Å; S757-Y759 PolarHBondContact OG-N 3.09Å; Y759-T761 PolarHBondContact O-N 2.85Å; Y759-A762 WeakPolarHBondContact O-CB 3.35Å; Y759-A762 PolarHBondContact O-N 3.46Å; Y759-A762 VanDerWaalsContact O-N 3.1Å; Y759-A763 WeakPolarHBondContact O-CB 3.43Å; Y759-A763 PolarHBondContact O-N 3.24Å
760	Y	95.5	Very high	94.1	Very high	39 Å²	39	76.7 Å²	76.7	15%	0.153	35%	0.353	C	S	.	.	H	α-helix	trans	-58.6	-47.5	172.5	-167.6	-82.3	0	0	0	111.1	F750 N753 E755 S757 A762 A763 M764	F750-Y760 HydrophobicContact CB-CD2 4.24Å; F750-Y760 HydrophobicContact CB-CE2 3.81Å; F750-Y760 HydrophobicContact CD1-CD1 4.44Å; F750-Y760 AromaticContact CD1-CD2 3.59Å; F750-Y760 HydrophobicContact CD1-CD2 3.59Å; F750-Y760 HydrophobicContact CD1-CE1 4.44Å; F750-Y760 AromaticContact CD1-CE2 3.54Å; F750-Y760 HydrophobicContact CD1-CE2 3.54Å; F750-Y760 HydrophobicContact CD1-CG 4.05Å; F750-Y760 HydrophobicContact CE1-CD2 4.5Å; F750-Y760 HydrophobicContact CG-CD2 4.38Å; F750-Y760 HydrophobicContact CG-CE2 4.04Å; N753-Y760 HydrophobicContact CB-CD2 4.39Å; N753-Y760 VanDerWaalsContact O-CD2 3.25Å; N753-Y760 WeakPolarHBondContact O-CD2 3.23Å; E755-Y760 VanDerWaalsContact CA-CD1 3.5Å; E755-Y760 HydrophobicContact CB-CD1 4.1Å; E755-Y760 HydrophobicContact CB-CE1 3.8Å; E755-Y760 HydrophobicContact CG-CE1 3.92Å; E755-Y760 HydrophobicContact CG-CE2 4.1Å; E755-Y760 WeakPolarHBondContact O-CD1 3.25Å; E755-Y760 PolarHBondContact OE1-OH 3.09Å; S757-Y760 PolarHBondContact O-N 3.28Å; Y760-A762 VanDerWaalsContact C-N 3.26Å; Y760-A762 PolarHBondContact O-N 3.44Å; Y760-A763 PolarHBondContact O-N 3.47Å; Y760-M764 HydrophobicContact CD1-CG 4.1Å; Y760-M764 HydrophobicContact CE1-CG 3.96Å; Y760-M764 WeakPolarHBondContact O-CB 3.38Å; Y760-M764 PolarHBondContact O-N 3.45Å
761	T	94.2	Very high	94	Very high	57 Å²	57	80 Å²	80	35%	0.35	37%	0.367	S	S	.	.	H	α-helix	trans	-60.4	-33.6	175.5	-62.7	0	0	0	0	112.4	S757 Y759 K765	S757-T761 VanDerWaalsContact O-CB 3.3Å; S757-T761 WeakPolarHBondContact O-CB 3.44Å; S757-T761 PolarHBondContact O-N 2.96Å; S757-T761 PolarHBondContact O-OG1 3.4Å; Y759-T761 PolarHBondContact O-N 2.85Å; T761-K765 HydrophobicContact CG2-CD 4.28Å; T761-K765 VanDerWaalsContact CG2-NZ 3.35Å; T761-K765 WeakPolarHBondContact O-CD 3.22Å; T761-K765 VanDerWaalsContact O-CG 3.28Å; T761-K765 WeakPolarHBondContact O-CG 3.18Å; T761-K765 PolarHBondContact O-N 3.41Å
762	A	94.2	Very high	94	Very high	18 Å²	18	77.6 Å²	77.6	15%	0.149	36%	0.363	C	S	.	.	H	α-helix	trans	-75.7	-44.8	175.9	0	0	0	0	0	112	F697 F698 I758 Y759 Y760 M764 K765 L766	F697-A762 HydrophobicContact CD2-CB 3.64Å; F697-A762 HydrophobicContact CE2-CB 3.91Å; F698-A762 HydrophobicContact CE2-CB 4.3Å; I758-A762 VanDerWaalsContact O-CB 3.27Å; I758-A762 WeakPolarHBondContact O-CB 3.5Å; I758-A762 PolarHBondContact O-N 3.31Å; Y759-A762 WeakPolarHBondContact O-CB 3.35Å; Y759-A762 PolarHBondContact O-N 3.46Å; Y759-A762 VanDerWaalsContact O-N 3.1Å; Y760-A762 VanDerWaalsContact C-N 3.26Å; Y760-A762 PolarHBondContact O-N 3.44Å; A762-M764 PolarHBondContact O-N 3.43Å; A762-K765 CarbonylContact O-C 3.51Å; A762-K765 PolarHBondContact O-N 3.08Å; A762-K765 VanDerWaalsContact O-N 3.14Å; A762-L766 WeakPolarHBondContact O-CB 3.3Å; A762-L766 PolarHBondContact O-N 2.91Å
763	A	95.6	Very high	93.9	Very high	0 Å²	0	76.2 Å²	76.2	0%	0	36%	0.359	C	S	.	.	H	α-helix	trans	-60.6	-42.4	176.1	0	0	0	0	0	111.8	F698 L746 C749 F750 Y759 Y760 K765 L766 R767	F698-A763 HydrophobicContact CE1-CB 4.38Å; F698-A763 HydrophobicContact CZ-CB 3.81Å; L746-A763 HydrophobicContact CD2-CB 3.76Å; C749-A763 HydrophobicContact CB-CB 4.03Å; F750-A763 HydrophobicContact CD1-CB 4.15Å; F750-A763 HydrophobicContact CE1-CB 3.35Å; F750-A763 HydrophobicContact CZ-CB 3.68Å; Y759-A763 WeakPolarHBondContact O-CB 3.43Å; Y759-A763 PolarHBondContact O-N 3.24Å; Y760-A763 PolarHBondContact O-N 3.47Å; A763-K765 PolarHBondContact O-N 3.26Å; A763-L766 PolarHBondContact O-N 3.03Å; A763-R767 WeakPolarHBondContact O-CB 3.28Å; A763-R767 PolarHBondContact O-N 3.35Å
764	M	94.7	Very high	94	Very high	62 Å²	62	76.2 Å²	76.2	31%	0.305	36%	0.359	S	S	.	.	H	α-helix	trans	-57.5	-46.9	171.3	-85.7	-74.8	115.4	0	0	112	F750 Y760 A762 L766 R767 E768	F750-M764 HydrophobicContact CD1-CE 4.34Å; F750-M764 HydrophobicContact CE1-CE 3.6Å; F750-M764 HydrophobicContact CE1-CG 3.93Å; F750-M764 HydrophobicContact CE2-CE 3.83Å; F750-M764 HydrophobicContact CZ-CE 3.33Å; F750-M764 HydrophobicContact CZ-CG 4.39Å; Y760-M764 HydrophobicContact CD1-CG 4.1Å; Y760-M764 HydrophobicContact CE1-CG 3.96Å; Y760-M764 WeakPolarHBondContact O-CB 3.38Å; Y760-M764 PolarHBondContact O-N 3.45Å; A762-M764 PolarHBondContact O-N 3.43Å; M764-L766 VanDerWaalsContact C-N 3.34Å; M764-L766 PolarHBondContact O-N 3.05Å; M764-R767 PolarHBondContact O-N 3.29Å; M764-E768 PolarHBondContact O-N 3.03Å
765	K	94.4	Very high	94	Very high	118 Å²	118	69.4 Å²	69.4	51%	0.513	34%	0.344	S	S	.	.	H	α-helix	trans	-67.1	-33.3	177.9	-73.4	167.6	-174.8	169	0	112.8	T761 A762 A763 R769	T761-K765 HydrophobicContact CG2-CD 4.28Å; T761-K765 VanDerWaalsContact CG2-NZ 3.35Å; T761-K765 WeakPolarHBondContact O-CD 3.22Å; T761-K765 VanDerWaalsContact O-CG 3.28Å; T761-K765 WeakPolarHBondContact O-CG 3.18Å; T761-K765 PolarHBondContact O-N 3.41Å; A762-K765 CarbonylContact O-C 3.51Å; A762-K765 PolarHBondContact O-N 3.08Å; A762-K765 VanDerWaalsContact O-N 3.14Å; A763-K765 PolarHBondContact O-N 3.26Å; K765-R769 VanDerWaalsContact O-CB 3.25Å; K765-R769 WeakPolarHBondContact O-CB 3.43Å; K765-R769 WeakPolarHBondContact O-CD 3.27Å; K765-R769 WeakPolarHBondContact O-CG 3.08Å; K765-R769 PolarHBondContact O-N 3.43Å; K765-R769 VanDerWaalsContact O-N 3.1Å
766	L	95.5	Very high	93.9	Very high	5 Å²	5	68.1 Å²	68.1	3%	0.026	34%	0.338	C	S	.	.	H	α-helix	trans	-68.8	-47.4	175.6	-178.6	54.4	0	0	0	110.6	L692 F698 F720 F742 M745 L746 A762 A763 M764 E768 R769 S770	L692-L766 HydrophobicContact CB-CD1 3.54Å; L692-L766 HydrophobicContact CD1-CD1 4.14Å; L692-L766 HydrophobicContact CG-CD1 4.49Å; F698-L766 HydrophobicContact CD2-CD2 3.72Å; F698-L766 HydrophobicContact CE2-CD2 3.98Å; F698-L766 HydrophobicContact CG-CD2 4.43Å; F720-L766 HydrophobicContact CE2-CD2 4.43Å; F720-L766 HydrophobicContact CZ-CD2 4.4Å; F742-L766 HydrophobicContact CE2-CD2 4.38Å; F742-L766 HydrophobicContact CE2-CG 4.28Å; F742-L766 HydrophobicContact CZ-CD1 4.48Å; F742-L766 HydrophobicContact CZ-CG 4.15Å; M745-L766 HydrophobicContact CE-CD2 4.08Å; L746-L766 HydrophobicContact CD2-CB 4.24Å; L746-L766 HydrophobicContact CD2-CD2 4.02Å; L746-L766 HydrophobicContact CD2-CG 4.2Å; A762-L766 WeakPolarHBondContact O-CB 3.3Å; A762-L766 PolarHBondContact O-N 2.91Å; A763-L766 PolarHBondContact O-N 3.03Å; M764-L766 VanDerWaalsContact C-N 3.34Å; M764-L766 PolarHBondContact O-N 3.05Å; L766-E768 PolarHBondContact O-N 2.74Å; L766-R769 PolarHBondContact O-N 3.14Å; L766-S770 VanDerWaalsContact O-CB 3.31Å; L766-S770 WeakPolarHBondContact O-CB 3.29Å; L766-S770 PolarHBondContact O-N 3.3Å; L766-S770 PolarHBondContact O-OG 2.96Å; L766-S770 VanDerWaalsContact O-OG 3.09Å
767	R	95.8	Very high	93.9	Very high	115 Å²	115	62.1 Å²	62.1	43%	0.434	30%	0.302	S	S	.	.	H	α-helix	trans	-56.9	-43.4	175.6	-173.6	179.2	177.9	-179.3	-1.4	113	L746 A763 M764 S770	L746-R767 HydrophobicContact CD1-CB 3.99Å; L746-R767 HydrophobicContact CD1-CG 4.32Å; A763-R767 WeakPolarHBondContact O-CB 3.28Å; A763-R767 PolarHBondContact O-N 3.35Å; M764-R767 PolarHBondContact O-N 3.29Å; R767-S770 PolarHBondContact O-OG 3.22Å
768	E	94.3	Very high	93.8	Very high	99 Å²	99	63.3 Å²	63.3	46%	0.463	31%	0.306	S	S	.	.	H	α-helix	trans	-75.4	-36.8	179.4	-69.5	-54.1	121	0	0	112.9	M764 L766 K771	M764-E768 PolarHBondContact O-N 3.03Å; L766-E768 PolarHBondContact O-N 2.74Å; E768-K771 VanDerWaalsContact OE1-CE 3.24Å; E768-K771 WeakPolarHBondContact OE1-CE 3.47Å; E768-K771 IonicContact OE1-NZ 2.65Å; E768-K771 PolarHBondContact OE1-NZ 3.44Å; E768-K771 WeakPolarHBondContact OE2-CE 3.22Å; E768-K771 IonicContact OE2-NZ 2.57Å; E768-K771 PolarHBondContact OE2-NZ 2.88Å
769	R	94.9	Very high	93.6	Very high	144 Å²	144	61.4 Å²	61.4	54%	0.543	30%	0.3	S	S	.	.	H	α-helix	trans	-78.7	-23.2	-179.5	-71.3	173.4	173.6	-168.1	-4.7	114	L692 K765 L766 P772	L692-R769 HydrophobicContact CD1-CB 3.84Å; L692-R769 HydrophobicContact CD2-CB 4.16Å; K765-R769 VanDerWaalsContact O-CB 3.25Å; K765-R769 WeakPolarHBondContact O-CB 3.43Å; K765-R769 WeakPolarHBondContact O-CD 3.27Å; K765-R769 WeakPolarHBondContact O-CG 3.08Å; K765-R769 PolarHBondContact O-N 3.43Å; K765-R769 VanDerWaalsContact O-N 3.1Å; L766-R769 PolarHBondContact O-N 3.14Å; R769-P772 WeakPolarHBondContact O-CD 3.09Å
770	S	95.2	Very high	93.2	Very high	2 Å²	2	58.9 Å²	58.9	1%	0.014	29%	0.291	C	S	.	.	H	α-helix	trans	-76.3	-29.3	178.7	61.9	0	0	0	0	113.1	L766 R767 I773 I774	L766-S770 VanDerWaalsContact O-CB 3.31Å; L766-S770 WeakPolarHBondContact O-CB 3.29Å; L766-S770 PolarHBondContact O-N 3.3Å; L766-S770 PolarHBondContact O-OG 2.96Å; L766-S770 VanDerWaalsContact O-OG 3.09Å; R767-S770 PolarHBondContact O-OG 3.22Å; S770-I773 WeakPolarHBondContact O-CA 3.48Å; S770-I773 WeakPolarHBondContact O-CB 3.32Å; S770-I773 PolarHBondContact O-N 3.44Å; S770-I774 WeakPolarHBondContact O-CG1 3.33Å; S770-I774 PolarHBondContact O-N 3.14Å; S770-I774 WeakPolarHBondContact OG-CD1 3.29Å
771	K	94.8	Very high	92.7	Very high	106 Å²	106	57.9 Å²	57.9	46%	0.461	29%	0.291	S	S	.	.	H	α-helix	trans	-39.3	-53.6	179.8	-73.4	176.5	-175.6	174.5	0	115.5	E768 I774 S775	E768-K771 VanDerWaalsContact OE1-CE 3.24Å; E768-K771 WeakPolarHBondContact OE1-CE 3.47Å; E768-K771 IonicContact OE1-NZ 2.65Å; E768-K771 PolarHBondContact OE1-NZ 3.44Å; E768-K771 WeakPolarHBondContact OE2-CE 3.22Å; E768-K771 IonicContact OE2-NZ 2.57Å; E768-K771 PolarHBondContact OE2-NZ 2.88Å; K771-I774 PolarHBondContact O-N 3.35Å; K771-S775 WeakPolarHBondContact O-CB 3.33Å; K771-S775 PolarHBondContact O-N 3.46Å
772	P	93.9	Very high	92.2	Very high	84 Å²	84	63.1 Å²	63.1	55%	0.545	31%	0.309	S	S	.	.	H	α-helix	trans	-63.6	-40.9	178.2	23.9	-34.5	0	0	0	112.9	R769 S775 E776	R769-P772 WeakPolarHBondContact O-CD 3.09Å; P772-S775 PolarHBondContact O-N 2.69Å; P772-E776 WeakPolarHBondContact O-CB 3.49Å; P772-E776 PolarHBondContact O-N 2.8Å
773	I	92.9	Very high	91.6	Very high	27 Å²	27	67.4 Å²	67.4	14%	0.138	33%	0.326	C	S	.	.	H	α-helix	trans	-66	-40.9	179.2	-45.9	-175.7	0	0	0	110.4	F685 Q688 L692 S770 E776 A777	F685-I773 HydrophobicContact CD2-CG2 4.25Å; F685-I773 HydrophobicContact CE2-CG2 4.04Å; Q688-I773 HydrophobicContact CB-CD1 4.48Å; Q688-I773 HydrophobicContact CB-CG2 3.78Å; L692-I773 HydrophobicContact CD1-CD1 3.77Å; L692-I773 HydrophobicContact CD2-CD1 4.44Å; L692-I773 HydrophobicContact CG-CD1 4.19Å; S770-I773 WeakPolarHBondContact O-CA 3.48Å; S770-I773 WeakPolarHBondContact O-CB 3.32Å; S770-I773 PolarHBondContact O-N 3.44Å; I773-E776 PolarHBondContact O-N 3.44Å; I773-A777 VanDerWaalsContact O-CB 3.3Å; I773-A777 WeakPolarHBondContact O-CB 3.42Å; I773-A777 PolarHBondContact O-N 3.48Å
774	I	94.1	Very high	90.6	Very high	28 Å²	28	67.5 Å²	67.5	14%	0.144	33%	0.327	C	S	.	.	H	α-helix	trans	-63.4	-44.8	175.9	-64.7	169	0	0	0	110.5	F685 L689 L739 F742 S770 K771 A777 L778	F685-I774 HydrophobicContact CE2-CG1 4.48Å; F685-I774 HydrophobicContact CZ-CB 4.47Å; F685-I774 HydrophobicContact CZ-CG1 4.04Å; L689-I774 HydrophobicContact CD2-CG1 4.26Å; L739-I774 HydrophobicContact CD1-CG2 3.93Å; L739-I774 HydrophobicContact CD2-CB 4.44Å; L739-I774 HydrophobicContact CD2-CD1 4.03Å; L739-I774 HydrophobicContact CD2-CG1 3.87Å; L739-I774 HydrophobicContact CD2-CG2 3.79Å; F742-I774 HydrophobicContact CD1-CD1 4.43Å; F742-I774 HydrophobicContact CE1-CD1 4.02Å; S770-I774 WeakPolarHBondContact O-CG1 3.33Å; S770-I774 PolarHBondContact O-N 3.14Å; S770-I774 WeakPolarHBondContact OG-CD1 3.29Å; K771-I774 PolarHBondContact O-N 3.35Å; I774-A777 PolarHBondContact O-N 3.09Å; I774-L778 HydrophobicContact CG2-CD1 3.86Å; I774-L778 HydrophobicContact CG2-CG 4.41Å; I774-L778 WeakPolarHBondContact O-CB 3.21Å; I774-L778 VanDerWaalsContact O-CG 3.31Å; I774-L778 WeakPolarHBondContact O-CG 3.18Å; I774-L778 PolarHBondContact O-N 2.99Å
775	S	92.2	Very high	89.7	Confident	73 Å²	73	67.8 Å²	67.8	51%	0.51	33%	0.329	S	S	.	.	H	α-helix	trans	-64.1	-43.2	177.7	-167.6	0	0	0	0	112.4	K771 P772 T779	K771-S775 WeakPolarHBondContact O-CB 3.33Å; K771-S775 PolarHBondContact O-N 3.46Å; P772-S775 PolarHBondContact O-N 2.69Å; S775-T779 WeakPolarHBondContact O-CB 3.2Å; S775-T779 PolarHBondContact O-N 2.85Å; S775-T779 PolarHBondContact O-OG1 3.29Å
776	E	90.9	Very high	89.1	Confident	108 Å²	108	63.4 Å²	63.4	51%	0.505	31%	0.311	S	S	.	.	H	α-helix	trans	-61	-50.9	174.6	-174.8	-179	-179.3	0	0	111	P772 I773 L778 T779 I780	P772-E776 WeakPolarHBondContact O-CB 3.49Å; P772-E776 PolarHBondContact O-N 2.8Å; I773-E776 PolarHBondContact O-N 3.44Å; E776-L778 PolarHBondContact O-N 3.31Å; E776-T779 WeakPolarHBondContact O-CB 3.33Å; E776-T779 PolarHBondContact O-N 3.26Å; E776-T779 VanDerWaalsContact O-N 3.13Å; E776-I780 HydrophobicContact CG-CD1 3.86Å; E776-I780 WeakPolarHBondContact O-CG1 3.3Å; E776-I780 PolarHBondContact O-N 2.9Å
777	A	89.1	Confident	88.3	Confident	6 Å²	6	64.3 Å²	64.3	5%	0.05	32%	0.317	C	S	.	.	H	α-helix	trans	-63	-42.3	-179.4	0	0	0	0	0	113	F681 F685 I773 I774 T779 I780 A781	F681-A777 HydrophobicContact CE1-CB 4.38Å; F681-A777 HydrophobicContact CZ-CB 4.11Å; F685-A777 HydrophobicContact CD2-CB 3.5Å; F685-A777 HydrophobicContact CE1-CB 4.4Å; F685-A777 HydrophobicContact CE2-CB 3.34Å; F685-A777 HydrophobicContact CG-CB 4.12Å; F685-A777 HydrophobicContact CZ-CB 3.81Å; I773-A777 VanDerWaalsContact O-CB 3.3Å; I773-A777 WeakPolarHBondContact O-CB 3.42Å; I773-A777 PolarHBondContact O-N 3.48Å; I774-A777 PolarHBondContact O-N 3.09Å; A777-T779 VanDerWaalsContact C-N 3.28Å; A777-T779 PolarHBondContact O-N 3.04Å; A777-I780 PolarHBondContact O-N 2.87Å; A777-A781 VanDerWaalsContact O-CB 3.26Å; A777-A781 WeakPolarHBondContact O-CB 3.47Å; A777-A781 PolarHBondContact O-N 3.44Å
778	L	90.8	Very high	87.1	Confident	47 Å²	47	63 Å²	63	25%	0.246	32%	0.324	C	S	.	.	H	α-helix	trans	-66.5	-28.5	174.9	-73.9	173.9	0	0	0	112.8	I735 L739 I774 E776 K782	I735-L778 HydrophobicContact CG2-CD2 4.11Å; L739-L778 HydrophobicContact CD1-CD1 3.93Å; L739-L778 HydrophobicContact CD1-CD2 3.87Å; L739-L778 HydrophobicContact CD1-CG 4.05Å; I774-L778 HydrophobicContact CG2-CD1 3.86Å; I774-L778 HydrophobicContact CG2-CG 4.41Å; I774-L778 WeakPolarHBondContact O-CB 3.21Å; I774-L778 VanDerWaalsContact O-CG 3.31Å; I774-L778 WeakPolarHBondContact O-CG 3.18Å; I774-L778 PolarHBondContact O-N 2.99Å; E776-L778 PolarHBondContact O-N 3.31Å; L778-K782 WeakPolarHBondContact O-CD 3.41Å; L778-K782 VanDerWaalsContact O-CG 3.3Å; L778-K782 WeakPolarHBondContact O-CG 3.49Å; L778-K782 PolarHBondContact O-N 2.79Å
779	T	88.7	Confident	85.9	Confident	69 Å²	69	63.6 Å²	63.6	42%	0.423	32%	0.324	S	S	.	.	H	α-helix	trans	-73.3	-49.2	174.9	-58	0	0	0	0	110.7	S775 E776 A777 A781 K782 Q783	S775-T779 WeakPolarHBondContact O-CB 3.2Å; S775-T779 PolarHBondContact O-N 2.85Å; S775-T779 PolarHBondContact O-OG1 3.29Å; E776-T779 WeakPolarHBondContact O-CB 3.33Å; E776-T779 PolarHBondContact O-N 3.26Å; E776-T779 VanDerWaalsContact O-N 3.13Å; A777-T779 VanDerWaalsContact C-N 3.28Å; A777-T779 PolarHBondContact O-N 3.04Å; T779-A781 VanDerWaalsContact C-N 3.32Å; T779-A781 PolarHBondContact O-N 3.34Å; T779-K782 PolarHBondContact O-N 3.25Å; T779-Q783 WeakPolarHBondContact O-CG 3.47Å; T779-Q783 PolarHBondContact O-N 3.01Å
780	I	86.1	Confident	84.9	Confident	29 Å²	29	58.2 Å²	58.2	15%	0.149	31%	0.308	C	S	.	.	H	α-helix	trans	-61.4	-41.4	177.9	-64.9	167.9	0	0	0	110.7	F681 E776 A777 K782 Q783 I784	F681-I780 HydrophobicContact CE2-CB 4.26Å; F681-I780 HydrophobicContact CE2-CG2 3.71Å; F681-I780 HydrophobicContact CZ-CB 4.43Å; F681-I780 HydrophobicContact CZ-CG2 4.33Å; E776-I780 HydrophobicContact CG-CD1 3.86Å; E776-I780 WeakPolarHBondContact O-CG1 3.3Å; E776-I780 PolarHBondContact O-N 2.9Å; A777-I780 PolarHBondContact O-N 2.87Å; I780-K782 VanDerWaalsContact C-N 3.29Å; I780-K782 PolarHBondContact O-N 3.36Å; I780-Q783 WeakPolarHBondContact O-CB 3.37Å; I780-Q783 PolarHBondContact O-N 2.91Å; I780-I784 HydrophobicContact CG2-CD1 3.42Å; I780-I784 VanDerWaalsContact CG2-CD1 3.42Å; I780-I784 HydrophobicContact CG2-CG1 4.02Å; I780-I784 WeakPolarHBondContact O-CB 3.48Å; I780-I784 WeakPolarHBondContact O-CG1 3.29Å; I780-I784 PolarHBondContact O-N 2.57Å
781	A	85.1	Confident	84.1	Confident	18 Å²	18	58.7 Å²	58.7	15%	0.149	31%	0.313	C	S	.	.	H	α-helix	trans	-62.4	-33.7	178.6	0	0	0	0	0	113.9	F681 I735 A777 T779 Q783 N785 F786	F681-A781 HydrophobicContact CE1-CB 4.44Å; F681-A781 HydrophobicContact CZ-CB 4.42Å; I735-A781 HydrophobicContact CD1-CB 3.3Å; A777-A781 VanDerWaalsContact O-CB 3.26Å; A777-A781 WeakPolarHBondContact O-CB 3.47Å; A777-A781 PolarHBondContact O-N 3.44Å; T779-A781 VanDerWaalsContact C-N 3.32Å; T779-A781 PolarHBondContact O-N 3.34Å; A781-Q783 VanDerWaalsContact C-N 3.29Å; A781-N785 PolarHBondContact O-N 3.24Å; A781-F786 HydrophobicContact CB-CE2 4.22Å
782	K	83.6	Confident	83.4	Confident	168 Å²	168	55.6 Å²	55.6	73%	0.73	30%	0.301	S	S	*	.	H	α-helix	trans	-73	-18.6	173.1	-71.6	172.5	-178.2	-178	0	113.4	L778 T779 I780	L778-K782 WeakPolarHBondContact O-CD 3.41Å; L778-K782 VanDerWaalsContact O-CG 3.3Å; L778-K782 WeakPolarHBondContact O-CG 3.49Å; L778-K782 PolarHBondContact O-N 2.79Å; T779-K782 PolarHBondContact O-N 3.25Å; I780-K782 VanDerWaalsContact C-N 3.29Å; I780-K782 PolarHBondContact O-N 3.36Å
783	Q	81.8	Confident	82.6	Confident	108 Å²	108	53.8 Å²	53.8	51%	0.505	29%	0.287	S	S	.	.	H	α-helix	trans	-89.2	-32.6	175.7	-67.7	168.4	-31.6	0	0	111.8	T779 I780 A781	T779-Q783 WeakPolarHBondContact O-CG 3.47Å; T779-Q783 PolarHBondContact O-N 3.01Å; I780-Q783 WeakPolarHBondContact O-CB 3.37Å; I780-Q783 PolarHBondContact O-N 2.91Å; A781-Q783 VanDerWaalsContact C-N 3.29Å
784	I	74.5	Confident	81.4	Confident	1 Å²	1	56.8 Å²	56.8	1%	0.005	30%	0.302	C	S	.	.	H	α-helix	trans	-86.8	-10.4	-172.3	-69.1	-172.4	0	0	0	113.8	I780 F786 L793 P870 E873 L874	I780-I784 HydrophobicContact CG2-CD1 3.42Å; I780-I784 VanDerWaalsContact CG2-CD1 3.42Å; I780-I784 HydrophobicContact CG2-CG1 4.02Å; I780-I784 WeakPolarHBondContact O-CB 3.48Å; I780-I784 WeakPolarHBondContact O-CG1 3.29Å; I780-I784 PolarHBondContact O-N 2.57Å; I784-F786 HydrophobicContact CB-CE2 4.2Å; I784-F786 HydrophobicContact CB-CZ 4.24Å; I784-F786 HydrophobicContact CG2-CD1 4.18Å; I784-F786 HydrophobicContact CG2-CD2 4.35Å; I784-F786 HydrophobicContact CG2-CE1 3.65Å; I784-F786 HydrophobicContact CG2-CE2 3.86Å; I784-F786 HydrophobicContact CG2-CZ 3.47Å; I784-F786 VanDerWaalsContact CG2-CZ 3.47Å; I784-F786 PolarHBondContact O-N 3.37Å; I784-L793 HydrophobicContact CG2-CD2 3.31Å; I784-P870 HydrophobicContact CG1-CB 4.4Å; I784-P870 HydrophobicContact CG2-CB 4.26Å; I784-E873 HydrophobicContact CD1-CB 4.32Å; I784-L874 HydrophobicContact CD1-CD2 3.86Å; I784-L874 HydrophobicContact CD1-CG 4.04Å
785	N	75.8	Confident	79.6	Confident	68 Å²	68	62.8 Å²	62.8	36%	0.364	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.2	56.2	170.6	-76.1	-15.8	0	0	0	114.2	A781 C787 L794 N796	A781-N785 PolarHBondContact O-N 3.24Å; N785-C787 PolarHBondContact O-N 3.08Å; N785-L794 HydrophobicContact CB-CB 4.46Å; N785-L794 WeakPolarHBondContact O-CB 3.41Å; N785-L794 PolarHBondContact O-N 2.84Å; N785-L794 VanDerWaalsContact O-N 3.14Å; N785-N796 PolarHBondContact ND2-OD1 2.81Å
786	F	81.7	Confident	77.6	Confident	27 Å²	27	63.5 Å²	63.5	12%	0.118	33%	0.328	C	S	.	.	B	Isolated β-bridge	trans	-63.7	130.7	170.6	-56.2	-75.8	0	0	0	110.8	P677 L678 F681 I735 A781 I784 P788 L792 L793	P677-F786 HydrophobicContact CB-CE1 4.19Å; L678-F786 HydrophobicContact CB-CD1 3.89Å; L678-F786 HydrophobicContact CB-CE1 4.24Å; L678-F786 HydrophobicContact CB-CG 4.33Å; L678-F786 HydrophobicContact CD1-CB 4.43Å; L678-F786 HydrophobicContact CD1-CD1 4.26Å; L678-F786 HydrophobicContact CD1-CD2 4.01Å; L678-F786 HydrophobicContact CD1-CE2 4.27Å; L678-F786 HydrophobicContact CD1-CG 4Å; F681-F786 HydrophobicContact CB-CE1 4.39Å; F681-F786 HydrophobicContact CB-CZ 3.76Å; F681-F786 HydrophobicContact CD1-CE2 4.32Å; F681-F786 HydrophobicContact CD1-CZ 4.32Å; F681-F786 HydrophobicContact CD2-CE2 4.46Å; F681-F786 HydrophobicContact CD2-CZ 4.01Å; F681-F786 HydrophobicContact CG-CE2 4.18Å; F681-F786 AromaticContact CG-CZ 3.76Å; F681-F786 HydrophobicContact CG-CZ 3.76Å; I735-F786 HydrophobicContact CD1-CE2 4.44Å; A781-F786 HydrophobicContact CB-CE2 4.22Å; I784-F786 HydrophobicContact CB-CE2 4.2Å; I784-F786 HydrophobicContact CB-CZ 4.24Å; I784-F786 HydrophobicContact CG2-CD1 4.18Å; I784-F786 HydrophobicContact CG2-CD2 4.35Å; I784-F786 HydrophobicContact CG2-CE1 3.65Å; I784-F786 HydrophobicContact CG2-CE2 3.86Å; I784-F786 HydrophobicContact CG2-CZ 3.47Å; I784-F786 VanDerWaalsContact CG2-CZ 3.47Å; I784-F786 PolarHBondContact O-N 3.37Å; F786-P788 WeakPolarHBondContact O-CD 3.21Å; F786-L792 CarbonylContact C-O 3.33Å; F786-L792 WeakPolarHBondContact CA-O 3.42Å; F786-L793 HydrophobicContact CD1-CD2 4.3Å; F786-L793 HydrophobicContact CE1-CD2 4.22Å
787	C	77.8	Confident	74.8	Confident	24 Å²	24	63.6 Å²	63.6	16%	0.162	34%	0.335	C	S	.	.			trans	-67.3	122.6	172.7	175.7	0	0	0	0	110.6	N785 K789 T790 G791 L792 L794	N785-C787 PolarHBondContact O-N 3.08Å; C787-K789 PolarHBondContact O-N 2.96Å; C787-T790 VanDerWaalsContact CB-OG1 3.32Å; C787-T790 WeakPolarHBondContact CB-OG1 3.44Å; C787-T790 PolarHBondContact O-N 2.89Å; C787-T790 PolarHBondContact SG-OG1 3.36Å; C787-G791 WeakPolarHBondContact O-CA 3.25Å; C787-G791 PolarHBondContact O-N 2.92Å; C787-L792 PolarHBondContact N-O 3.32Å; C787-L794 HydrophobicContact CB-CD1 4.38Å; C787-L794 HydrophobicContact CB-CD2 3.93Å; C787-L794 HydrophobicContact CB-CG 3.99Å
788	P	70.6	Confident	72.1	Confident	88 Å²	88	71.3 Å²	71.3	57%	0.571	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-26.8	-177.9	-25.4	35.2	0	0	0	114.7	F786	F786-P788 WeakPolarHBondContact O-CD 3.21Å
789	K	70.1	Confident	69.2	Low	110 Å²	110	74 Å²	74	48%	0.478	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.1	-47.1	177.2	-76.3	-175.1	173.6	-178.7	0	112.5	C787 D1018 R1025	C787-K789 PolarHBondContact O-N 2.96Å; K789-D1018 IonicContact NZ-OD1 3.89Å; K789-D1018 PolarHBondContact NZ-OD1 3.14Å; K789-D1018 IonicContact NZ-OD2 3.57Å; K789-D1018 PolarHBondContact NZ-OD2 3.18Å; K789-R1025 PolarHBondContact O-NE 2.92Å; K789-R1025 PolarHBondContact O-NH2 3.2Å
790	T	74.1	Confident	66.4	Low	32 Å²	32	78.6 Å²	78.6	20%	0.196	40%	0.403	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.9	-20.9	-170.4	58.6	0	0	0	0	114.9	C787 L792 C1021	C787-T790 VanDerWaalsContact CB-OG1 3.32Å; C787-T790 WeakPolarHBondContact CB-OG1 3.44Å; C787-T790 PolarHBondContact O-N 2.89Å; C787-T790 PolarHBondContact SG-OG1 3.36Å; T790-L792 HydrophobicContact CG2-CD1 4.41Å; T790-L792 PolarHBondContact O-N 3.21Å; T790-L792 WeakPolarHBondContact OG1-CB 3.48Å; T790-L792 PolarHBondContact OG1-N 3.29Å; T790-C1021 HydrophobicContact CG2-CB 4.46Å; T790-C1021 VanDerWaalsContact CG2-SG 3.59Å
791	G	77	Confident	63.8	Low	11 Å²	11	82.7 Å²	82.7	11%	0.113	43%	0.43	C	S	.	.			trans	69.6	7.7	-169	0	0	0	0	0	114.4	P677 L678 C787	P677-G791 WeakPolarHBondContact CG-O 3.25Å; L678-G791 VanDerWaalsContact CB-O 3.24Å; L678-G791 WeakPolarHBondContact CB-O 3.3Å; L678-G791 PolarHBondContact N-O 3.39Å; L678-G791 VanDerWaalsContact N-O 3.17Å; C787-G791 WeakPolarHBondContact O-CA 3.25Å; C787-G791 PolarHBondContact O-N 2.92Å
792	L	81.4	Confident	61.1	Low	42 Å²	42	89 Å²	89	22%	0.22	46%	0.456	C	S	.	.	P	Polyproline II helix	trans	-81.1	162.1	175.3	-62.3	173.5	0	0	0	111.4	K674 I675 F786 C787 T790	K674-L792 WeakPolarHBondContact O-CD2 3.36Å; I675-L792 WeakPolarHBondContact O-CD2 3.32Å; F786-L792 CarbonylContact C-O 3.33Å; F786-L792 WeakPolarHBondContact CA-O 3.42Å; C787-L792 PolarHBondContact N-O 3.32Å; T790-L792 HydrophobicContact CG2-CD1 4.41Å; T790-L792 PolarHBondContact O-N 3.21Å; T790-L792 WeakPolarHBondContact OG1-CB 3.48Å; T790-L792 PolarHBondContact OG1-N 3.29Å
793	L	75.7	Confident	58.7	Low	46 Å²	46	86.8 Å²	86.8	24%	0.241	46%	0.457	C	S	.	.	B	Isolated β-bridge	trans	-70.8	130.9	168.8	-62.8	173.8	0	0	0	109.8	P677 I784 F786 P870 L871 L874	P677-L793 HydrophobicContact CB-CD2 4.3Å; P677-L793 HydrophobicContact CB-CG 4.06Å; P677-L793 HydrophobicContact CG-CD2 4.49Å; P677-L793 HydrophobicContact CG-CG 3.9Å; I784-L793 HydrophobicContact CG2-CD2 3.31Å; F786-L793 HydrophobicContact CD1-CD2 4.3Å; F786-L793 HydrophobicContact CE1-CD2 4.22Å; L793-P870 HydrophobicContact CD1-CB 4.3Å; L793-P870 HydrophobicContact CD2-CB 4.12Å; L793-L871 HydrophobicContact CD1-CG 4.47Å; L793-L874 HydrophobicContact CD1-CD1 4.42Å; L793-L874 HydrophobicContact CD2-CD1 4.4Å
794	L	68.6	Low	56.2	Low	90 Å²	90	88.5 Å²	88.5	47%	0.471	47%	0.47	S	S	.	.	P	Polyproline II helix	trans	-80	132.1	164	-65.8	169	0	0	0	108.9	N785 C787 N796	N785-L794 HydrophobicContact CB-CB 4.46Å; N785-L794 WeakPolarHBondContact O-CB 3.41Å; N785-L794 PolarHBondContact O-N 2.84Å; N785-L794 VanDerWaalsContact O-N 3.14Å; C787-L794 HydrophobicContact CB-CD1 4.38Å; C787-L794 HydrophobicContact CB-CD2 3.93Å; C787-L794 HydrophobicContact CB-CG 3.99Å; L794-N796 PolarHBondContact O-N 2.7Å
795	E	56.9	Low	54.1	Low	154 Å²	154	96.8 Å²	96.8	72%	0.72	51%	0.508	S	S	*	.	P	Polyproline II helix	trans	-71.3	121.2	171.2	-68.4	-160.9	136.1	0	0	109.6	V797	E795-V797 VanDerWaalsContact C-N 3.32Å; E795-V797 PolarHBondContact O-N 2.87Å
796	N	48.6	Very low	52	Low	87 Å²	87	102 Å²	102	47%	0.465	53%	0.53	S	S	.	.			trans	-71.9	87.9	174.4	-75	-26.8	0	0	0	109.3	N785 L794 Q798	N785-N796 PolarHBondContact ND2-OD1 2.81Å; L794-N796 PolarHBondContact O-N 2.7Å; N796-Q798 PolarHBondContact O-N 3.29Å
797	V	34	Very low	49.4	Very low	110 Å²	110	106.7 Å²	106.7	67%	0.667	57%	0.567	S	S	*	*			trans	-67.4	81.8	174.2	-175.9	0	0	0	0	109.7	E795 T799	E795-V797 VanDerWaalsContact C-N 3.32Å; E795-V797 PolarHBondContact O-N 2.87Å; V797-T799 HydrophobicContact CG1-CG2 3.81Å; V797-T799 PolarHBondContact O-N 3.19Å; V797-T799 VanDerWaalsContact O-N 3.11Å
798	Q	31.5	Very low	47.1	Very low	169 Å²	169	110.8 Å²	110.8	79%	0.79	60%	0.596	S	S	*	*			trans	-84.3	59.9	171.1	-69.1	-167.4	-9.1	0	0	110.8	N796 K800	N796-Q798 PolarHBondContact O-N 3.29Å; Q798-K800 VanDerWaalsContact C-N 3.3Å; Q798-K800 PolarHBondContact O-N 3.2Å
799	T	29.6	Very low	45.2	Very low	103 Å²	103	114.3 Å²	114.3	63%	0.632	60%	0.604	S	S	*	*			trans	-68.2	91	162.8	43.2	0	0	0	0	108.9	V797 T801	V797-T799 HydrophobicContact CG1-CG2 3.81Å; V797-T799 PolarHBondContact O-N 3.19Å; V797-T799 VanDerWaalsContact O-N 3.11Å; T799-T801 PolarHBondContact O-N 3.29Å
800	K	29.5	Very low	43.3	Very low	165 Å²	165	115.8 Å²	115.8	72%	0.717	61%	0.613	S	S	*	*			trans	-69.1	80	165	-81.8	-175.9	146.2	-129.3	0	110	Q798 E802	Q798-K800 VanDerWaalsContact C-N 3.3Å; Q798-K800 PolarHBondContact O-N 3.2Å; K800-E802 VanDerWaalsContact C-N 3.3Å; K800-E802 IonicContact NZ-OE1 2.75Å; K800-E802 PolarHBondContact NZ-OE1 3.13Å; K800-E802 PolarHBondContact O-N 3.35Å; K800-E802 VanDerWaalsContact O-N 3.15Å
801	T	31.7	Very low	41.2	Very low	115 Å²	115	119.4 Å²	119.4	71%	0.706	63%	0.631	S	S	*	*			trans	-78.6	85	161	47.2	0	0	0	0	108.5	T799 T803	T799-T801 PolarHBondContact O-N 3.29Å; T801-T803 PolarHBondContact O-N 2.89Å
802	E	29.7	Very low	38.9	Very low	151 Å²	151	125.1 Å²	125.1	71%	0.706	66%	0.659	S	S	*	*			trans	-77.6	91	169.6	-71.7	175.1	-169.5	0	0	108.9	K800	K800-E802 VanDerWaalsContact C-N 3.3Å; K800-E802 IonicContact NZ-OE1 2.75Å; K800-E802 PolarHBondContact NZ-OE1 3.13Å; K800-E802 PolarHBondContact O-N 3.35Å; K800-E802 VanDerWaalsContact O-N 3.15Å
803	T	32.5	Very low	36.5	Very low	121 Å²	121	129.7 Å²	129.7	74%	0.742	68%	0.682	S	S	*	*			trans	-134	128.3	169	46.4	0	0	0	0	110	T801	T801-T803 PolarHBondContact O-N 2.89Å
804	N	28.7	Very low	34.2	Very low	145 Å²	145	134.6 Å²	134.6	78%	0.775	70%	0.704	S	S	*	*			trans	-66.6	143.6	168.1	-68	-49.4	0	0	0	109.9
805	E	30.1	Very low	32.2	Very low	175 Å²	175	136.6 Å²	136.6	82%	0.818	72%	0.715	S	S	*	*				177	109.7	120.8	-93.2	153.8	-152.7	0	0	106.9
806	Q	32.6	Very low	30.8	Very low	176 Å²	176	134.3 Å²	134.3	82%	0.822	72%	0.716	S	S	*	*				67.3	120.6	83.5	-71.4	-168.5	11.1	0	0	112.9	S808	Q806-S808 PolarHBondContact O-N 2.88Å
807	S	27.6	Very low	29.7	Very low	127 Å²	127	135 Å²	135	89%	0.888	73%	0.728	S	S	*	*			trans	-70.4	105.9	170.8	51.8	0	0	0	0	110.3
808	S	28.1	Very low	29.5	Very low	110 Å²	110	138.3 Å²	138.3	77%	0.769	73%	0.733	S	S	*	*			trans	-84.6	140.7	156.8	50.4	0	0	0	0	109.9	Q806	Q806-S808 PolarHBondContact O-N 2.88Å
809	H	31.5	Very low	29.2	Very low	162 Å²	162	135.9 Å²	135.9	75%	0.75	73%	0.73	S	S	*	*			trans	-70.7	144.7	158.2	-113	-121.1	0	0	0	108.6
810	Q	30.6	Very low	29.1	Very low	140 Å²	140	137.7 Å²	137.7	65%	0.654	74%	0.736	S	S	*	*			trans	73.1	132.6	143.5	-79.8	175.5	-105.9	0	0	121.2
811	D	29.3	Very low	28.9	Very low	109 Å²	109	137.5 Å²	137.5	58%	0.583	74%	0.737	S	S	*	*				76.7	104.8	128.3	-58.6	-7.9	0	0	0	120.7
812	N	29.4	Very low	28.7	Very low	130 Å²	130	138.3 Å²	138.3	70%	0.695	74%	0.737	S	S	*	*				85.8	135.2	120.2	-70.7	-27.7	0	0	0	120.8
813	I	29.7	Very low	28.6	Very low	138 Å²	138	137 Å²	137	71%	0.708	74%	0.744	S	S	*	*			trans	62.5	129.9	132.3	-63.6	170.8	0	0	0	116.9
814	E	27.2	Very low	28.3	Very low	150 Å²	150	137 Å²	137	70%	0.701	74%	0.743	S	S	*	*			cis	-173.7	-178.7	-8.7	-116.8	-174	-174.1	0	0	106.8
815	N	26.8	Very low	28.2	Very low	131 Å²	131	138 Å²	138	70%	0.701	74%	0.743	S	S	*	*			trans	21.6	115.8	141.6	-58.8	-43.6	0	0	0	120
816	S	28.3	Very low	27.9	Very low	107 Å²	107	133.9 Å²	133.9	75%	0.748	73%	0.734	S	S	*	*				175.9	135.4	96.1	-172.4	0	0	0	0	113.4
817	S	26.4	Very low	27.5	Very low	101 Å²	101	131.2 Å²	131.2	71%	0.706	73%	0.729	S	S	*	*			trans	-65.3	149	160.5	48.2	0	0	0	0	113.1
818	K	29.3	Very low	27.3	Very low	179 Å²	179	131.3 Å²	131.3	78%	0.778	72%	0.72	S	S	*	*			trans	173.2	108.8	143.2	-95.9	153.8	-171.7	172.4	0	109.5
819	T	25.2	Very low	27.1	Very low	119 Å²	119	131.7 Å²	131.7	73%	0.73	72%	0.717	S	S	*	*				76	151.2	88.9	59.1	0	0	0	0	115
820	N	27	Very low	26.9	Very low	140 Å²	140	128.9 Å²	128.9	75%	0.749	72%	0.716	S	S	*	*			trans	77.4	112.1	-178.5	-52.2	6.1	0	0	0	112.4
821	E	25.4	Very low	26.6	Very low	161 Å²	161	128.4 Å²	128.4	75%	0.752	72%	0.718	S	S	*	*				80.3	144.1	56.7	-74.5	-165.3	-173.9	0	0	114.6
822	N	27.1	Very low	26.4	Very low	132 Å²	132	128.1 Å²	128.1	71%	0.706	72%	0.72	S	S	*	*			trans	59.6	91.3	156.4	-55.7	-35.3	0	0	0	118.2
823	C	28.1	Very low	26.2	Very low	124 Å²	124	126 Å²	126	84%	0.838	71%	0.709	S	S	*	*				-143.2	87.3	125.8	-161.4	0	0	0	0	111.5	Q825	C823-Q825 PolarHBondContact O-N 2.86Å
824	V	26.2	Very low	25.9	Very low	121 Å²	121	124.6 Å²	124.6	73%	0.733	70%	0.696	S	S	*	*			trans	-79.5	109.2	164.1	175	0	0	0	0	108.5
825	Q	26.4	Very low	25.8	Very low	165 Å²	165	121.1 Å²	121.1	77%	0.771	68%	0.682	S	S	*	*			trans	-169.9	115	148.3	-97.3	135	69.8	0	0	106.8	C823	C823-Q825 PolarHBondContact O-N 2.86Å
826	S	24.5	Very low	25.7	Very low	89 Å²	89	125 Å²	125	62%	0.622	69%	0.688	S	S	*	*				67.5	157.9	57.7	89.2	0	0	0	0	112.9
827	V	23.8	Very low	25.5	Very low	120 Å²	120	124.7 Å²	124.7	73%	0.727	69%	0.686	S	S	*	*			trans	69	124.8	168	166	0	0	0	0	113.2
828	N	23.8	Very low	25.5	Very low	129 Å²	129	128.9 Å²	128.9	69%	0.69	69%	0.692	S	S	*	*			cis	-162.8	-179.4	0.4	-120.9	-8.9	0	0	0	110.8
829	T	23.9	Very low	25.4	Very low	118 Å²	118	127.7 Å²	127.7	72%	0.724	69%	0.694	S	S	*	*			trans	34.4	125	148.6	58.4	0	0	0	0	119
830	S	26.2	Very low	25.8	Very low	103 Å²	103	127.1 Å²	127.1	72%	0.72	69%	0.692	S	S	*	*				-175.3	144.9	63.6	38.3	0	0	0	0	109.9
831	N	24.1	Very low	25.6	Very low	130 Å²	130	125.8 Å²	125.8	70%	0.695	69%	0.689	S	S	*	*				33.1	114.4	91.2	-81.7	-35.9	0	0	0	112.7
832	T	25.4	Very low	25.6	Very low	103 Å²	103	125.2 Å²	125.2	63%	0.632	69%	0.691	S	S	*	*				-152	152.3	51.8	43.3	0	0	0	0	110.4	Y834	T832-Y834 HydrophobicContact CG2-CE2 4.02Å
833	N	26	Very low	25.5	Very low	85 Å²	85	124 Å²	124	46%	0.455	69%	0.693	S	S	.	*			cis	76.4	140.9	35.9	-139.5	-23.6	0	0	0	113	Q169	Q169-N833 PolarHBondContact NE2-OD1 3.25Å
834	Y	23.5	Very low	25.3	Very low	110 Å²	110	123.5 Å²	123.5	43%	0.431	69%	0.691	S	S	.	*			trans	105.4	139.6	166.2	-48.7	-22	0	0	0	119.9	Q169 P170 T832	Q169-Y834 VanDerWaalsContact CA-CE1 3.48Å; Q169-Y834 HydrophobicContact CB-CD1 3.95Å; Q169-Y834 HydrophobicContact CB-CE1 3.38Å; Q169-Y834 HydrophobicContact CG-CD1 4.16Å; Q169-Y834 HydrophobicContact CG-CE1 3.74Å; P170-Y834 HydrophobicContact CB-CD1 4.5Å; T832-Y834 HydrophobicContact CG2-CE2 4.02Å
835	N	23.8	Very low	25.3	Very low	77 Å²	77	122.9 Å²	122.9	41%	0.412	69%	0.688	S	S	.	*			cis	-161.2	165.2	-34.7	-134.6	-0.6	0	0	0	114.5	Q169 P170	Q169-N835 VanDerWaalsContact CD-ND2 3.28Å; Q169-N835 PolarHBondContact NE2-ND2 3.39Å; Q169-N835 PolarHBondContact NE2-OD1 3.08Å; Q169-N835 PolarHBondContact OE1-ND2 2.86Å; Q169-N835 PolarHBondContact OE1-OD1 3.34Å; P170-N835 WeakPolarHBondContact CB-ND2 3.47Å
836	Y	26.3	Very low	25.2	Very low	211 Å²	211	122.1 Å²	122.1	83%	0.827	69%	0.688	S	S	*	*			trans	-52.2	140.3	164.3	-104.3	-106.9	0	0	0	115.2
837	S	23.5	Very low	25.2	Very low	102 Å²	102	124.3 Å²	124.3	71%	0.713	69%	0.692	S	S	*	*			trans	-174.4	146.1	135.7	-88.4	0	0	0	0	109.6
838	K	25.2	Very low	25.2	Very low	188 Å²	188	126.2 Å²	126.2	82%	0.817	69%	0.693	S	S	*	*			cis	177.6	149.2	-12	-114	175.4	-174.7	-179.6	0	104.2
839	N	27.9	Very low	25.2	Very low	154 Å²	154	126.6 Å²	126.6	82%	0.824	69%	0.694	S	S	*	*			trans	-47.7	164.7	161	-66	0.7	0	0	0	111.6
840	P	33.4	Very low	25.2	Very low	107 Å²	107	125.4 Å²	125.4	70%	0.695	69%	0.691	S	S	*	*			cis	-156.9	173	37.9	42.4	-19.4	0	0	0	121.2
841	T	24	Very low	25.1	Very low	112 Å²	112	126.1 Å²	126.1	69%	0.687	69%	0.691	S	S	*	*			trans	64	140.6	139	48.7	0	0	0	0	124.7
842	N	24.1	Very low	25.1	Very low	149 Å²	149	125.6 Å²	125.6	80%	0.797	69%	0.692	S	S	*	*			trans	88.9	141.8	138.8	-70.3	-3.3	0	0	0	122
843	S	25.6	Very low	25.1	Very low	107 Å²	107	132.4 Å²	132.4	75%	0.748	71%	0.706	S	S	*	*			trans	62.8	107.5	167	-142.9	0	0	0	0	116.1
844	S	24.2	Very low	25.3	Very low	113 Å²	113	137.9 Å²	137.9	79%	0.79	73%	0.726	S	S	*	*				76.5	160	55.2	-162.7	0	0	0	0	114
845	V	25.1	Very low	25.7	Very low	109 Å²	109	138.1 Å²	138.1	66%	0.661	74%	0.741	S	S	*	*			trans	75.9	84.9	176.6	-166.6	0	0	0	0	116.2
846	L	24.1	Very low	25.7	Very low	149 Å²	149	140 Å²	140	78%	0.78	76%	0.761	S	S	*	*				52.6	154	112.2	-72.9	165.2	0	0	0	122.3
847	L	25.1	Very low	25.8	Very low	135 Å²	135	137 Å²	137	71%	0.707	75%	0.752	S	S	*	*			trans	70	143.1	157.4	-63.2	144.9	0	0	0	116.8
848	H	24.7	Very low	25.8	Very low	160 Å²	160	137.9 Å²	137.9	74%	0.741	76%	0.756	S	S	*	*			cis	-165.6	173.4	-24.3	-130.2	-159.5	0	0	0	109.5
849	L	23.7	Very low	25.9	Very low	136 Å²	136	133.9 Å²	133.9	71%	0.712	75%	0.752	S	S	*	*			trans	59.2	101.3	153.5	-100.1	70.7	0	0	0	122
850	S	23.2	Very low	26	Very low	94 Å²	94	135 Å²	135	66%	0.657	76%	0.757	S	S	*	*				80.1	152.7	109.9	74.6	0	0	0	0	124.8
851	T	23.8	Very low	25.7	Very low	118 Å²	118	135.6 Å²	135.6	72%	0.724	76%	0.759	S	S	*	*			trans	73.7	94.9	154.3	42.1	0	0	0	0	122.4
852	T	24.3	Very low	26	Very low	119 Å²	119	137.1 Å²	137.1	73%	0.73	77%	0.769	S	S	*	*				48.5	113.5	127.2	60.2	0	0	0	0	121.2
853	R	25	Very low	26.1	Very low	246 Å²	246	137.7 Å²	137.7	93%	0.928	77%	0.771	S	S	*	*				178.8	151	120.2	-98.3	162.5	-172	-142.5	2	113.1
854	K	31.1	Very low	26.3	Very low	199 Å²	199	141.7 Å²	141.7	87%	0.865	78%	0.778	S	S	*	*			trans	-67.5	159.5	156.7	-70.9	-178.6	177.5	-179.9	0	108.8
855	P	31.5	Very low	26.4	Very low	115 Å²	115	145.5 Å²	145.5	75%	0.747	78%	0.784	S	S	*	*			cis	-157	-156.4	40.2	45.2	-22.5	0	0	0	117.2
856	S	24.1	Very low	26.5	Very low	118 Å²	118	150.1 Å²	150.1	83%	0.825	79%	0.789	S	S	*	*			trans	92.6	148.4	149.2	67.9	0	0	0	0	121
857	K	29	Very low	26.7	Very low	148 Å²	148	149 Å²	149	64%	0.643	79%	0.789	S	S	*	*			trans	-105	155.2	178.6	-69.9	-178.1	172.2	-175.5	0	110.4	E213	E213-K857 IonicContact OE2-NZ 2.76Å; E213-K857 PolarHBondContact OE2-NZ 2.92Å
858	C	23.7	Very low	27.1	Very low	119 Å²	119	149.7 Å²	149.7	80%	0.804	79%	0.788	S	S	*	*			trans	-175.5	119.9	131	-90.9	0	0	0	0	105.8
859	S	27	Very low	28.1	Very low	105 Å²	105	144.7 Å²	144.7	73%	0.734	77%	0.771	S	S	*	*				72.7	107.1	58.8	76	0	0	0	0	113.9
860	L	29.3	Very low	29.3	Very low	177 Å²	177	139.6 Å²	139.6	93%	0.927	75%	0.746	S	S	*	*			trans	-143.9	139.9	158.1	-107.9	169.6	0	0	0	107.8
861	T	26.9	Very low	30.5	Very low	120 Å²	120	137 Å²	137	74%	0.736	73%	0.725	S	S	*	*			trans	-120.4	146.5	-172.8	47.9	0	0	0	0	110.6
862	T	31.2	Very low	32	Very low	144 Å²	144	136.9 Å²	136.9	88%	0.883	71%	0.714	S	S	*	*			trans	-142.4	143.3	158.9	24.5	0	0	0	0	108.9
863	D	25.9	Very low	33.4	Very low	160 Å²	160	134.4 Å²	134.4	86%	0.856	69%	0.694	S	S	*	*			trans	-74.8	138.3	-177.1	-69.3	-82.4	0	0	0	113
864	E	28.8	Very low	34.9	Very low	192 Å²	192	123.1 Å²	123.1	90%	0.897	65%	0.652	S	S	*	*			trans	-137.5	146.1	142.9	-78.6	-158.4	139.1	0	0	109.2	R866	E864-R866 PolarHBondContact O-N 3.42Å
865	Q	27	Very low	36	Very low	193 Å²	193	117 Å²	117	90%	0.902	63%	0.628	S	S	*	*			trans	-75.8	122.7	-160.7	-66.1	171.6	-10.1	0	0	112.4	V867	Q865-V867 PolarHBondContact O-N 2.83Å; Q865-V867 VanDerWaalsContact O-N 3.08Å
866	R	27.1	Very low	36.9	Very low	206 Å²	206	115 Å²	115	78%	0.777	61%	0.611	S	S	*	*			trans	-76.5	97.5	178.4	179.7	-176.3	-82	-177.8	-2.2	110.9	E864 H868	E864-R866 PolarHBondContact O-N 3.42Å; R866-H868 PolarHBondContact O-N 3.01Å
867	V	28.3	Very low	38	Very low	126 Å²	126	111 Å²	111	76%	0.764	58%	0.583	S	S	*	*			trans	-56.4	122	165.5	-176.8	0	0	0	0	109.9	Q865	Q865-V867 PolarHBondContact O-N 2.83Å; Q865-V867 VanDerWaalsContact O-N 3.08Å
868	H	32.8	Very low	38.7	Very low	148 Å²	148	108 Å²	108	69%	0.685	57%	0.574	S	S	*	*			trans	-83	125.8	173.1	-90	-117	0	0	0	109.7	R866	R866-H868 PolarHBondContact O-N 3.01Å
869	S	46.2	Very low	39.3	Very low	56 Å²	56	111 Å²	111	39%	0.392	57%	0.568	S	S	.	*			trans	-117.5	127.5	170.5	61.8	0	0	0	0	110.7	L871 K872	S869-L871 PolarHBondContact O-N 3.08Å; S869-K872 WeakPolarHBondContact O-CB 3.4Å; S869-K872 PolarHBondContact O-N 2.81Å
870	P	48.4	Very low	39.6	Very low	29 Å²	29	113.2 Å²	113.2	19%	0.188	57%	0.572	C	S	.	*	H	α-helix	trans	-57.6	-31.9	-178.7	-27.1	34.8	0	0	0	113.8	I784 L793 K872 E873 L874	I784-P870 HydrophobicContact CG1-CB 4.4Å; I784-P870 HydrophobicContact CG2-CB 4.26Å; L793-P870 HydrophobicContact CD1-CB 4.3Å; L793-P870 HydrophobicContact CD2-CB 4.12Å; P870-K872 PolarHBondContact O-N 2.99Å; P870-K872 VanDerWaalsContact O-N 3.09Å; P870-E873 PolarHBondContact O-N 2.98Å; P870-L874 PolarHBondContact O-N 3.22Å
871	L	49.2	Very low	39.6	Very low	40 Å²	40	107.8 Å²	107.8	21%	0.209	55%	0.549	C	S	.	.	H	α-helix	trans	-49.6	-33.3	171.5	-125.3	164.3	0	0	0	112.9	F673 K674 L793 S869 I875	F673-L871 HydrophobicContact CB-CD2 3.78Å; F673-L871 HydrophobicContact CG-CD2 4.39Å; K674-L871 HydrophobicContact CG-CD1 4.09Å; L793-L871 HydrophobicContact CD1-CG 4.47Å; S869-L871 PolarHBondContact O-N 3.08Å; L871-I875 HydrophobicContact CD2-CD1 3.69Å; L871-I875 HydrophobicContact CD2-CG1 4.38Å; L871-I875 WeakPolarHBondContact O-CB 3.46Å; L871-I875 WeakPolarHBondContact O-CD1 3.19Å; L871-I875 VanDerWaalsContact O-CG1 3.25Å; L871-I875 WeakPolarHBondContact O-CG1 3.4Å; L871-I875 PolarHBondContact O-N 3.47Å; L871-I875 VanDerWaalsContact O-N 3.14Å
872	K	55	Low	39.6	Very low	115 Å²	115	107.6 Å²	107.6	50%	0.5	55%	0.552	S	S	.	*	H	α-helix	trans	-76.8	-25.6	-178.9	-154.7	171.2	-166.3	164.6	0	113.1	S869 P870 N876	S869-K872 WeakPolarHBondContact O-CB 3.4Å; S869-K872 PolarHBondContact O-N 2.81Å; P870-K872 PolarHBondContact O-N 2.99Å; P870-K872 VanDerWaalsContact O-N 3.09Å; K872-N876 VanDerWaalsContact O-CB 3.26Å; K872-N876 WeakPolarHBondContact O-CB 3.22Å; K872-N876 PolarHBondContact O-N 2.67Å; K872-N876 PolarHBondContact O-ND2 3.28Å; K872-N876 VanDerWaalsContact O-ND2 3.08Å
873	E	54	Low	39.4	Very low	66 Å²	66	105.9 Å²	105.9	31%	0.308	54%	0.541	S	S	.	.	H	α-helix	trans	-77.9	-48.2	174.9	-67.9	-179.1	170.9	0	0	109.9	I784 P870 I875 N876 C877	I784-E873 HydrophobicContact CD1-CB 4.32Å; P870-E873 PolarHBondContact O-N 2.98Å; E873-I875 VanDerWaalsContact C-N 3.28Å; E873-I875 PolarHBondContact O-N 3.13Å; E873-N876 PolarHBondContact O-N 2.82Å; E873-C877 PolarHBondContact O-N 3.39Å; E873-C877 PolarHBondContact O-SG 3.1Å
874	L	56.6	Low	39.4	Very low	10 Å²	10	102.7 Å²	102.7	5%	0.052	53%	0.53	C	S	.	.	H	α-helix	trans	-49.4	-47.8	171.1	-66.1	172.8	0	0	0	112.1	F673 P677 F681 I784 L793 P870	F673-L874 HydrophobicContact CD1-CB 3.88Å; F673-L874 HydrophobicContact CD1-CD1 4.11Å; F673-L874 HydrophobicContact CE1-CB 3.71Å; F673-L874 HydrophobicContact CZ-CB 4.45Å; P677-L874 HydrophobicContact CB-CD1 4.12Å; F681-L874 HydrophobicContact CB-CD2 4.44Å; F681-L874 HydrophobicContact CD2-CD2 3.94Å; I784-L874 HydrophobicContact CD1-CD2 3.86Å; I784-L874 HydrophobicContact CD1-CG 4.04Å; L793-L874 HydrophobicContact CD1-CD1 4.42Å; L793-L874 HydrophobicContact CD2-CD1 4.4Å; P870-L874 PolarHBondContact O-N 3.22Å
875	I	54.5	Low	39.3	Very low	70 Å²	70	99 Å²	99	36%	0.359	53%	0.525	S	S	.	.	H	α-helix	trans	-70.2	-33.4	177.4	-69.8	168.1	0	0	0	113	F673 L871 E873	F673-I875 HydrophobicContact CD2-CD1 4.44Å; F673-I875 HydrophobicContact CD2-CG1 3.87Å; F673-I875 HydrophobicContact CE2-CG1 3.68Å; F673-I875 HydrophobicContact CZ-CG1 4.31Å; L871-I875 HydrophobicContact CD2-CD1 3.69Å; L871-I875 HydrophobicContact CD2-CG1 4.38Å; L871-I875 WeakPolarHBondContact O-CB 3.46Å; L871-I875 WeakPolarHBondContact O-CD1 3.19Å; L871-I875 VanDerWaalsContact O-CG1 3.25Å; L871-I875 WeakPolarHBondContact O-CG1 3.4Å; L871-I875 PolarHBondContact O-N 3.47Å; L871-I875 VanDerWaalsContact O-N 3.14Å; E873-I875 VanDerWaalsContact C-N 3.28Å; E873-I875 PolarHBondContact O-N 3.13Å
876	N	50.5	Low	39.4	Very low	73 Å²	73	93.7 Å²	93.7	39%	0.39	51%	0.509	S	S	.	.	H	α-helix	trans	-73	-38.9	178.6	-85.4	-30.4	0	0	0	111.9	K872 E873 D878 R879	K872-N876 VanDerWaalsContact O-CB 3.26Å; K872-N876 WeakPolarHBondContact O-CB 3.22Å; K872-N876 PolarHBondContact O-N 2.67Å; K872-N876 PolarHBondContact O-ND2 3.28Å; K872-N876 VanDerWaalsContact O-ND2 3.08Å; E873-N876 PolarHBondContact O-N 2.82Å; N876-D878 PolarHBondContact O-N 3.46Å; N876-R879 WeakPolarHBondContact O-CB 3.5Å; N876-R879 WeakPolarHBondContact O-CG 3.49Å; N876-R879 PolarHBondContact O-N 3.03Å
877	C	47.2	Very low	39.6	Very low	35 Å²	35	89.6 Å²	89.6	24%	0.236	50%	0.501	C	S	.	.	H	α-helix	trans	-58.7	-32.4	175.2	-67	0	0	0	0	112	R684 E873 R879	R684-C877 PolarHBondContact NH1-O 3.47Å; R684-C877 PolarHBondContact NH2-O 2.75Å; E873-C877 PolarHBondContact O-N 3.39Å; E873-C877 PolarHBondContact O-SG 3.1Å; C877-R879 PolarHBondContact O-N 3.03Å
878	D	42.9	Very low	39.7	Very low	84 Å²	84	94.6 Å²	94.6	45%	0.449	51%	0.506	S	S	.	.	G	3₁₀ helix	trans	-65	-19	179.9	-163.9	41.9	0	0	0	114.1	N876 N880 S881	N876-D878 PolarHBondContact O-N 3.46Å; D878-N880 PolarHBondContact O-N 3.17Å; D878-S881 PolarHBondContact O-N 3.3Å
879	R	36.5	Very low	39.6	Very low	182 Å²	182	91.7 Å²	91.7	69%	0.687	50%	0.503	S	S	*	.	G	3₁₀ helix	trans	-67.8	-11.1	-176.4	-63.5	179.9	172.8	-162.7	-2.4	115.1	N876 C877	N876-R879 WeakPolarHBondContact O-CB 3.5Å; N876-R879 WeakPolarHBondContact O-CG 3.49Å; N876-R879 PolarHBondContact O-N 3.03Å; C877-R879 PolarHBondContact O-N 3.03Å
880	N	33.3	Very low	38.8	Very low	151 Å²	151	99.4 Å²	99.4	81%	0.807	52%	0.523	S	S	*	.	G	3₁₀ helix	trans	-98.4	3.7	-174	-68.6	-10.2	0	0	0	114.1	D878	D878-N880 PolarHBondContact O-N 3.17Å
881	S	29.1	Very low	37.8	Very low	64 Å²	64	104.8 Å²	104.8	45%	0.448	55%	0.55	S	S	.	.	S	Bend	trans	-110	139.7	178.4	82.6	0	0	0	0	114.1	D878 V883	D878-S881 PolarHBondContact O-N 3.3Å; S881-V883 PolarHBondContact O-N 2.66Å
882	S	27	Very low	36.8	Very low	115 Å²	115	114.4 Å²	114.4	80%	0.804	58%	0.583	S	S	*	*			trans	20.2	79.3	159	51	0	0	0	0	120.6
883	V	26.8	Very low	35.5	Very low	108 Å²	108	114.1 Å²	114.1	66%	0.655	60%	0.596	S	S	*	*			trans	-135.4	121.5	151	-176.1	0	0	0	0	110.6	S881 S885	S881-V883 PolarHBondContact O-N 2.66Å; V883-S885 PolarHBondContact O-N 3.3Å
884	P	25.1	Very low	34.1	Very low	94 Å²	94	121 Å²	121	61%	0.61	63%	0.625	S	S	*	*			trans	-58.6	132.4	176.2	-26.8	35.9	0	0	0	113.3	S886	P884-S886 PolarHBondContact O-N 3.31Å
885	S	27.7	Very low	32.8	Very low	114 Å²	114	129.6 Å²	129.6	80%	0.797	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.6	-3.7	-173.2	49.1	0	0	0	0	115.5	V883 I887	V883-S885 PolarHBondContact O-N 3.3Å; S885-I887 VanDerWaalsContact C-N 3.32Å; S885-I887 PolarHBondContact O-N 3.14Å
886	S	30	Very low	31.5	Very low	82 Å²	82	131.5 Å²	131.5	57%	0.573	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.8	-8.2	-176.9	57.1	0	0	0	0	115.5	P884	P884-S886 PolarHBondContact O-N 3.31Å
887	I	31.1	Very low	30.5	Very low	119 Å²	119	133.8 Å²	133.8	61%	0.61	70%	0.703	S	S	*	*	S	Bend	trans	-105.3	-29.3	-172.3	-61.7	178.9	0	0	0	113.4	S885 S889	S885-I887 VanDerWaalsContact C-N 3.32Å; S885-I887 PolarHBondContact O-N 3.14Å; I887-S889 VanDerWaalsContact C-N 3.29Å; I887-S889 PolarHBondContact O-N 3.05Å
888	R	29.6	Very low	29.6	Very low	231 Å²	231	137.7 Å²	137.7	87%	0.872	73%	0.726	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.9	-12.8	-177.3	-88.2	-176.9	174	156.4	1.5	114.9
889	S	30	Very low	29	Very low	87 Å²	87	142.8 Å²	142.8	61%	0.608	74%	0.744	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.3	4.2	-168.7	52.1	0	0	0	0	116.4	I887	I887-S889 VanDerWaalsContact C-N 3.29Å; I887-S889 PolarHBondContact O-N 3.05Å
890	R	29.3	Very low	28.9	Very low	218 Å²	218	138.5 Å²	138.5	82%	0.823	74%	0.74	S	S	*	*	S	Bend	trans	-115	18.8	-173.3	-63.7	-167.9	-178.7	-155.5	-0.6	116.2
891	L	28.4	Very low	28.7	Very low	143 Å²	143	138.6 Å²	138.6	75%	0.749	74%	0.74	S	S	*	*	S	Bend	trans	-130.5	6.2	-174.2	-79	171.7	0	0	0	116.5
892	R	27.7	Very low	28.6	Very low	241 Å²	241	143.9 Å²	143.9	91%	0.909	76%	0.758	S	S	*	*	S	Bend	trans	-147.3	69.3	176.6	-69.6	-167.3	178.9	-160.2	-0.4	114.2
893	S	28.2	Very low	28.7	Very low	109 Å²	109	143.6 Å²	143.6	76%	0.762	76%	0.756	S	S	*	*			trans	-172.6	53.7	163.4	48.6	0	0	0	0	114.8
894	F	24.9	Very low	29.3	Very low	211 Å²	211	144 Å²	144	93%	0.925	76%	0.761	S	S	*	*			trans	-106.9	74.6	162	-95.5	-72.7	0	0	0	110.6
895	H	28.6	Very low	29.5	Very low	191 Å²	191	147.8 Å²	147.8	88%	0.884	77%	0.774	S	S	*	*			trans	-143	105.6	159.7	-85.6	-60.2	0	0	0	108.7
896	S	27.2	Very low	29.5	Very low	109 Å²	109	146.3 Å²	146.3	76%	0.762	76%	0.764	S	S	*	*			trans	-87.3	159.6	157.7	-50.5	0	0	0	0	108.3
897	P	28.7	Very low	29.4	Very low	121 Å²	121	151 Å²	151	79%	0.786	77%	0.774	S	S	*	*				-140.7	162.6	82.9	36.7	-21.2	0	0	0	116.6
898	T	28.7	Very low	29.4	Very low	118 Å²	118	150.5 Å²	150.5	72%	0.724	78%	0.777	S	S	*	*			trans	-46.6	164.2	152.5	41.3	0	0	0	0	113.6
899	K	29.8	Very low	29.4	Very low	190 Å²	190	145.7 Å²	145.7	83%	0.826	77%	0.773	S	S	*	*			cis	-168.6	-155	19.6	-122.3	172.7	-178.6	-177.4	0	106.3
900	P	36	Very low	29.4	Very low	93 Å²	93	148 Å²	148	60%	0.604	78%	0.779	S	S	*	*				-131.6	-175.5	-58.3	41.1	-25.3	0	0	0	114.8
901	N	28.2	Very low	29.4	Very low	153 Å²	153	148 Å²	148	82%	0.818	78%	0.779	S	S	*	*			trans	70	155.5	153.6	-64	-5.6	0	0	0	118.5
902	Q	27.8	Very low	29.5	Very low	174 Å²	174	146.3 Å²	146.3	81%	0.813	77%	0.77	S	S	*	*			cis	-146.5	148.6	31.9	-72.2	178.4	-22.9	0	0	117.1
903	S	29.4	Very low	29.6	Very low	110 Å²	110	142.5 Å²	142.5	77%	0.769	76%	0.761	S	S	*	*			trans	77.4	154.1	132.9	67.8	0	0	0	0	123.8
904	P	38.1	Very low	29.6	Very low	116 Å²	116	144.8 Å²	144.8	75%	0.753	76%	0.76	S	S	*	*			trans	-137.4	-158.6	-151	45.2	-25.2	0	0	0	115.2
905	I	29.1	Very low	29.9	Very low	174 Å²	174	143.4 Å²	143.4	89%	0.892	75%	0.753	S	S	*	*			trans	-162.3	169.1	152.7	-100.6	149.2	0	0	0	110
906	S	28.3	Very low	29.9	Very low	82 Å²	82	140.6 Å²	140.6	57%	0.573	75%	0.75	S	S	*	*			trans	-147.3	-170.5	-139.6	48.8	0	0	0	0	118.1
907	F	29.1	Very low	30.2	Very low	182 Å²	182	140.9 Å²	140.9	80%	0.798	75%	0.752	S	S	*	*			trans	94.2	147	163.1	-60.1	-69.1	0	0	0	120.1
908	T	30.3	Very low	30.8	Very low	108 Å²	108	139.7 Å²	139.7	66%	0.663	74%	0.744	S	S	*	*			cis	-173	162.8	-37.3	17.7	0	0	0	0	114.4
909	T	30.2	Very low	31	Very low	129 Å²	129	141.1 Å²	141.1	79%	0.791	75%	0.747	S	S	*	*			trans	66.9	157.5	147.5	47	0	0	0	0	123.6
910	N	29.5	Very low	31.2	Very low	136 Å²	136	137.1 Å²	137.1	73%	0.727	74%	0.743	S	S	*	*			cis	-177.9	163.3	-28.5	-156.2	2.4	0	0	0	114.6
911	R	29.3	Very low	31.1	Very low	218 Å²	218	137 Å²	137	82%	0.823	75%	0.751	S	S	*	*			trans	72.2	162.5	161	-77	-173.1	174.1	-179.4	-1.6	123
912	N	29.8	Very low	31.2	Very low	107 Å²	107	135.6 Å²	135.6	57%	0.572	75%	0.748	S	S	*	*			cis	-179.5	156.8	-35.8	-118.7	90.5	0	0	0	116.1
913	F	29.9	Very low	31.5	Very low	162 Å²	162	133.1 Å²	133.1	71%	0.711	74%	0.744	S	S	*	*			trans	91.3	133.6	142.6	-83.4	-54.4	0	0	0	129.7
914	E	29.6	Very low	31.6	Very low	157 Å²	157	132.3 Å²	132.3	73%	0.734	74%	0.739	S	S	*	*			trans	51.7	162	141.5	-79.8	154.6	-171.9	0	0	126.3
915	F	29.7	Very low	31.3	Very low	182 Å²	182	133.8 Å²	133.8	80%	0.798	74%	0.74	S	S	*	*			cis	-174.9	177.4	-39.1	-156.4	-102	0	0	0	113.2
916	T	30.3	Very low	31.5	Very low	131 Å²	131	131.1 Å²	131.1	80%	0.804	73%	0.732	S	S	*	*			trans	115.6	155.6	159.8	67.8	0	0	0	0	121.7
917	S	31.9	Very low	31.7	Very low	116 Å²	116	132.6 Å²	132.6	81%	0.811	74%	0.738	S	S	*	*			trans	-158.8	-153	-171.4	-144.6	0	0	0	0	109.7
918	P	41.7	Very low	31.8	Very low	96 Å²	96	130.8 Å²	130.8	62%	0.623	74%	0.736	S	S	*	*			cis	-147	-164.1	6.6	46.1	-24.1	0	0	0	118.1
919	N	33.6	Very low	32	Very low	147 Å²	147	133.8 Å²	133.8	79%	0.786	75%	0.747	S	S	*	*			trans	73	152.5	148.6	-68.8	-6.9	0	0	0	122.7
920	S	32.8	Very low	32	Very low	106 Å²	106	133.4 Å²	133.4	74%	0.741	74%	0.744	S	S	*	*			cis	-175.3	163.6	-13	50.4	0	0	0	0	114.7
921	A	33.8	Very low	32.2	Very low	92 Å²	92	135.3 Å²	135.3	76%	0.76	75%	0.751	S	S	*	*			trans	84.9	163.9	156	0	0	0	0	0	122.7
922	T	31.9	Very low	32.2	Very low	123 Å²	123	131.2 Å²	131.2	76%	0.755	75%	0.745	S	S	*	*			cis	-169.1	163.2	-41.9	-61.8	0	0	0	0	112.3
923	T	32.7	Very low	32.2	Very low	122 Å²	122	130.6 Å²	130.6	75%	0.748	75%	0.749	S	S	*	*			trans	89.4	104.3	149.8	17.7	0	0	0	0	126.3
924	S	32	Very low	32.1	Very low	93 Å²	93	127.6 Å²	127.6	65%	0.65	75%	0.748	S	S	*	*				59.2	140.7	122	69.1	0	0	0	0	128.6
925	N	32.5	Very low	32.2	Very low	147 Å²	147	126.6 Å²	126.6	79%	0.786	75%	0.753	S	S	*	*			trans	121.4	106.7	130.5	-83.6	2.4	0	0	0	125.1
926	T	32.1	Very low	32.1	Very low	117 Å²	117	125.7 Å²	125.7	72%	0.718	76%	0.755	S	S	*	*			trans	65.3	144.6	130.5	32.2	0	0	0	0	129.7
927	T	32.7	Very low	32.3	Very low	114 Å²	114	124.6 Å²	124.6	70%	0.699	75%	0.75	S	S	*	*			trans	92.9	118.2	139.6	40.3	0	0	0	0	126.3
928	N	31.6	Very low	32	Very low	143 Å²	143	130 Å²	130	77%	0.765	75%	0.753	S	S	*	*			trans	59	135.8	131.1	-57.9	-5.7	0	0	0	125.1
929	I	33.8	Very low	31.2	Very low	172 Å²	172	135 Å²	135	88%	0.882	77%	0.765	S	S	*	*				-175.5	172.6	114.4	-93.5	163.3	0	0	0	111.3
930	V	31.5	Very low	31	Very low	120 Å²	120	140.1 Å²	140.1	73%	0.727	77%	0.773	S	S	*	*			trans	-127.9	166.3	-152.3	179	0	0	0	0	113.3
931	M	34.2	Very low	30.6	Very low	176 Å²	176	146.3 Å²	146.3	87%	0.867	78%	0.78	S	S	*	*			trans	136.7	156.9	144.1	-70.3	-69.5	-179.1	0	0	113.9
932	D	28.1	Very low	30.4	Very low	132 Å²	132	150.2 Å²	150.2	71%	0.706	79%	0.787	S	S	*	*				-163.1	160.3	-68.3	-179.8	44.7	0	0	0	110.7
933	S	29.9	Very low	30.1	Very low	94 Å²	94	149.2 Å²	149.2	66%	0.657	79%	0.786	S	S	*	*			trans	64.6	158.4	155.9	-84.6	0	0	0	0	121.2
934	S	27.3	Very low	29.8	Very low	99 Å²	99	148.6 Å²	148.6	69%	0.692	79%	0.786	S	S	*	*			cis	-173.1	175.7	-22.4	56	0	0	0	0	113.1
935	V	31.6	Very low	29.7	Very low	137 Å²	137	149.5 Å²	149.5	83%	0.83	79%	0.788	S	S	*	*			trans	88.8	148.3	159	-174.2	0	0	0	0	121.1
936	L	27.6	Very low	29.5	Very low	162 Å²	162	149.9 Å²	149.9	85%	0.848	79%	0.79	S	S	*	*			trans	-105.1	-146.3	-163.4	-64	159.3	0	0	0	113
937	P	34.5	Very low	29.4	Very low	108 Å²	108	147.6 Å²	147.6	70%	0.701	79%	0.79	S	S	*	*				-132.5	-161.1	-92.3	43	-25.3	0	0	0	115.8
938	R	26	Very low	29.5	Very low	231 Å²	231	150.3 Å²	150.3	87%	0.872	80%	0.8	S	S	*	*			trans	93.2	116.7	157.1	-81.5	177.4	172	-177.1	-1.4	122
939	K	25.1	Very low	29.3	Very low	201 Å²	201	155 Å²	155	87%	0.874	81%	0.807	S	S	*	*			trans	20.8	127.1	135.5	-63.1	-176.1	177.6	-176.7	0	120.5
940	R	29.9	Very low	29.2	Very low	253 Å²	253	155.4 Å²	155.4	96%	0.955	81%	0.805	S	S	*	*				-156.8	150.4	129.1	-117.2	170.3	-178.3	163.5	0.4	112.6
941	R	24.5	Very low	29.1	Very low	236 Å²	236	155.3 Å²	155.3	89%	0.891	80%	0.8	S	S	*	*			trans	-86.3	146.2	164.4	-73.2	178.7	172.9	175	-3.1	108.7
942	L	29.1	Very low	28.7	Very low	174 Å²	174	156.2 Å²	156.2	91%	0.911	80%	0.801	S	S	*	*				-177.9	171.1	118.2	-97.9	163.4	0	0	0	111.2
943	S	24.7	Very low	28.7	Very low	103 Å²	103	156.7 Å²	156.7	72%	0.72	80%	0.803	S	S	*	*			trans	-106.2	148.6	-164.4	52.3	0	0	0	0	114.5
944	S	27.9	Very low	28.4	Very low	108 Å²	108	157.4 Å²	157.4	76%	0.755	81%	0.809	S	S	*	*				-172	147.2	128.2	40.7	0	0	0	0	114.4
945	T	30	Very low	28.7	Very low	112 Å²	112	158.4 Å²	158.4	69%	0.687	81%	0.812	S	S	*	*			trans	55.9	117.8	147.5	50.5	0	0	0	0	123.4
946	N	28.5	Very low	28.4	Very low	155 Å²	155	157.4 Å²	157.4	83%	0.829	81%	0.807	S	S	*	*			trans	80.8	133.4	133.4	-54.6	-10.4	0	0	0	120.4
947	G	28.7	Very low	28.4	Very low	69 Å²	69	156.7 Å²	156.7	71%	0.711	80%	0.803	S	S	*	*			trans	82	127.3	-178.8	0	0	0	0	0	113
948	D	34.4	Very low	28.3	Very low	172 Å²	172	159.9 Å²	159.9	92%	0.92	81%	0.813	S	S	*	*			cis	-139	161.8	0.1	-73.2	-45.9	0	0	0	111.5
949	R	28.5	Very low	28.4	Very low	241 Å²	241	155.7 Å²	155.7	91%	0.909	81%	0.808	S	S	*	*			trans	-127.7	103.9	176.7	-91.2	-178.4	160	-172.9	-2.3	111
950	E	30.8	Very low	28.7	Very low	180 Å²	180	149.9 Å²	149.9	84%	0.841	81%	0.805	S	S	*	*			trans	-153.8	143.2	155.2	-77.5	-151.8	143.7	0	0	111.1
951	L	29.1	Very low	28.7	Very low	118 Å²	118	144.8 Å²	144.8	62%	0.618	80%	0.797	S	S	*	*			cis	-158.5	126.9	-26.8	-124.4	175.3	0	0	0	108.4	L953	L951-L953 HydrophobicContact CD1-CD1 4.28Å; L951-L953 HydrophobicContact CD2-CD2 4.18Å; L951-L953 HydrophobicContact CD2-CG 4.14Å
952	H	25.9	Very low	28.9	Very low	195 Å²	195	139.6 Å²	139.6	90%	0.903	80%	0.796	S	S	*	*			trans	-80.7	122.6	165.4	-93.7	-110.7	0	0	0	108.8
953	L	29.5	Very low	29	Very low	142 Å²	142	142.6 Å²	142.6	74%	0.743	80%	0.795	S	S	*	*			trans	-134.9	117	176	-74.5	177	0	0	0	113.8	L951	L951-L953 HydrophobicContact CD1-CD1 4.28Å; L951-L953 HydrophobicContact CD2-CD2 4.18Å; L951-L953 HydrophobicContact CD2-CG 4.14Å
954	S	23.5	Very low	29.2	Very low	110 Å²	110	147.1 Å²	147.1	77%	0.769	80%	0.801	S	S	*	*			trans	-89.8	153.1	153.9	-48.4	0	0	0	0	109.5
955	P	32.8	Very low	29.6	Very low	119 Å²	119	147.7 Å²	147.7	77%	0.773	80%	0.803	S	S	*	*			trans	-111.5	136.4	165.5	34.5	-25.5	0	0	0	112.1
956	T	26.4	Very low	29.6	Very low	116 Å²	116	146.4 Å²	146.4	71%	0.712	80%	0.803	S	S	*	*			trans	-147.6	143.9	170.7	-35	0	0	0	0	109.8
957	L	27.2	Very low	29.7	Very low	148 Å²	148	148.2 Å²	148.2	78%	0.775	80%	0.804	S	S	*	*			trans	60.9	121.5	173.8	-52.9	-175.5	0	0	0	118.5
958	L	31.8	Very low	29.7	Very low	174 Å²	174	152.6 Å²	152.6	91%	0.911	81%	0.81	S	S	*	*			trans	-152.8	130	130.1	-117.7	166.8	0	0	0	108.2
959	N	28	Very low	29.4	Very low	144 Å²	144	148.8 Å²	148.8	77%	0.77	80%	0.803	S	S	*	*			trans	-87.7	157.5	-176.4	-74.8	-15.1	0	0	0	111.7
960	G	32.7	Very low	29.2	Very low	78 Å²	78	148.4 Å²	148.4	80%	0.804	80%	0.801	S	S	*	*			trans	-166.4	83.9	176.6	0	0	0	0	0	111.6
961	D	28.5	Very low	29.1	Very low	147 Å²	147	147.3 Å²	147.3	79%	0.786	80%	0.8	S	S	*	*			trans	-71.8	144.4	-177.3	-88.7	-71.6	0	0	0	114.6
962	C	29.5	Very low	28.9	Very low	127 Å²	127	149.7 Å²	149.7	86%	0.858	81%	0.808	S	S	*	*			trans	-155.5	75.4	154.4	-107.5	0	0	0	0	114.4
963	R	30.5	Very low	28.9	Very low	237 Å²	237	145.5 Å²	145.5	89%	0.894	80%	0.801	S	S	*	*			trans	54	120.3	136.6	-60.8	-177.8	177.4	-166.5	-2.3	122.1
964	K	29.9	Very low	28.9	Very low	197 Å²	197	147.4 Å²	147.4	86%	0.857	81%	0.805	S	S	*	*			trans	-58.9	177.2	150	-73.8	173.6	180	173.2	0	111.9
965	P	36.6	Very low	29	Very low	121 Å²	121	151.4 Å²	151.4	79%	0.786	81%	0.809	S	S	*	*			cis	-134.3	176	28.5	28.2	-2	0	0	0	115.8
966	A	29.5	Very low	28.9	Very low	85 Å²	85	151.1 Å²	151.1	70%	0.702	81%	0.808	S	S	*	*			cis	97.5	124.4	17.6	0	0	0	0	0	117.5
967	K	30.4	Very low	29	Very low	192 Å²	192	148.1 Å²	148.1	84%	0.835	80%	0.8	S	S	*	*			trans	-178.1	129.3	158.5	-101.1	163.2	-179	-173.6	0	108.1
968	L	27.5	Very low	29.1	Very low	161 Å²	161	146.9 Å²	146.9	84%	0.843	79%	0.794	S	S	*	*				69.6	139.2	82.4	-82.2	153.7	0	0	0	113.6
969	A	29	Very low	29.2	Very low	93 Å²	93	143.3 Å²	143.3	77%	0.769	78%	0.779	S	S	*	*			cis	-147.2	-179	12.5	0	0	0	0	0	115.6
970	R	24.6	Very low	29.3	Very low	233 Å²	233	142.3 Å²	142.3	88%	0.879	77%	0.768	S	S	*	*			trans	-73.9	160	-178.9	-61.3	163.2	165.4	160.7	-8.4	114.2
971	L	27.9	Very low	29.3	Very low	156 Å²	156	141.1 Å²	141.1	82%	0.817	75%	0.751	S	S	*	*			trans	-178	101.3	138.9	-95.3	160	0	0	0	106.6
972	Q	24.4	Very low	29.4	Very low	169 Å²	169	139.5 Å²	139.5	79%	0.79	74%	0.739	S	S	*	*				54.7	104.9	91.3	-71.7	-179.3	-61.5	0	0	115.8
973	S	26.3	Very low	29.6	Very low	107 Å²	107	134.9 Å²	134.9	75%	0.748	71%	0.71	S	S	*	*				161.6	153.6	101.7	60.3	0	0	0	0	115.3
974	H	29.6	Very low	29.6	Very low	181 Å²	181	128 Å²	128	84%	0.838	69%	0.685	S	S	*	*			trans	66.6	148.9	163.1	-66	-68.4	0	0	0	124.1
975	F	26.5	Very low	29.9	Very low	194 Å²	194	121 Å²	121	85%	0.851	66%	0.658	S	S	*	*			trans	-84.1	179.5	-178.9	-77.9	-102.6	0	0	0	112
976	P	30.5	Very low	29.8	Very low	114 Å²	114	119.1 Å²	119.1	74%	0.74	64%	0.642	S	S	*	*			cis	-117	-178	1.4	43	-30.5	0	0	0	112.6
977	G	28	Very low	30	Very low	53 Å²	53	116.8 Å²	116.8	55%	0.546	62%	0.62	S	S	.	*			cis	107.2	115.4	11.6	0	0	0	0	0	111.4	T979	G977-T979 PolarHBondContact O-N 2.79Å
978	N	29.2	Very low	30.2	Very low	122 Å²	122	110.2 Å²	110.2	65%	0.652	60%	0.601	S	S	*	*			trans	33.4	74.3	173.4	-71.6	6.8	0	0	0	118.3	E1365	N978-E1365 PolarHBondContact ND2-OE1 3.27Å; N978-E1365 VanDerWaalsContact ND2-OE1 3.13Å
979	T	33.4	Very low	30.6	Very low	98 Å²	98	106 Å²	106	60%	0.601	58%	0.58	S	S	*	*			trans	-122.8	-22.9	165.8	52.8	0	0	0	0	115	G977 Q982 A983	G977-T979 PolarHBondContact O-N 2.79Å; T979-Q982 CarbonylContact O-C 3.56Å; T979-A983 WeakPolarHBondContact O-CB 3.38Å; T979-A983 PolarHBondContact O-N 2.91Å
980	F	30.8	Very low	30.7	Very low	123 Å²	123	104.9 Å²	104.9	54%	0.539	57%	0.566	S	S	.	*	H	α-helix	trans	-78.7	-40.2	-166.8	-154.1	-90.1	0	0	0	114.9	A983 Y984 L1037 L1040	F980-A983 PolarHBondContact O-N 3.07Å; F980-Y984 PolarHBondContact O-N 3.29Å; F980-L1037 HydrophobicContact CD2-CD2 4.31Å; F980-L1037 HydrophobicContact CE2-CD2 3.57Å; F980-L1037 HydrophobicContact CZ-CD2 3.77Å; F980-L1040 HydrophobicContact CE2-CD1 4.4Å; F980-L1040 HydrophobicContact CZ-CD1 4.29Å
981	A	33.3	Very low	31.2	Very low	53 Å²	53	99.4 Å²	99.4	44%	0.438	55%	0.548	S	S	.	.	H	α-helix	trans	-64.6	-47.7	171.1	0	0	0	0	0	110	A983 Y984 T985	A981-A983 VanDerWaalsContact C-N 3.25Å; A981-A983 PolarHBondContact O-N 3.14Å; A981-Y984 WeakPolarHBondContact O-CA 3.43Å; A981-Y984 PolarHBondContact O-N 3.03Å; A981-T985 PolarHBondContact O-N 3.32Å; A981-T985 PolarHBondContact O-OG1 2.9Å; A981-T985 VanDerWaalsContact O-OG1 3.13Å
982	Q	31.2	Very low	31.5	Very low	114 Å²	114	96.5 Å²	96.5	53%	0.533	53%	0.531	S	S	.	.	H	α-helix	trans	-60.6	-29.3	176.6	-143.9	130.5	29.4	0	0	113	T979 T985 N986	T979-Q982 CarbonylContact O-C 3.56Å; Q982-T985 WeakPolarHBondContact CA-OG1 3.31Å; Q982-N986 WeakPolarHBondContact O-CA 3.47Å; Q982-N986 WeakPolarHBondContact O-CB 3.25Å; Q982-N986 PolarHBondContact O-N 3.19Å; Q982-N986 PolarHBondContact O-ND2 3.25Å
983	A	31.9	Very low	32	Very low	30 Å²	30	92.9 Å²	92.9	25%	0.248	52%	0.517	C	S	.	.	H	α-helix	trans	-75.8	-26.6	172.2	0	0	0	0	0	112.9	T979 F980 A981 S987 L1037	T979-A983 WeakPolarHBondContact O-CB 3.38Å; T979-A983 PolarHBondContact O-N 2.91Å; F980-A983 PolarHBondContact O-N 3.07Å; A981-A983 VanDerWaalsContact C-N 3.25Å; A981-A983 PolarHBondContact O-N 3.14Å; A983-S987 WeakPolarHBondContact O-CB 3.47Å; A983-S987 PolarHBondContact O-N 3.18Å; A983-S987 PolarHBondContact O-OG 3.07Å; A983-L1037 HydrophobicContact CB-CD1 4.13Å
984	Y	31.3	Very low	32.4	Very low	93 Å²	93	92.8 Å²	92.8	37%	0.365	51%	0.507	S	S	.	.	H	α-helix	trans	-80.6	-41.7	175.4	-139.9	-82.1	0	0	0	111.4	F980 A981 S987 A988 T1361	F980-Y984 PolarHBondContact O-N 3.29Å; A981-Y984 WeakPolarHBondContact O-CA 3.43Å; A981-Y984 PolarHBondContact O-N 3.03Å; Y984-S987 WeakPolarHBondContact CA-OG 3.47Å; Y984-S987 PolarHBondContact O-N 3.39Å; Y984-S987 PolarHBondContact O-OG 3.49Å; Y984-S987 VanDerWaalsContact O-OG 3.07Å; Y984-A988 PolarHBondContact O-N 3.29Å; Y984-A988 VanDerWaalsContact O-N 3.1Å; Y984-T1361 HydrophobicContact CE1-CG2 4.27Å
985	T	36.8	Very low	32.7	Very low	48 Å²	48	88.1 Å²	88.1	29%	0.294	49%	0.488	S	S	.	.	H	α-helix	trans	-71.1	-38.9	170.5	47	0	0	0	0	112	A981 Q982 S987 A988 N989 D1363	A981-T985 PolarHBondContact O-N 3.32Å; A981-T985 PolarHBondContact O-OG1 2.9Å; A981-T985 VanDerWaalsContact O-OG1 3.13Å; Q982-T985 WeakPolarHBondContact CA-OG1 3.31Å; T985-S987 PolarHBondContact O-N 3.11Å; T985-A988 PolarHBondContact O-N 3.27Å; T985-N989 WeakPolarHBondContact O-CA 3.39Å; T985-N989 WeakPolarHBondContact O-CB 3.34Å; T985-N989 PolarHBondContact O-N 2.86Å; T985-N989 PolarHBondContact O-ND2 3.4Å; T985-D1363 WeakPolarHBondContact CG2-OD2 3.24Å
986	N	34.2	Very low	33	Very low	83 Å²	83	84.3 Å²	84.3	44%	0.444	47%	0.471	S	S	.	.	H	α-helix	trans	-72.3	-22.9	172.1	-67.4	-18.4	0	0	0	113.5	Q982 C990	Q982-N986 WeakPolarHBondContact O-CA 3.47Å; Q982-N986 WeakPolarHBondContact O-CB 3.25Å; Q982-N986 PolarHBondContact O-N 3.19Å; Q982-N986 PolarHBondContact O-ND2 3.25Å; N986-C990 WeakPolarHBondContact O-CA 3.36Å; N986-C990 WeakPolarHBondContact O-CB 3.42Å; N986-C990 PolarHBondContact O-N 3.45Å; N986-C990 PolarHBondContact O-SG 2.83Å
987	S	33.4	Very low	33	Very low	36 Å²	36	85.5 Å²	85.5	25%	0.252	47%	0.47	S	S	.	.	H	α-helix	trans	-75.4	-40.4	170.4	52.8	0	0	0	0	111.4	A983 Y984 T985 F991	A983-S987 WeakPolarHBondContact O-CB 3.47Å; A983-S987 PolarHBondContact O-N 3.18Å; A983-S987 PolarHBondContact O-OG 3.07Å; Y984-S987 WeakPolarHBondContact CA-OG 3.47Å; Y984-S987 PolarHBondContact O-N 3.39Å; Y984-S987 PolarHBondContact O-OG 3.49Å; Y984-S987 VanDerWaalsContact O-OG 3.07Å; T985-S987 PolarHBondContact O-N 3.11Å; S987-F991 WeakPolarHBondContact O-CB 3.13Å; S987-F991 PolarHBondContact O-N 3.25Å
988	A	34.9	Very low	33	Very low	53 Å²	53	89 Å²	89	44%	0.438	48%	0.483	S	S	.	.	H	α-helix	trans	-62.9	-47.8	170.5	0	0	0	0	0	112	Y984 T985 F991 E992	Y984-A988 PolarHBondContact O-N 3.29Å; Y984-A988 VanDerWaalsContact O-N 3.1Å; T985-A988 PolarHBondContact O-N 3.27Å; A988-F991 PolarHBondContact O-N 2.92Å; A988-E992 PolarHBondContact O-N 3.35Å
989	N	34.9	Very low	33	Very low	74 Å²	74	86.6 Å²	86.6	40%	0.396	49%	0.487	S	S	.	.	H	α-helix	trans	-74.4	-30.3	-178.7	-65.4	-11.4	0	0	0	112.4	T985 N993	T985-N989 WeakPolarHBondContact O-CA 3.39Å; T985-N989 WeakPolarHBondContact O-CB 3.34Å; T985-N989 PolarHBondContact O-N 2.86Å; T985-N989 PolarHBondContact O-ND2 3.4Å; N989-N993 WeakPolarHBondContact O-CA 3.43Å; N989-N993 WeakPolarHBondContact O-CB 3.07Å; N989-N993 PolarHBondContact O-N 2.76Å; N989-N993 PolarHBondContact O-ND2 3.38Å; N989-N993 PolarHBondContact O-OD1 2.9Å
990	C	32.6	Very low	32.9	Very low	69 Å²	69	89.5 Å²	89.5	47%	0.466	50%	0.499	S	S	.	.	H	α-helix	trans	-71	-32.8	167.7	-76	0	0	0	0	111.2	N986 N993 L994	N986-C990 WeakPolarHBondContact O-CA 3.36Å; N986-C990 WeakPolarHBondContact O-CB 3.42Å; N986-C990 PolarHBondContact O-N 3.45Å; N986-C990 PolarHBondContact O-SG 2.83Å; C990-N993 PolarHBondContact O-N 2.9Å; C990-L994 WeakPolarHBondContact O-CB 3.41Å; C990-L994 WeakPolarHBondContact O-CD1 3.47Å; C990-L994 WeakPolarHBondContact O-CG 3.49Å; C990-L994 PolarHBondContact O-N 2.91Å
991	F	34	Very low	32.7	Very low	117 Å²	117	90.8 Å²	90.8	51%	0.513	51%	0.511	S	S	.	.	H	α-helix	trans	-68.6	-38.1	173.2	-140	-87.6	0	0	0	111.7	S987 A988 I995 W1008	S987-F991 WeakPolarHBondContact O-CB 3.13Å; S987-F991 PolarHBondContact O-N 3.25Å; A988-F991 PolarHBondContact O-N 2.92Å; F991-I995 HydrophobicContact CD1-CD1 4.03Å; F991-I995 HydrophobicContact CE1-CD1 4.27Å; F991-I995 VanDerWaalsContact O-CD1 3.3Å; F991-I995 WeakPolarHBondContact O-CD1 3.45Å; F991-I995 VanDerWaalsContact O-CG1 3.27Å; F991-I995 WeakPolarHBondContact O-CG1 3.27Å; F991-W1008 HydrophobicContact CE2-CZ2 4.45Å; F991-W1008 HydrophobicContact CZ-CZ2 4.05Å
992	E	34.7	Very low	32.6	Very low	96 Å²	96	95.2 Å²	95.2	45%	0.449	53%	0.528	S	S	.	.	H	α-helix	trans	-68.3	-42.6	169.5	-76.3	-138.3	115.9	0	0	112.6	A988 I995 K996	A988-E992 PolarHBondContact O-N 3.35Å; E992-I995 CarbonylContact O-C 3.59Å; E992-I995 VanDerWaalsContact O-C 3.3Å; E992-I995 VanDerWaalsContact O-CA 3.29Å; E992-I995 WeakPolarHBondContact O-CA 3.18Å; E992-I995 WeakPolarHBondContact O-CB 3.26Å; E992-I995 PolarHBondContact O-N 2.92Å; E992-K996 HydrophobicContact CB-CD 4.31Å; E992-K996 VanDerWaalsContact O-CB 3.32Å; E992-K996 WeakPolarHBondContact O-CB 3.46Å; E992-K996 WeakPolarHBondContact O-CG 3.47Å; E992-K996 PolarHBondContact O-N 3.38Å; E992-K996 WeakPolarHBondContact OE1-CE 3.28Å; E992-K996 IonicContact OE1-NZ 2.73Å; E992-K996 PolarHBondContact OE1-NZ 2.93Å; E992-K996 IonicContact OE2-NZ 2.7Å; E992-K996 PolarHBondContact OE2-NZ 3.41Å
993	N	34.3	Very low	32.4	Very low	93 Å²	93	94.6 Å²	94.6	50%	0.497	54%	0.536	S	S	.	.	H	α-helix	trans	-75.2	-29.5	-176.2	-68.2	-16	0	0	0	112.5	N989 C990 I995 K996 L997	N989-N993 WeakPolarHBondContact O-CA 3.43Å; N989-N993 WeakPolarHBondContact O-CB 3.07Å; N989-N993 PolarHBondContact O-N 2.76Å; N989-N993 PolarHBondContact O-ND2 3.38Å; N989-N993 PolarHBondContact O-OD1 2.9Å; C990-N993 PolarHBondContact O-N 2.9Å; N993-I995 PolarHBondContact O-N 3.16Å; N993-K996 CarbonylContact O-C 3.35Å; N993-K996 PolarHBondContact O-N 3.11Å; N993-K996 VanDerWaalsContact O-N 3.11Å; N993-L997 PolarHBondContact O-N 3.18Å
994	L	34.9	Very low	32.2	Very low	105 Å²	105	99.4 Å²	99.4	55%	0.55	56%	0.562	S	S	.	*	T	Hydrogen-bonded Turn	trans	-66	-15.2	164.6	-75.9	165.2	0	0	0	112.7	C990	C990-L994 WeakPolarHBondContact O-CB 3.41Å; C990-L994 WeakPolarHBondContact O-CD1 3.47Å; C990-L994 WeakPolarHBondContact O-CG 3.49Å; C990-L994 PolarHBondContact O-N 2.91Å
995	I	37	Very low	32	Very low	83 Å²	83	102.2 Å²	102.2	43%	0.426	58%	0.584	S	S	.	*	T	Hydrogen-bonded Turn	trans	-100.3	-13.9	172.2	-66.7	170.5	0	0	0	111.5	F991 E992 N993	F991-I995 HydrophobicContact CD1-CD1 4.03Å; F991-I995 HydrophobicContact CE1-CD1 4.27Å; F991-I995 VanDerWaalsContact O-CD1 3.3Å; F991-I995 WeakPolarHBondContact O-CD1 3.45Å; F991-I995 VanDerWaalsContact O-CG1 3.27Å; F991-I995 WeakPolarHBondContact O-CG1 3.27Å; E992-I995 CarbonylContact O-C 3.59Å; E992-I995 VanDerWaalsContact O-C 3.3Å; E992-I995 VanDerWaalsContact O-CA 3.29Å; E992-I995 WeakPolarHBondContact O-CA 3.18Å; E992-I995 WeakPolarHBondContact O-CB 3.26Å; E992-I995 PolarHBondContact O-N 2.92Å; N993-I995 PolarHBondContact O-N 3.16Å
996	K	31.8	Very low	31.4	Very low	114 Å²	114	105.4 Å²	105.4	50%	0.496	61%	0.606	S	S	.	*			trans	-124.7	25.9	-173.2	-63.2	172.6	-173.3	178.3	0	114	E992 N993	E992-K996 HydrophobicContact CB-CD 4.31Å; E992-K996 VanDerWaalsContact O-CB 3.32Å; E992-K996 WeakPolarHBondContact O-CB 3.46Å; E992-K996 WeakPolarHBondContact O-CG 3.47Å; E992-K996 PolarHBondContact O-N 3.38Å; E992-K996 WeakPolarHBondContact OE1-CE 3.28Å; E992-K996 IonicContact OE1-NZ 2.73Å; E992-K996 PolarHBondContact OE1-NZ 2.93Å; E992-K996 IonicContact OE2-NZ 2.7Å; E992-K996 PolarHBondContact OE2-NZ 3.41Å; N993-K996 CarbonylContact O-C 3.35Å; N993-K996 PolarHBondContact O-N 3.11Å; N993-K996 VanDerWaalsContact O-N 3.11Å
997	L	31.2	Very low	31.2	Very low	139 Å²	139	110.4 Å²	110.4	73%	0.728	62%	0.624	S	S	*	*			trans	-60.4	132.5	170	-86.7	166.8	0	0	0	109.5	N993	N993-L997 PolarHBondContact O-N 3.18Å
998	P	28.3	Very low	30.8	Very low	127 Å²	127	116.7 Å²	116.7	83%	0.825	64%	0.643	S	S	*	*			trans	-78.3	128.3	-161	29.2	-35.4	0	0	0	113.1
999	G	28.5	Very low	30.7	Very low	71 Å²	71	118.8 Å²	118.8	73%	0.732	65%	0.646	S	S	*	*			trans	-174.7	80.6	177.5	0	0	0	0	0	113.2
1000	N	30.7	Very low	30.5	Very low	159 Å²	159	119.8 Å²	119.8	85%	0.85	66%	0.657	S	S	*	*			trans	52.9	115.5	168.6	-65.4	-5.9	0	0	0	119.3	D1002	N1000-D1002 PolarHBondContact O-N 3.27Å
1001	N	26.6	Very low	30.6	Very low	149 Å²	149	120.2 Å²	120.2	80%	0.797	66%	0.661	S	S	*	*			trans	-7.6	110.2	149.3	-47.9	-11.2	0	0	0	116.4
1002	D	30.5	Very low	30.7	Very low	147 Å²	147	121 Å²	121	79%	0.786	67%	0.67	S	S	*	*				172.4	145.8	99.6	-89.6	-23.7	0	0	0	114.2	N1000	N1000-D1002 PolarHBondContact O-N 3.27Å
1003	S	28.8	Very low	30.7	Very low	100 Å²	100	121.8 Å²	121.8	70%	0.699	68%	0.677	S	S	*	*			trans	49.6	90.8	160.3	62.6	0	0	0	0	120.5	N1005	S1003-N1005 PolarHBondContact O-N 3.49Å
1004	T	26.8	Very low	30.9	Very low	131 Å²	131	123.2 Å²	123.2	80%	0.804	68%	0.684	S	S	*	*	S	Bend		46.8	68.8	129.9	59.4	0	0	0	0	120.1
1005	N	26.3	Very low	31	Very low	152 Å²	152	121.6 Å²	121.6	81%	0.813	69%	0.686	S	S	*	*			trans	-176.2	98	142.6	-105.1	-59.6	0	0	0	113.3	S1003	S1003-N1005 PolarHBondContact O-N 3.49Å
1006	C	25.7	Very low	30.7	Very low	115 Å²	115	121.4 Å²	121.4	78%	0.777	70%	0.697	S	S	*	*			trans	-118	94.7	176.8	-59.5	0	0	0	0	111.6
1007	K	28.7	Very low	30.9	Very low	189 Å²	189	121.6 Å²	121.6	82%	0.822	70%	0.703	S	S	*	*			trans	-86.9	142	163.8	-73.9	176	-179.1	167.6	0	109.5	N1009	K1007-N1009 PolarHBondContact O-N 3.17Å
1008	W	25.7	Very low	31.3	Very low	167 Å²	167	120.1 Å²	120.1	63%	0.633	70%	0.696	S	S	*	*			trans	-55.2	129.5	165.7	-97.7	60.9	0	0	0	111.1	F991	F991-W1008 HydrophobicContact CE2-CZ2 4.45Å; F991-W1008 HydrophobicContact CZ-CZ2 4.05Å
1009	N	33	Very low	32	Very low	97 Å²	97	117.9 Å²	117.9	52%	0.519	68%	0.684	S	S	.	*			trans	-119.2	106.3	173.7	-176.5	8.5	0	0	0	110.4	K1007 S1011	K1007-N1009 PolarHBondContact O-N 3.17Å; N1009-S1011 PolarHBondContact O-N 3.39Å; N1009-S1011 PolarHBondContact OD1-N 3.14Å; N1009-S1011 PolarHBondContact OD1-OG 2.91Å
1010	P	30.3	Very low	32.9	Very low	96 Å²	96	116.8 Å²	116.8	62%	0.623	66%	0.661	S	S	*	*	G	3₁₀ helix	trans	-63.6	-20.2	-179	-24.5	35.4	0	0	0	115.3	N1012 L1013	P1010-N1012 PolarHBondContact O-N 3.3Å; P1010-L1013 PolarHBondContact O-N 3.41Å
1011	S	34.4	Very low	33.4	Very low	77 Å²	77	110.1 Å²	110.1	54%	0.538	63%	0.627	S	S	.	*	G	3₁₀ helix	trans	-65	-21.9	-170.1	-55.5	0	0	0	0	114.5	N1009 L1013 L1014	N1009-S1011 PolarHBondContact O-N 3.39Å; N1009-S1011 PolarHBondContact OD1-N 3.14Å; N1009-S1011 PolarHBondContact OD1-OG 2.91Å; S1011-L1013 PolarHBondContact O-N 3.01Å; S1011-L1014 PolarHBondContact O-N 3.47Å
1012	N	37.6	Very low	34.6	Very low	133 Å²	133	109 Å²	109	71%	0.711	62%	0.62	S	S	*	*	G	3₁₀ helix	trans	-71.1	-10.3	-177.9	-68.5	13.6	0	0	0	113.7	P1010 L1014	P1010-N1012 PolarHBondContact O-N 3.3Å; N1012-L1014 VanDerWaalsContact C-N 3.33Å
1013	L	34.7	Very low	35.4	Very low	114 Å²	114	107.4 Å²	107.4	60%	0.597	61%	0.608	S	S	*	*	G	3₁₀ helix	trans	-80.1	-6.2	177.9	-89.3	159.5	0	0	0	114.6	P1010 S1011	P1010-L1013 PolarHBondContact O-N 3.41Å; S1011-L1013 PolarHBondContact O-N 3.01Å
1014	L	38	Very low	36.4	Very low	122 Å²	122	104.2 Å²	104.2	64%	0.639	58%	0.583	S	S	*	*	G	3₁₀ helix	trans	-90.4	-5.5	-175.1	-76.1	139.5	0	0	0	114.4	S1011 N1012 A1016	S1011-L1014 PolarHBondContact O-N 3.47Å; N1012-L1014 VanDerWaalsContact C-N 3.33Å; L1014-A1016 PolarHBondContact O-N 3.34Å
1015	A	35.6	Very low	37.5	Very low	72 Å²	72	101.1 Å²	101.1	60%	0.595	56%	0.556	S	S	*	*			trans	-84.2	87.4	176.5	0	0	0	0	0	111.9	N1017 N1020	A1015-N1017 PolarHBondContact O-N 3.17Å; A1015-N1020 PolarHBondContact O-ND2 2.89Å
1016	A	31.5	Very low	38.9	Very low	79 Å²	79	100.1 Å²	100.1	65%	0.653	55%	0.546	S	S	*	.			trans	-97.2	87.9	-174.2	0	0	0	0	0	113.8	L1014	L1014-A1016 PolarHBondContact O-N 3.34Å
1017	N	35.7	Very low	40.1	Very low	117 Å²	117	99.1 Å²	99.1	63%	0.626	53%	0.533	S	S	*	.			trans	-82	152.7	157.7	-67.9	-2.7	0	0	0	109.5	A1015 S1019 N1020	A1015-N1017 PolarHBondContact O-N 3.17Å; N1017-S1019 PolarHBondContact O-N 3.41Å; N1017-S1019 VanDerWaalsContact O-N 3.11Å; N1017-N1020 WeakPolarHBondContact O-CB 3.48Å; N1017-N1020 PolarHBondContact O-N 2.86Å
1018	D	40.6	Very low	41	Very low	109 Å²	109	90.5 Å²	90.5	58%	0.583	50%	0.497	S	S	*	.	H	α-helix	trans	-59.3	-29.3	-173.3	-105.5	-37.2	0	0	0	113.9	K789 N1020 C1021	K789-D1018 IonicContact NZ-OD1 3.89Å; K789-D1018 PolarHBondContact NZ-OD1 3.14Å; K789-D1018 IonicContact NZ-OD2 3.57Å; K789-D1018 PolarHBondContact NZ-OD2 3.18Å; D1018-N1020 VanDerWaalsContact C-N 3.27Å; D1018-N1020 PolarHBondContact O-N 3.3Å; D1018-C1021 WeakPolarHBondContact O-CB 3.28Å; D1018-C1021 PolarHBondContact O-N 3.25Å
1019	S	42.6	Very low	42.3	Very low	80 Å²	80	88.6 Å²	88.6	56%	0.559	49%	0.489	S	S	*	.	H	α-helix	trans	-55.7	-38.9	170.7	50.9	0	0	0	0	113.4	N1017 C1021	N1017-S1019 PolarHBondContact O-N 3.41Å; N1017-S1019 VanDerWaalsContact O-N 3.11Å; S1019-C1021 PolarHBondContact O-N 2.88Å
1020	N	47.2	Very low	43.1	Very low	48 Å²	48	86.1 Å²	86.1	26%	0.257	48%	0.48	S	S	.	.	H	α-helix	trans	-74	-22.1	-173.9	-57.1	0.9	0	0	0	110.5	A1015 N1017 D1018 L1022 Q1023 I1024	A1015-N1020 PolarHBondContact O-ND2 2.89Å; N1017-N1020 WeakPolarHBondContact O-CB 3.48Å; N1017-N1020 PolarHBondContact O-N 2.86Å; D1018-N1020 VanDerWaalsContact C-N 3.27Å; D1018-N1020 PolarHBondContact O-N 3.3Å; N1020-L1022 VanDerWaalsContact C-N 3.33Å; N1020-L1022 PolarHBondContact O-N 3.45Å; N1020-Q1023 PolarHBondContact O-N 3.19Å; N1020-I1024 HydrophobicContact CB-CD1 4.43Å; N1020-I1024 WeakPolarHBondContact O-CB 3.49Å; N1020-I1024 VanDerWaalsContact O-CG1 3.25Å; N1020-I1024 WeakPolarHBondContact O-CG1 3.41Å; N1020-I1024 PolarHBondContact O-N 2.98Å
1021	C	41.8	Very low	44	Very low	19 Å²	19	82.9 Å²	82.9	13%	0.128	46%	0.458	C	S	.	.	H	α-helix	trans	-63.5	-35.3	-177.7	-171.8	0	0	0	0	113	T790 D1018 S1019 R1025	T790-C1021 HydrophobicContact CG2-CB 4.46Å; T790-C1021 VanDerWaalsContact CG2-SG 3.59Å; D1018-C1021 WeakPolarHBondContact O-CB 3.28Å; D1018-C1021 PolarHBondContact O-N 3.25Å; S1019-C1021 PolarHBondContact O-N 2.88Å; C1021-R1025 PolarHBondContact O-N 2.89Å
1022	L	50.4	Low	44.4	Very low	125 Å²	125	80.7 Å²	80.7	65%	0.654	44%	0.441	S	S	*	.	H	α-helix	trans	-75.2	-41.5	174.9	-78.9	171.1	0	0	0	111.8	N1020 I1024 R1025 Q1026	N1020-L1022 VanDerWaalsContact C-N 3.33Å; N1020-L1022 PolarHBondContact O-N 3.45Å; L1022-I1024 VanDerWaalsContact C-N 3.33Å; L1022-I1024 PolarHBondContact O-N 3.05Å; L1022-R1025 PolarHBondContact O-N 2.84Å; L1022-Q1026 WeakPolarHBondContact O-CG 3.34Å; L1022-Q1026 PolarHBondContact O-N 3.31Å
1023	Q	47.8	Very low	44.8	Very low	114 Å²	114	80.7 Å²	80.7	53%	0.533	44%	0.436	S	S	.	.	H	α-helix	trans	-61.7	-40.5	176	-69.6	-179.4	-21.3	0	0	111.7	N1020 Q1026 L1027	N1020-Q1023 PolarHBondContact O-N 3.19Å; Q1023-Q1026 PolarHBondContact O-N 3.28Å; Q1023-L1027 WeakPolarHBondContact O-CB 3.35Å; Q1023-L1027 WeakPolarHBondContact O-CG 3.3Å; Q1023-L1027 PolarHBondContact O-N 3.02Å
1024	I	51	Low	44.9	Very low	33 Å²	33	78.7 Å²	78.7	17%	0.169	43%	0.425	C	S	.	.	H	α-helix	trans	-62.7	-42.3	174.6	-69.5	164.1	0	0	0	111	N1020 L1022 A1028	N1020-I1024 HydrophobicContact CB-CD1 4.43Å; N1020-I1024 WeakPolarHBondContact O-CB 3.49Å; N1020-I1024 VanDerWaalsContact O-CG1 3.25Å; N1020-I1024 WeakPolarHBondContact O-CG1 3.41Å; N1020-I1024 PolarHBondContact O-N 2.98Å; L1022-I1024 VanDerWaalsContact C-N 3.33Å; L1022-I1024 PolarHBondContact O-N 3.05Å; I1024-A1028 VanDerWaalsContact O-CB 3.26Å; I1024-A1028 WeakPolarHBondContact O-CB 3.47Å; I1024-A1028 PolarHBondContact O-N 3.49Å
1025	R	49.4	Very low	45	Very low	66 Å²	66	74.5 Å²	74.5	25%	0.249	40%	0.403	C	S	.	.	H	α-helix	trans	-65.3	-37	174.2	-75.3	-177.7	175.9	-139.8	3.1	112.5	C733 K789 C1021 L1022 A1028 R1029	C733-R1025 PolarHBondContact SG-NH2 3.01Å; K789-R1025 PolarHBondContact O-NE 2.92Å; K789-R1025 PolarHBondContact O-NH2 3.2Å; C1021-R1025 PolarHBondContact O-N 2.89Å; L1022-R1025 PolarHBondContact O-N 2.84Å; R1025-A1028 PolarHBondContact O-N 3.39Å; R1025-R1029 WeakPolarHBondContact O-CG 3.42Å; R1025-R1029 PolarHBondContact O-N 3.38Å; R1025-R1029 VanDerWaalsContact O-N 3.07Å
1026	Q	54.6	Low	45	Very low	130 Å²	130	78.1 Å²	78.1	61%	0.607	41%	0.408	S	S	*	.	H	α-helix	trans	-67.8	-45.9	175.6	-74	172.6	-36.6	0	0	112.1	L1022 Q1023 A1028 R1029 S1030	L1022-Q1026 WeakPolarHBondContact O-CG 3.34Å; L1022-Q1026 PolarHBondContact O-N 3.31Å; Q1023-Q1026 PolarHBondContact O-N 3.28Å; Q1026-A1028 VanDerWaalsContact C-N 3.33Å; Q1026-A1028 PolarHBondContact O-N 3.45Å; Q1026-R1029 PolarHBondContact O-N 3.2Å; Q1026-S1030 PolarHBondContact O-N 3.34Å; Q1026-S1030 VanDerWaalsContact O-N 3.08Å
1027	L	51	Low	45.2	Very low	94 Å²	94	76.2 Å²	76.2	49%	0.492	39%	0.386	S	S	.	.	H	α-helix	trans	-58.8	-43.6	172.1	-75.3	164.1	0	0	0	111.3	Q1023 R1029 S1030 T1031	Q1023-L1027 WeakPolarHBondContact O-CB 3.35Å; Q1023-L1027 WeakPolarHBondContact O-CG 3.3Å; Q1023-L1027 PolarHBondContact O-N 3.02Å; L1027-R1029 VanDerWaalsContact C-N 3.32Å; L1027-R1029 PolarHBondContact O-N 2.92Å; L1027-S1030 PolarHBondContact O-N 3.31Å; L1027-S1030 PolarHBondContact O-OG 2.88Å; L1027-T1031 WeakPolarHBondContact O-CG2 3.39Å; L1027-T1031 PolarHBondContact O-N 3.43Å
1028	A	49.1	Very low	45.1	Very low	8 Å²	8	74 Å²	74	7%	0.066	37%	0.373	C	S	.	.	H	α-helix	trans	-62.4	-38.6	178.2	0	0	0	0	0	112.1	F730 I1024 R1025 Q1026 T1031 N1032	F730-A1028 HydrophobicContact CE1-CB 3.7Å; F730-A1028 HydrophobicContact CE2-CB 4.18Å; F730-A1028 HydrophobicContact CZ-CB 3.41Å; F730-A1028 VanDerWaalsContact CZ-CB 3.41Å; I1024-A1028 VanDerWaalsContact O-CB 3.26Å; I1024-A1028 WeakPolarHBondContact O-CB 3.47Å; I1024-A1028 PolarHBondContact O-N 3.49Å; R1025-A1028 PolarHBondContact O-N 3.39Å; Q1026-A1028 VanDerWaalsContact C-N 3.33Å; Q1026-A1028 PolarHBondContact O-N 3.45Å; A1028-T1031 WeakPolarHBondContact CA-OG1 3.27Å; A1028-T1031 PolarHBondContact O-N 3.06Å; A1028-T1031 PolarHBondContact O-OG1 3.44Å; A1028-N1032 PolarHBondContact O-N 2.79Å
1029	R	51.7	Low	44.9	Very low	127 Å²	127	73 Å²	73	48%	0.479	38%	0.375	S	S	.	.	H	α-helix	trans	-61.4	-49	171.5	-75.1	177.8	174.6	-179.7	-2.1	112.1	N729 F730 R1025 Q1026 L1027 T1031 N1032 E1033	N729-R1029 PolarHBondContact O-NE 3.2Å; N729-R1029 VanDerWaalsContact O-NE 3.14Å; N729-R1029 PolarHBondContact O-NH2 3.32Å; F730-R1029 HydrophobicContact CD2-CG 3.64Å; F730-R1029 HydrophobicContact CE2-CB 4.46Å; F730-R1029 HydrophobicContact CE2-CG 3.68Å; R1025-R1029 WeakPolarHBondContact O-CG 3.42Å; R1025-R1029 PolarHBondContact O-N 3.38Å; R1025-R1029 VanDerWaalsContact O-N 3.07Å; Q1026-R1029 PolarHBondContact O-N 3.2Å; L1027-R1029 VanDerWaalsContact C-N 3.32Å; L1027-R1029 PolarHBondContact O-N 2.92Å; R1029-T1031 VanDerWaalsContact C-N 3.26Å; R1029-T1031 PolarHBondContact O-N 2.92Å; R1029-N1032 WeakPolarHBondContact O-CB 3.5Å; R1029-N1032 PolarHBondContact O-N 3.19Å; R1029-E1033 PolarHBondContact O-N 2.99Å
1030	S	51.3	Low	44.5	Very low	45 Å²	45	74.8 Å²	74.8	32%	0.315	38%	0.378	S	S	.	.	H	α-helix	trans	-66.9	-24.2	177.4	62.3	0	0	0	0	113.7	Q1026 L1027 N1032 E1033 M1034	Q1026-S1030 PolarHBondContact O-N 3.34Å; Q1026-S1030 VanDerWaalsContact O-N 3.08Å; L1027-S1030 PolarHBondContact O-N 3.31Å; L1027-S1030 PolarHBondContact O-OG 2.88Å; S1030-N1032 VanDerWaalsContact C-N 3.34Å; S1030-E1033 PolarHBondContact O-N 3.11Å; S1030-M1034 PolarHBondContact O-N 3.46Å
1031	T	47.9	Very low	43.8	Very low	28 Å²	28	75 Å²	75	17%	0.172	38%	0.383	C	S	.	.	H	α-helix	trans	-73.7	-19.4	168.8	64.8	0	0	0	0	114.3	I675 L1027 A1028 R1029 M1034 N1035	I675-T1031 HydrophobicContact CD1-CG2 4.09Å; L1027-T1031 WeakPolarHBondContact O-CG2 3.39Å; L1027-T1031 PolarHBondContact O-N 3.43Å; A1028-T1031 WeakPolarHBondContact CA-OG1 3.27Å; A1028-T1031 PolarHBondContact O-N 3.06Å; A1028-T1031 PolarHBondContact O-OG1 3.44Å; R1029-T1031 VanDerWaalsContact C-N 3.26Å; R1029-T1031 PolarHBondContact O-N 2.92Å; T1031-M1034 HydrophobicContact CG2-CE 3.89Å; T1031-N1035 WeakPolarHBondContact O-CB 3.48Å; T1031-N1035 PolarHBondContact O-N 2.93Å; T1031-N1035 VanDerWaalsContact O-N 3.14Å; T1031-N1035 PolarHBondContact O-ND2 2.9Å
1032	N	44.1	Very low	43.4	Very low	32 Å²	32	79.3 Å²	79.3	17%	0.171	41%	0.405	C	S	.	.	H	α-helix	trans	-74.9	-41.2	169.3	-75	-13.5	0	0	0	110.6	K676 E728 A1028 R1029 S1030 M1034 N1035 E1036	K676-N1032 PolarHBondContact NZ-OD1 3.04Å; E728-N1032 PolarHBondContact O-ND2 2.8Å; A1028-N1032 PolarHBondContact O-N 2.79Å; R1029-N1032 WeakPolarHBondContact O-CB 3.5Å; R1029-N1032 PolarHBondContact O-N 3.19Å; S1030-N1032 VanDerWaalsContact C-N 3.34Å; N1032-M1034 VanDerWaalsContact C-N 3.34Å; N1032-M1034 PolarHBondContact O-N 3.27Å; N1032-N1035 WeakPolarHBondContact O-CB 3.37Å; N1032-N1035 PolarHBondContact O-N 2.9Å; N1032-E1036 PolarHBondContact O-N 3.43Å
1033	E	44.3	Very low	42.5	Very low	132 Å²	132	76.1 Å²	76.1	62%	0.617	40%	0.402	S	S	*	.	H	α-helix	trans	-58.9	-43.7	172.5	-61.1	170.6	158.6	0	0	111.2	R1029 S1030 N1035 E1036 L1037	R1029-E1033 PolarHBondContact O-N 2.99Å; S1030-E1033 PolarHBondContact O-N 3.11Å; E1033-N1035 VanDerWaalsContact C-N 3.31Å; E1033-N1035 PolarHBondContact O-N 3.28Å; E1033-E1036 PolarHBondContact O-N 3.23Å; E1033-L1037 PolarHBondContact O-N 3.08Å
1034	M	36.8	Very low	41.6	Very low	73 Å²	73	76.5 Å²	76.5	36%	0.36	41%	0.414	S	S	.	.	H	α-helix	trans	-63.5	-31.4	172.1	-72.5	-161.8	-69.3	0	0	113.6	S1030 T1031 N1032 L1037 I1038	S1030-M1034 PolarHBondContact O-N 3.46Å; T1031-M1034 HydrophobicContact CG2-CE 3.89Å; N1032-M1034 VanDerWaalsContact C-N 3.34Å; N1032-M1034 PolarHBondContact O-N 3.27Å; M1034-L1037 PolarHBondContact O-N 2.92Å; M1034-I1038 HydrophobicContact CB-CD1 4.48Å; M1034-I1038 WeakPolarHBondContact O-CB 3.45Å; M1034-I1038 WeakPolarHBondContact O-CD1 3.48Å; M1034-I1038 WeakPolarHBondContact O-CG1 3.43Å; M1034-I1038 PolarHBondContact O-N 2.81Å
1035	N	40	Very low	40.6	Very low	33 Å²	33	79.7 Å²	79.7	18%	0.176	45%	0.446	C	S	.	.	H	α-helix	trans	-71.6	-30.4	179.4	-92.1	-57.1	0	0	0	113.1	D672 K676 T1031 N1032 E1033 S1039	D672-N1035 PolarHBondContact OD1-ND2 2.85Å; K676-N1035 PolarHBondContact NZ-ND2 3.26Å; T1031-N1035 WeakPolarHBondContact O-CB 3.48Å; T1031-N1035 PolarHBondContact O-N 2.93Å; T1031-N1035 VanDerWaalsContact O-N 3.14Å; T1031-N1035 PolarHBondContact O-ND2 2.9Å; N1032-N1035 WeakPolarHBondContact O-CB 3.37Å; N1032-N1035 PolarHBondContact O-N 2.9Å; E1033-N1035 VanDerWaalsContact C-N 3.31Å; E1033-N1035 PolarHBondContact O-N 3.28Å; N1035-S1039 WeakPolarHBondContact O-CB 3.26Å; N1035-S1039 PolarHBondContact O-N 3.47Å; N1035-S1039 PolarHBondContact O-OG 3.47Å
1036	E	37.2	Very low	39.6	Very low	149 Å²	149	84.1 Å²	84.1	70%	0.696	47%	0.468	S	S	*	.	H	α-helix	trans	-66.5	-45	168	-70	-141.1	120.5	0	0	111.3	N1032 E1033 I1038 S1039 L1040	N1032-E1036 PolarHBondContact O-N 3.43Å; E1033-E1036 PolarHBondContact O-N 3.23Å; E1036-I1038 PolarHBondContact O-N 3.46Å; E1036-S1039 WeakPolarHBondContact O-CB 3.39Å; E1036-S1039 PolarHBondContact O-N 3.42Å; E1036-S1039 VanDerWaalsContact O-N 3.13Å; E1036-L1040 PolarHBondContact O-N 3.09Å
1037	L	34	Very low	38.3	Very low	39 Å²	39	83.5 Å²	83.5	20%	0.204	47%	0.472	C	S	.	.	H	α-helix	trans	-61.3	-40.8	176.7	-66	170.9	0	0	0	112.2	F980 A983 E1033 M1034 S1039 L1040 S1041	F980-L1037 HydrophobicContact CD2-CD2 4.31Å; F980-L1037 HydrophobicContact CE2-CD2 3.57Å; F980-L1037 HydrophobicContact CZ-CD2 3.77Å; A983-L1037 HydrophobicContact CB-CD1 4.13Å; E1033-L1037 PolarHBondContact O-N 3.08Å; M1034-L1037 PolarHBondContact O-N 2.92Å; L1037-S1039 VanDerWaalsContact C-N 3.33Å; L1037-S1039 PolarHBondContact O-N 2.99Å; L1037-L1040 CarbonylContact O-C 3.41Å; L1037-L1040 PolarHBondContact O-N 3.43Å; L1037-S1041 WeakPolarHBondContact O-CB 3.33Å; L1037-S1041 PolarHBondContact O-N 3.33Å
1038	I	34.2	Very low	37.2	Very low	69 Å²	69	88.1 Å²	88.1	35%	0.354	48%	0.483	S	S	.	.	H	α-helix	trans	-68.7	-30.8	175.7	-69.4	163	0	0	0	111.7	F664 M1034 E1036 L1040 S1041	F664-I1038 HydrophobicContact CE1-CG2 4.26Å; M1034-I1038 HydrophobicContact CB-CD1 4.48Å; M1034-I1038 WeakPolarHBondContact O-CB 3.45Å; M1034-I1038 WeakPolarHBondContact O-CD1 3.48Å; M1034-I1038 WeakPolarHBondContact O-CG1 3.43Å; M1034-I1038 PolarHBondContact O-N 2.81Å; E1036-I1038 PolarHBondContact O-N 3.46Å; I1038-L1040 VanDerWaalsContact C-N 3.29Å; I1038-S1041 WeakPolarHBondContact CA-OG 3.49Å; I1038-S1041 PolarHBondContact O-N 3.08Å; I1038-S1041 PolarHBondContact O-OG 3.37Å; I1038-S1041 VanDerWaalsContact O-OG 3.08Å
1039	S	37.6	Very low	36	Very low	89 Å²	89	98.3 Å²	98.3	62%	0.622	52%	0.522	S	S	*	.	H	α-helix	trans	-69.6	-29.1	172.8	-63.2	0	0	0	0	112.3	N1035 E1036 L1037 N1042	N1035-S1039 WeakPolarHBondContact O-CB 3.26Å; N1035-S1039 PolarHBondContact O-N 3.47Å; N1035-S1039 PolarHBondContact O-OG 3.47Å; E1036-S1039 WeakPolarHBondContact O-CB 3.39Å; E1036-S1039 PolarHBondContact O-N 3.42Å; E1036-S1039 VanDerWaalsContact O-N 3.13Å; L1037-S1039 VanDerWaalsContact C-N 3.33Å; L1037-S1039 PolarHBondContact O-N 2.99Å; S1039-N1042 PolarHBondContact O-ND2 3.31Å
1040	L	34.3	Very low	34.9	Very low	118 Å²	118	103.4 Å²	103.4	62%	0.618	54%	0.541	S	S	*	.	H	α-helix	trans	-82.4	-25.7	173.6	-69.3	164.9	0	0	0	113.2	F980 E1036 L1037 I1038 N1042	F980-L1040 HydrophobicContact CE2-CD1 4.4Å; F980-L1040 HydrophobicContact CZ-CD1 4.29Å; E1036-L1040 PolarHBondContact O-N 3.09Å; L1037-L1040 CarbonylContact O-C 3.41Å; L1037-L1040 PolarHBondContact O-N 3.43Å; I1038-L1040 VanDerWaalsContact C-N 3.29Å; L1040-N1042 PolarHBondContact O-N 3.1Å
1041	S	32.3	Very low	33.9	Very low	52 Å²	52	109 Å²	109	36%	0.364	57%	0.565	S	S	.	*			trans	-74.2	49.8	-173.1	77.6	0	0	0	0	115.3	L1037 I1038 G1043	L1037-S1041 WeakPolarHBondContact O-CB 3.33Å; L1037-S1041 PolarHBondContact O-N 3.33Å; I1038-S1041 WeakPolarHBondContact CA-OG 3.49Å; I1038-S1041 PolarHBondContact O-N 3.08Å; I1038-S1041 PolarHBondContact O-OG 3.37Å; I1038-S1041 VanDerWaalsContact O-OG 3.08Å; S1041-G1043 PolarHBondContact O-N 3.38Å
1042	N	32.5	Very low	32.9	Very low	110 Å²	110	110.9 Å²	110.9	59%	0.588	59%	0.591	S	S	*	*			trans	-75.5	71.9	173.9	-82.1	-83.7	0	0	0	111.4	S1039 L1040	S1039-N1042 PolarHBondContact O-ND2 3.31Å; L1040-N1042 PolarHBondContact O-N 3.1Å
1043	G	31	Very low	32.1	Very low	58 Å²	58	120.8 Å²	120.8	60%	0.598	63%	0.626	S	S	*	*	P	Polyproline II helix	trans	-55.2	155.4	-173.9	0	0	0	0	0	115.9	S1041	S1041-G1043 PolarHBondContact O-N 3.38Å
1044	P	30.6	Very low	31.5	Very low	121 Å²	121	122.4 Å²	122.4	79%	0.786	64%	0.638	S	S	*	*	P	Polyproline II helix	trans	-70.5	135	-160.4	26.6	-35.5	0	0	0	114.4	F1046	P1044-F1046 PolarHBondContact O-N 2.96Å
1045	A	29	Very low	31.1	Very low	101 Å²	101	124.7 Å²	124.7	84%	0.835	66%	0.661	S	S	*	*	P	Polyproline II helix	trans	-71.4	124.3	173.4	0	0	0	0	0	111.5
1046	F	29	Very low	30.7	Very low	159 Å²	159	129.8 Å²	129.8	70%	0.697	68%	0.678	S	S	*	*			trans	-41.8	129.8	-174.1	-96.8	-107.5	0	0	0	115.9	P1044 R1048	P1044-F1046 PolarHBondContact O-N 2.96Å; F1046-R1048 PolarHBondContact O-N 3.33Å; F1046-R1048 VanDerWaalsContact O-N 3.07Å
1047	T	27.4	Very low	30.5	Very low	116 Å²	116	125.6 Å²	125.6	71%	0.712	67%	0.674	S	S	*	*			trans	26.4	68.7	145.2	50.4	0	0	0	0	117.5	Y1049	T1047-Y1049 PolarHBondContact O-N 3.05Å
1048	R	26.2	Very low	30.4	Very low	191 Å²	191	130 Å²	130	72%	0.721	70%	0.698	S	S	*	*			trans	-69.2	98.8	161.8	-168.3	-171.2	-52.1	169.6	10.8	109.3	F1046 R1050	F1046-R1048 PolarHBondContact O-N 3.33Å; F1046-R1048 VanDerWaalsContact O-N 3.07Å; R1048-R1050 PolarHBondContact O-N 3.1Å
1049	Y	25.8	Very low	30.4	Very low	223 Å²	223	134 Å²	134	88%	0.875	72%	0.72	S	S	*	*			trans	-42.9	113.7	173.5	-109.7	-96.7	0	0	0	110.6	T1047	T1047-Y1049 PolarHBondContact O-N 3.05Å
1050	R	27.3	Very low	30.4	Very low	234 Å²	234	137.3 Å²	137.3	88%	0.883	73%	0.725	S	S	*	*			trans	-113.3	83.6	-177.8	-161.9	-178.9	-157.2	173.8	5.7	108.2	R1048 G1052	R1048-R1050 PolarHBondContact O-N 3.1Å; R1050-G1052 PolarHBondContact O-N 3.11Å
1051	I	30.7	Very low	30.4	Very low	161 Å²	161	138.8 Å²	138.8	83%	0.826	73%	0.734	S	S	*	*			trans	-48.2	130.9	174.4	-61.3	174.7	0	0	0	108.4	R1053	I1051-R1053 PolarHBondContact O-N 3.17Å
1052	G	26.6	Very low	30.6	Very low	68 Å²	68	142.6 Å²	142.6	70%	0.701	75%	0.75	S	S	*	*			trans	-62.5	124.4	-157.1	0	0	0	0	0	113.9	R1050 L1054	R1050-G1052 PolarHBondContact O-N 3.11Å; G1052-L1054 PolarHBondContact O-N 3.41Å
1053	R	28.4	Very low	31	Very low	241 Å²	241	146.8 Å²	146.8	91%	0.909	77%	0.766	S	S	*	*			trans	-80.5	102.2	154.2	-79.2	-167.4	176.1	-165.5	-1.3	108	I1051 S1055	I1051-R1053 PolarHBondContact O-N 3.17Å; R1053-S1055 PolarHBondContact O-N 3.4Å
1054	L	31.1	Very low	31.1	Very low	166 Å²	166	151.6 Å²	151.6	87%	0.869	78%	0.778	S	S	*	*			trans	-59.6	125.5	159	-77.1	163.3	0	0	0	108.3	G1052 R1056	G1052-L1054 PolarHBondContact O-N 3.41Å; L1054-R1056 PolarHBondContact O-N 3.37Å
1055	S	29.1	Very low	31.2	Very low	120 Å²	120	153.6 Å²	153.6	84%	0.839	78%	0.783	S	S	*	*			trans	-66.5	101.8	172.1	-59.9	0	0	0	0	109.1	R1053 G1057	R1053-S1055 PolarHBondContact O-N 3.4Å; S1055-G1057 PolarHBondContact O-N 2.87Å
1056	R	31.2	Very low	31.6	Very low	141 Å²	141	153.6 Å²	153.6	53%	0.532	78%	0.776	S	S	.	*			trans	-69.2	105.8	151.4	-79	179	164.5	127.8	-11.2	105.6	E385 L1054	E385-R1056 IonicContact OE1-CZ 2.73Å; E385-R1056 IonicContact OE1-NH1 3.03Å; E385-R1056 PolarHBondContact OE1-NH1 3.37Å; E385-R1056 IonicContact OE1-NH2 3.69Å; E385-R1056 PolarHBondContact OE1-NH2 3.26Å; E385-R1056 IonicContact OE2-NH1 2.61Å; L1054-R1056 PolarHBondContact O-N 3.37Å
1057	G	32.2	Very low	31.9	Very low	60 Å²	60	155 Å²	155	62%	0.619	79%	0.785	S	S	*	*			trans	-70.1	130.1	159.3	0	0	0	0	0	107.4	S1055	S1055-G1057 PolarHBondContact O-N 2.87Å
1058	D	32.8	Very low	32.2	Very low	133 Å²	133	157 Å²	157	71%	0.711	79%	0.792	S	S	*	*			trans	-84.2	115.2	163.7	-63.5	-61.6	0	0	0	106	E1060	D1058-E1060 PolarHBondContact O-N 3.35Å
1059	D	34.3	Very low	32.5	Very low	152 Å²	152	154 Å²	154	81%	0.813	80%	0.795	S	S	*	*			trans	-85.4	99.2	172	-66.7	-38.6	0	0	0	106.8
1060	E	36.9	Very low	33.1	Very low	158 Å²	158	151.4 Å²	151.4	74%	0.738	80%	0.796	S	S	*	*			trans	-86.3	153.6	162.2	-68.4	-179.7	153.8	0	0	109.3	D1058	D1058-E1060 PolarHBondContact O-N 3.35Å
1061	D	34.7	Very low	33.3	Very low	150 Å²	150	149.2 Å²	149.2	80%	0.802	80%	0.796	S	S	*	*			trans	-74.5	135.6	-160.6	-46.8	-93	0	0	0	113.7
1062	D	35.2	Very low	33.7	Very low	132 Å²	132	149.7 Å²	149.7	71%	0.706	80%	0.8	S	S	*	*			trans	-117.6	136.8	162.3	-78.6	-52	0	0	0	106.6
1063	E	41	Very low	34.1	Very low	198 Å²	198	155 Å²	155	93%	0.925	81%	0.806	S	S	*	*			trans	-77.9	170.5	-165.5	-64	179.3	130.6	0	0	114.7
1064	D	34.1	Very low	34.4	Very low	158 Å²	158	148.3 Å²	148.3	85%	0.845	80%	0.796	S	S	*	*			trans	-68	142.4	-175.2	-67.1	-67.8	0	0	0	113.3
1065	D	32.9	Very low	34.6	Very low	164 Å²	164	147.2 Å²	147.2	88%	0.877	79%	0.792	S	S	*	*			trans	-154.9	93.3	163.7	-107.8	-24.6	0	0	0	108.6
1066	S	37	Very low	34.9	Very low	101 Å²	101	149.2 Å²	149.2	71%	0.706	79%	0.793	S	S	*	*			trans	-153.8	85.3	166	65.6	0	0	0	0	110.3	D1068	S1066-D1068 PolarHBondContact O-N 2.88Å
1067	E	34.2	Very low	35.1	Very low	187 Å²	187	145.8 Å²	145.8	87%	0.874	80%	0.801	S	S	*	*			trans	-66.9	111.2	161.6	-62.1	177	142.6	0	0	108.5
1068	D	35.5	Very low	35	Very low	160 Å²	160	148.9 Å²	148.9	86%	0.856	81%	0.812	S	S	*	*			trans	-125.8	109.6	157	-88.6	-49.5	0	0	0	105.3	S1066	S1066-D1068 PolarHBondContact O-N 2.88Å
1069	T	32.5	Very low	35	Very low	127 Å²	127	149.7 Å²	149.7	78%	0.779	82%	0.815	S	S	*	*			trans	-78.1	134	179.5	49.4	0	0	0	0	111.1
1070	D	37.2	Very low	35	Very low	168 Å²	168	148 Å²	148	90%	0.898	81%	0.81	S	S	*	*			trans	-143.9	125.7	151.8	-82	-46.2	0	0	0	106.8
1071	E	32.9	Very low	34.7	Very low	189 Å²	189	150 Å²	150	88%	0.883	81%	0.812	S	S	*	*			trans	-92.5	143.8	178.1	-61.1	176.7	139.6	0	0	109.8
1072	D	38.4	Very low	34.9	Very low	171 Å²	171	148.3 Å²	148.3	91%	0.914	81%	0.809	S	S	*	*			trans	-158.4	146.3	164.4	-101.6	-35.9	0	0	0	108.8
1073	E	35.4	Very low	34.8	Very low	179 Å²	179	148.1 Å²	148.1	84%	0.836	81%	0.808	S	S	*	*			trans	-99.8	-173.7	-155.9	-54.5	179.7	106.8	0	0	115.2
1074	S	33.6	Very low	34.5	Very low	100 Å²	100	144.1 Å²	144.1	70%	0.699	80%	0.798	S	S	*	*			trans	64.1	128.3	152.3	52.2	0	0	0	0	118.4
1075	D	36.4	Very low	34.5	Very low	144 Å²	144	143.7 Å²	143.7	77%	0.77	80%	0.795	S	S	*	*			cis	-170.5	156.5	31.1	-90.8	-27.5	0	0	0	113.4
1076	D	35.4	Very low	34.6	Very low	162 Å²	162	140.6 Å²	140.6	87%	0.866	79%	0.786	S	S	*	*			trans	54.6	146.2	142.7	-77.8	-15.5	0	0	0	127.4
1077	G	34.2	Very low	34.6	Very low	69 Å²	69	140.5 Å²	140.5	71%	0.711	79%	0.786	S	S	*	*			trans	94.5	81.5	154.5	0	0	0	0	0	116.7
1078	C	30.3	Very low	34.7	Very low	124 Å²	124	138 Å²	138	84%	0.838	78%	0.784	S	S	*	*				78.6	148.3	55.5	-159.3	0	0	0	0	115.2
1079	I	33.5	Very low	34.9	Very low	151 Å²	151	135.2 Å²	135.2	77%	0.774	77%	0.774	S	S	*	*			trans	82.2	126.2	-178.6	-57.7	171.9	0	0	0	115.3
1080	T	34.7	Very low	34.8	Very low	115 Å²	115	136.5 Å²	136.5	71%	0.706	78%	0.776	S	S	*	*			cis	-158.2	156.4	-20	28.5	0	0	0	0	112.6
1081	Y	29.6	Very low	34.8	Very low	201 Å²	201	133.6 Å²	133.6	79%	0.788	77%	0.766	S	S	*	*			trans	-23.1	169.5	147.6	-60.7	-71.2	0	0	0	119.9
1082	P	38.2	Very low	35	Very low	114 Å²	114	129.5 Å²	129.5	74%	0.74	76%	0.759	S	S	*	*			cis	-131.3	-178.4	19.1	39.2	-20.9	0	0	0	115.3
1083	N	34.4	Very low	35	Very low	129 Å²	129	129 Å²	129	69%	0.69	75%	0.75	S	S	*	*			cis	-155.9	161.9	-20.3	-101	-11.2	0	0	0	104.9
1084	T	33.9	Very low	35	Very low	114 Å²	114	126.8 Å²	126.8	70%	0.699	75%	0.745	S	S	*	*			cis	-161.4	146.1	49.4	45.2	0	0	0	0	112.1
1085	N	35	Very low	35	Very low	148 Å²	148	127.3 Å²	127.3	79%	0.791	75%	0.748	S	S	*	*			trans	47.2	135.9	141.8	-52.1	0.7	0	0	0	121
1086	S	34.2	Very low	34.8	Very low	99 Å²	99	127.8 Å²	127.8	69%	0.692	75%	0.751	S	S	*	*			cis	-174.6	152.4	-7	45	0	0	0	0	111.2
1087	S	36.9	Very low	34.8	Very low	99 Å²	99	130.2 Å²	130.2	69%	0.692	75%	0.748	S	S	*	*			trans	55.4	120.8	163.2	51.6	0	0	0	0	119.2
1088	T	36.5	Very low	34.5	Very low	136 Å²	136	131.7 Å²	131.7	83%	0.834	75%	0.747	S	S	*	*			cis	88.6	159.4	28.1	82.8	0	0	0	0	115.3
1089	P	38.8	Very low	34.6	Very low	101 Å²	101	133.4 Å²	133.4	66%	0.656	75%	0.747	S	S	*	*				-143.8	171.3	-83.8	42	-23.4	0	0	0	118.2
1090	N	31.6	Very low	34.3	Very low	153 Å²	153	131 Å²	131	82%	0.818	74%	0.744	S	S	*	*			trans	61.5	172.4	144	-77.3	7.1	0	0	0	121.3
1091	P	37.5	Very low	34.1	Very low	107 Å²	107	136.5 Å²	136.5	70%	0.695	75%	0.751	S	S	*	*			cis	-138	-177.4	-35.3	36.7	-18.6	0	0	0	115.9
1092	S	35.8	Very low	34.2	Very low	103 Å²	103	134.5 Å²	134.5	72%	0.72	75%	0.749	S	S	*	*			trans	101.1	150.4	138.3	80.5	0	0	0	0	123.5
1093	H	39.3	Very low	33.8	Very low	160 Å²	160	136.6 Å²	136.6	74%	0.741	74%	0.743	S	S	*	*			trans	73.6	111	164.8	-78.3	-80.1	0	0	0	123.9
1094	D	34.8	Very low	33.9	Very low	134 Å²	134	136.7 Å²	136.7	72%	0.717	74%	0.74	S	S	*	*			trans	72.9	134.7	132.1	-62.7	-24.4	0	0	0	126.4
1095	S	34.1	Very low	34	Very low	110 Å²	110	137.7 Å²	137.7	77%	0.769	74%	0.736	S	S	*	*			trans	83.6	112.3	148.1	70.8	0	0	0	0	121
1096	D	33	Very low	34.1	Very low	154 Å²	154	136.5 Å²	136.5	82%	0.824	73%	0.726	S	S	*	*			trans	74.2	154.9	137	-118	-31.4	0	0	0	122.8
1097	R	34.4	Very low	34	Very low	214 Å²	214	141.9 Å²	141.9	81%	0.808	73%	0.731	S	S	*	*			trans	52.9	94	161.6	-75.3	-177.9	167	-177.7	-3	120.9
1098	S	28.3	Very low	33.9	Very low	99 Å²	99	141.4 Å²	141.4	69%	0.692	73%	0.728	S	S	*	*				64.8	145.4	115.3	72.7	0	0	0	0	122.8
1099	L	31.4	Very low	34	Very low	161 Å²	161	143.4 Å²	143.4	84%	0.843	73%	0.725	S	S	*	*			trans	75.8	97.4	156.8	-65.7	162.6	0	0	0	120.2
1100	S	28.7	Very low	33.9	Very low	100 Å²	100	146.3 Å²	146.3	70%	0.699	73%	0.729	S	S	*	*				62	106.6	121	-158.5	0	0	0	0	121.8
1101	R	28.9	Very low	33.8	Very low	230 Å²	230	146.3 Å²	146.3	87%	0.868	73%	0.729	S	S	*	*			trans	45.9	106.2	135	-64.5	177.5	169.4	177.8	-1.8	119.8
1102	H	32.7	Very low	34	Very low	159 Å²	159	146.1 Å²	146.1	74%	0.736	73%	0.728	S	S	*	*			trans	-163.6	155.3	148.3	-108.8	55.9	0	0	0	108
1103	Y	29.9	Very low	33.9	Very low	159 Å²	159	149.1 Å²	149.1	62%	0.624	73%	0.731	S	S	*	*			cis	-171.1	152.7	-15.8	-140.1	-150.3	0	0	0	111.2
1104	Q	35.7	Very low	33.6	Very low	131 Å²	131	147.2 Å²	147.2	61%	0.612	73%	0.73	S	S	*	*			trans	62.2	177	142.1	-84.2	-174.6	-1.7	0	0	119.9
1105	Q	37	Very low	33.4	Very low	135 Å²	135	148.7 Å²	148.7	63%	0.631	73%	0.733	S	S	*	*			cis	-152.8	176.7	0.3	-131.9	-175.6	83.6	0	0	108.2
1106	Q	35.9	Very low	33.4	Very low	122 Å²	122	149.2 Å²	149.2	57%	0.57	73%	0.726	S	S	*	*			cis	-160.9	177.1	-7	-158	-171.5	37.7	0	0	108.5
1107	R	33.7	Very low	33.3	Very low	213 Å²	213	147.8 Å²	147.8	80%	0.804	72%	0.718	S	S	*	*			trans	90.5	149.5	153.2	-50.2	-144.1	169.3	153.4	6.9	118.7
1108	S	33	Very low	33.3	Very low	89 Å²	89	145.6 Å²	145.6	62%	0.622	71%	0.714	S	S	*	*			cis	-172.6	157.5	-27.3	58.6	0	0	0	0	112.3
1109	K	40.3	Very low	33.5	Very low	177 Å²	177	150 Å²	150	77%	0.77	72%	0.721	S	S	*	*			trans	74.9	134.8	162.4	-61.3	-175	170.6	-168.1	0	117
1110	Q	35.4	Very low	33.4	Very low	162 Å²	162	146.9 Å²	146.9	76%	0.757	71%	0.713	S	S	*	*			cis	-155.9	147.6	-13	-126.8	161.9	-48.2	0	0	111
1111	D	30.4	Very low	33.3	Very low	153 Å²	153	148.2 Å²	148.2	82%	0.818	72%	0.717	S	S	*	*			trans	-87.5	-175.2	-175.2	-61.8	-79.7	0	0	0	112.7
1112	P	40.7	Very low	33.2	Very low	103 Å²	103	144.3 Å²	144.3	67%	0.669	71%	0.712	S	S	*	*			cis	-126	-160.9	3.2	42.5	-23.2	0	0	0	112.6
1113	E	33.6	Very low	32.8	Very low	167 Å²	167	143 Å²	143	78%	0.78	72%	0.715	S	S	*	*			cis	-154.8	176.8	7.9	-143	150.2	-93.3	0	0	106.9
1114	V	34.1	Very low	32.8	Very low	120 Å²	120	141.1 Å²	141.1	73%	0.727	73%	0.725	S	S	*	*			cis	-144.5	168	21.7	-176.6	0	0	0	0	110.7
1115	E	31.3	Very low	32.4	Very low	164 Å²	164	146.4 Å²	146.4	77%	0.766	74%	0.739	S	S	*	*			trans	-36.8	157.3	165.8	-65.4	-164.5	124.5	0	0	118.3
1116	I	32.6	Very low	31.9	Very low	121 Å²	121	146.5 Å²	146.5	62%	0.621	75%	0.749	S	S	*	*			cis	-157.6	143.9	15.1	-128.5	156.1	0	0	0	111.2
1117	N	32.3	Very low	31.6	Very low	124 Å²	124	146.6 Å²	146.6	66%	0.663	76%	0.758	S	S	*	*			trans	50.8	143.2	161	-67.6	-47	0	0	0	120.7
1118	K	34.2	Very low	31.5	Very low	168 Å²	168	141.9 Å²	141.9	73%	0.73	75%	0.753	S	S	*	*			cis	-163.6	152.6	0.3	-109.9	158.2	-172.3	168.2	0	108.9
1119	K	31.1	Very low	31.1	Very low	192 Å²	192	146.2 Å²	146.2	84%	0.835	77%	0.768	S	S	*	*			trans	22.9	141.2	143.6	-57.8	-176.2	-177.3	-173.9	0	120
1120	S	29.3	Very low	30.6	Very low	96 Å²	96	144.4 Å²	144.4	67%	0.671	77%	0.772	S	S	*	*			cis	-176	130	1.5	42.7	0	0	0	0	113.5
1121	T	26.7	Very low	30.2	Very low	128 Å²	128	140 Å²	140	79%	0.785	77%	0.77	S	S	*	*			trans	61.6	147.6	133.5	-25.1	0	0	0	0	122.9
1122	I	27	Very low	30.1	Very low	147 Å²	147	139.1 Å²	139.1	75%	0.754	77%	0.77	S	S	*	*			trans	83.5	92.6	163.7	-45	-173.5	0	0	0	118.4
1123	V	25	Very low	29.4	Very low	132 Å²	132	138.2 Å²	138.2	80%	0.8	77%	0.767	S	S	*	*			trans	29.7	109.9	134.2	-168.9	0	0	0	0	119
1124	S	29.3	Very low	29.1	Very low	119 Å²	119	140.1 Å²	140.1	83%	0.832	77%	0.767	S	S	*	*			trans	-156.3	136.7	147.8	-82.4	0	0	0	0	110.2
1125	R	28	Very low	28.7	Very low	243 Å²	243	138.7 Å²	138.7	92%	0.917	75%	0.753	S	S	*	*			trans	-85.1	126.1	-175.5	-77.7	174.7	165	151.4	-6.5	111.7	T1127	R1125-T1127 PolarHBondContact O-N 3.06Å
1126	T	27.2	Very low	28.6	Very low	137 Å²	137	135.3 Å²	135.3	84%	0.84	75%	0.753	S	S	*	*			trans	-86.2	102.4	-177.8	-6.4	0	0	0	0	112.5
1127	T	29.2	Very low	28.4	Very low	124 Å²	124	137.2 Å²	137.2	76%	0.761	76%	0.757	S	S	*	*			trans	-95.9	107.7	179.7	34.2	0	0	0	0	113.7	R1125	R1125-T1127 PolarHBondContact O-N 3.06Å
1128	T	30.6	Very low	28.2	Very low	113 Å²	113	136.1 Å²	136.1	69%	0.693	77%	0.766	S	S	*	*			trans	34.6	118.4	143.1	49.4	0	0	0	0	120.6	V1130	T1128-V1130 PolarHBondContact O-N 2.77Å
1129	L	25.9	Very low	27.9	Very low	181 Å²	181	135.2 Å²	135.2	95%	0.948	77%	0.769	S	S	*	*			trans	-62.8	127.3	166.7	-65.2	89.8	0	0	0	112.9
1130	V	29.6	Very low	27.9	Very low	138 Å²	138	132.6 Å²	132.6	84%	0.836	76%	0.757	S	S	*	*			trans	-134.4	130.3	156.6	-175.7	0	0	0	0	108.7	T1128	T1128-V1130 PolarHBondContact O-N 2.77Å
1131	G	25.9	Very low	27.9	Very low	70 Å²	70	140.2 Å²	140.2	72%	0.722	77%	0.771	S	S	*	*			trans	-89.7	139.3	-169.1	0	0	0	0	0	114.7	S1133	G1131-S1133 PolarHBondContact O-N 3.32Å
1132	T	28.7	Very low	28	Very low	135 Å²	135	139.2 Å²	139.2	83%	0.828	77%	0.77	S	S	*	*			trans	-98.2	65.7	176.6	59.8	0	0	0	0	112.8	R1134	T1132-R1134 VanDerWaalsContact C-N 3.27Å; T1132-R1134 PolarHBondContact O-N 3.31Å
1133	S	25.5	Very low	28	Very low	84 Å²	84	137.9 Å²	137.9	59%	0.587	77%	0.77	S	S	*	*			trans	-71.8	75.8	172.7	-72	0	0	0	0	112	G1131 M1135	G1131-S1133 PolarHBondContact O-N 3.32Å; S1133-M1135 VanDerWaalsContact C-N 3.26Å; S1133-M1135 PolarHBondContact O-N 2.89Å
1134	R	27.4	Very low	28.1	Very low	207 Å²	207	137 Å²	137	78%	0.781	77%	0.765	S	S	*	*			trans	-81	70.9	171.6	-85.8	-173.8	169	160.6	0.5	111.9	T1132 A1136	T1132-R1134 VanDerWaalsContact C-N 3.27Å; T1132-R1134 PolarHBondContact O-N 3.31Å; R1134-A1136 PolarHBondContact O-N 3.33Å
1135	M	25.5	Very low	28.1	Very low	90 Å²	90	137 Å²	137	44%	0.443	77%	0.765	S	S	.	*			trans	-73.7	90.1	169.9	-97.4	163.2	146.4	0	0	110.9	E266 F270 S1133 F1137	E266-M1135 HydrophobicContact CB-CB 4.12Å; E266-M1135 HydrophobicContact CB-CE 4.46Å; E266-M1135 HydrophobicContact CB-CG 4.35Å; E266-M1135 HydrophobicContact CB-SD 3.66Å; E266-M1135 HydrophobicContact CG-SD 4.37Å; E266-M1135 WeakPolarHBondContact OE2-CB 3.21Å; E266-M1135 WeakPolarHBondContact OE2-CG 3.37Å; F270-M1135 HydrophobicContact CD2-SD 4.01Å; F270-M1135 HydrophobicContact CE2-CE 3.92Å; F270-M1135 HydrophobicContact CE2-SD 3.6Å; F270-M1135 VanDerWaalsContact CE2-SD 3.6Å; S1133-M1135 VanDerWaalsContact C-N 3.26Å; S1133-M1135 PolarHBondContact O-N 2.89Å; M1135-F1137 PolarHBondContact O-N 2.73Å
1136	A	29.2	Very low	28.1	Very low	93 Å²	93	137.3 Å²	137.3	77%	0.769	77%	0.766	S	S	*	*			trans	-94.5	84.1	178.8	0	0	0	0	0	111	R1134 A1138	R1134-A1136 PolarHBondContact O-N 3.33Å; A1136-A1138 PolarHBondContact O-N 2.96Å
1137	F	29.4	Very low	28	Very low	160 Å²	160	139.4 Å²	139.4	70%	0.702	77%	0.771	S	S	*	*			trans	15.9	97.9	167.9	-80.9	-89.9	0	0	0	116.7	D265 M1135 N1139	D265-F1137 HydrophobicContact CB-CE2 4.26Å; D265-F1137 HydrophobicContact CB-CZ 3.87Å; M1135-F1137 PolarHBondContact O-N 2.73Å; F1137-N1139 PolarHBondContact O-N 2.58Å; F1137-N1139 VanDerWaalsContact O-N 3.07Å
1138	A	27.2	Very low	28	Very low	102 Å²	102	142.5 Å²	142.5	84%	0.843	77%	0.774	S	S	*	*			trans	-65.6	105	178.8	0	0	0	0	0	112.5	A1136	A1136-A1138 PolarHBondContact O-N 2.96Å
1139	N	28.9	Very low	27.8	Very low	148 Å²	148	141.3 Å²	141.3	79%	0.791	77%	0.771	S	S	*	*			trans	-143.2	65.4	168.8	-143.4	-24.1	0	0	0	114	F1137	F1137-N1139 PolarHBondContact O-N 2.58Å; F1137-N1139 VanDerWaalsContact O-N 3.07Å
1140	K	31.4	Very low	28	Very low	138 Å²	138	139 Å²	139	60%	0.6	76%	0.764	S	S	*	*			trans	-158.1	103.8	160.2	-133.8	136.4	-70.4	-172.3	0	111.2
1141	R	28.3	Very low	27.9	Very low	255 Å²	255	141 Å²	141	96%	0.962	76%	0.758	S	S	*	*			trans	-73.7	128.8	167.6	-67.7	179.6	177.1	-177.3	-1.9	109.7
1142	S	28.1	Very low	27.9	Very low	108 Å²	108	148.5 Å²	148.5	76%	0.755	76%	0.764	S	S	*	*			trans	-128.2	140.1	152.8	49	0	0	0	0	108.2
1143	P	28	Very low	27.7	Very low	118 Å²	118	148.7 Å²	148.7	77%	0.766	75%	0.754	S	S	*	*			trans	-85.5	-172.3	-176.6	36.1	-36	0	0	0	112.6
1144	V	27.9	Very low	27.9	Very low	115 Å²	115	154 Å²	154	70%	0.697	77%	0.767	S	S	*	*			trans	78.9	88.1	173.6	-167.9	0	0	0	0	115.2
1145	S	28.1	Very low	27.8	Very low	117 Å²	117	149.1 Å²	149.1	82%	0.818	76%	0.759	S	S	*	*			trans	173.5	54.8	144.4	60.7	0	0	0	0	113
1146	R	27.5	Very low	28	Very low	251 Å²	251	154.6 Å²	154.6	95%	0.947	78%	0.781	S	S	*	*			trans	-160.8	68.3	165.9	-117.6	171	-162.5	-170.5	4.2	113.6
1147	L	26.8	Very low	27.9	Very low	180 Å²	180	158.6 Å²	158.6	94%	0.942	78%	0.784	S	S	*	*			trans	-117.8	79.2	157.4	-93.6	167.2	0	0	0	108.4
1148	K	29.4	Very low	27.9	Very low	189 Å²	189	157 Å²	157	82%	0.822	79%	0.787	S	S	*	*			trans	-129.3	124.4	149.9	-82.8	-151.3	171.3	-159.6	0	106.8
1149	S	26.2	Very low	27.7	Very low	89 Å²	89	156.8 Å²	156.8	62%	0.622	78%	0.78	S	S	*	*			trans	-84.4	119.3	-174.9	44.3	0	0	0	0	111.1
1150	T	30.1	Very low	27.7	Very low	131 Å²	131	156.2 Å²	156.2	80%	0.804	78%	0.781	S	S	*	*			trans	-124.5	71.2	161.4	50.7	0	0	0	0	109.7	R1152	T1150-R1152 VanDerWaalsContact C-N 3.32Å; T1150-R1152 PolarHBondContact O-N 2.96Å
1151	Y	25.9	Very low	27.4	Very low	182 Å²	182	156.1 Å²	156.1	71%	0.714	79%	0.787	S	S	*	*			trans	-65.3	93.9	164.3	-111.8	-85.8	0	0	0	108.1	F1153	Y1151-F1153 HydrophobicContact CD1-CD2 4.06Å; Y1151-F1153 HydrophobicContact CD1-CE2 4.03Å; Y1151-F1153 HydrophobicContact CE1-CE2 4.09Å
1152	R	26.3	Very low	27.3	Very low	227 Å²	227	149.5 Å²	149.5	86%	0.857	77%	0.77	S	S	*	*			trans	-104.4	81.1	174.6	-151.1	173.8	-160	179.3	8.4	110.2	T1150 K1154	T1150-R1152 VanDerWaalsContact C-N 3.32Å; T1150-R1152 PolarHBondContact O-N 2.96Å; R1152-K1154 PolarHBondContact O-N 3.06Å
1153	F	24.8	Very low	27.1	Very low	138 Å²	138	154.5 Å²	154.5	61%	0.605	77%	0.772	S	S	*	*			trans	-55.2	130.9	167	-102.3	-89.9	0	0	0	109.9	Y1151 T1155	Y1151-F1153 HydrophobicContact CD1-CD2 4.06Å; Y1151-F1153 HydrophobicContact CD1-CE2 4.03Å; Y1151-F1153 HydrophobicContact CE1-CE2 4.09Å; F1153-T1155 HydrophobicContact CD1-CG2 4.18Å
1154	K	29.3	Very low	27	Very low	197 Å²	197	157.8 Å²	157.8	86%	0.857	77%	0.774	S	S	*	*			trans	-129	83.8	162.5	-100.1	-169.7	173	-176.4	0	109.3	R1152	R1152-K1154 PolarHBondContact O-N 3.06Å
1155	T	25.9	Very low	27	Very low	103 Å²	103	162.5 Å²	162.5	63%	0.632	78%	0.781	S	S	*	*			trans	-82.6	113.6	169.9	25.7	0	0	0	0	110.9	F1153	F1153-T1155 HydrophobicContact CD1-CG2 4.18Å
1156	K	30.6	Very low	27	Very low	206 Å²	206	165.1 Å²	165.1	90%	0.896	78%	0.778	S	S	*	*			trans	-142.6	114.2	150.9	-71.7	-166.9	175.3	-169.4	0	104.8
1157	Q	25.5	Very low	27.2	Very low	177 Å²	177	160.3 Å²	160.3	83%	0.827	77%	0.766	S	S	*	*			cis	79.5	55.8	23.5	-151	-177	12.5	0	0	115.8
1158	T	29.5	Very low	27.4	Very low	125 Å²	125	159.8 Å²	159.8	77%	0.767	76%	0.756	S	S	*	*			trans	-144.5	116.4	141.2	45.7	0	0	0	0	105
1159	S	24.4	Very low	27.2	Very low	99 Å²	99	160.9 Å²	160.9	69%	0.692	76%	0.755	S	S	*	*				64.7	146.8	52.2	86	0	0	0	0	113.2
1160	V	27.4	Very low	27.2	Very low	136 Å²	136	167.2 Å²	167.2	82%	0.824	77%	0.765	S	S	*	*			trans	73.2	136.6	-176.3	-176.1	0	0	0	0	114.3
1161	N	25.2	Very low	27.3	Very low	136 Å²	136	165.8 Å²	165.8	73%	0.727	76%	0.758	S	S	*	*			cis	-167.4	-175.7	-31.8	-148.7	-27.2	0	0	0	109.7
1162	I	25.7	Very low	27.4	Very low	116 Å²	116	162.4 Å²	162.4	60%	0.595	76%	0.761	S	S	*	*			trans	72.7	103.6	145.1	-71.9	161.8	0	0	0	120.4
1163	R	25.8	Very low	27.4	Very low	212 Å²	212	157 Å²	157	80%	0.8	76%	0.758	S	S	*	*				53.7	115.4	126.5	-54.1	175.1	-174.1	164.8	-0.1	122.1
1164	K	24.6	Very low	27.3	Very low	187 Å²	187	161.3 Å²	161.3	81%	0.813	77%	0.77	S	S	*	*				40	111.2	117.2	-57.6	171.4	179.6	173.9	0	119.5
1165	Y	29.2	Very low	27	Very low	215 Å²	215	156.4 Å²	156.4	84%	0.843	76%	0.76	S	S	*	*				-153	121.2	121.7	-100.5	-85.2	0	0	0	106.3
1166	K	27.5	Very low	27	Very low	172 Å²	172	159 Å²	159	75%	0.748	77%	0.765	S	S	*	*				61	102.1	53.6	-84.6	-169	174.1	-179.3	0	114.7
1167	H	31.4	Very low	26.8	Very low	149 Å²	149	158.7 Å²	158.7	69%	0.69	76%	0.764	S	S	*	*				162.1	143	127.5	-82.9	-50.3	0	0	0	108.5
1168	K	30.4	Very low	26.9	Very low	170 Å²	170	154.9 Å²	154.9	74%	0.739	76%	0.763	S	S	*	*			cis	-141.6	140.2	-12.9	-94.3	162.3	-177.3	174.9	0	105.3
1169	R	25.5	Very low	27	Very low	211 Å²	211	153.3 Å²	153.3	80%	0.796	76%	0.762	S	S	*	*				54.4	137	76.4	-68.7	-170.1	169	-168.3	-3	113.6
1170	R	25.7	Very low	27.3	Very low	222 Å²	222	155.1 Å²	155.1	84%	0.838	76%	0.764	S	S	*	*			cis	-165.2	-179.4	-9.1	-118.5	-162.5	173.4	-179.6	-4.2	108.9
1171	P	32.6	Very low	27.4	Very low	101 Å²	101	154.2 Å²	154.2	66%	0.656	75%	0.754	S	S	*	*			trans	-108.6	-173.9	-166.9	43.2	-38.6	0	0	0	115.9
1172	S	27.7	Very low	27.6	Very low	112 Å²	112	156.1 Å²	156.1	78%	0.783	76%	0.757	S	S	*	*			trans	69.4	98.2	145.9	68.1	0	0	0	0	121.4
1173	S	26.3	Very low	27.6	Very low	113 Å²	113	157.6 Å²	157.6	79%	0.79	77%	0.765	S	S	*	*			trans	-160.8	130.8	146.9	47.7	0	0	0	0	106.5
1174	R	23.6	Very low	27.7	Very low	228 Å²	228	155 Å²	155	86%	0.86	76%	0.762	S	S	*	*			cis	77.3	127.7	41	-168	-179.4	177.7	163.6	3.5	112.4
1175	C	23.4	Very low	27.7	Very low	94 Å²	94	152 Å²	152	64%	0.635	75%	0.754	S	S	*	*			trans	68.7	148.1	-179.4	-60.6	0	0	0	0	114.8
1176	E	24.2	Very low	27.7	Very low	158 Å²	158	148 Å²	148	74%	0.738	75%	0.752	S	S	*	*			cis	-168.1	-171.9	-32.1	-122.3	153.7	172	0	0	108.8
1177	F	26.5	Very low	27.6	Very low	200 Å²	200	147.9 Å²	147.9	88%	0.877	75%	0.754	S	S	*	*			trans	68	103.8	179.9	-58.1	-84.9	0	0	0	114.9
1178	A	28.9	Very low	27.6	Very low	97 Å²	97	148 Å²	148	80%	0.802	76%	0.759	S	S	*	*			cis	97.7	97.2	26.2	0	0	0	0	0	115.3
1179	A	31.9	Very low	27.3	Very low	92 Å²	92	147.2 Å²	147.2	76%	0.76	76%	0.763	S	S	*	*			trans	-178.1	134.2	144.2	0	0	0	0	0	109.4
1180	N	30.7	Very low	27.6	Very low	136 Å²	136	143.3 Å²	143.3	73%	0.727	76%	0.757	S	S	*	*			cis	-157.7	140.1	-19	-129.3	-17.1	0	0	0	111.8
1181	N	28.6	Very low	27.7	Very low	117 Å²	117	138.8 Å²	138.8	63%	0.626	76%	0.756	S	S	*	*			trans	64.7	123.9	149.2	-70.8	-42.7	0	0	0	123.9
1182	K	29.6	Very low	27.5	Very low	177 Å²	177	139.3 Å²	139.3	77%	0.77	76%	0.762	S	S	*	*			trans	80	117.5	144.2	-62.9	172.6	-176.4	-177.6	0	116.7
1183	L	25.6	Very low	27.6	Very low	146 Å²	146	139.4 Å²	139.4	76%	0.764	76%	0.76	S	S	*	*				69	134.5	74.8	-66.1	172.4	0	0	0	112
1184	H	27.2	Very low	27.8	Very low	159 Å²	159	142.2 Å²	142.2	74%	0.736	76%	0.764	S	S	*	*			cis	-149.1	-160.7	14	-144.1	-16.7	0	0	0	113.6
1185	N	25.4	Very low	28	Very low	123 Å²	123	138.2 Å²	138.2	66%	0.658	76%	0.759	S	S	*	*			trans	-96.6	164.2	-174.2	-55	-47.4	0	0	0	113.5
1186	T	28.2	Very low	28.5	Very low	131 Å²	131	139.7 Å²	139.7	80%	0.804	77%	0.765	S	S	*	*			trans	64.2	160.7	151.4	38.7	0	0	0	0	117.1
1187	E	25.7	Very low	28.9	Very low	170 Å²	170	136.9 Å²	136.9	79%	0.794	76%	0.761	S	S	*	*			cis	-143.2	-163.2	10.8	-146.5	164.5	-140.6	0	0	112.8
1188	L	31.7	Very low	29.1	Very low	151 Å²	151	136.4 Å²	136.4	79%	0.791	76%	0.759	S	S	*	*			trans	-75.1	156	-179.2	-71.9	158.6	0	0	0	113.3
1189	N	24.4	Very low	29.2	Very low	154 Å²	154	137.7 Å²	137.7	82%	0.824	75%	0.752	S	S	*	*			trans	-155.3	153.9	140.8	-117.8	-40.6	0	0	0	114.2
1190	I	32.9	Very low	29.2	Very low	129 Å²	129	139.4 Å²	139.4	66%	0.662	75%	0.748	S	S	*	*			trans	-127.2	140	-175.4	-64.6	167.6	0	0	0	108.6
1191	P	27	Very low	29.1	Very low	127 Å²	127	137 Å²	137	83%	0.825	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-72.7	123.7	165.2	-16.5	32.1	0	0	0	111.8
1192	S	27.8	Very low	29.1	Very low	111 Å²	111	138.8 Å²	138.8	78%	0.776	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-76.1	163.4	-172.6	-74.1	0	0	0	0	115.2
1193	P	31.2	Very low	28.9	Very low	115 Å²	115	137.4 Å²	137.4	75%	0.747	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-87.6	168.3	-174.4	36.5	-37.8	0	0	0	114.4
1194	I	30.1	Very low	29	Very low	171 Å²	171	135.9 Å²	135.9	88%	0.877	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-76.3	135	168.6	-63.8	172.5	0	0	0	109.8
1195	L	27.7	Very low	29	Very low	144 Å²	144	132.9 Å²	132.9	75%	0.754	74%	0.739	S	S	*	*			trans	-150.8	119.2	-173.1	-165.2	-178.4	0	0	0	110.6
1196	V	32.5	Very low	29.3	Very low	126 Å²	126	134.6 Å²	134.6	76%	0.764	75%	0.748	S	S	*	*			trans	-164.3	152	167	-96.8	0	0	0	0	109.5
1197	P	34.4	Very low	29.2	Very low	99 Å²	99	137.1 Å²	137.1	64%	0.643	75%	0.748	S	S	*	*			cis	-139.5	139.7	-31.6	33.7	-14.7	0	0	0	116
1198	F	29.8	Very low	29.2	Very low	189 Å²	189	135.7 Å²	135.7	83%	0.829	75%	0.746	S	S	*	*			trans	64	151.6	135.7	-80.6	-76.8	0	0	0	126
1199	N	30.8	Very low	29.1	Very low	125 Å²	125	134.6 Å²	134.6	67%	0.668	75%	0.745	S	S	*	*			trans	71.1	136.9	157.6	-67.6	20.8	0	0	0	120.2
1200	D	31.8	Very low	29.2	Very low	127 Å²	127	134 Å²	134	68%	0.679	74%	0.741	S	S	*	*			cis	-156.3	144.3	-11.4	-125.7	-31.4	0	0	0	116.8
1201	S	28.2	Very low	28.8	Very low	87 Å²	87	137.2 Å²	137.2	61%	0.608	75%	0.751	S	S	*	*			trans	55.2	136.3	142.9	95.2	0	0	0	0	126
1202	H	29	Very low	28.8	Very low	154 Å²	154	136.6 Å²	136.6	71%	0.713	75%	0.745	S	S	*	*			trans	81.3	123.3	136.1	-77.8	-53.1	0	0	0	126
1203	M	26.1	Very low	28.9	Very low	148 Å²	148	140 Å²	140	73%	0.729	75%	0.746	S	S	*	*			trans	73.2	143.6	136.3	-62.8	-76.6	137.9	0	0	119.2
1204	T	27.9	Very low	28.8	Very low	113 Å²	113	145.1 Å²	145.1	69%	0.693	76%	0.757	S	S	*	*			cis	-157.2	174	-27.9	4	0	0	0	0	109.4
1205	S	26.8	Very low	28.7	Very low	97 Å²	97	144.6 Å²	144.6	68%	0.678	76%	0.755	S	S	*	*			trans	-21.6	137.4	167	51.2	0	0	0	0	118.8
1206	D	32	Very low	28.7	Very low	159 Å²	159	143.1 Å²	143.1	85%	0.85	75%	0.754	S	S	*	*				-163.3	179	101.7	-112.5	-22.8	0	0	0	115.2
1207	F	25	Very low	28.5	Very low	184 Å²	184	146.7 Å²	146.7	81%	0.807	76%	0.759	S	S	*	*			trans	-88.9	156.4	-168	-109	-110.2	0	0	0	115.9
1208	D	26.8	Very low	28.2	Very low	140 Å²	140	149.3 Å²	149.3	75%	0.749	77%	0.773	S	S	*	*			trans	65.4	154.7	162.6	-81	-46.4	0	0	0	120.4
1209	T	28.5	Very low	28.2	Very low	127 Å²	127	144 Å²	144	78%	0.779	77%	0.772	S	S	*	*			trans	73.2	105.9	177.5	-33.4	0	0	0	0	116.8
1210	L	27	Very low	27.9	Very low	141 Å²	141	145.7 Å²	145.7	74%	0.738	78%	0.78	S	S	*	*				-176.3	92.9	115.1	-99	172.6	0	0	0	111.9
1211	F	25	Very low	27.6	Very low	198 Å²	198	146.9 Å²	146.9	87%	0.868	78%	0.784	S	S	*	*			trans	-86.3	142.5	154	-141.7	-104.3	0	0	0	107.7
1212	T	27.5	Very low	27.6	Very low	113 Å²	113	151.4 Å²	151.4	69%	0.693	79%	0.793	S	S	*	*			trans	70.9	124.6	178.9	78.3	0	0	0	0	118.1
1213	K	29.2	Very low	27.5	Very low	183 Å²	183	148.7 Å²	148.7	80%	0.796	79%	0.792	S	S	*	*			trans	-174.3	103.2	132.8	-105.6	167.8	-175.2	173.8	0	112.1
1214	F	28.2	Very low	27.6	Very low	222 Å²	222	148.3 Å²	148.3	97%	0.974	79%	0.792	S	S	*	*			trans	-146.3	77.5	151.5	-103.5	-69	0	0	0	107.3
1215	L	27.5	Very low	27.6	Very low	161 Å²	161	149.8 Å²	149.8	84%	0.843	80%	0.796	S	S	*	*			trans	-134.3	135.4	176.8	-79.5	172.1	0	0	0	108.8
1216	P	28.3	Very low	27.7	Very low	112 Å²	112	151.7 Å²	151.7	73%	0.727	80%	0.797	S	S	*	*			trans	-85.5	133.6	179	32.6	-32.4	0	0	0	112.6
1217	K	29	Very low	27.6	Very low	201 Å²	201	150.6 Å²	150.6	87%	0.874	79%	0.787	S	S	*	*			trans	56.9	111.5	152.4	-58	178	178.4	-177.7	0	119.1
1218	T	28.1	Very low	27.8	Very low	154 Å²	154	150.8 Å²	150.8	95%	0.945	78%	0.782	S	S	*	*				-157.5	132.4	116.3	35.3	0	0	0	0	109.5
1219	G	29	Very low	28.2	Very low	78 Å²	78	151.9 Å²	151.9	80%	0.804	78%	0.783	S	S	*	*			trans	175	123.3	175.3	0	0	0	0	0	110.6
1220	I	24.7	Very low	28.3	Very low	161 Å²	161	153.4 Å²	153.4	83%	0.826	78%	0.781	S	S	*	*			trans	-121.3	133.7	177.7	-56.7	171.4	0	0	0	106.4
1221	I	26.7	Very low	28.6	Very low	151 Å²	151	154.2 Å²	154.2	77%	0.774	79%	0.786	S	S	*	*			trans	173.3	117.8	137.7	-91.6	156.7	0	0	0	111.8
1222	K	27	Very low	28.8	Very low	183 Å²	183	150 Å²	150	80%	0.796	78%	0.776	S	S	*	*			trans	51.4	110.2	144.1	-58.2	-177.1	179.9	-178	0	122.5
1223	S	27.1	Very low	28.9	Very low	97 Å²	97	151.1 Å²	151.1	68%	0.678	78%	0.782	S	S	*	*				95.4	144.2	109.6	69.5	0	0	0	0	122.3
1224	N	29.2	Very low	28.8	Very low	140 Å²	140	149 Å²	149	75%	0.749	78%	0.78	S	S	*	*			trans	78.4	105.9	165.7	-58.8	-12.4	0	0	0	115.5
1225	N	26.6	Very low	28.9	Very low	144 Å²	144	145.8 Å²	145.8	77%	0.77	77%	0.771	S	S	*	*				77.6	122.7	82.7	-88.3	-12.6	0	0	0	110.9
1226	I	30.1	Very low	28.9	Very low	136 Å²	136	143.9 Å²	143.9	70%	0.697	76%	0.762	S	S	*	*				-158.5	148.1	50.5	-109.8	138.1	0	0	0	112.2
1227	Q	29.8	Very low	28.8	Very low	136 Å²	136	147 Å²	147	64%	0.636	77%	0.765	S	S	*	*			trans	14.3	152.3	143.4	-57.6	163	3.4	0	0	120.2
1228	R	29.2	Very low	28.8	Very low	188 Å²	188	146.6 Å²	146.6	71%	0.709	77%	0.766	S	S	*	*			cis	-154.9	-178.2	4.8	-114.2	163.2	-146	160.5	2.4	106.8
1229	E	34.2	Very low	28.7	Very low	163 Å²	163	144 Å²	144	76%	0.762	75%	0.754	S	S	*	*			cis	-149.4	-175.1	28.7	-147.3	115.8	-106	0	0	111.1
1230	H	31.1	Very low	28.8	Very low	160 Å²	160	147.4 Å²	147.4	74%	0.741	76%	0.758	S	S	*	*			trans	-129.2	151.7	-170.4	-96.1	-115	0	0	0	113.5
1231	D	33.7	Very low	28.8	Very low	158 Å²	158	148.9 Å²	148.9	85%	0.845	76%	0.759	S	S	*	*			trans	-167.3	117.2	132.5	-92	-28	0	0	0	107.5
1232	V	27.7	Very low	28.9	Very low	110 Å²	110	153.4 Å²	153.4	67%	0.667	77%	0.766	S	S	*	*				80.5	91	55.7	-179	0	0	0	0	113.5
1233	V	31.3	Very low	28.8	Very low	135 Å²	135	148.8 Å²	148.8	82%	0.818	76%	0.757	S	S	*	*				-145.4	134.6	117.7	-178.8	0	0	0	0	107.8
1234	N	25.2	Very low	29.1	Very low	138 Å²	138	150.9 Å²	150.9	74%	0.738	76%	0.761	S	S	*	*			trans	-152.3	136.8	170.3	-178.3	36.7	0	0	0	108.9
1235	I	31	Very low	28.9	Very low	156 Å²	156	152 Å²	152	80%	0.8	76%	0.761	S	S	*	*			trans	-130.2	124.8	174.4	-59.8	-175.6	0	0	0	110.4
1236	N	27.9	Very low	29.1	Very low	121 Å²	121	152.5 Å²	152.5	65%	0.647	76%	0.762	S	S	*	*			trans	-65	145.7	-176.6	-84.4	-15.4	0	0	0	113.2
1237	F	26.1	Very low	29	Very low	178 Å²	178	152.4 Å²	152.4	78%	0.781	76%	0.763	S	S	*	*				71	119.9	71.5	-127.5	-78	0	0	0	112.1
1238	E	28.5	Very low	29	Very low	192 Å²	192	153.1 Å²	153.1	90%	0.897	77%	0.77	S	S	*	*				-168.8	176.1	127.2	-111.3	-179.7	-178.7	0	0	113.4
1239	S	26.6	Very low	29	Very low	99 Å²	99	149.6 Å²	149.6	69%	0.692	77%	0.772	S	S	*	*			trans	-143	136.3	-163.4	-58.9	0	0	0	0	112.7
1240	V	30.4	Very low	28.6	Very low	149 Å²	149	148.9 Å²	148.9	90%	0.903	77%	0.773	S	S	*	*			trans	-131.3	135.4	168.9	-178.3	0	0	0	0	110.6
1241	K	25.2	Very low	28.5	Very low	193 Å²	193	147.3 Å²	147.3	84%	0.839	77%	0.77	S	S	*	*			trans	-99.5	150.1	174.7	-55	166.3	-178.5	171.7	0	109.8
1242	R	28	Very low	28.2	Very low	245 Å²	245	145.7 Å²	145.7	93%	0.925	76%	0.761	S	S	*	*				-163.4	162.7	126.7	-111.4	169.6	-178.8	114.8	-1.4	112.2
1243	S	25.7	Very low	28.3	Very low	87 Å²	87	147.9 Å²	147.9	61%	0.608	76%	0.764	S	S	*	*			trans	-91.5	168.8	179.7	47.5	0	0	0	0	111.4
1244	D	32.9	Very low	28.1	Very low	140 Å²	140	149.7 Å²	149.7	75%	0.749	76%	0.761	S	S	*	*				177.1	117.1	108.3	-74	-17.6	0	0	0	106.6
1245	H	26.4	Very low	28.2	Very low	164 Å²	164	148.6 Å²	148.6	76%	0.759	76%	0.755	S	S	*	*				55.7	114.9	87.7	-100.8	-80.7	0	0	0	115.3
1246	I	29.4	Very low	28.1	Very low	155 Å²	155	145.7 Å²	145.7	80%	0.795	75%	0.745	S	S	*	*			trans	178.1	96.4	135.9	-87.7	152.5	0	0	0	108.4
1247	D	28.9	Very low	28.1	Very low	133 Å²	133	148.7 Å²	148.7	71%	0.711	75%	0.752	S	S	*	*				57.6	147	127.2	-43.7	-33.1	0	0	0	124.7
1248	L	29.2	Very low	28.2	Very low	151 Å²	151	143.7 Å²	143.7	79%	0.791	74%	0.744	S	S	*	*			trans	-96.8	159.7	168.6	-72	153.3	0	0	0	109.3
1249	P	30.7	Very low	28.2	Very low	114 Å²	114	141.7 Å²	141.7	74%	0.74	74%	0.739	S	S	*	*				-125.1	159.8	85.3	10.3	11.7	0	0	0	111.4
1250	L	25.1	Very low	28.2	Very low	149 Å²	149	142.5 Å²	142.5	78%	0.78	74%	0.744	S	S	*	*			cis	69.9	148.5	46.3	-74.4	175.1	0	0	0	114.9
1251	D	28.8	Very low	28	Very low	127 Å²	127	141.7 Å²	141.7	68%	0.679	74%	0.739	S	S	*	*			trans	105.8	114.6	172.8	-62.2	-3.1	0	0	0	117.5
1252	N	26.7	Very low	28.3	Very low	124 Å²	124	140.5 Å²	140.5	66%	0.663	74%	0.74	S	S	*	*				58.9	144.9	114.5	-49.4	-18.7	0	0	0	119.1
1253	E	29.6	Very low	28.3	Very low	155 Å²	155	136.1 Å²	136.1	72%	0.724	74%	0.735	S	S	*	*			cis	-161.7	151.3	-0.4	-124.5	167.4	166.5	0	0	112.2
1254	F	28.2	Very low	28.7	Very low	173 Å²	173	137.2 Å²	137.2	76%	0.759	74%	0.74	S	S	*	*			trans	58.5	154.8	140.5	-92.1	-131.4	0	0	0	125.7
1255	D	27.9	Very low	28.6	Very low	115 Å²	115	138.1 Å²	138.1	62%	0.615	74%	0.744	S	S	*	*			trans	68.7	88.5	144.1	-75.7	8.5	0	0	0	125.9
1256	T	27.6	Very low	28.6	Very low	95 Å²	95	134.9 Å²	134.9	58%	0.583	74%	0.739	S	S	*	*				55.2	149.5	106.1	69.3	0	0	0	0	124.5
1257	K	28.4	Very low	28.7	Very low	184 Å²	184	133.6 Å²	133.6	80%	0.8	74%	0.738	S	S	*	*			trans	85.6	112.4	138.4	-85.1	160	-172.7	167	0	120.4
1258	A	28.5	Very low	28.6	Very low	74 Å²	74	131.9 Å²	131.9	61%	0.612	74%	0.737	S	S	*	*				95.3	113.6	111.3	0	0	0	0	0	121.1
1259	N	28	Very low	28.5	Very low	150 Å²	150	129.3 Å²	129.3	80%	0.802	73%	0.732	S	S	*	*				75.1	157.3	122.4	-60.9	-0	0	0	0	121.7
1260	C	27.5	Very low	28.4	Very low	116 Å²	116	130.8 Å²	130.8	78%	0.784	73%	0.733	S	S	*	*			trans	66.1	115.3	171.2	-58	0	0	0	0	115.2
1261	V	25.9	Very low	28.7	Very low	132 Å²	132	131 Å²	131	80%	0.8	73%	0.734	S	S	*	*			cis	66	107.8	47	-172.5	0	0	0	0	112.5
1262	I	31.5	Very low	28.6	Very low	168 Å²	168	133 Å²	133	86%	0.862	74%	0.739	S	S	*	*			trans	-172.2	156.3	134	-96.6	156.7	0	0	0	109.7
1263	D	27	Very low	28.5	Very low	153 Å²	153	133 Å²	133	82%	0.818	74%	0.743	S	S	*	*			trans	-68.6	171.7	-166.9	-89.3	-54.1	0	0	0	117.9
1264	P	35.6	Very low	28.6	Very low	109 Å²	109	131.2 Å²	131.2	71%	0.708	75%	0.748	S	S	*	*			trans	-95.2	176.1	-167.9	39.2	-38.6	0	0	0	114.7
1265	L	29.8	Very low	28.5	Very low	160 Å²	160	132.9 Å²	132.9	84%	0.838	75%	0.751	S	S	*	*			trans	-177.9	133.2	139.4	-102.6	164.5	0	0	0	115.8
1266	S	26.7	Very low	28.6	Very low	95 Å²	95	134.2 Å²	134.2	66%	0.664	76%	0.763	S	S	*	*			trans	70	157.9	135.9	74.1	0	0	0	0	124.4
1267	V	30.8	Very low	28.6	Very low	128 Å²	128	134 Å²	134	78%	0.776	77%	0.766	S	S	*	*			trans	66.2	133.7	163	-166.6	0	0	0	0	117.3
1268	S	26.9	Very low	28.6	Very low	98 Å²	98	132.3 Å²	132.3	69%	0.685	77%	0.765	S	S	*	*			cis	164.3	133.2	-29.8	-90.4	0	0	0	0	107.6
1269	S	26.9	Very low	28.9	Very low	96 Å²	96	134.3 Å²	134.3	67%	0.671	78%	0.775	S	S	*	*			trans	73.7	140.9	141.8	73.4	0	0	0	0	123.8
1270	N	28.5	Very low	29	Very low	145 Å²	145	136.7 Å²	136.7	78%	0.775	78%	0.778	S	S	*	*			trans	100.2	154.3	143.9	-58.5	-28.3	0	0	0	122.2
1271	I	31.3	Very low	29.3	Very low	154 Å²	154	136.8 Å²	136.8	79%	0.79	78%	0.777	S	S	*	*			trans	70.1	95	172.3	-43.8	-177.8	0	0	0	114.2
1272	E	27.1	Very low	29.6	Very low	169 Å²	169	138.9 Å²	138.9	79%	0.79	78%	0.782	S	S	*	*				83.8	116.9	58.9	-67.9	-161.6	128.3	0	0	116.3
1273	T	25.8	Very low	29.7	Very low	123 Å²	123	141.7 Å²	141.7	76%	0.755	78%	0.782	S	S	*	*			trans	20.9	127.9	148.9	56	0	0	0	0	121.5
1274	S	29.9	Very low	29.7	Very low	118 Å²	118	139.4 Å²	139.4	83%	0.825	78%	0.778	S	S	*	*				-165.1	144.1	108	63	0	0	0	0	114.9
1275	Y	26.8	Very low	29.6	Very low	208 Å²	208	139 Å²	139	82%	0.816	78%	0.776	S	S	*	*			trans	-51.4	148.5	170.9	-57.5	-104.1	0	0	0	115.3
1276	T	30.4	Very low	29.5	Very low	143 Å²	143	138.9 Å²	138.9	88%	0.877	78%	0.775	S	S	*	*				177.8	165.3	101.7	32.9	0	0	0	0	113.5
1277	S	26.8	Very low	29.6	Very low	90 Å²	90	138.3 Å²	138.3	63%	0.629	77%	0.771	S	S	*	*			trans	-79.9	146.8	-177.9	52.5	0	0	0	0	114.7
1278	N	30.1	Very low	29.5	Very low	149 Å²	149	140.4 Å²	140.4	80%	0.797	77%	0.765	S	S	*	*				177.6	167.4	104.4	-99.2	-50.8	0	0	0	116.6
1279	S	33.2	Very low	29.6	Very low	116 Å²	116	141.4 Å²	141.4	81%	0.811	77%	0.767	S	S	*	*			trans	80.2	154	160.8	81.4	0	0	0	0	120.4
1280	K	30.4	Very low	29.6	Very low	201 Å²	201	141 Å²	141	87%	0.874	76%	0.763	S	S	*	*			trans	-148.2	-177.3	179.4	-62.7	175.5	-179.9	165.4	0	106.3
1281	P	34.7	Very low	29.8	Very low	117 Å²	117	139.8 Å²	139.8	76%	0.76	77%	0.766	S	S	*	*				-130.3	160.7	-63.1	37.9	-23.3	0	0	0	112.2
1282	I	31.4	Very low	29.6	Very low	177 Å²	177	142.1 Å²	142.1	91%	0.908	77%	0.765	S	S	*	*			trans	-125.8	156.8	166	-65	-175	0	0	0	110.9
1283	R	32.7	Very low	29.6	Very low	226 Å²	226	137.9 Å²	137.9	85%	0.853	77%	0.767	S	S	*	*			trans	-98.1	136.3	-158	-67.4	172.8	158.9	-176.1	-3.4	115.4
1284	S	28.6	Very low	29.8	Very low	105 Å²	105	138 Å²	138	73%	0.734	77%	0.774	S	S	*	*				68.7	170.1	129.5	75.3	0	0	0	0	120.2
1285	P	33.6	Very low	29.6	Very low	102 Å²	102	138.2 Å²	138.2	66%	0.662	77%	0.769	S	S	*	*				-137.9	-178.2	-52.7	38.8	-22.8	0	0	0	113.5
1286	L	27	Very low	29.6	Very low	156 Å²	156	131.6 Å²	131.6	82%	0.817	76%	0.764	S	S	*	*			trans	70.8	151.7	167.2	-54.7	165.5	0	0	0	115.8
1287	S	29.3	Very low	29.5	Very low	84 Å²	84	132.5 Å²	132.5	59%	0.587	76%	0.758	S	S	*	*			cis	-162.2	138.2	-24.8	55.5	0	0	0	0	113.1
1288	R	27.2	Very low	29.7	Very low	172 Å²	172	134.9 Å²	134.9	65%	0.649	76%	0.764	S	S	*	*			trans	33.6	106.8	148.1	-172.6	-168	-66.7	-163.3	-1	118.2
1289	V	29.4	Very low	29.6	Very low	119 Å²	119	134.9 Å²	134.9	72%	0.721	76%	0.762	S	S	*	*			trans	-133.1	148.4	150.3	174.5	0	0	0	0	108.5	P23	P23-V1289 HydrophobicContact CG-CG1 4.48Å
1290	S	28.1	Very low	29.9	Very low	86 Å²	86	135.3 Å²	135.3	60%	0.601	75%	0.75	S	S	*	*			trans	-96.6	139.7	178.3	-52.6	0	0	0	0	111.4
1291	S	31.4	Very low	30.4	Very low	120 Å²	120	130.7 Å²	130.7	84%	0.839	74%	0.741	S	S	*	*			trans	-124	129.9	167.3	-60.7	0	0	0	0	110.1
1292	R	28.6	Very low	31.2	Very low	203 Å²	203	134 Å²	134	77%	0.766	75%	0.746	S	S	*	*			trans	-83.2	142.3	164.4	-73.4	175.3	170	175.4	-5.6	108	Q32	Q32-R1292 VanDerWaalsContact OE1-NH1 3.1Å
1293	G	25.7	Very low	32.7	Very low	81 Å²	81	129.8 Å²	129.8	84%	0.835	72%	0.722	S	S	*	*			trans	53.2	106	153.8	0	0	0	0	0	118.7
1294	S	29.7	Very low	34.6	Very low	126 Å²	126	127.9 Å²	127.9	88%	0.881	72%	0.723	S	S	*	*				-142.7	164.1	121.7	-161.1	0	0	0	0	109.6
1295	V	27.2	Very low	37.3	Very low	122 Å²	122	124.4 Å²	124.4	74%	0.739	70%	0.695	S	S	*	*			trans	-66	139.8	177.8	176.4	0	0	0	0	110	E1297	V1295-E1297 HydrophobicContact CG1-CB 4.44Å; V1295-E1297 HydrophobicContact CG1-CG 4.07Å
1296	G	26.4	Very low	39.8	Very low	68 Å²	68	122.1 Å²	122.1	70%	0.701	68%	0.681	S	S	*	*			trans	-151.9	65	171	0	0	0	0	0	107.2	D1298	G1296-D1298 PolarHBondContact O-N 3.27Å; G1296-D1298 VanDerWaalsContact O-N 3.13Å
1297	E	27.3	Very low	42.7	Very low	162 Å²	162	117.8 Å²	117.8	76%	0.757	66%	0.662	S	S	*	*			trans	-72.7	96.8	169.3	-73.8	178.8	154.7	0	0	107.3	V1295 I1299	V1295-E1297 HydrophobicContact CG1-CB 4.44Å; V1295-E1297 HydrophobicContact CG1-CG 4.07Å; E1297-I1299 VanDerWaalsContact C-N 3.31Å; E1297-I1299 WeakPolarHBondContact O-CG1 2.84Å; E1297-I1299 PolarHBondContact O-N 3.17Å
1298	D	31.8	Very low	45.7	Very low	140 Å²	140	115.7 Å²	115.7	75%	0.749	64%	0.644	S	S	*	*			trans	-64.1	98.8	161.4	-74	-38.2	0	0	0	106.8	G1296 F1300	G1296-D1298 PolarHBondContact O-N 3.27Å; G1296-D1298 VanDerWaalsContact O-N 3.13Å; D1298-F1300 HydrophobicContact CB-CD2 4.25Å; D1298-F1300 HydrophobicContact CB-CE2 4.3Å; D1298-F1300 PolarHBondContact O-N 3.06Å
1299	I	28	Very low	48.7	Very low	149 Å²	149	110.1 Å²	110.1	76%	0.764	63%	0.627	S	S	*	*			trans	-69.8	75.5	-177.4	-50.6	175	0	0	0	109.5	E1297 P1301	E1297-I1299 VanDerWaalsContact C-N 3.31Å; E1297-I1299 WeakPolarHBondContact O-CG1 2.84Å; E1297-I1299 PolarHBondContact O-N 3.17Å; I1299-P1301 WeakPolarHBondContact O-CD 3.42Å
1300	F	39	Very low	51.7	Low	126 Å²	126	105.4 Å²	105.4	55%	0.553	60%	0.598	S	S	*	*			trans	-74.1	111.7	151.5	-74.9	-86.1	0	0	0	106.4	D1298 E1302	D1298-F1300 HydrophobicContact CB-CD2 4.25Å; D1298-F1300 HydrophobicContact CB-CE2 4.3Å; D1298-F1300 PolarHBondContact O-N 3.06Å; F1300-E1302 PolarHBondContact O-N 3.04Å
1301	P	40.5	Very low	54.9	Low	104 Å²	104	101.4 Å²	101.4	68%	0.675	57%	0.57	S	S	*	*			trans	-57.5	142.5	176.4	25.7	-34.2	0	0	0	109.1	I1299 H1303	I1299-P1301 WeakPolarHBondContact O-CD 3.42Å; P1301-H1303 PolarHBondContact O-N 2.88Å
1302	E	51.5	Low	57.9	Low	186 Å²	186	95.7 Å²	95.7	87%	0.869	53%	0.53	S	S	*	.			trans	-56.5	100.9	-174.2	-69.6	-163.1	126.2	0	0	110.9	F1300 Q1304	F1300-E1302 PolarHBondContact O-N 3.04Å; E1302-Q1304 PolarHBondContact O-N 3.3Å; E1302-Q1304 VanDerWaalsContact O-N 3.12Å
1303	H	64.2	Low	61	Low	89 Å²	89	86 Å²	86	41%	0.412	49%	0.493	S	S	.	.			trans	-72.1	111.7	-177.3	-157.5	64.9	0	0	0	107.8	P1301 F1305	P1301-H1303 PolarHBondContact O-N 2.88Å; H1303-F1305 VanDerWaalsContact C-N 3.27Å; H1303-F1305 HydrophobicContact CB-CE1 4.41Å; H1303-F1305 HydrophobicContact CB-CZ 4.25Å; H1303-F1305 AromaticContact CD2-CE1 3.96Å; H1303-F1305 WeakPolarHBondContact O-CD2 3.37Å; H1303-F1305 WeakPolarHBondContact O-CE2 3.27Å; H1303-F1305 PolarHBondContact O-N 3.34Å
1304	Q	71.3	Confident	64.2	Low	186 Å²	186	85.1 Å²	85.1	87%	0.869	47%	0.466	S	S	*	.			trans	-71.3	86.2	-178.6	-70.8	-172.2	-6.3	0	0	109.8	E1302 S1306	E1302-Q1304 PolarHBondContact O-N 3.3Å; E1302-Q1304 VanDerWaalsContact O-N 3.12Å; Q1304-S1306 PolarHBondContact O-N 3.31Å
1305	F	86.8	Confident	66.7	Low	32 Å²	32	80.4 Å²	80.4	14%	0.14	43%	0.433	C	S	.	.	P	Polyproline II helix	trans	-62	122.7	178.7	-62.9	-69.3	0	0	0	111.6	H1303 V1311 I1325 L1367 P1383 L1386	H1303-F1305 VanDerWaalsContact C-N 3.27Å; H1303-F1305 HydrophobicContact CB-CE1 4.41Å; H1303-F1305 HydrophobicContact CB-CZ 4.25Å; H1303-F1305 AromaticContact CD2-CE1 3.96Å; H1303-F1305 WeakPolarHBondContact O-CD2 3.37Å; H1303-F1305 WeakPolarHBondContact O-CE2 3.27Å; H1303-F1305 PolarHBondContact O-N 3.34Å; F1305-V1311 HydrophobicContact CD1-CG1 3.63Å; F1305-V1311 HydrophobicContact CE1-CG1 3.69Å; F1305-I1325 HydrophobicContact CB-CD1 3.56Å; F1305-I1325 HydrophobicContact CD1-CD1 4.28Å; F1305-I1325 HydrophobicContact CG-CD1 4.17Å; F1305-L1367 HydrophobicContact CB-CD1 3.85Å; F1305-L1367 HydrophobicContact CD2-CD1 4.43Å; F1305-P1383 HydrophobicContact CD2-CB 4.13Å; F1305-P1383 HydrophobicContact CE2-CB 4.39Å; F1305-L1386 HydrophobicContact CD2-CB 4.16Å; F1305-L1386 HydrophobicContact CD2-CD1 4.26Å; F1305-L1386 HydrophobicContact CE1-CB 4.17Å; F1305-L1386 HydrophobicContact CE2-CB 3.74Å; F1305-L1386 HydrophobicContact CG-CD1 4.34Å; F1305-L1386 HydrophobicContact CZ-CB 3.75Å
1306	S	85.4	Confident	69	Low	53 Å²	53	82.9 Å²	82.9	37%	0.371	44%	0.441	S	S	.	.	P	Polyproline II helix	trans	-102.1	160.6	178.7	72.1	0	0	0	0	112	Q1304 D1309	Q1304-S1306 PolarHBondContact O-N 3.31Å; S1306-D1309 WeakPolarHBondContact CA-OD2 3.46Å; S1306-D1309 WeakPolarHBondContact CB-OD2 3.44Å; S1306-D1309 PolarHBondContact N-OD2 2.9Å; S1306-D1309 WeakPolarHBondContact O-CB 3.42Å; S1306-D1309 PolarHBondContact O-N 2.94Å; S1306-D1309 VanDerWaalsContact OG-CG 3.24Å; S1306-D1309 PolarHBondContact OG-OD2 3.02Å
1307	P	88.4	Confident	71.3	Confident	66 Å²	66	83.7 Å²	83.7	43%	0.429	45%	0.45	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.3	143.1	166.7	-21.5	33.6	0	0	0	110.8	D1309 D1327	P1307-D1309 VanDerWaalsContact C-N 3.31Å; P1307-D1327 HydrophobicContact CB-CB 4.24Å
1308	L	90.9	Very high	73.7	Confident	39 Å²	39	78.6 Å²	78.6	20%	0.204	43%	0.432	C	S	.	.	T	Hydrogen-bonded Turn	trans	79.4	-12.4	-171.6	-49.5	-179.6	0	0	0	116.4	I1324 I1325 Y1334 H1336 I1341	L1308-I1324 WeakPolarHBondContact O-CD1 3.37Å; L1308-I1324 WeakPolarHBondContact O-CG1 3.47Å; L1308-I1325 WeakPolarHBondContact CA-O 3.29Å; L1308-I1325 PolarHBondContact N-O 3.46Å; L1308-Y1334 HydrophobicContact CD2-CE1 3.57Å; L1308-Y1334 VanDerWaalsContact CD2-OH 3.3Å; L1308-Y1334 WeakPolarHBondContact CD2-OH 3.5Å; L1308-H1336 HydrophobicContact CD1-CB 4.3Å; L1308-H1336 HydrophobicContact CD2-CB 4.13Å; L1308-H1336 PolarHBondContact O-CE1 3.26Å; L1308-I1341 HydrophobicContact CD2-CD1 3.42Å; L1308-I1341 VanDerWaalsContact CD2-CD1 3.42Å
1309	D	91.8	Very high	76.3	Confident	55 Å²	55	72.3 Å²	72.3	29%	0.294	40%	0.399	S	S	.	.			trans	-62.6	142.8	174.3	-77.5	-36.8	0	0	0	112.4	S1306 P1307 V1311 I1324 I1325	S1306-D1309 WeakPolarHBondContact CA-OD2 3.46Å; S1306-D1309 WeakPolarHBondContact CB-OD2 3.44Å; S1306-D1309 PolarHBondContact N-OD2 2.9Å; S1306-D1309 WeakPolarHBondContact O-CB 3.42Å; S1306-D1309 PolarHBondContact O-N 2.94Å; S1306-D1309 VanDerWaalsContact OG-CG 3.24Å; S1306-D1309 PolarHBondContact OG-OD2 3.02Å; P1307-D1309 VanDerWaalsContact C-N 3.31Å; D1309-V1311 HydrophobicContact CB-CG1 4.45Å; D1309-I1324 WeakPolarHBondContact O-CA 3.49Å; D1309-I1325 HydrophobicContact CB-CD1 4.2Å; D1309-I1325 PolarHBondContact O-N 3.23Å
1310	I	92.9	Very high	79.4	Confident	21 Å²	21	66.3 Å²	66.3	11%	0.108	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	124.5	-179.9	-62.3	173.3	0	0	0	108.8	A1323 I1324 F1372 L1389 A1419 I1423	I1310-A1323 WeakPolarHBondContact CA-O 3.44Å; I1310-I1324 HydrophobicContact CD1-CD1 4.44Å; I1310-I1324 HydrophobicContact CG1-CB 4.25Å; I1310-I1324 HydrophobicContact CG1-CD1 4.03Å; I1310-I1324 HydrophobicContact CG1-CG1 4.04Å; I1310-F1372 HydrophobicContact CG2-CE2 4.24Å; I1310-L1389 HydrophobicContact CG2-CB 4.29Å; I1310-L1389 HydrophobicContact CG2-CD1 4.32Å; I1310-L1389 HydrophobicContact CG2-CD2 4.07Å; I1310-L1389 HydrophobicContact CG2-CG 4.48Å; I1310-L1389 WeakPolarHBondContact O-CB 3.41Å; I1310-L1389 PolarHBondContact O-N 3.5Å; I1310-L1389 VanDerWaalsContact O-N 3.15Å; I1310-A1419 HydrophobicContact CG2-CB 4.16Å; I1310-I1423 HydrophobicContact CD1-CD1 4.21Å; I1310-I1423 HydrophobicContact CD1-CG1 3.55Å
1311	V	94	Very high	82	Confident	1 Å²	1	61.9 Å²	61.9	1%	0.006	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	149.6	-163.1	-67.2	0	0	0	0	112.3	F1305 D1309 P1322 A1323 I1325 L1386 Q1387	F1305-V1311 HydrophobicContact CD1-CG1 3.63Å; F1305-V1311 HydrophobicContact CE1-CG1 3.69Å; D1309-V1311 HydrophobicContact CB-CG1 4.45Å; V1311-P1322 CarbonylContact O-C 3.5Å; V1311-P1322 WeakPolarHBondContact O-CA 3.45Å; V1311-A1323 HydrophobicContact CG2-CB 4.39Å; V1311-A1323 PolarHBondContact N-O 3.3Å; V1311-A1323 PolarHBondContact O-N 2.85Å; V1311-I1325 HydrophobicContact CG1-CD1 4.03Å; V1311-I1325 HydrophobicContact CG1-CG1 4.39Å; V1311-I1325 HydrophobicContact CG2-CD1 4.34Å; V1311-I1325 HydrophobicContact CG2-CG1 3.94Å; V1311-L1386 HydrophobicContact CB-CB 4.46Å; V1311-L1386 HydrophobicContact CG2-CD2 4.14Å; V1311-Q1387 CarbonylContact C-O 3.58Å; V1311-Q1387 VanDerWaalsContact CA-O 3.23Å; V1311-Q1387 WeakPolarHBondContact CA-O 3.35Å; V1311-Q1387 VanDerWaalsContact CB-O 3.31Å; V1311-Q1387 WeakPolarHBondContact CB-O 3.43Å
1312	W	94.7	Very high	84.6	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	121.5	157	-70.9	104.9	0	0	0	109.2	W1320 P1322 L1386 Q1387 L1389 D1396 R1399 L1400 V1412 Y1416	W1312-W1320 HydrophobicContact CB-CB 4.29Å; W1312-W1320 HydrophobicContact CB-CE3 3.95Å; W1312-W1320 HydrophobicContact CE3-CB 3.9Å; W1312-W1320 WeakPolarHBondContact O-CZ3 3.35Å; W1312-P1322 HydrophobicContact CE3-CG 4.13Å; W1312-P1322 HydrophobicContact CH2-CG 3.81Å; W1312-P1322 HydrophobicContact CZ2-CG 4.47Å; W1312-P1322 HydrophobicContact CZ3-CG 3.65Å; W1312-L1386 CarbonylContact O-C 3.59Å; W1312-L1386 VanDerWaalsContact O-CA 3.24Å; W1312-L1386 WeakPolarHBondContact O-CA 3.29Å; W1312-Q1387 HydrophobicContact CB-CB 4.31Å; W1312-Q1387 PolarHBondContact N-O 2.96Å; W1312-Q1387 PolarHBondContact O-N 2.9Å; W1312-L1389 HydrophobicContact CD2-CD1 4.08Å; W1312-L1389 HydrophobicContact CG-CB 4.49Å; W1312-L1389 HydrophobicContact CG-CD1 4.37Å; W1312-L1389 HydrophobicContact CZ2-CD1 4.03Å; W1312-L1389 HydrophobicContact CZ2-CG 4.43Å; W1312-D1396 PolarHBondContact NE1-OD1 3.07Å; W1312-R1399 HydrophobicContact CB-CG 4.41Å; W1312-R1399 HydrophobicContact CD2-CB 3.5Å; W1312-R1399 VanDerWaalsContact CD2-CB 3.5Å; W1312-R1399 HydrophobicContact CD2-CG 3.83Å; W1312-R1399 HydrophobicContact CE3-CB 3.57Å; W1312-R1399 HydrophobicContact CE3-CG 4.23Å; W1312-R1399 HydrophobicContact CG-CB 4.11Å; W1312-R1399 HydrophobicContact CG-CG 3.88Å; W1312-R1399 HydrophobicContact CH2-CB 3.91Å; W1312-R1399 HydrophobicContact CZ2-CB 3.83Å; W1312-R1399 HydrophobicContact CZ3-CB 3.75Å; W1312-L1400 HydrophobicContact CH2-CD2 4.5Å; W1312-L1400 HydrophobicContact CH2-CG 3.91Å; W1312-L1400 HydrophobicContact CZ2-CG 4.27Å; W1312-V1412 HydrophobicContact CH2-CG1 4.07Å; W1312-V1412 HydrophobicContact CZ3-CG1 3.8Å; W1312-Y1416 AromaticContact CH2-CD2 3.73Å; W1312-Y1416 HydrophobicContact CH2-CD2 3.73Å; W1312-Y1416 HydrophobicContact CH2-CE2 4.43Å; W1312-Y1416 AromaticContact CZ2-CD2 3.48Å; W1312-Y1416 HydrophobicContact CZ2-CD2 3.48Å; W1312-Y1416 VanDerWaalsContact CZ2-CD2 3.48Å; W1312-Y1416 AromaticContact CZ2-CE2 3.73Å; W1312-Y1416 HydrophobicContact CZ2-CE2 3.73Å
1313	A	94.2	Very high	86.7	Confident	0 Å²	0	48 Å²	48	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	134.8	-178.4	0	0	0	0	0	112.2	W1320 Y1321 A1323 V1369 F1371 L1381 K1385 L1386	A1313-W1320 WeakPolarHBondContact O-CA 3.48Å; A1313-Y1321 PolarHBondContact N-O 3.38Å; A1313-Y1321 PolarHBondContact O-N 3.4Å; A1313-A1323 HydrophobicContact CB-CB 3.99Å; A1313-V1369 HydrophobicContact CB-CG2 4.44Å; A1313-F1371 HydrophobicContact CB-CE1 3.6Å; A1313-F1371 HydrophobicContact CB-CZ 3.81Å; A1313-L1381 HydrophobicContact CB-CD1 3.75Å; A1313-K1385 CarbonylContact C-O 3.49Å; A1313-K1385 WeakPolarHBondContact CA-O 3.37Å; A1313-L1386 HydrophobicContact CB-CD2 3.66Å
1314	K	91.6	Very high	88.2	Confident	62 Å²	62	44 Å²	44	27%	0.27	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	101.2	-174.8	-152.9	-175.8	-163.8	72.3	0	114	W1320 K1385 E1402	K1314-W1320 HydrophobicContact CB-CD2 3.76Å; K1314-W1320 HydrophobicContact CB-CE3 3.67Å; K1314-W1320 HydrophobicContact CB-CG 4.37Å; K1314-W1320 HydrophobicContact CB-CH2 4.19Å; K1314-W1320 HydrophobicContact CB-CZ2 4.3Å; K1314-W1320 HydrophobicContact CB-CZ3 3.9Å; K1314-W1320 HydrophobicContact CD-CD2 4.24Å; K1314-W1320 HydrophobicContact CD-CZ2 4.01Å; K1314-W1320 HydrophobicContact CG-CD2 4.05Å; K1314-W1320 HydrophobicContact CG-CE3 4.46Å; K1314-W1320 HydrophobicContact CG-CG 4.28Å; K1314-K1385 HydrophobicContact CB-CB 4.45Å; K1314-K1385 PolarHBondContact N-O 3.31Å; K1314-E1402 IonicContact NZ-OE1 3.71Å; K1314-E1402 PolarHBondContact NZ-OE1 2.66Å; K1314-E1402 IonicContact NZ-OE2 3.32Å
1315	C	83.5	Confident	89.3	Confident	28 Å²	28	35.2 Å²	35.2	19%	0.189	21%	0.213	C	C	.	.			trans	-77.6	149	168	-76.9	0	0	0	0	112.4	G1317 S1318 F1371	C1315-G1317 PolarHBondContact O-N 2.9Å; C1315-G1317 VanDerWaalsContact O-N 3.08Å; C1315-S1318 PolarHBondContact O-N 3.4Å; C1315-F1371 VanDerWaalsContact SG-CZ 3.53Å
1316	L	74.6	Confident	89.6	Confident	174 Å²	174	33.8 Å²	33.8	91%	0.911	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66	110.3	-176.4	-160.2	90.4	0	0	0	111.3
1317	G	74.9	Confident	89.7	Confident	85 Å²	85	33.9 Å²	33.9	88%	0.876	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	93.4	-3.7	-177.4	0	0	0	0	0	115.3	C1315	C1315-G1317 PolarHBondContact O-N 2.9Å; C1315-G1317 VanDerWaalsContact O-N 3.08Å
1318	S	78.8	Confident	89.6	Confident	55 Å²	55	32.9 Å²	32.9	39%	0.385	20%	0.197	S	C	.	.	S	Bend	trans	-95.7	160.2	170.7	-67.8	0	0	0	0	111.4	C1315	C1315-S1318 PolarHBondContact O-N 3.4Å
1319	P	86.3	Confident	89.4	Confident	7 Å²	7	36.5 Å²	36.5	5%	0.045	22%	0.216	C	C	.	.	P	Polyproline II helix	trans	-64.8	173.5	156.8	34.1	-37.5	0	0	0	109.8	Y1321 M1408 V1412	P1319-Y1321 HydrophobicContact CG-CD2 4.01Å; P1319-Y1321 HydrophobicContact CG-CE2 3.87Å; P1319-M1408 HydrophobicContact CG-CE 4.1Å; P1319-M1408 HydrophobicContact CG-CG 3.96Å; P1319-M1408 HydrophobicContact CG-SD 4.07Å; P1319-V1412 HydrophobicContact CG-CG2 3.93Å
1320	W	92.6	Very high	88.9	Confident	23 Å²	23	34.6 Å²	34.6	9%	0.087	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.2	142.6	163.7	-59.1	87.2	0	0	0	110.1	W1312 A1313 K1314 K1385 Q1387 R1399 E1402	W1312-W1320 HydrophobicContact CB-CB 4.29Å; W1312-W1320 HydrophobicContact CB-CE3 3.95Å; W1312-W1320 HydrophobicContact CE3-CB 3.9Å; W1312-W1320 WeakPolarHBondContact O-CZ3 3.35Å; A1313-W1320 WeakPolarHBondContact O-CA 3.48Å; K1314-W1320 HydrophobicContact CB-CD2 3.76Å; K1314-W1320 HydrophobicContact CB-CE3 3.67Å; K1314-W1320 HydrophobicContact CB-CG 4.37Å; K1314-W1320 HydrophobicContact CB-CH2 4.19Å; K1314-W1320 HydrophobicContact CB-CZ2 4.3Å; K1314-W1320 HydrophobicContact CB-CZ3 3.9Å; K1314-W1320 HydrophobicContact CD-CD2 4.24Å; K1314-W1320 HydrophobicContact CD-CZ2 4.01Å; K1314-W1320 HydrophobicContact CG-CD2 4.05Å; K1314-W1320 HydrophobicContact CG-CE3 4.46Å; K1314-W1320 HydrophobicContact CG-CG 4.28Å; W1320-K1385 VanDerWaalsContact CZ3-O 3.24Å; W1320-K1385 WeakPolarHBondContact CZ3-O 3.45Å; W1320-Q1387 HydrophobicContact CH2-CG 3.71Å; W1320-Q1387 HydrophobicContact CZ2-CG 4.41Å; W1320-Q1387 HydrophobicContact CZ3-CB 4.33Å; W1320-Q1387 HydrophobicContact CZ3-CG 3.81Å; W1320-R1399 HydrophobicContact CB-CB 4.32Å; W1320-R1399 HydrophobicContact CB-CG 4.25Å; W1320-R1399 HydrophobicContact CG-CG 4.27Å; W1320-E1402 PolarHBondContact NE1-OE2 3.41Å
1321	Y	93.7	Very high	88.4	Confident	33 Å²	33	39.7 Å²	39.7	13%	0.129	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	145.6	177.5	-106.1	-90.9	0	0	0	110.4	A1313 P1319 A1323 S1411 V1412 A1415	A1313-Y1321 PolarHBondContact N-O 3.38Å; A1313-Y1321 PolarHBondContact O-N 3.4Å; P1319-Y1321 HydrophobicContact CG-CD2 4.01Å; P1319-Y1321 HydrophobicContact CG-CE2 3.87Å; Y1321-A1323 PolarHBondContact O-N 2.83Å; Y1321-S1411 WeakPolarHBondContact OH-CB 3.41Å; Y1321-S1411 PolarHBondContact OH-OG 3.39Å; Y1321-V1412 HydrophobicContact CD1-CG2 4.27Å; Y1321-V1412 HydrophobicContact CD2-CG2 3.83Å; Y1321-V1412 HydrophobicContact CE1-CB 4.49Å; Y1321-V1412 HydrophobicContact CE1-CG2 3.94Å; Y1321-V1412 HydrophobicContact CE2-CG2 3.47Å; Y1321-V1412 VanDerWaalsContact CE2-CG2 3.47Å; Y1321-V1412 HydrophobicContact CG-CG2 4.23Å; Y1321-A1415 HydrophobicContact CD1-CB 3.81Å; Y1321-A1415 HydrophobicContact CE1-CB 3.89Å
1322	P	94.9	Very high	87.7	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64	132.3	171.9	-24.6	38.3	0	0	0	111.6	V1311 W1312 F1372 L1389 A1415 Y1416 A1419	V1311-P1322 CarbonylContact O-C 3.5Å; V1311-P1322 WeakPolarHBondContact O-CA 3.45Å; W1312-P1322 HydrophobicContact CE3-CG 4.13Å; W1312-P1322 HydrophobicContact CH2-CG 3.81Å; W1312-P1322 HydrophobicContact CZ2-CG 4.47Å; W1312-P1322 HydrophobicContact CZ3-CG 3.65Å; P1322-F1372 HydrophobicContact CB-CB 4.45Å; P1322-F1372 HydrophobicContact CB-CD2 4.21Å; P1322-F1372 PolarHBondContact O-N 2.83Å; P1322-L1389 HydrophobicContact CB-CD1 3.66Å; P1322-L1389 HydrophobicContact CG-CD1 3.87Å; P1322-A1415 HydrophobicContact CG-CB 4.31Å; P1322-Y1416 HydrophobicContact CG-CD2 4.24Å; P1322-A1419 HydrophobicContact CB-CB 3.85Å
1323	A	95.6	Very high	86.8	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	165.1	174.6	0	0	0	0	0	110.5	I1310 V1311 A1313 Y1321 V1369 L1370 F1371	I1310-A1323 WeakPolarHBondContact CA-O 3.44Å; V1311-A1323 HydrophobicContact CG2-CB 4.39Å; V1311-A1323 PolarHBondContact N-O 3.3Å; V1311-A1323 PolarHBondContact O-N 2.85Å; A1313-A1323 HydrophobicContact CB-CB 3.99Å; Y1321-A1323 PolarHBondContact O-N 2.83Å; A1323-V1369 HydrophobicContact CB-CB 4.01Å; A1323-V1369 HydrophobicContact CB-CG2 4.41Å; A1323-L1370 CarbonylContact C-O 3.54Å; A1323-L1370 VanDerWaalsContact CA-O 3.27Å; A1323-L1370 WeakPolarHBondContact CA-O 3.3Å; A1323-L1370 WeakPolarHBondContact CB-O 3.45Å; A1323-F1371 HydrophobicContact CB-CD1 3.76Å; A1323-F1371 HydrophobicContact CB-CE1 4.07Å; A1323-F1371 HydrophobicContact CB-CG 4.24Å
1324	I	95.2	Very high	86.5	Confident	3 Å²	3	54 Å²	54	2%	0.015	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	141.9	166.4	-172.7	163.5	0	0	0	108.9	L1308 D1309 I1310 V1326 I1341 V1369 L1370 F1372	L1308-I1324 WeakPolarHBondContact O-CD1 3.37Å; L1308-I1324 WeakPolarHBondContact O-CG1 3.47Å; D1309-I1324 WeakPolarHBondContact O-CA 3.49Å; I1310-I1324 HydrophobicContact CD1-CD1 4.44Å; I1310-I1324 HydrophobicContact CG1-CB 4.25Å; I1310-I1324 HydrophobicContact CG1-CD1 4.03Å; I1310-I1324 HydrophobicContact CG1-CG1 4.04Å; I1324-V1326 HydrophobicContact CG2-CG2 4.2Å; I1324-I1341 HydrophobicContact CD1-CD1 3.7Å; I1324-V1369 WeakPolarHBondContact O-CA 3.46Å; I1324-L1370 HydrophobicContact CG2-CB 4.02Å; I1324-L1370 HydrophobicContact CG2-CD2 4.47Å; I1324-L1370 HydrophobicContact CG2-CG 4.45Å; I1324-L1370 PolarHBondContact N-O 3.19Å; I1324-L1370 PolarHBondContact O-N 3.39Å; I1324-F1372 HydrophobicContact CB-CE2 3.87Å; I1324-F1372 HydrophobicContact CB-CZ 4.06Å; I1324-F1372 HydrophobicContact CG2-CE2 4.2Å; I1324-F1372 HydrophobicContact CG2-CZ 4.18Å
1325	I	94.3	Very high	86.3	Confident	2 Å²	2	53.5 Å²	53.5	1%	0.01	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	133.9	174.7	-55.5	180	0	0	0	108.4	F1305 L1308 D1309 V1311 L1367 V1369 L1386	F1305-I1325 HydrophobicContact CB-CD1 3.56Å; F1305-I1325 HydrophobicContact CD1-CD1 4.28Å; F1305-I1325 HydrophobicContact CG-CD1 4.17Å; L1308-I1325 WeakPolarHBondContact CA-O 3.29Å; L1308-I1325 PolarHBondContact N-O 3.46Å; D1309-I1325 HydrophobicContact CB-CD1 4.2Å; D1309-I1325 PolarHBondContact O-N 3.23Å; V1311-I1325 HydrophobicContact CG1-CD1 4.03Å; V1311-I1325 HydrophobicContact CG1-CG1 4.39Å; V1311-I1325 HydrophobicContact CG2-CD1 4.34Å; V1311-I1325 HydrophobicContact CG2-CG1 3.94Å; I1325-L1367 HydrophobicContact CD1-CD1 4.32Å; I1325-L1367 HydrophobicContact CG2-CB 4.47Å; I1325-L1367 HydrophobicContact CG2-CD2 4.25Å; I1325-V1369 HydrophobicContact CG1-CG1 4.2Å; I1325-L1386 HydrophobicContact CD1-CD1 3.85Å; I1325-L1386 HydrophobicContact CG1-CD1 4.4Å
1326	V	92.8	Very high	86.4	Confident	2 Å²	2	53.4 Å²	53.4	1%	0.012	32%	0.32	C	S	.	.			trans	-126.6	131.4	-176.4	-176.3	0	0	0	0	109.3	I1324 Y1334 I1341 P1344 L1368 L1370 W1378	I1324-V1326 HydrophobicContact CG2-CG2 4.2Å; V1326-Y1334 HydrophobicContact CG1-CD1 4.46Å; V1326-Y1334 HydrophobicContact CG1-CE1 3.96Å; V1326-I1341 HydrophobicContact CG1-CG2 4.18Å; V1326-I1341 HydrophobicContact CG2-CG2 4.01Å; V1326-P1344 HydrophobicContact CG1-CG 4.29Å; V1326-L1368 PolarHBondContact N-O 3.36Å; V1326-L1370 HydrophobicContact CG2-CB 3.82Å; V1326-L1370 HydrophobicContact CG2-CD2 4.41Å; V1326-W1378 HydrophobicContact CB-CH2 4.31Å; V1326-W1378 HydrophobicContact CB-CZ3 3.89Å; V1326-W1378 HydrophobicContact CG1-CH2 4.03Å; V1326-W1378 HydrophobicContact CG1-CZ3 4.01Å; V1326-W1378 HydrophobicContact CG2-CH2 4.21Å; V1326-W1378 HydrophobicContact CG2-CZ3 3.98Å
1327	D	88.6	Confident	86.8	Confident	56 Å²	56	50.5 Å²	50.5	30%	0.299	31%	0.306	S	S	.	.			trans	-58.3	122.7	172.8	-175.8	-14.2	0	0	0	110.2	P1307 D1329 A1330 Y1334	P1307-D1327 HydrophobicContact CB-CB 4.24Å; D1327-D1329 PolarHBondContact O-N 2.97Å; D1327-D1329 PolarHBondContact OD1-N 3.25Å; D1327-A1330 HydrophobicContact CB-CB 4.33Å; D1327-A1330 WeakPolarHBondContact O-CB 3.44Å; D1327-A1330 PolarHBondContact O-N 3.45Å; D1327-Y1334 HydrophobicContact CB-CE2 3.94Å; D1327-Y1334 PolarHBondContact N-OH 3.01Å
1328	P	86.6	Confident	87.1	Confident	44 Å²	44	49.5 Å²	49.5	29%	0.286	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-17.5	178	29.6	-36.8	0	0	0	114.3	L1349 L1368 W1380	P1328-L1349 HydrophobicContact CB-CD2 4.06Å; P1328-L1349 VanDerWaalsContact O-CD2 3.29Å; P1328-L1349 WeakPolarHBondContact O-CD2 3.44Å; P1328-L1368 HydrophobicContact CB-CD2 4.08Å; P1328-W1380 HydrophobicContact CB-CH2 3.62Å; P1328-W1380 HydrophobicContact CB-CZ2 4.3Å; P1328-W1380 HydrophobicContact CB-CZ3 4.47Å; P1328-W1380 HydrophobicContact CG-CH2 4.16Å
1329	D	84.9	Confident	87.4	Confident	115 Å²	115	47.9 Å²	47.9	62%	0.615	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.6	17.5	175.4	-68.8	-35.9	0	0	0	112.3	D1327 N1331	D1327-D1329 PolarHBondContact O-N 2.97Å; D1327-D1329 PolarHBondContact OD1-N 3.25Å; D1329-N1331 PolarHBondContact O-ND2 2.79Å
1330	A	82.8	Confident	87.5	Confident	16 Å²	16	52.4 Å²	52.4	13%	0.132	31%	0.313	C	S	.	.			trans	-54	136	171.9	0	0	0	0	0	113.2	D1327 Y1334 L1343	D1327-A1330 HydrophobicContact CB-CB 4.33Å; D1327-A1330 WeakPolarHBondContact O-CB 3.44Å; D1327-A1330 PolarHBondContact O-N 3.45Å; A1330-Y1334 HydrophobicContact CB-CD1 4Å; A1330-Y1334 HydrophobicContact CB-CD2 3.62Å; A1330-Y1334 HydrophobicContact CB-CE1 4.38Å; A1330-Y1334 HydrophobicContact CB-CE2 4Å; A1330-Y1334 HydrophobicContact CB-CG 3.61Å; A1330-L1343 HydrophobicContact CB-CD2 3.76Å
1331	N	82.4	Confident	87.3	Confident	127 Å²	127	51.9 Å²	51.9	68%	0.679	31%	0.311	S	S	*	.			trans	-112.4	169.2	-177.4	-70.3	-79.4	0	0	0	112.4	D1329 G1333 Y1334	D1329-N1331 PolarHBondContact O-ND2 2.79Å; N1331-G1333 PolarHBondContact O-N 2.96Å; N1331-Y1334 WeakPolarHBondContact O-CB 3.33Å; N1331-Y1334 PolarHBondContact O-N 3.37Å
1332	E	78.1	Confident	87	Confident	188 Å²	188	53.5 Å²	53.5	88%	0.879	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.4	121.4	176.8	-65.9	-174.8	164.7	0	0	111.6	L1343	E1332-L1343 HydrophobicContact CG-CD1 4.23Å
1333	G	76.7	Confident	86.7	Confident	70 Å²	70	57 Å²	57	72%	0.722	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	107.4	-6.3	-173.3	0	0	0	0	0	115.5	N1331 S1335	N1331-G1333 PolarHBondContact O-N 2.96Å; G1333-S1335 PolarHBondContact O-N 2.8Å; G1333-S1335 PolarHBondContact O-OG 3.13Å
1334	Y	87.5	Confident	86.3	Confident	45 Å²	45	57.5 Å²	57.5	18%	0.176	35%	0.348	C	S	.	.			trans	-54.6	122.3	178.4	-166.1	-100.8	0	0	0	112.5	L1308 V1326 D1327 A1330 N1331 I1341	L1308-Y1334 HydrophobicContact CD2-CE1 3.57Å; L1308-Y1334 VanDerWaalsContact CD2-OH 3.3Å; L1308-Y1334 WeakPolarHBondContact CD2-OH 3.5Å; V1326-Y1334 HydrophobicContact CG1-CD1 4.46Å; V1326-Y1334 HydrophobicContact CG1-CE1 3.96Å; D1327-Y1334 HydrophobicContact CB-CE2 3.94Å; D1327-Y1334 PolarHBondContact N-OH 3.01Å; A1330-Y1334 HydrophobicContact CB-CD1 4Å; A1330-Y1334 HydrophobicContact CB-CD2 3.62Å; A1330-Y1334 HydrophobicContact CB-CE1 4.38Å; A1330-Y1334 HydrophobicContact CB-CE2 4Å; A1330-Y1334 HydrophobicContact CB-CG 3.61Å; N1331-Y1334 WeakPolarHBondContact O-CB 3.33Å; N1331-Y1334 PolarHBondContact O-N 3.37Å; Y1334-I1341 HydrophobicContact CD1-CB 3.92Å; Y1334-I1341 HydrophobicContact CD1-CG2 3.93Å; Y1334-I1341 HydrophobicContact CE1-CB 4.33Å; Y1334-I1341 HydrophobicContact CE1-CD1 4.22Å; Y1334-I1341 HydrophobicContact CE1-CG2 4.11Å; Y1334-I1341 PolarHBondContact O-N 3.14Å
1335	S	86.7	Confident	86	Confident	50 Å²	50	59.9 Å²	59.9	35%	0.35	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	152.3	-173	55	0	0	0	0	111.7	G1333 V1339	G1333-S1335 PolarHBondContact O-N 2.8Å; G1333-S1335 PolarHBondContact O-OG 3.13Å; S1335-V1339 CarbonylContact C-O 3.16Å; S1335-V1339 WeakPolarHBondContact CA-O 3.43Å; S1335-V1339 VanDerWaalsContact CB-O 3.27Å; S1335-V1339 WeakPolarHBondContact CB-O 3.41Å
1336	H	85.8	Confident	85.6	Confident	26 Å²	26	65.8 Å²	65.8	12%	0.12	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	106.9	174.4	-165.8	168.1	0	0	0	107.9	L1308 G1338 V1339 I1341 V1426	L1308-H1336 HydrophobicContact CD1-CB 4.3Å; L1308-H1336 HydrophobicContact CD2-CB 4.13Å; L1308-H1336 PolarHBondContact O-CE1 3.26Å; H1336-G1338 PolarHBondContact O-N 3.44Å; H1336-G1338 VanDerWaalsContact O-N 3.11Å; H1336-V1339 PolarHBondContact N-O 2.9Å; H1336-V1339 WeakPolarHBondContact O-CB 3.41Å; H1336-V1339 PolarHBondContact O-N 3.05Å; H1336-I1341 HydrophobicContact CB-CD1 3.85Å; H1336-V1426 HydrophobicContact CB-CG2 3.87Å; H1336-V1426 VanDerWaalsContact CD2-CG1 3.41Å; H1336-V1426 WeakPolarHBondContact CD2-CG1 3.44Å; H1336-V1426 WeakPolarHBondContact NE2-CG1 3.39Å
1337	N	84.7	Confident	85.4	Confident	114 Å²	114	69.5 Å²	69.5	61%	0.61	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.3	41.8	-175.1	-59.7	-10.3	0	0	0	113.8	V1426	N1337-V1426 HydrophobicContact CB-CG1 4.06Å; N1337-V1426 VanDerWaalsContact CB-O 3.29Å; N1337-V1426 WeakPolarHBondContact CB-O 3.49Å; N1337-V1426 WeakPolarHBondContact ND2-CG1 3.27Å; N1337-V1426 PolarHBondContact ND2-O 3.18Å; N1337-V1426 VanDerWaalsContact ND2-O 3.17Å
1338	G	80.4	Confident	85.4	Confident	63 Å²	63	67.6 Å²	67.6	65%	0.649	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.6	-8.9	-177.9	0	0	0	0	0	115.7	H1336 P1340	H1336-G1338 PolarHBondContact O-N 3.44Å; H1336-G1338 VanDerWaalsContact O-N 3.11Å; G1338-P1340 WeakPolarHBondContact O-CD 3.26Å
1339	V	85.5	Confident	85.5	Confident	22 Å²	22	67.2 Å²	67.2	13%	0.133	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	112.3	170	-174.1	0	0	0	0	109.1	S1335 H1336 H1422 K1425 V1426	S1335-V1339 CarbonylContact C-O 3.16Å; S1335-V1339 WeakPolarHBondContact CA-O 3.43Å; S1335-V1339 VanDerWaalsContact CB-O 3.27Å; S1335-V1339 WeakPolarHBondContact CB-O 3.41Å; H1336-V1339 PolarHBondContact N-O 2.9Å; H1336-V1339 WeakPolarHBondContact O-CB 3.41Å; H1336-V1339 PolarHBondContact O-N 3.05Å; V1339-H1422 WeakPolarHBondContact CG1-NE2 3.46Å; V1339-K1425 HydrophobicContact CG2-CB 3.72Å; V1339-V1426 HydrophobicContact CB-CG2 4.15Å; V1339-V1426 HydrophobicContact CG2-CG2 3.83Å
1340	P	86.7	Confident	85.5	Confident	102 Å²	102	66.6 Å²	66.6	66%	0.662	40%	0.395	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.4	137.9	-175	27.5	-34.9	0	0	0	111.8	G1338	G1338-P1340 WeakPolarHBondContact O-CD 3.26Å
1341	I	88.8	Confident	85.4	Confident	11 Å²	11	70.8 Å²	70.8	6%	0.056	41%	0.407	C	S	.	.			trans	-108.1	133.8	176.7	-75.5	172	0	0	0	109.2	L1308 I1324 V1326 Y1334 H1336 L1343 L1370 H1422	L1308-I1341 HydrophobicContact CD2-CD1 3.42Å; L1308-I1341 VanDerWaalsContact CD2-CD1 3.42Å; I1324-I1341 HydrophobicContact CD1-CD1 3.7Å; V1326-I1341 HydrophobicContact CG1-CG2 4.18Å; V1326-I1341 HydrophobicContact CG2-CG2 4.01Å; Y1334-I1341 HydrophobicContact CD1-CB 3.92Å; Y1334-I1341 HydrophobicContact CD1-CG2 3.93Å; Y1334-I1341 HydrophobicContact CE1-CB 4.33Å; Y1334-I1341 HydrophobicContact CE1-CD1 4.22Å; Y1334-I1341 HydrophobicContact CE1-CG2 4.11Å; Y1334-I1341 PolarHBondContact O-N 3.14Å; H1336-I1341 HydrophobicContact CB-CD1 3.85Å; I1341-L1343 PolarHBondContact O-N 2.9Å; I1341-L1370 HydrophobicContact CG2-CD2 4.49Å; I1341-H1422 WeakPolarHBondContact CG1-NE2 3.31Å
1342	P	88.2	Confident	85.3	Confident	68 Å²	68	65.1 Å²	65.1	44%	0.442	38%	0.378	S	S	.	.	P	Polyproline II helix	trans	-59	136.6	176	-23.7	33.9	0	0	0	111.9	L1370 W1378	P1342-L1370 HydrophobicContact CB-CD2 4.44Å; P1342-L1370 HydrophobicContact CG-CD2 4.22Å; P1342-W1378 HydrophobicContact CB-CZ2 4.36Å; P1342-W1378 WeakPolarHBondContact O-CH2 3.31Å; P1342-W1378 WeakPolarHBondContact O-CZ2 3.44Å
1343	L	88	Confident	85.4	Confident	72 Å²	72	63.1 Å²	63.1	38%	0.377	37%	0.367	S	S	.	.	P	Polyproline II helix	trans	-73.3	146.5	176.5	-67.8	-179.8	0	0	0	112.3	A1330 E1332 I1341 P1345 W1378	A1330-L1343 HydrophobicContact CB-CD2 3.76Å; E1332-L1343 HydrophobicContact CG-CD1 4.23Å; I1341-L1343 PolarHBondContact O-N 2.9Å; L1343-P1345 WeakPolarHBondContact O-CD 3.33Å; L1343-W1378 WeakPolarHBondContact O-CZ2 3.19Å
1344	P	88.2	Confident	85.4	Confident	12 Å²	12	66.6 Å²	66.6	8%	0.078	36%	0.358	C	S	.	.	P	Polyproline II helix	trans	-60.2	126.2	175.8	-22.5	32.4	0	0	0	112.3	V1326 E1346 L1349 L1368 W1378	V1326-P1344 HydrophobicContact CG1-CG 4.29Å; P1344-E1346 PolarHBondContact O-N 3.15Å; P1344-L1349 HydrophobicContact CB-CD1 4.32Å; P1344-L1349 HydrophobicContact CB-CD2 3.71Å; P1344-L1349 HydrophobicContact CB-CG 3.9Å; P1344-L1349 HydrophobicContact CG-CD2 4.27Å; P1344-L1368 HydrophobicContact CB-CD2 3.91Å; P1344-L1368 HydrophobicContact CG-CD2 3.67Å; P1344-W1378 HydrophobicContact CB-CE3 4.41Å; P1344-W1378 HydrophobicContact CB-CH2 4.09Å; P1344-W1378 HydrophobicContact CB-CZ3 4.05Å; P1344-W1378 HydrophobicContact CG-CH2 3.73Å; P1344-W1378 HydrophobicContact CG-CZ3 3.73Å
1345	P	89.1	Confident	84.7	Confident	52 Å²	52	66.1 Å²	66.1	34%	0.338	36%	0.358	S	S	.	.	P	Polyproline II helix	trans	-58.8	141.1	174.4	-25.7	34.2	0	0	0	111.8	L1343 S1347 V1348 L1349	L1343-P1345 WeakPolarHBondContact O-CD 3.33Å; P1345-S1347 PolarHBondContact O-N 2.97Å; P1345-V1348 HydrophobicContact CB-CG2 4.13Å; P1345-V1348 HydrophobicContact CG-CG2 4.2Å; P1345-V1348 WeakPolarHBondContact O-CA 3.31Å; P1345-V1348 VanDerWaalsContact O-CB 3.3Å; P1345-V1348 WeakPolarHBondContact O-CB 3.35Å; P1345-V1348 PolarHBondContact O-N 3.18Å; P1345-L1349 PolarHBondContact O-N 2.84Å; P1345-L1349 VanDerWaalsContact O-N 3.13Å
1346	E	85.6	Confident	83.8	Confident	126 Å²	126	67 Å²	67	59%	0.589	37%	0.368	S	S	*	.	H	α-helix	trans	-58.1	-25.8	-177.3	-159.2	-141.4	-168.1	0	0	112.8	P1344 K1350	P1344-E1346 PolarHBondContact O-N 3.15Å; E1346-K1350 HydrophobicContact CG-CD 4.39Å; E1346-K1350 VanDerWaalsContact O-CB 3.23Å; E1346-K1350 WeakPolarHBondContact O-CB 3.35Å; E1346-K1350 VanDerWaalsContact O-CG 3.23Å; E1346-K1350 WeakPolarHBondContact O-CG 3.25Å; E1346-K1350 PolarHBondContact O-N 3.07Å; E1346-K1350 WeakPolarHBondContact OE1-CE 3.38Å; E1346-K1350 IonicContact OE1-NZ 2.76Å; E1346-K1350 PolarHBondContact OE1-NZ 3.01Å; E1346-K1350 WeakPolarHBondContact OE2-CE 3.45Å; E1346-K1350 IonicContact OE2-NZ 2.7Å; E1346-K1350 PolarHBondContact OE2-NZ 3.36Å
1347	S	87.6	Confident	82.7	Confident	80 Å²	80	74.7 Å²	74.7	56%	0.559	40%	0.402	S	S	*	.	H	α-helix	trans	-66.8	-34.3	172	57.3	0	0	0	0	113.8	P1345 W1351	P1345-S1347 PolarHBondContact O-N 2.97Å; S1347-W1351 WeakPolarHBondContact O-CB 3.46Å; S1347-W1351 PolarHBondContact O-N 3.47Å
1348	V	88.8	Confident	81.4	Confident	16 Å²	16	75.5 Å²	75.5	10%	0.097	41%	0.406	C	S	.	.	H	α-helix	trans	-74.6	-42.5	175.3	175.3	0	0	0	0	110.4	P1345 W1351 G1352 L1368 W1378 W1380	P1345-V1348 HydrophobicContact CB-CG2 4.13Å; P1345-V1348 HydrophobicContact CG-CG2 4.2Å; P1345-V1348 WeakPolarHBondContact O-CA 3.31Å; P1345-V1348 VanDerWaalsContact O-CB 3.3Å; P1345-V1348 WeakPolarHBondContact O-CB 3.35Å; P1345-V1348 PolarHBondContact O-N 3.18Å; V1348-W1351 CarbonylContact O-C 3.47Å; V1348-W1351 WeakPolarHBondContact O-CA 3.18Å; V1348-W1351 WeakPolarHBondContact O-CB 3.25Å; V1348-W1351 PolarHBondContact O-N 2.62Å; V1348-G1352 PolarHBondContact O-N 3.5Å; V1348-L1368 HydrophobicContact CG1-CD1 3.93Å; V1348-W1378 HydrophobicContact CB-CB 4.46Å; V1348-W1378 HydrophobicContact CG1-CB 3.79Å; V1348-W1378 HydrophobicContact CG1-CG 4.32Å; V1348-W1378 HydrophobicContact CG2-CB 3.84Å; V1348-W1378 HydrophobicContact CG2-CG 4.12Å; V1348-W1380 PolarHBondContact O-NE1 3.39Å
1349	L	88.3	Confident	80.1	Confident	37 Å²	37	76.2 Å²	76.2	19%	0.194	39%	0.391	C	S	.	.	H	α-helix	trans	-63.8	-44.4	173.5	-62.4	178.2	0	0	0	111.1	P1328 P1344 P1345 W1351 G1352 K1353 L1368 W1380	P1328-L1349 HydrophobicContact CB-CD2 4.06Å; P1328-L1349 VanDerWaalsContact O-CD2 3.29Å; P1328-L1349 WeakPolarHBondContact O-CD2 3.44Å; P1344-L1349 HydrophobicContact CB-CD1 4.32Å; P1344-L1349 HydrophobicContact CB-CD2 3.71Å; P1344-L1349 HydrophobicContact CB-CG 3.9Å; P1344-L1349 HydrophobicContact CG-CD2 4.27Å; P1345-L1349 PolarHBondContact O-N 2.84Å; P1345-L1349 VanDerWaalsContact O-N 3.13Å; L1349-W1351 PolarHBondContact O-N 3.28Å; L1349-G1352 PolarHBondContact O-N 2.83Å; L1349-K1353 WeakPolarHBondContact O-CB 3.41Å; L1349-K1353 WeakPolarHBondContact O-CG 3.24Å; L1349-K1353 PolarHBondContact O-N 2.81Å; L1349-L1368 HydrophobicContact CD2-CD2 4.42Å; L1349-W1380 HydrophobicContact CD2-CZ2 4.44Å
1350	K	84.8	Confident	78.3	Confident	102 Å²	102	78.6 Å²	78.6	44%	0.443	41%	0.409	S	S	.	.	H	α-helix	trans	-64.5	-18.6	170.1	-75	171.1	176.7	168.3	0	113	E1346 R1354	E1346-K1350 HydrophobicContact CG-CD 4.39Å; E1346-K1350 VanDerWaalsContact O-CB 3.23Å; E1346-K1350 WeakPolarHBondContact O-CB 3.35Å; E1346-K1350 VanDerWaalsContact O-CG 3.23Å; E1346-K1350 WeakPolarHBondContact O-CG 3.25Å; E1346-K1350 PolarHBondContact O-N 3.07Å; E1346-K1350 WeakPolarHBondContact OE1-CE 3.38Å; E1346-K1350 IonicContact OE1-NZ 2.76Å; E1346-K1350 PolarHBondContact OE1-NZ 3.01Å; E1346-K1350 WeakPolarHBondContact OE2-CE 3.45Å; E1346-K1350 IonicContact OE2-NZ 2.7Å; E1346-K1350 PolarHBondContact OE2-NZ 3.36Å; K1350-R1354 WeakPolarHBondContact O-CG 3.23Å; K1350-R1354 PolarHBondContact O-NE 3.3Å; K1350-R1354 PolarHBondContact O-NH2 3.11Å
1351	W	81.3	Confident	76.3	Confident	104 Å²	104	79.2 Å²	79.2	39%	0.394	41%	0.411	S	S	.	.	H	α-helix	trans	-83.2	-45.6	172.5	-177.1	28.6	0	0	0	111.5	S1347 V1348 L1349 K1353 R1354 I1355	S1347-W1351 WeakPolarHBondContact O-CB 3.46Å; S1347-W1351 PolarHBondContact O-N 3.47Å; V1348-W1351 CarbonylContact O-C 3.47Å; V1348-W1351 WeakPolarHBondContact O-CA 3.18Å; V1348-W1351 WeakPolarHBondContact O-CB 3.25Å; V1348-W1351 PolarHBondContact O-N 2.62Å; L1349-W1351 PolarHBondContact O-N 3.28Å; W1351-K1353 PolarHBondContact O-N 3.17Å; W1351-R1354 CarbonylContact O-C 3.35Å; W1351-R1354 WeakPolarHBondContact O-CA 3.48Å; W1351-R1354 WeakPolarHBondContact O-CB 3.43Å; W1351-R1354 PolarHBondContact O-N 3.06Å; W1351-I1355 HydrophobicContact CD2-CD1 4.19Å; W1351-I1355 HydrophobicContact CG-CD1 4.33Å; W1351-I1355 HydrophobicContact CZ2-CD1 4.3Å; W1351-I1355 WeakPolarHBondContact O-CG1 3.32Å; W1351-I1355 PolarHBondContact O-N 2.95Å
1352	G	80.9	Confident	74.4	Confident	7 Å²	7	83.1 Å²	83.1	7%	0.072	43%	0.432	C	S	.	.	H	α-helix	trans	-54.5	-50.2	172.7	0	0	0	0	0	112.2	V1348 L1349 R1354 I1355 A1356 W1380	V1348-G1352 PolarHBondContact O-N 3.5Å; L1349-G1352 PolarHBondContact O-N 2.83Å; G1352-R1354 PolarHBondContact O-N 2.92Å; G1352-R1354 VanDerWaalsContact O-N 3.15Å; G1352-I1355 PolarHBondContact O-N 2.86Å; G1352-A1356 PolarHBondContact O-N 2.66Å; G1352-W1380 VanDerWaalsContact CA-NE1 3.3Å
1353	K	79.5	Confident	72.5	Confident	146 Å²	146	85 Å²	85	64%	0.635	44%	0.439	S	S	*	.	H	α-helix	trans	-58.6	-27.6	174.6	-67.9	175.1	-177.9	-179.7	0	112.8	L1349 W1351 F1357	L1349-K1353 WeakPolarHBondContact O-CB 3.41Å; L1349-K1353 WeakPolarHBondContact O-CG 3.24Å; L1349-K1353 PolarHBondContact O-N 2.81Å; W1351-K1353 PolarHBondContact O-N 3.17Å; K1353-F1357 WeakPolarHBondContact O-CB 3.42Å; K1353-F1357 PolarHBondContact O-N 3.49Å
1354	R	76.6	Confident	71	Confident	143 Å²	143	82.8 Å²	82.8	54%	0.54	43%	0.429	S	S	.	.	H	α-helix	trans	-82.1	-29	171	-82.9	177.5	-70.4	163.6	2.2	113.9	K1350 W1351 G1352 N1358	K1350-R1354 WeakPolarHBondContact O-CG 3.23Å; K1350-R1354 PolarHBondContact O-NE 3.3Å; K1350-R1354 PolarHBondContact O-NH2 3.11Å; W1351-R1354 CarbonylContact O-C 3.35Å; W1351-R1354 WeakPolarHBondContact O-CA 3.48Å; W1351-R1354 WeakPolarHBondContact O-CB 3.43Å; W1351-R1354 PolarHBondContact O-N 3.06Å; G1352-R1354 PolarHBondContact O-N 2.92Å; G1352-R1354 VanDerWaalsContact O-N 3.15Å; R1354-N1358 PolarHBondContact O-N 3.34Å; R1354-N1358 PolarHBondContact O-ND2 3Å
1355	I	72.9	Confident	70.1	Confident	36 Å²	36	88.6 Å²	88.6	19%	0.185	46%	0.455	C	S	.	.	H	α-helix	trans	-70.1	-47.4	173.4	-62.6	165	0	0	0	109.1	W1351 G1352 F1357 N1358 K1359 L1366 W1380	W1351-I1355 HydrophobicContact CD2-CD1 4.19Å; W1351-I1355 HydrophobicContact CG-CD1 4.33Å; W1351-I1355 HydrophobicContact CZ2-CD1 4.3Å; W1351-I1355 WeakPolarHBondContact O-CG1 3.32Å; W1351-I1355 PolarHBondContact O-N 2.95Å; G1352-I1355 PolarHBondContact O-N 2.86Å; I1355-F1357 VanDerWaalsContact C-N 3.3Å; I1355-F1357 PolarHBondContact O-N 3.2Å; I1355-N1358 CarbonylContact O-C 3.58Å; I1355-N1358 PolarHBondContact O-N 3.17Å; I1355-K1359 HydrophobicContact CG2-CG 4.43Å; I1355-K1359 PolarHBondContact O-N 2.69Å; I1355-L1366 HydrophobicContact CB-CD1 4.35Å; I1355-L1366 HydrophobicContact CG2-CD1 3.42Å; I1355-L1366 VanDerWaalsContact CG2-CD1 3.42Å; I1355-W1380 HydrophobicContact CD1-CB 3.9Å; I1355-W1380 HydrophobicContact CD1-CG 4.12Å
1356	A	68.6	Low	70	Confident	68 Å²	68	88.1 Å²	88.1	56%	0.562	45%	0.449	S	S	*	.	H	α-helix	trans	-54.3	-44.9	173.2	0	0	0	0	0	111.8	G1352 N1358	G1352-A1356 PolarHBondContact O-N 2.66Å; A1356-N1358 PolarHBondContact O-N 3.22Å; A1356-N1358 VanDerWaalsContact O-N 3.17Å
1357	F	63	Low	70.2	Confident	188 Å²	188	83.8 Å²	83.8	83%	0.825	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.4	-9.7	176.7	-158.9	-90.9	0	0	0	115	K1353 I1355	K1353-F1357 WeakPolarHBondContact O-CB 3.42Å; K1353-F1357 PolarHBondContact O-N 3.49Å; I1355-F1357 VanDerWaalsContact C-N 3.3Å; I1355-F1357 PolarHBondContact O-N 3.2Å
1358	N	57.8	Low	70.5	Confident	131 Å²	131	80.1 Å²	80.1	70%	0.701	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.7	-7	-179.2	-75.5	-91.9	0	0	0	114.3	R1354 I1355 A1356	R1354-N1358 PolarHBondContact O-N 3.34Å; R1354-N1358 PolarHBondContact O-ND2 3Å; I1355-N1358 CarbonylContact O-C 3.58Å; I1355-N1358 PolarHBondContact O-N 3.17Å; A1356-N1358 PolarHBondContact O-N 3.22Å; A1356-N1358 VanDerWaalsContact O-N 3.17Å
1359	K	51.8	Low	70.7	Confident	78 Å²	78	79.3 Å²	79.3	34%	0.339	40%	0.399	S	S	.	.			trans	-98.6	126	169.2	-91.9	-158.2	171.8	-151.6	0	108.6	I1355 D1362 L1366	I1355-K1359 HydrophobicContact CG2-CG 4.43Å; I1355-K1359 PolarHBondContact O-N 2.69Å; K1359-D1362 IonicContact NZ-OD2 3.11Å; K1359-D1362 PolarHBondContact NZ-OD2 3.39Å; K1359-L1366 HydrophobicContact CD-CD1 4.32Å
1360	S	46.9	Very low	71	Confident	72 Å²	72	77.7 Å²	77.7	50%	0.503	39%	0.391	S	S	.	.			trans	-135.5	8.3	-178	69	0	0	0	0	115.2
1361	T	45.6	Very low	71.5	Confident	114 Å²	114	73.2 Å²	73.2	70%	0.699	37%	0.371	S	S	*	.	S	Bend	trans	-157	39.5	-172.1	62.9	0	0	0	0	113.3	Y984	Y984-T1361 HydrophobicContact CE1-CG2 4.27Å
1362	D	49.6	Very low	72.2	Confident	93 Å²	93	68.3 Å²	68.3	50%	0.497	35%	0.353	S	S	.	.			trans	-155.2	97.9	-175.7	-167.7	36.8	0	0	0	109.7	K1359 S1364	K1359-D1362 IonicContact NZ-OD2 3.11Å; K1359-D1362 PolarHBondContact NZ-OD2 3.39Å; D1362-S1364 PolarHBondContact O-N 3.31Å
1363	D	47.7	Very low	72.6	Confident	109 Å²	109	69.4 Å²	69.4	58%	0.583	36%	0.357	S	S	*	.			trans	-85.9	74.7	-157.2	-139	1.9	0	0	0	111.5	T985	T985-D1363 WeakPolarHBondContact CG2-OD2 3.24Å
1364	S	56.2	Low	73	Confident	24 Å²	24	66.4 Å²	66.4	17%	0.168	35%	0.351	C	S	.	.			trans	-148.1	112.4	-179.9	-63	0	0	0	0	109.9	D1362 L1366	D1362-S1364 PolarHBondContact O-N 3.31Å; S1364-L1366 PolarHBondContact O-N 2.98Å
1365	E	70.6	Confident	73.5	Confident	135 Å²	135	65.3 Å²	65.3	63%	0.631	35%	0.35	S	S	*	.			trans	-54.3	124.9	174.9	-68.3	-165.7	150.8	0	0	109.8	N978 L1367 P1383	N978-E1365 PolarHBondContact ND2-OE1 3.27Å; N978-E1365 VanDerWaalsContact ND2-OE1 3.13Å; E1365-L1367 PolarHBondContact O-N 3.09Å; E1365-P1383 WeakPolarHBondContact O-CD 3.39Å
1366	L	85.3	Confident	74.3	Confident	42 Å²	42	67.8 Å²	67.8	22%	0.22	36%	0.357	C	S	.	.			trans	-83.1	108	-177.9	-69.4	177.6	0	0	0	109.1	I1355 K1359 S1364 W1380 L1381	I1355-L1366 HydrophobicContact CB-CD1 4.35Å; I1355-L1366 HydrophobicContact CG2-CD1 3.42Å; I1355-L1366 VanDerWaalsContact CG2-CD1 3.42Å; K1359-L1366 HydrophobicContact CD-CD1 4.32Å; S1364-L1366 PolarHBondContact O-N 2.98Å; L1366-W1380 HydrophobicContact CB-CB 4.48Å; L1366-W1380 HydrophobicContact CB-CE3 4.02Å; L1366-W1380 VanDerWaalsContact O-CZ3 3.29Å; L1366-W1380 WeakPolarHBondContact O-CZ3 3.32Å; L1366-L1381 CarbonylContact C-O 3.57Å; L1366-L1381 VanDerWaalsContact CA-O 3.3Å; L1366-L1381 WeakPolarHBondContact CA-O 3.46Å
1367	L	90	Very high	75.4	Confident	34 Å²	34	67.2 Å²	67.2	18%	0.178	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	136.6	173.7	-67.6	166.3	0	0	0	109.5	F1305 I1325 E1365 L1381 P1383 L1386	F1305-L1367 HydrophobicContact CB-CD1 3.85Å; F1305-L1367 HydrophobicContact CD2-CD1 4.43Å; I1325-L1367 HydrophobicContact CD1-CD1 4.32Å; I1325-L1367 HydrophobicContact CG2-CB 4.47Å; I1325-L1367 HydrophobicContact CG2-CD2 4.25Å; E1365-L1367 PolarHBondContact O-N 3.09Å; L1367-L1381 PolarHBondContact N-O 3.18Å; L1367-L1381 PolarHBondContact O-N 3.1Å; L1367-P1383 HydrophobicContact CD1-CB 4.4Å; L1367-P1383 HydrophobicContact CD1-CG 4.06Å; L1367-L1386 HydrophobicContact CB-CD1 4.12Å; L1367-L1386 HydrophobicContact CD1-CD1 3.51Å; L1367-L1386 HydrophobicContact CG-CD1 4.47Å
1368	L	93.7	Very high	76.8	Confident	3 Å²	3	60.1 Å²	60.1	2%	0.016	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	118.8	174.2	176.5	60.4	0	0	0	109	V1326 P1328 P1344 V1348 L1349 W1378 W1380	V1326-L1368 PolarHBondContact N-O 3.36Å; P1328-L1368 HydrophobicContact CB-CD2 4.08Å; P1344-L1368 HydrophobicContact CB-CD2 3.91Å; P1344-L1368 HydrophobicContact CG-CD2 3.67Å; V1348-L1368 HydrophobicContact CG1-CD1 3.93Å; L1349-L1368 HydrophobicContact CD2-CD2 4.42Å; L1368-W1378 HydrophobicContact CD1-CE3 3.85Å; L1368-W1378 HydrophobicContact CD1-CZ3 4.48Å; L1368-W1378 HydrophobicContact CD2-CE3 4.11Å; L1368-W1378 HydrophobicContact CD2-CZ3 4Å; L1368-W1378 HydrophobicContact CG-CE3 3.96Å; L1368-W1378 HydrophobicContact CG-CZ3 4.09Å; L1368-W1380 HydrophobicContact CB-CD2 4.32Å; L1368-W1380 HydrophobicContact CB-CE3 4.11Å; L1368-W1380 HydrophobicContact CB-CH2 4.16Å; L1368-W1380 HydrophobicContact CB-CZ2 4.32Å; L1368-W1380 HydrophobicContact CB-CZ3 4.03Å; L1368-W1380 HydrophobicContact CD1-CD2 4.14Å; L1368-W1380 HydrophobicContact CD1-CG 4.37Å; L1368-W1380 HydrophobicContact CD1-CZ2 4.24Å; L1368-W1380 HydrophobicContact CD2-CH2 4.47Å; L1368-W1380 HydrophobicContact CD2-CZ2 4.15Å; L1368-W1380 HydrophobicContact CG-CZ2 4.48Å
1369	V	93.8	Very high	78.4	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	143.7	178.5	-58.2	0	0	0	0	112.3	A1313 A1323 I1324 I1325 F1371 W1378 Q1379 L1381 L1386	A1313-V1369 HydrophobicContact CB-CG2 4.44Å; A1323-V1369 HydrophobicContact CB-CB 4.01Å; A1323-V1369 HydrophobicContact CB-CG2 4.41Å; I1324-V1369 WeakPolarHBondContact O-CA 3.46Å; I1325-V1369 HydrophobicContact CG1-CG1 4.2Å; V1369-F1371 HydrophobicContact CG2-CE2 4Å; V1369-F1371 HydrophobicContact CG2-CZ 4.21Å; V1369-W1378 WeakPolarHBondContact O-CA 3.46Å; V1369-Q1379 HydrophobicContact CG2-CB 4.15Å; V1369-Q1379 WeakPolarHBondContact CG2-O 3.24Å; V1369-Q1379 PolarHBondContact N-O 3.08Å; V1369-Q1379 PolarHBondContact O-N 2.81Å; V1369-L1381 HydrophobicContact CG2-CD1 3.8Å; V1369-L1381 HydrophobicContact CG2-CG 4.19Å; V1369-L1386 HydrophobicContact CG1-CD1 4.36Å; V1369-L1386 HydrophobicContact CG1-CD2 3.86Å
1370	L	95.3	Very high	80.2	Confident	2 Å²	2	54.2 Å²	54.2	1%	0.01	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	112.8	172.9	176	57.7	0	0	0	109.2	A1323 I1324 V1326 I1341 P1342 R1376 W1378	A1323-L1370 CarbonylContact C-O 3.54Å; A1323-L1370 VanDerWaalsContact CA-O 3.27Å; A1323-L1370 WeakPolarHBondContact CA-O 3.3Å; A1323-L1370 WeakPolarHBondContact CB-O 3.45Å; I1324-L1370 HydrophobicContact CG2-CB 4.02Å; I1324-L1370 HydrophobicContact CG2-CD2 4.47Å; I1324-L1370 HydrophobicContact CG2-CG 4.45Å; I1324-L1370 PolarHBondContact N-O 3.19Å; I1324-L1370 PolarHBondContact O-N 3.39Å; V1326-L1370 HydrophobicContact CG2-CB 3.82Å; V1326-L1370 HydrophobicContact CG2-CD2 4.41Å; I1341-L1370 HydrophobicContact CG2-CD2 4.49Å; P1342-L1370 HydrophobicContact CB-CD2 4.44Å; P1342-L1370 HydrophobicContact CG-CD2 4.22Å; L1370-R1376 HydrophobicContact CD1-CB 4.05Å; L1370-R1376 VanDerWaalsContact CD1-O 3.25Å; L1370-R1376 WeakPolarHBondContact CD1-O 3.26Å; L1370-W1378 HydrophobicContact CB-CE3 4.14Å; L1370-W1378 HydrophobicContact CB-CH2 4.28Å; L1370-W1378 HydrophobicContact CB-CZ3 4.01Å; L1370-W1378 HydrophobicContact CD1-CD2 3.92Å; L1370-W1378 HydrophobicContact CD1-CE3 4.35Å; L1370-W1378 HydrophobicContact CD1-CG 4.32Å; L1370-W1378 HydrophobicContact CD1-CH2 4.43Å; L1370-W1378 HydrophobicContact CD1-CZ2 3.98Å; L1370-W1378 HydrophobicContact CD2-CH2 4Å; L1370-W1378 HydrophobicContact CD2-CZ2 3.98Å; L1370-W1378 HydrophobicContact CG-CH2 4.48Å; L1370-W1378 HydrophobicContact CG-CZ2 4.43Å
1371	F	95.2	Very high	82.2	Confident	9 Å²	9	51.3 Å²	51.3	4%	0.039	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	150.9	-178.6	-75	-77.2	0	0	0	113	A1313 C1315 A1323 V1369 D1373 R1376 T1377 Q1379 L1381	A1313-F1371 HydrophobicContact CB-CE1 3.6Å; A1313-F1371 HydrophobicContact CB-CZ 3.81Å; C1315-F1371 VanDerWaalsContact SG-CZ 3.53Å; A1323-F1371 HydrophobicContact CB-CD1 3.76Å; A1323-F1371 HydrophobicContact CB-CE1 4.07Å; A1323-F1371 HydrophobicContact CB-CG 4.24Å; V1369-F1371 HydrophobicContact CG2-CE2 4Å; V1369-F1371 HydrophobicContact CG2-CZ 4.21Å; F1371-D1373 HydrophobicContact CB-CB 4.33Å; F1371-D1373 PolarHBondContact O-N 3.3Å; F1371-R1376 WeakPolarHBondContact O-CD 3.5Å; F1371-T1377 WeakPolarHBondContact CD2-O 3.4Å; F1371-T1377 WeakPolarHBondContact CD2-OG1 3.33Å; F1371-T1377 PolarHBondContact N-O 2.86Å; F1371-Q1379 HydrophobicContact CE2-CB 3.85Å; F1371-L1381 HydrophobicContact CZ-CD1 4.4Å
1372	F	94.2	Very high	84.2	Confident	1 Å²	1	46.1 Å²	46.1	0%	0.004	23%	0.229	C	C	.	.	S	Bend	trans	-85.1	18.1	170.1	-71.8	-86	0	0	0	113.2	I1310 P1322 I1324 A1415 R1418 A1419 H1422	I1310-F1372 HydrophobicContact CG2-CE2 4.24Å; P1322-F1372 HydrophobicContact CB-CB 4.45Å; P1322-F1372 HydrophobicContact CB-CD2 4.21Å; P1322-F1372 PolarHBondContact O-N 2.83Å; I1324-F1372 HydrophobicContact CB-CE2 3.87Å; I1324-F1372 HydrophobicContact CB-CZ 4.06Å; I1324-F1372 HydrophobicContact CG2-CE2 4.2Å; I1324-F1372 HydrophobicContact CG2-CZ 4.18Å; F1372-A1415 HydrophobicContact CB-CB 4.17Å; F1372-A1415 WeakPolarHBondContact CB-O 3.31Å; F1372-A1415 WeakPolarHBondContact O-CA 3.39Å; F1372-A1415 WeakPolarHBondContact O-CB 3.5Å; F1372-R1418 HydrophobicContact CB-CB 4.2Å; F1372-R1418 HydrophobicContact CD1-CB 4.06Å; F1372-R1418 WeakPolarHBondContact O-CD 3.38Å; F1372-R1418 PolarHBondContact O-NH1 3.46Å; F1372-A1419 HydrophobicContact CD1-CB 4.38Å; F1372-A1419 HydrophobicContact CD2-CB 3.75Å; F1372-A1419 HydrophobicContact CE2-CB 3.91Å; F1372-A1419 HydrophobicContact CG-CB 4.01Å; F1372-A1419 HydrophobicContact CZ-CB 4.31Å; F1372-H1422 HydrophobicContact CE1-CB 3.71Å; F1372-H1422 HydrophobicContact CZ-CB 3.97Å
1373	D	91.3	Very high	86	Confident	30 Å²	30	43.8 Å²	43.8	16%	0.16	22%	0.219	C	C	.	.	S	Bend	trans	-68.9	180	174.5	73.2	-6.5	0	0	0	112.5	F1371 K1375 R1376 T1377 R1418	F1371-D1373 HydrophobicContact CB-CB 4.33Å; F1371-D1373 PolarHBondContact O-N 3.3Å; D1373-K1375 PolarHBondContact OD1-N 3.35Å; D1373-R1376 VanDerWaalsContact OD1-CA 3.26Å; D1373-R1376 WeakPolarHBondContact OD1-CA 3.04Å; D1373-R1376 PolarHBondContact OD1-N 3.46Å; D1373-T1377 PolarHBondContact OD1-N 3.39Å; D1373-T1377 WeakPolarHBondContact OD2-CB 3.4Å; D1373-T1377 WeakPolarHBondContact OD2-CG2 3.13Å; D1373-T1377 PolarHBondContact OD2-OG1 2.81Å; D1373-R1418 PolarHBondContact O-NH1 3.31Å
1374	T	86.9	Confident	87.8	Confident	83 Å²	83	45.1 Å²	45.1	51%	0.509	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-39.5	-179.6	45.7	0	0	0	0	112.9	R1376	T1374-R1376 VanDerWaalsContact C-N 3.34Å; T1374-R1376 PolarHBondContact O-N 2.84Å
1375	K	86.4	Confident	89.4	Confident	120 Å²	120	48 Å²	48	52%	0.522	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.4	8.6	-174.5	-58.2	-164.5	176	-166.6	0	113.9	D1373 T1377	D1373-K1375 PolarHBondContact OD1-N 3.35Å; K1375-T1377 VanDerWaalsContact C-N 3.32Å; K1375-T1377 HydrophobicContact CB-CG2 4.06Å; K1375-T1377 PolarHBondContact O-N 2.64Å
1376	R	90.5	Very high	90.5	Very high	88 Å²	88	41.9 Å²	41.9	33%	0.332	20%	0.203	S	C	.	.			trans	45.7	55.3	-177.6	-73.1	-61	-160	164.9	2.7	111.3	L1370 F1371 D1373 T1374	L1370-R1376 HydrophobicContact CD1-CB 4.05Å; L1370-R1376 VanDerWaalsContact CD1-O 3.25Å; L1370-R1376 WeakPolarHBondContact CD1-O 3.26Å; F1371-R1376 WeakPolarHBondContact O-CD 3.5Å; D1373-R1376 VanDerWaalsContact OD1-CA 3.26Å; D1373-R1376 WeakPolarHBondContact OD1-CA 3.04Å; D1373-R1376 PolarHBondContact OD1-N 3.46Å; T1374-R1376 VanDerWaalsContact C-N 3.34Å; T1374-R1376 PolarHBondContact O-N 2.84Å
1377	T	91.6	Very high	90.8	Very high	56 Å²	56	41.5 Å²	41.5	34%	0.344	20%	0.2	S	C	.	.			trans	-71	139.5	-169.4	55.8	0	0	0	0	112.6	F1371 D1373 K1375	F1371-T1377 WeakPolarHBondContact CD2-O 3.4Å; F1371-T1377 WeakPolarHBondContact CD2-OG1 3.33Å; F1371-T1377 PolarHBondContact N-O 2.86Å; D1373-T1377 PolarHBondContact OD1-N 3.39Å; D1373-T1377 WeakPolarHBondContact OD2-CB 3.4Å; D1373-T1377 WeakPolarHBondContact OD2-CG2 3.13Å; D1373-T1377 PolarHBondContact OD2-OG1 2.81Å; K1375-T1377 VanDerWaalsContact C-N 3.32Å; K1375-T1377 HydrophobicContact CB-CG2 4.06Å; K1375-T1377 PolarHBondContact O-N 2.64Å
1378	W	92.4	Very high	90.8	Very high	38 Å²	38	41.1 Å²	41.1	14%	0.144	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	132.8	179.2	-68.1	90.8	0	0	0	110.9	V1326 P1342 L1343 P1344 V1348 L1368 V1369 L1370	V1326-W1378 HydrophobicContact CB-CH2 4.31Å; V1326-W1378 HydrophobicContact CB-CZ3 3.89Å; V1326-W1378 HydrophobicContact CG1-CH2 4.03Å; V1326-W1378 HydrophobicContact CG1-CZ3 4.01Å; V1326-W1378 HydrophobicContact CG2-CH2 4.21Å; V1326-W1378 HydrophobicContact CG2-CZ3 3.98Å; P1342-W1378 HydrophobicContact CB-CZ2 4.36Å; P1342-W1378 WeakPolarHBondContact O-CH2 3.31Å; P1342-W1378 WeakPolarHBondContact O-CZ2 3.44Å; L1343-W1378 WeakPolarHBondContact O-CZ2 3.19Å; P1344-W1378 HydrophobicContact CB-CE3 4.41Å; P1344-W1378 HydrophobicContact CB-CH2 4.09Å; P1344-W1378 HydrophobicContact CB-CZ3 4.05Å; P1344-W1378 HydrophobicContact CG-CH2 3.73Å; P1344-W1378 HydrophobicContact CG-CZ3 3.73Å; V1348-W1378 HydrophobicContact CB-CB 4.46Å; V1348-W1378 HydrophobicContact CG1-CB 3.79Å; V1348-W1378 HydrophobicContact CG1-CG 4.32Å; V1348-W1378 HydrophobicContact CG2-CB 3.84Å; V1348-W1378 HydrophobicContact CG2-CG 4.12Å; L1368-W1378 HydrophobicContact CD1-CE3 3.85Å; L1368-W1378 HydrophobicContact CD1-CZ3 4.48Å; L1368-W1378 HydrophobicContact CD2-CE3 4.11Å; L1368-W1378 HydrophobicContact CD2-CZ3 4Å; L1368-W1378 HydrophobicContact CG-CE3 3.96Å; L1368-W1378 HydrophobicContact CG-CZ3 4.09Å; V1369-W1378 WeakPolarHBondContact O-CA 3.46Å; L1370-W1378 HydrophobicContact CB-CE3 4.14Å; L1370-W1378 HydrophobicContact CB-CH2 4.28Å; L1370-W1378 HydrophobicContact CB-CZ3 4.01Å; L1370-W1378 HydrophobicContact CD1-CD2 3.92Å; L1370-W1378 HydrophobicContact CD1-CE3 4.35Å; L1370-W1378 HydrophobicContact CD1-CG 4.32Å; L1370-W1378 HydrophobicContact CD1-CH2 4.43Å; L1370-W1378 HydrophobicContact CD1-CZ2 3.98Å; L1370-W1378 HydrophobicContact CD2-CH2 4Å; L1370-W1378 HydrophobicContact CD2-CZ2 3.98Å; L1370-W1378 HydrophobicContact CG-CH2 4.48Å; L1370-W1378 HydrophobicContact CG-CZ2 4.43Å
1379	Q	90.8	Very high	90.6	Very high	49 Å²	49	41.1 Å²	41.1	23%	0.229	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	142.6	179.2	-175.3	57.6	63.6	0	0	111.8	V1369 F1371 L1381	V1369-Q1379 HydrophobicContact CG2-CB 4.15Å; V1369-Q1379 WeakPolarHBondContact CG2-O 3.24Å; V1369-Q1379 PolarHBondContact N-O 3.08Å; V1369-Q1379 PolarHBondContact O-N 2.81Å; F1371-Q1379 HydrophobicContact CE2-CB 3.85Å; Q1379-L1381 HydrophobicContact CG-CD2 3.71Å; Q1379-L1381 HydrophobicContact CG-CG 3.86Å
1380	W	90.6	Very high	90	Very high	36 Å²	36	41.5 Å²	41.5	14%	0.136	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	124.7	167.2	-65.2	86.7	0	0	0	109.3	P1328 V1348 L1349 G1352 I1355 L1366 L1368	P1328-W1380 HydrophobicContact CB-CH2 3.62Å; P1328-W1380 HydrophobicContact CB-CZ2 4.3Å; P1328-W1380 HydrophobicContact CB-CZ3 4.47Å; P1328-W1380 HydrophobicContact CG-CH2 4.16Å; V1348-W1380 PolarHBondContact O-NE1 3.39Å; L1349-W1380 HydrophobicContact CD2-CZ2 4.44Å; G1352-W1380 VanDerWaalsContact CA-NE1 3.3Å; I1355-W1380 HydrophobicContact CD1-CB 3.9Å; I1355-W1380 HydrophobicContact CD1-CG 4.12Å; L1366-W1380 HydrophobicContact CB-CB 4.48Å; L1366-W1380 HydrophobicContact CB-CE3 4.02Å; L1366-W1380 VanDerWaalsContact O-CZ3 3.29Å; L1366-W1380 WeakPolarHBondContact O-CZ3 3.32Å; L1368-W1380 HydrophobicContact CB-CD2 4.32Å; L1368-W1380 HydrophobicContact CB-CE3 4.11Å; L1368-W1380 HydrophobicContact CB-CH2 4.16Å; L1368-W1380 HydrophobicContact CB-CZ2 4.32Å; L1368-W1380 HydrophobicContact CB-CZ3 4.03Å; L1368-W1380 HydrophobicContact CD1-CD2 4.14Å; L1368-W1380 HydrophobicContact CD1-CG 4.37Å; L1368-W1380 HydrophobicContact CD1-CZ2 4.24Å; L1368-W1380 HydrophobicContact CD2-CH2 4.47Å; L1368-W1380 HydrophobicContact CD2-CZ2 4.15Å; L1368-W1380 HydrophobicContact CG-CZ2 4.48Å
1381	L	89	Confident	89.3	Confident	11 Å²	11	46.5 Å²	46.5	6%	0.058	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	156.2	-178.5	-65.7	-179.8	0	0	0	111.2	A1313 L1366 L1367 V1369 F1371 Q1379 K1385 L1386	A1313-L1381 HydrophobicContact CB-CD1 3.75Å; L1366-L1381 CarbonylContact C-O 3.57Å; L1366-L1381 VanDerWaalsContact CA-O 3.3Å; L1366-L1381 WeakPolarHBondContact CA-O 3.46Å; L1367-L1381 PolarHBondContact N-O 3.18Å; L1367-L1381 PolarHBondContact O-N 3.1Å; V1369-L1381 HydrophobicContact CG2-CD1 3.8Å; V1369-L1381 HydrophobicContact CG2-CG 4.19Å; F1371-L1381 HydrophobicContact CZ-CD1 4.4Å; Q1379-L1381 HydrophobicContact CG-CD2 3.71Å; Q1379-L1381 HydrophobicContact CG-CG 3.86Å; L1381-K1385 HydrophobicContact CB-CB 4.44Å; L1381-K1385 HydrophobicContact CD2-CD 4.32Å; L1381-L1386 HydrophobicContact CB-CD2 4.3Å; L1381-L1386 HydrophobicContact CD1-CD2 3.93Å
1382	S	86.7	Confident	88.7	Confident	5 Å²	5	48.7 Å²	48.7	4%	0.035	24%	0.242	C	C	.	.			trans	-83.1	156.3	169	49.1	0	0	0	0	110.9	Q1384 K1385	S1382-Q1384 PolarHBondContact O-N 2.76Å; S1382-K1385 WeakPolarHBondContact O-CB 3.37Å; S1382-K1385 PolarHBondContact O-N 3.06Å
1383	P	87.4	Confident	88	Confident	44 Å²	44	52.9 Å²	52.9	29%	0.286	26%	0.26	S	S	.	.	G	3₁₀ helix	trans	-58.9	-34.7	-178	-24.7	36.5	0	0	0	112.6	F1305 E1365 L1367 K1385 L1386	F1305-P1383 HydrophobicContact CD2-CB 4.13Å; F1305-P1383 HydrophobicContact CE2-CB 4.39Å; E1365-P1383 WeakPolarHBondContact O-CD 3.39Å; L1367-P1383 HydrophobicContact CD1-CB 4.4Å; L1367-P1383 HydrophobicContact CD1-CG 4.06Å; P1383-K1385 PolarHBondContact O-N 2.89Å; P1383-L1386 WeakPolarHBondContact O-CA 3.24Å; P1383-L1386 WeakPolarHBondContact O-CB 3.42Å; P1383-L1386 PolarHBondContact O-N 3.14Å
1384	Q	85.9	Confident	87.6	Confident	138 Å²	138	57.1 Å²	57.1	65%	0.645	28%	0.279	S	S	*	.	G	3₁₀ helix	trans	-54.1	-12.4	170.4	-60.1	162.3	-8.6	0	0	115.2	S1382	S1382-Q1384 PolarHBondContact O-N 2.76Å
1385	K	90.8	Very high	87.5	Confident	85 Å²	85	53.8 Å²	53.8	37%	0.37	26%	0.258	S	S	.	.	G	3₁₀ helix	trans	-111.7	11.1	177.2	-63.2	177.9	-176.1	169.6	0	112.4	A1313 K1314 W1320 L1381 S1382 P1383	A1313-K1385 CarbonylContact C-O 3.49Å; A1313-K1385 WeakPolarHBondContact CA-O 3.37Å; K1314-K1385 HydrophobicContact CB-CB 4.45Å; K1314-K1385 PolarHBondContact N-O 3.31Å; W1320-K1385 VanDerWaalsContact CZ3-O 3.24Å; W1320-K1385 WeakPolarHBondContact CZ3-O 3.45Å; L1381-K1385 HydrophobicContact CB-CB 4.44Å; L1381-K1385 HydrophobicContact CD2-CD 4.32Å; S1382-K1385 WeakPolarHBondContact O-CB 3.37Å; S1382-K1385 PolarHBondContact O-N 3.06Å; P1383-K1385 PolarHBondContact O-N 2.89Å
1386	L	92.4	Very high	87.6	Confident	6 Å²	6	48.2 Å²	48.2	3%	0.031	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	151	173.5	-50.7	-176.3	0	0	0	109.2	F1305 V1311 W1312 A1313 I1325 L1367 V1369 L1381 P1383	F1305-L1386 HydrophobicContact CD2-CB 4.16Å; F1305-L1386 HydrophobicContact CD2-CD1 4.26Å; F1305-L1386 HydrophobicContact CE1-CB 4.17Å; F1305-L1386 HydrophobicContact CE2-CB 3.74Å; F1305-L1386 HydrophobicContact CG-CD1 4.34Å; F1305-L1386 HydrophobicContact CZ-CB 3.75Å; V1311-L1386 HydrophobicContact CB-CB 4.46Å; V1311-L1386 HydrophobicContact CG2-CD2 4.14Å; W1312-L1386 CarbonylContact O-C 3.59Å; W1312-L1386 VanDerWaalsContact O-CA 3.24Å; W1312-L1386 WeakPolarHBondContact O-CA 3.29Å; A1313-L1386 HydrophobicContact CB-CD2 3.66Å; I1325-L1386 HydrophobicContact CD1-CD1 3.85Å; I1325-L1386 HydrophobicContact CG1-CD1 4.4Å; L1367-L1386 HydrophobicContact CB-CD1 4.12Å; L1367-L1386 HydrophobicContact CD1-CD1 3.51Å; L1367-L1386 HydrophobicContact CG-CD1 4.47Å; V1369-L1386 HydrophobicContact CG1-CD1 4.36Å; V1369-L1386 HydrophobicContact CG1-CD2 3.86Å; L1381-L1386 HydrophobicContact CB-CD2 4.3Å; L1381-L1386 HydrophobicContact CD1-CD2 3.93Å; P1383-L1386 WeakPolarHBondContact O-CA 3.24Å; P1383-L1386 WeakPolarHBondContact O-CB 3.42Å; P1383-L1386 PolarHBondContact O-N 3.14Å
1387	Q	91.3	Very high	87.4	Confident	33 Å²	33	47.6 Å²	47.6	15%	0.154	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	147.1	166.8	-68	-171.7	-62.7	0	0	107.9	V1311 W1312 W1320 L1395 R1399	V1311-Q1387 CarbonylContact C-O 3.58Å; V1311-Q1387 VanDerWaalsContact CA-O 3.23Å; V1311-Q1387 WeakPolarHBondContact CA-O 3.35Å; V1311-Q1387 VanDerWaalsContact CB-O 3.31Å; V1311-Q1387 WeakPolarHBondContact CB-O 3.43Å; W1312-Q1387 HydrophobicContact CB-CB 4.31Å; W1312-Q1387 PolarHBondContact N-O 2.96Å; W1312-Q1387 PolarHBondContact O-N 2.9Å; W1320-Q1387 HydrophobicContact CH2-CG 3.71Å; W1320-Q1387 HydrophobicContact CZ2-CG 4.41Å; W1320-Q1387 HydrophobicContact CZ3-CB 4.33Å; W1320-Q1387 HydrophobicContact CZ3-CG 3.81Å; Q1387-L1395 HydrophobicContact CB-CD2 4.15Å; Q1387-R1399 VanDerWaalsContact OE1-CZ 3.31Å
1388	P	90.3	Very high	87.1	Confident	27 Å²	27	50 Å²	50	18%	0.175	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61	145.7	177	25.5	-33.8	0	0	0	111.3	I1391	P1388-I1391 HydrophobicContact CB-CB 4.31Å; P1388-I1391 HydrophobicContact CB-CD1 3.67Å; P1388-I1391 HydrophobicContact CB-CG1 4.04Å; P1388-I1391 HydrophobicContact CG-CD1 4.41Å
1389	L	89.5	Confident	87	Confident	3 Å²	3	49.7 Å²	49.7	2%	0.016	24%	0.238	C	C	.	.	S	Bend	trans	-108.4	140.8	175.7	-175.9	154.5	0	0	0	109.4	I1310 W1312 P1322 I1391 Y1416 I1423	I1310-L1389 HydrophobicContact CG2-CB 4.29Å; I1310-L1389 HydrophobicContact CG2-CD1 4.32Å; I1310-L1389 HydrophobicContact CG2-CD2 4.07Å; I1310-L1389 HydrophobicContact CG2-CG 4.48Å; I1310-L1389 WeakPolarHBondContact O-CB 3.41Å; I1310-L1389 PolarHBondContact O-N 3.5Å; I1310-L1389 VanDerWaalsContact O-N 3.15Å; W1312-L1389 HydrophobicContact CD2-CD1 4.08Å; W1312-L1389 HydrophobicContact CG-CB 4.49Å; W1312-L1389 HydrophobicContact CG-CD1 4.37Å; W1312-L1389 HydrophobicContact CZ2-CD1 4.03Å; W1312-L1389 HydrophobicContact CZ2-CG 4.43Å; P1322-L1389 HydrophobicContact CB-CD1 3.66Å; P1322-L1389 HydrophobicContact CG-CD1 3.87Å; L1389-I1391 PolarHBondContact O-N 3.32Å; L1389-I1391 VanDerWaalsContact O-N 3.15Å; L1389-Y1416 HydrophobicContact CD1-CD2 4.03Å; L1389-Y1416 HydrophobicContact CD1-CE2 4.07Å; L1389-Y1416 HydrophobicContact CD2-CD2 4.43Å; L1389-Y1416 HydrophobicContact CD2-CE2 3.81Å; L1389-Y1416 HydrophobicContact CG-CD2 4.42Å; L1389-Y1416 HydrophobicContact CG-CE2 3.95Å; L1389-I1423 HydrophobicContact CD2-CD1 4.31Å
1390	G	80.9	Confident	86.7	Confident	8 Å²	8	48 Å²	48	8%	0.082	23%	0.231	C	C	.	.	S	Bend	trans	83.2	-34.7	-179.9	0	0	0	0	0	115.1	N1392 D1396	G1390-N1392 PolarHBondContact O-N 2.8Å; G1390-D1396 WeakPolarHBondContact CA-OD2 3.44Å; G1390-D1396 PolarHBondContact N-OD1 2.9Å; G1390-D1396 VanDerWaalsContact N-OD1 3.09Å; G1390-D1396 PolarHBondContact N-OD2 3.46Å; G1390-D1396 VanDerWaalsContact N-OD2 3.14Å
1391	I	81.6	Confident	86.3	Confident	106 Å²	106	54 Å²	54	54%	0.544	25%	0.253	S	S	.	.	S	Bend	trans	-61.6	-41.3	-179.6	-55.4	-173	0	0	0	112.3	P1388 L1389	P1388-I1391 HydrophobicContact CB-CB 4.31Å; P1388-I1391 HydrophobicContact CB-CD1 3.67Å; P1388-I1391 HydrophobicContact CB-CG1 4.04Å; P1388-I1391 HydrophobicContact CG-CD1 4.41Å; L1389-I1391 PolarHBondContact O-N 3.32Å; L1389-I1391 VanDerWaalsContact O-N 3.15Å
1392	N	81.8	Confident	85.9	Confident	56 Å²	56	56.7 Å²	56.7	30%	0.299	27%	0.265	S	S	.	.			trans	-118.2	112.4	-179.8	-175.2	-62.9	0	0	0	110.2	G1390 E1394 L1395 D1396	G1390-N1392 PolarHBondContact O-N 2.8Å; N1392-E1394 PolarHBondContact OD1-N 3.42Å; N1392-L1395 HydrophobicContact CB-CB 3.87Å; N1392-L1395 HydrophobicContact CB-CD2 4.46Å; N1392-L1395 PolarHBondContact O-N 2.71Å; N1392-L1395 VanDerWaalsContact OD1-CB 3.29Å; N1392-L1395 WeakPolarHBondContact OD1-CB 3.43Å; N1392-L1395 PolarHBondContact OD1-N 3.25Å; N1392-D1396 PolarHBondContact O-N 2.75Å
1393	K	80.5	Confident	85.2	Confident	88 Å²	88	57 Å²	57	38%	0.383	27%	0.269	S	S	.	.	H	α-helix	trans	-64.6	-41.9	-174.6	-176.9	177.6	-177.6	176.9	0	111.9	L1395 D1396 Y1397 V1443	K1393-L1395 VanDerWaalsContact C-N 3.34Å; K1393-D1396 PolarHBondContact O-N 2.93Å; K1393-Y1397 HydrophobicContact CD-CE2 4.48Å; K1393-Y1397 HydrophobicContact CG-CD2 3.93Å; K1393-Y1397 HydrophobicContact CG-CE2 3.88Å; K1393-Y1397 VanDerWaalsContact O-CD2 3.25Å; K1393-Y1397 WeakPolarHBondContact O-CD2 3.32Å; K1393-Y1397 PolarHBondContact O-N 3.46Å; K1393-V1443 HydrophobicContact CD-CG2 3.7Å; K1393-V1443 HydrophobicContact CG-CG2 4.22Å
1394	E	82.4	Confident	84.4	Confident	119 Å²	119	66.5 Å²	66.5	56%	0.556	30%	0.299	S	S	*	.	H	α-helix	trans	-66.9	-38.6	-178.2	-70.4	55	-122.2	0	0	111	N1392 Y1397 E1398	N1392-E1394 PolarHBondContact OD1-N 3.42Å; E1394-Y1397 CarbonylContact O-C 3.53Å; E1394-Y1397 WeakPolarHBondContact O-CB 3.48Å; E1394-Y1397 PolarHBondContact O-N 2.91Å; E1394-E1398 PolarHBondContact O-N 3.46Å
1395	L	85.8	Confident	84.1	Confident	14 Å²	14	67.3 Å²	67.3	7%	0.073	30%	0.301	C	S	.	.	H	α-helix	trans	-66.4	-46.4	174.2	-172.2	66.8	0	0	0	111.8	Q1387 N1392 K1393 Y1397 E1398 R1399	Q1387-L1395 HydrophobicContact CB-CD2 4.15Å; N1392-L1395 HydrophobicContact CB-CB 3.87Å; N1392-L1395 HydrophobicContact CB-CD2 4.46Å; N1392-L1395 PolarHBondContact O-N 2.71Å; N1392-L1395 VanDerWaalsContact OD1-CB 3.29Å; N1392-L1395 WeakPolarHBondContact OD1-CB 3.43Å; N1392-L1395 PolarHBondContact OD1-N 3.25Å; K1393-L1395 VanDerWaalsContact C-N 3.34Å; L1395-Y1397 VanDerWaalsContact C-N 3.3Å; L1395-Y1397 PolarHBondContact O-N 2.91Å; L1395-E1398 WeakPolarHBondContact O-CB 3.42Å; L1395-E1398 PolarHBondContact O-N 2.99Å; L1395-E1398 VanDerWaalsContact O-N 3.1Å; L1395-R1399 WeakPolarHBondContact O-CG 3.4Å; L1395-R1399 PolarHBondContact O-N 3.06Å
1396	D	88.4	Confident	83.5	Confident	2 Å²	2	67.6 Å²	67.6	1%	0.011	31%	0.314	C	S	.	.	H	α-helix	trans	-56.2	-45.9	171.9	-90.1	20.9	0	0	0	110.8	W1312 G1390 N1392 K1393 E1398 R1399 L1400 Y1416 I1441	W1312-D1396 PolarHBondContact NE1-OD1 3.07Å; G1390-D1396 WeakPolarHBondContact CA-OD2 3.44Å; G1390-D1396 PolarHBondContact N-OD1 2.9Å; G1390-D1396 VanDerWaalsContact N-OD1 3.09Å; G1390-D1396 PolarHBondContact N-OD2 3.46Å; G1390-D1396 VanDerWaalsContact N-OD2 3.14Å; N1392-D1396 PolarHBondContact O-N 2.75Å; K1393-D1396 PolarHBondContact O-N 2.93Å; D1396-E1398 PolarHBondContact O-N 3.25Å; D1396-R1399 PolarHBondContact O-N 2.91Å; D1396-L1400 WeakPolarHBondContact O-CB 3.38Å; D1396-L1400 PolarHBondContact O-N 2.98Å; D1396-Y1416 VanDerWaalsContact OD2-CE2 3.24Å; D1396-Y1416 WeakPolarHBondContact OD2-CE2 3.3Å; D1396-Y1416 PolarHBondContact OD2-OH 3.3Å; D1396-I1441 HydrophobicContact CB-CD1 4.41Å
1397	Y	85.2	Confident	82.9	Confident	75 Å²	75	76.2 Å²	76.2	29%	0.294	35%	0.351	S	S	.	.	H	α-helix	trans	-62.1	-36.1	174	-91.2	-69	0	0	0	113.1	K1393 E1394 L1395 R1401 I1441	K1393-Y1397 HydrophobicContact CD-CE2 4.48Å; K1393-Y1397 HydrophobicContact CG-CD2 3.93Å; K1393-Y1397 HydrophobicContact CG-CE2 3.88Å; K1393-Y1397 VanDerWaalsContact O-CD2 3.25Å; K1393-Y1397 WeakPolarHBondContact O-CD2 3.32Å; K1393-Y1397 PolarHBondContact O-N 3.46Å; E1394-Y1397 CarbonylContact O-C 3.53Å; E1394-Y1397 WeakPolarHBondContact O-CB 3.48Å; E1394-Y1397 PolarHBondContact O-N 2.91Å; L1395-Y1397 VanDerWaalsContact C-N 3.3Å; L1395-Y1397 PolarHBondContact O-N 2.91Å; Y1397-R1401 WeakPolarHBondContact O-CB 3.44Å; Y1397-R1401 VanDerWaalsContact O-CG 3.23Å; Y1397-R1401 WeakPolarHBondContact O-CG 3.42Å; Y1397-R1401 PolarHBondContact O-N 3.48Å; Y1397-R1401 PolarHBondContact O-NE 2.91Å; Y1397-I1441 HydrophobicContact CD1-CD1 3.35Å; Y1397-I1441 HydrophobicContact CD1-CG1 4.03Å; Y1397-I1441 HydrophobicContact CD2-CD1 3.72Å; Y1397-I1441 HydrophobicContact CD2-CG1 4.47Å; Y1397-I1441 HydrophobicContact CE1-CB 4.3Å; Y1397-I1441 HydrophobicContact CE1-CD1 3.53Å; Y1397-I1441 HydrophobicContact CE1-CG1 3.65Å; Y1397-I1441 HydrophobicContact CE2-CB 3.96Å; Y1397-I1441 HydrophobicContact CE2-CD1 3.85Å; Y1397-I1441 HydrophobicContact CE2-CG1 4.11Å; Y1397-I1441 HydrophobicContact CG-CD1 3.43Å; Y1397-I1441 VanDerWaalsContact CG-CD1 3.43Å; Y1397-I1441 HydrophobicContact CG-CG1 4.41Å
1398	E	86	Confident	82.5	Confident	106 Å²	106	77.5 Å²	77.5	50%	0.495	36%	0.357	S	S	.	.	H	α-helix	trans	-64.2	-52.4	171.8	-84.2	-131.6	127.1	0	0	111.9	E1394 L1395 D1396 L1400 R1401 E1402	E1394-E1398 PolarHBondContact O-N 3.46Å; L1395-E1398 WeakPolarHBondContact O-CB 3.42Å; L1395-E1398 PolarHBondContact O-N 2.99Å; L1395-E1398 VanDerWaalsContact O-N 3.1Å; D1396-E1398 PolarHBondContact O-N 3.25Å; E1398-L1400 VanDerWaalsContact C-N 3.32Å; E1398-L1400 PolarHBondContact O-N 3.33Å; E1398-R1401 CarbonylContact O-C 3.55Å; E1398-R1401 WeakPolarHBondContact O-CA 3.44Å; E1398-R1401 WeakPolarHBondContact O-CB 3.44Å; E1398-R1401 PolarHBondContact O-N 2.96Å; E1398-E1402 PolarHBondContact O-N 2.87Å
1399	R	89.3	Confident	82.3	Confident	32 Å²	32	80.7 Å²	80.7	12%	0.121	37%	0.368	C	S	.	.	H	α-helix	trans	-67	-34.6	-173	-60.9	-37.1	-177.5	-138.5	-10.7	111.9	W1312 W1320 Q1387 L1395 D1396 R1401 E1402	W1312-R1399 HydrophobicContact CB-CG 4.41Å; W1312-R1399 HydrophobicContact CD2-CB 3.5Å; W1312-R1399 VanDerWaalsContact CD2-CB 3.5Å; W1312-R1399 HydrophobicContact CD2-CG 3.83Å; W1312-R1399 HydrophobicContact CE3-CB 3.57Å; W1312-R1399 HydrophobicContact CE3-CG 4.23Å; W1312-R1399 HydrophobicContact CG-CB 4.11Å; W1312-R1399 HydrophobicContact CG-CG 3.88Å; W1312-R1399 HydrophobicContact CH2-CB 3.91Å; W1312-R1399 HydrophobicContact CZ2-CB 3.83Å; W1312-R1399 HydrophobicContact CZ3-CB 3.75Å; W1320-R1399 HydrophobicContact CB-CB 4.32Å; W1320-R1399 HydrophobicContact CB-CG 4.25Å; W1320-R1399 HydrophobicContact CG-CG 4.27Å; Q1387-R1399 VanDerWaalsContact OE1-CZ 3.31Å; L1395-R1399 WeakPolarHBondContact O-CG 3.4Å; L1395-R1399 PolarHBondContact O-N 3.06Å; D1396-R1399 PolarHBondContact O-N 2.91Å; R1399-R1401 PolarHBondContact O-N 3.24Å; R1399-E1402 IonicContact NH1-OE2 2.74Å; R1399-E1402 PolarHBondContact O-N 3.43Å
1400	L	85.6	Confident	82.1	Confident	15 Å²	15	86.6 Å²	86.6	8%	0.079	40%	0.396	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-16	168.1	-83.6	156.7	0	0	0	114.5	W1312 D1396 E1398 K1409 V1412 T1413 Y1416 I1441	W1312-L1400 HydrophobicContact CH2-CD2 4.5Å; W1312-L1400 HydrophobicContact CH2-CG 3.91Å; W1312-L1400 HydrophobicContact CZ2-CG 4.27Å; D1396-L1400 WeakPolarHBondContact O-CB 3.38Å; D1396-L1400 PolarHBondContact O-N 2.98Å; E1398-L1400 VanDerWaalsContact C-N 3.32Å; E1398-L1400 PolarHBondContact O-N 3.33Å; L1400-K1409 WeakPolarHBondContact O-CE 3.45Å; L1400-V1412 HydrophobicContact CD2-CG1 4.23Å; L1400-T1413 HydrophobicContact CD2-CG2 4.41Å; L1400-Y1416 HydrophobicContact CD1-CD1 4Å; L1400-Y1416 HydrophobicContact CD1-CD2 4Å; L1400-Y1416 HydrophobicContact CD1-CE1 4.15Å; L1400-Y1416 HydrophobicContact CD1-CE2 4.15Å; L1400-Y1416 HydrophobicContact CD1-CG 3.93Å; L1400-Y1416 HydrophobicContact CD2-CG 4.25Å; L1400-Y1416 HydrophobicContact CG-CD2 4.48Å; L1400-Y1416 HydrophobicContact CG-CG 4.43Å; L1400-I1441 HydrophobicContact CD1-CD1 3.39Å; L1400-I1441 HydrophobicContact CD1-CG1 3.91Å
1401	R	81.3	Confident	82.5	Confident	161 Å²	161	88.2 Å²	88.2	61%	0.608	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.1	-17.8	178.4	-73.6	-177.9	-71	-174.9	4.9	114.3	Y1397 E1398 R1399 G1403	Y1397-R1401 WeakPolarHBondContact O-CB 3.44Å; Y1397-R1401 VanDerWaalsContact O-CG 3.23Å; Y1397-R1401 WeakPolarHBondContact O-CG 3.42Å; Y1397-R1401 PolarHBondContact O-N 3.48Å; Y1397-R1401 PolarHBondContact O-NE 2.91Å; E1398-R1401 CarbonylContact O-C 3.55Å; E1398-R1401 WeakPolarHBondContact O-CA 3.44Å; E1398-R1401 WeakPolarHBondContact O-CB 3.44Å; E1398-R1401 PolarHBondContact O-N 2.96Å; R1399-R1401 PolarHBondContact O-N 3.24Å; R1401-G1403 PolarHBondContact O-N 3.19Å; R1401-G1403 VanDerWaalsContact O-N 3.1Å
1402	E	80.1	Confident	82.8	Confident	68 Å²	68	83.2 Å²	83.2	32%	0.318	38%	0.38	S	S	.	.			trans	-64.1	-16.6	-177.4	-157.3	179.4	120.5	0	0	114.5	K1314 W1320 E1398 R1399 R1404	K1314-E1402 IonicContact NZ-OE1 3.71Å; K1314-E1402 PolarHBondContact NZ-OE1 2.66Å; K1314-E1402 IonicContact NZ-OE2 3.32Å; W1320-E1402 PolarHBondContact NE1-OE2 3.41Å; E1398-E1402 PolarHBondContact O-N 2.87Å; R1399-E1402 IonicContact NH1-OE2 2.74Å; R1399-E1402 PolarHBondContact O-N 3.43Å; E1402-R1404 PolarHBondContact O-N 3.27Å
1403	G	72	Confident	83.2	Confident	11 Å²	11	82.7 Å²	82.7	11%	0.113	38%	0.379	C	S	.	.			trans	-66.6	85.1	-178.3	0	0	0	0	0	115.4	R1401 K1405	R1401-G1403 PolarHBondContact O-N 3.19Å; R1401-G1403 VanDerWaalsContact O-N 3.1Å; G1403-K1405 PolarHBondContact O-N 3.22Å
1404	R	72	Confident	83.6	Confident	243 Å²	243	83.9 Å²	83.9	92%	0.917	38%	0.384	S	S	*	.	S	Bend	trans	-51.3	-10.9	-179.7	-61.5	-173.2	-176.4	-175	1.4	117.7	E1402	E1402-R1404 PolarHBondContact O-N 3.27Å
1405	K	78.7	Confident	84.1	Confident	155 Å²	155	78.2 Å²	78.2	67%	0.674	36%	0.358	S	S	*	.	S	Bend	trans	-132.6	137.6	-179.3	-69.2	-178.3	178.3	178.1	0	109.7	G1403 K1407 M1408 K1409	G1403-K1405 PolarHBondContact O-N 3.22Å; K1405-K1407 PolarHBondContact O-N 3.2Å; K1405-M1408 HydrophobicContact CB-CB 4.18Å; K1405-M1408 CarbonylContact O-C 3.48Å; K1405-M1408 WeakPolarHBondContact O-CA 3.33Å; K1405-M1408 VanDerWaalsContact O-CB 3.31Å; K1405-M1408 WeakPolarHBondContact O-CB 3.26Å; K1405-M1408 PolarHBondContact O-N 2.65Å; K1405-K1409 PolarHBondContact O-N 3.45Å
1406	S	77.6	Confident	84.4	Confident	92 Å²	92	77.8 Å²	77.8	64%	0.643	36%	0.355	S	S	*	.	H	α-helix	trans	-54.6	-48.3	-174.4	-170.7	0	0	0	0	114.1	M1408 K1409 H1410	S1406-M1408 PolarHBondContact O-N 3.22Å; S1406-K1409 PolarHBondContact O-N 3.43Å; S1406-H1410 PolarHBondContact O-N 3.37Å
1407	K	81.5	Confident	84.4	Confident	187 Å²	187	81.1 Å²	81.1	81%	0.813	37%	0.368	S	S	*	.	H	α-helix	trans	-52.9	-40.9	173.1	-80.6	-160.8	171.3	-159.1	0	112.6	K1405 S1411	K1405-K1407 PolarHBondContact O-N 3.2Å; K1407-S1411 VanDerWaalsContact O-CB 3.3Å; K1407-S1411 WeakPolarHBondContact O-CB 3.25Å; K1407-S1411 PolarHBondContact O-N 3.38Å
1408	M	82.9	Confident	84.7	Confident	59 Å²	59	80.8 Å²	80.8	29%	0.291	37%	0.366	S	S	.	.	H	α-helix	trans	-73.6	-40.4	-177.5	-163.9	165	77.8	0	0	111.3	P1319 K1405 S1406 S1411 V1412	P1319-M1408 HydrophobicContact CG-CE 4.1Å; P1319-M1408 HydrophobicContact CG-CG 3.96Å; P1319-M1408 HydrophobicContact CG-SD 4.07Å; K1405-M1408 HydrophobicContact CB-CB 4.18Å; K1405-M1408 CarbonylContact O-C 3.48Å; K1405-M1408 WeakPolarHBondContact O-CA 3.33Å; K1405-M1408 VanDerWaalsContact O-CB 3.31Å; K1405-M1408 WeakPolarHBondContact O-CB 3.26Å; K1405-M1408 PolarHBondContact O-N 2.65Å; S1406-M1408 PolarHBondContact O-N 3.22Å; M1408-S1411 PolarHBondContact O-N 2.79Å; M1408-V1412 WeakPolarHBondContact O-CG2 3.25Å; M1408-V1412 PolarHBondContact O-N 3.5Å
1409	K	84.5	Confident	85	Confident	94 Å²	94	75.7 Å²	75.7	41%	0.409	34%	0.342	S	S	.	.	H	α-helix	trans	-60.6	-50.4	171.7	-168.7	-176.7	-179.3	-171.3	0	111	L1400 K1405 S1406 S1411 V1412 T1413	L1400-K1409 WeakPolarHBondContact O-CE 3.45Å; K1405-K1409 PolarHBondContact O-N 3.45Å; S1406-K1409 PolarHBondContact O-N 3.43Å; K1409-S1411 VanDerWaalsContact C-N 3.32Å; K1409-S1411 PolarHBondContact O-N 3.14Å; K1409-V1412 PolarHBondContact O-N 3.27Å; K1409-T1413 PolarHBondContact O-N 3.47Å; K1409-T1413 PolarHBondContact O-OG1 3.3Å
1410	H	85.7	Confident	85	Confident	128 Å²	128	74.2 Å²	74.2	59%	0.593	34%	0.337	S	S	*	.	H	α-helix	trans	-59.5	-40.7	178.5	179.6	84	0	0	0	112.5	S1406 T1413 K1414	S1406-H1410 PolarHBondContact O-N 3.37Å; H1410-T1413 PolarHBondContact O-N 3.25Å; H1410-K1414 PolarHBondContact O-N 3.17Å
1411	S	89	Confident	85.1	Confident	41 Å²	41	76.7 Å²	76.7	29%	0.287	35%	0.348	S	S	.	.	H	α-helix	trans	-66.3	-39.3	176.3	-172.1	0	0	0	0	112.7	Y1321 K1407 M1408 K1409 K1414 A1415	Y1321-S1411 WeakPolarHBondContact OH-CB 3.41Å; Y1321-S1411 PolarHBondContact OH-OG 3.39Å; K1407-S1411 VanDerWaalsContact O-CB 3.3Å; K1407-S1411 WeakPolarHBondContact O-CB 3.25Å; K1407-S1411 PolarHBondContact O-N 3.38Å; M1408-S1411 PolarHBondContact O-N 2.79Å; K1409-S1411 VanDerWaalsContact C-N 3.32Å; K1409-S1411 PolarHBondContact O-N 3.14Å; S1411-K1414 PolarHBondContact O-N 3.22Å; S1411-A1415 WeakPolarHBondContact O-CB 3.3Å; S1411-A1415 PolarHBondContact O-N 3.43Å
1412	V	89.6	Confident	85.6	Confident	2 Å²	2	70.1 Å²	70.1	1%	0.012	32%	0.324	C	S	.	.	H	α-helix	trans	-62.6	-42.5	169.8	172.2	0	0	0	0	110.9	W1312 P1319 Y1321 L1400 M1408 K1409 A1415 Y1416	W1312-V1412 HydrophobicContact CH2-CG1 4.07Å; W1312-V1412 HydrophobicContact CZ3-CG1 3.8Å; P1319-V1412 HydrophobicContact CG-CG2 3.93Å; Y1321-V1412 HydrophobicContact CD1-CG2 4.27Å; Y1321-V1412 HydrophobicContact CD2-CG2 3.83Å; Y1321-V1412 HydrophobicContact CE1-CB 4.49Å; Y1321-V1412 HydrophobicContact CE1-CG2 3.94Å; Y1321-V1412 HydrophobicContact CE2-CG2 3.47Å; Y1321-V1412 VanDerWaalsContact CE2-CG2 3.47Å; Y1321-V1412 HydrophobicContact CG-CG2 4.23Å; L1400-V1412 HydrophobicContact CD2-CG1 4.23Å; M1408-V1412 WeakPolarHBondContact O-CG2 3.25Å; M1408-V1412 PolarHBondContact O-N 3.5Å; K1409-V1412 PolarHBondContact O-N 3.27Å; V1412-A1415 PolarHBondContact O-N 3.32Å; V1412-Y1416 WeakPolarHBondContact O-CB 3.35Å; V1412-Y1416 PolarHBondContact O-N 2.96Å
1413	T	88.7	Confident	86	Confident	44 Å²	44	67 Å²	67	27%	0.27	31%	0.31	S	S	.	.	H	α-helix	trans	-65.6	-38.2	176.8	-53.4	0	0	0	0	112.9	L1400 K1409 H1410 Y1416 R1417	L1400-T1413 HydrophobicContact CD2-CG2 4.41Å; K1409-T1413 PolarHBondContact O-N 3.47Å; K1409-T1413 PolarHBondContact O-OG1 3.3Å; H1410-T1413 PolarHBondContact O-N 3.25Å; T1413-Y1416 PolarHBondContact O-N 2.99Å; T1413-R1417 PolarHBondContact O-N 3.09Å
1414	K	89.8	Confident	86.7	Confident	113 Å²	113	66.7 Å²	66.7	49%	0.491	31%	0.306	S	S	.	.	H	α-helix	trans	-68.3	-35.6	174.6	-167.4	166.3	-176	171	0	111.5	H1410 S1411 R1418	H1410-K1414 PolarHBondContact O-N 3.17Å; S1411-K1414 PolarHBondContact O-N 3.22Å; K1414-R1418 WeakPolarHBondContact O-CG 3.38Å; K1414-R1418 PolarHBondContact O-N 3.17Å
1415	A	91.9	Very high	87.4	Confident	1 Å²	1	61 Å²	61	1%	0.008	29%	0.287	C	S	.	.	H	α-helix	trans	-67.7	-37.9	170.7	0	0	0	0	0	112.6	Y1321 P1322 F1372 S1411 V1412 R1418 A1419	Y1321-A1415 HydrophobicContact CD1-CB 3.81Å; Y1321-A1415 HydrophobicContact CE1-CB 3.89Å; P1322-A1415 HydrophobicContact CG-CB 4.31Å; F1372-A1415 HydrophobicContact CB-CB 4.17Å; F1372-A1415 WeakPolarHBondContact CB-O 3.31Å; F1372-A1415 WeakPolarHBondContact O-CA 3.39Å; F1372-A1415 WeakPolarHBondContact O-CB 3.5Å; S1411-A1415 WeakPolarHBondContact O-CB 3.3Å; S1411-A1415 PolarHBondContact O-N 3.43Å; V1412-A1415 PolarHBondContact O-N 3.32Å; A1415-R1418 PolarHBondContact O-N 2.99Å; A1415-A1419 PolarHBondContact O-N 3.43Å
1416	Y	91.9	Very high	87.8	Confident	4 Å²	4	54 Å²	54	2%	0.016	26%	0.258	C	S	.	.	H	α-helix	trans	-65.4	-47.2	176.1	-173.7	-93.3	0	0	0	111.8	W1312 P1322 L1389 D1396 L1400 V1412 T1413 R1418 A1419 V1420 I1441	W1312-Y1416 AromaticContact CH2-CD2 3.73Å; W1312-Y1416 HydrophobicContact CH2-CD2 3.73Å; W1312-Y1416 HydrophobicContact CH2-CE2 4.43Å; W1312-Y1416 AromaticContact CZ2-CD2 3.48Å; W1312-Y1416 HydrophobicContact CZ2-CD2 3.48Å; W1312-Y1416 VanDerWaalsContact CZ2-CD2 3.48Å; W1312-Y1416 AromaticContact CZ2-CE2 3.73Å; W1312-Y1416 HydrophobicContact CZ2-CE2 3.73Å; P1322-Y1416 HydrophobicContact CG-CD2 4.24Å; L1389-Y1416 HydrophobicContact CD1-CD2 4.03Å; L1389-Y1416 HydrophobicContact CD1-CE2 4.07Å; L1389-Y1416 HydrophobicContact CD2-CD2 4.43Å; L1389-Y1416 HydrophobicContact CD2-CE2 3.81Å; L1389-Y1416 HydrophobicContact CG-CD2 4.42Å; L1389-Y1416 HydrophobicContact CG-CE2 3.95Å; D1396-Y1416 VanDerWaalsContact OD2-CE2 3.24Å; D1396-Y1416 WeakPolarHBondContact OD2-CE2 3.3Å; D1396-Y1416 PolarHBondContact OD2-OH 3.3Å; L1400-Y1416 HydrophobicContact CD1-CD1 4Å; L1400-Y1416 HydrophobicContact CD1-CD2 4Å; L1400-Y1416 HydrophobicContact CD1-CE1 4.15Å; L1400-Y1416 HydrophobicContact CD1-CE2 4.15Å; L1400-Y1416 HydrophobicContact CD1-CG 3.93Å; L1400-Y1416 HydrophobicContact CD2-CG 4.25Å; L1400-Y1416 HydrophobicContact CG-CD2 4.48Å; L1400-Y1416 HydrophobicContact CG-CG 4.43Å; V1412-Y1416 WeakPolarHBondContact O-CB 3.35Å; V1412-Y1416 PolarHBondContact O-N 2.96Å; T1413-Y1416 PolarHBondContact O-N 2.99Å; Y1416-R1418 PolarHBondContact O-N 3.23Å; Y1416-A1419 WeakPolarHBondContact O-CB 3.46Å; Y1416-A1419 PolarHBondContact O-N 3.26Å; Y1416-V1420 HydrophobicContact CD1-CG2 4.04Å; Y1416-V1420 HydrophobicContact CE1-CG2 3.61Å; Y1416-V1420 PolarHBondContact O-N 3.41Å; Y1416-I1441 HydrophobicContact CE1-CG2 4.22Å; Y1416-I1441 VanDerWaalsContact OH-CG2 3.31Å; Y1416-I1441 WeakPolarHBondContact OH-CG2 3.42Å
1417	R	90.1	Very high	88.1	Confident	72 Å²	72	53.5 Å²	53.5	27%	0.272	25%	0.245	S	C	.	.	H	α-helix	trans	-56	-38.3	173.5	-78.4	-177	169.9	-176.8	-5.7	112	T1413 V1420 E1421 Y1433 G1436 S1438	T1413-R1417 PolarHBondContact O-N 3.09Å; R1417-V1420 PolarHBondContact O-N 2.92Å; R1417-E1421 WeakPolarHBondContact O-CB 3.41Å; R1417-E1421 PolarHBondContact O-N 2.93Å; R1417-Y1433 HydrophobicContact CG-CD2 3.89Å; R1417-Y1433 HydrophobicContact CG-CE2 3.95Å; R1417-Y1433 HydrophobicContact CG-CG 4.41Å; R1417-G1436 PolarHBondContact NH2-O 2.92Å; R1417-S1438 PolarHBondContact NH2-O 3.15Å
1418	R	91.5	Very high	87.9	Confident	68 Å²	68	48 Å²	48	26%	0.257	24%	0.241	S	C	.	.	H	α-helix	trans	-71.2	-32.8	174.2	-73.9	167.3	168.3	-177.5	-7.6	114.6	F1372 D1373 K1414 A1415 Y1416 E1421 H1422	F1372-R1418 HydrophobicContact CB-CB 4.2Å; F1372-R1418 HydrophobicContact CD1-CB 4.06Å; F1372-R1418 WeakPolarHBondContact O-CD 3.38Å; F1372-R1418 PolarHBondContact O-NH1 3.46Å; D1373-R1418 PolarHBondContact O-NH1 3.31Å; K1414-R1418 WeakPolarHBondContact O-CG 3.38Å; K1414-R1418 PolarHBondContact O-N 3.17Å; A1415-R1418 PolarHBondContact O-N 2.99Å; Y1416-R1418 PolarHBondContact O-N 3.23Å; R1418-E1421 PolarHBondContact O-N 3.08Å; R1418-H1422 PolarHBondContact O-N 3.24Å
1419	A	91.7	Very high	87.8	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-67.7	-44.8	172.4	0	0	0	0	0	110.4	I1310 P1322 F1372 A1415 Y1416 E1421 H1422 I1423	I1310-A1419 HydrophobicContact CG2-CB 4.16Å; P1322-A1419 HydrophobicContact CB-CB 3.85Å; F1372-A1419 HydrophobicContact CD1-CB 4.38Å; F1372-A1419 HydrophobicContact CD2-CB 3.75Å; F1372-A1419 HydrophobicContact CE2-CB 3.91Å; F1372-A1419 HydrophobicContact CG-CB 4.01Å; F1372-A1419 HydrophobicContact CZ-CB 4.31Å; A1415-A1419 PolarHBondContact O-N 3.43Å; Y1416-A1419 WeakPolarHBondContact O-CB 3.46Å; Y1416-A1419 PolarHBondContact O-N 3.26Å; A1419-E1421 PolarHBondContact O-N 3.11Å; A1419-H1422 WeakPolarHBondContact O-CB 3.44Å; A1419-H1422 PolarHBondContact O-N 2.74Å; A1419-H1422 VanDerWaalsContact O-N 3.17Å; A1419-I1423 WeakPolarHBondContact O-CG1 3.45Å; A1419-I1423 PolarHBondContact O-N 3.26Å
1420	V	89.1	Confident	87.3	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-57.1	-45.4	170.2	161.5	0	0	0	0	111.8	Y1416 R1417 H1422 I1423 C1424 Y1431 P1432 Y1433 F1444	Y1416-V1420 HydrophobicContact CD1-CG2 4.04Å; Y1416-V1420 HydrophobicContact CE1-CG2 3.61Å; Y1416-V1420 PolarHBondContact O-N 3.41Å; R1417-V1420 PolarHBondContact O-N 2.92Å; V1420-H1422 VanDerWaalsContact C-N 3.26Å; V1420-H1422 PolarHBondContact O-N 3.03Å; V1420-I1423 PolarHBondContact O-N 3.13Å; V1420-C1424 WeakPolarHBondContact O-CB 3.19Å; V1420-C1424 PolarHBondContact O-N 3.17Å; V1420-C1424 PolarHBondContact O-SG 2.88Å; V1420-Y1431 HydrophobicContact CG1-CD2 4.06Å; V1420-Y1431 HydrophobicContact CG1-CE2 3.91Å; V1420-P1432 HydrophobicContact CG1-CG 4.16Å; V1420-Y1433 HydrophobicContact CB-CE2 4.39Å; V1420-Y1433 HydrophobicContact CG1-CD2 4.15Å; V1420-Y1433 HydrophobicContact CG1-CE2 3.89Å; V1420-Y1433 HydrophobicContact CG2-CE2 4.49Å; V1420-F1444 HydrophobicContact CB-CE2 4.04Å; V1420-F1444 HydrophobicContact CG1-CD2 4.42Å; V1420-F1444 HydrophobicContact CG1-CE2 3.36Å; V1420-F1444 HydrophobicContact CG1-CZ 3.67Å; V1420-F1444 HydrophobicContact CG2-CD2 4.08Å; V1420-F1444 HydrophobicContact CG2-CE2 3.73Å
1421	E	88.6	Confident	87.1	Confident	68 Å²	68	47.9 Å²	47.9	32%	0.318	25%	0.246	S	C	.	.	H	α-helix	trans	-59.9	-36.9	176.8	-164.8	-163.8	159.5	0	0	112.1	R1417 R1418 A1419 K1425 Y1431	R1417-E1421 WeakPolarHBondContact O-CB 3.41Å; R1417-E1421 PolarHBondContact O-N 2.93Å; R1418-E1421 PolarHBondContact O-N 3.08Å; A1419-E1421 PolarHBondContact O-N 3.11Å; E1421-K1425 WeakPolarHBondContact O-CG 3.47Å; E1421-K1425 PolarHBondContact O-N 2.94Å; E1421-K1425 VanDerWaalsContact O-N 3.15Å; E1421-K1425 WeakPolarHBondContact OE1-CE 3.5Å; E1421-K1425 IonicContact OE1-NZ 3.19Å; E1421-K1425 PolarHBondContact OE1-NZ 2.91Å; E1421-Y1431 HydrophobicContact CB-CD2 3.99Å; E1421-Y1431 HydrophobicContact CB-CE2 3.65Å; E1421-Y1431 HydrophobicContact CG-CD2 4.14Å; E1421-Y1431 HydrophobicContact CG-CE2 4.07Å
1422	H	90.1	Very high	86.3	Confident	22 Å²	22	48.4 Å²	48.4	10%	0.102	25%	0.248	C	C	.	.	H	α-helix	trans	-68.1	-47.8	173.7	-169.9	95.7	0	0	0	111.4	V1339 I1341 F1372 R1418 A1419 V1420 C1424 K1425 V1426	V1339-H1422 WeakPolarHBondContact CG1-NE2 3.46Å; I1341-H1422 WeakPolarHBondContact CG1-NE2 3.31Å; F1372-H1422 HydrophobicContact CE1-CB 3.71Å; F1372-H1422 HydrophobicContact CZ-CB 3.97Å; R1418-H1422 PolarHBondContact O-N 3.24Å; A1419-H1422 WeakPolarHBondContact O-CB 3.44Å; A1419-H1422 PolarHBondContact O-N 2.74Å; A1419-H1422 VanDerWaalsContact O-N 3.17Å; V1420-H1422 VanDerWaalsContact C-N 3.26Å; V1420-H1422 PolarHBondContact O-N 3.03Å; H1422-C1424 VanDerWaalsContact C-N 3.29Å; H1422-C1424 PolarHBondContact O-N 3.2Å; H1422-K1425 PolarHBondContact O-N 3.34Å; H1422-K1425 VanDerWaalsContact O-N 3.15Å; H1422-V1426 VanDerWaalsContact CD2-CG2 3.48Å; H1422-V1426 WeakPolarHBondContact CD2-CG2 3.21Å; H1422-V1426 WeakPolarHBondContact O-CB 3.3Å; H1422-V1426 VanDerWaalsContact O-CG2 3.25Å; H1422-V1426 WeakPolarHBondContact O-CG2 3.37Å; H1422-V1426 PolarHBondContact O-N 3.32Å
1423	I	88.8	Confident	85.4	Confident	3 Å²	3	49.2 Å²	49.2	2%	0.015	25%	0.251	C	S	.	.	H	α-helix	trans	-54	-46.6	173.8	-67.3	166.5	0	0	0	110.7	I1310 L1389 A1419 V1420 K1425 V1426 H1427 F1444 L1446	I1310-I1423 HydrophobicContact CD1-CD1 4.21Å; I1310-I1423 HydrophobicContact CD1-CG1 3.55Å; L1389-I1423 HydrophobicContact CD2-CD1 4.31Å; A1419-I1423 WeakPolarHBondContact O-CG1 3.45Å; A1419-I1423 PolarHBondContact O-N 3.26Å; V1420-I1423 PolarHBondContact O-N 3.13Å; I1423-K1425 PolarHBondContact O-N 3.02Å; I1423-V1426 PolarHBondContact O-N 2.91Å; I1423-H1427 PolarHBondContact O-CD2 3.4Å; I1423-H1427 VanDerWaalsContact O-CD2 3.27Å; I1423-H1427 PolarHBondContact O-N 3.02Å; I1423-F1444 HydrophobicContact CG2-CB 4.32Å; I1423-F1444 HydrophobicContact CG2-CD1 3.66Å; I1423-F1444 HydrophobicContact CG2-CE1 4.17Å; I1423-F1444 HydrophobicContact CG2-CG 3.92Å; I1423-L1446 HydrophobicContact CG2-CD2 4.2Å
1424	C	87.3	Confident	84.3	Confident	5 Å²	5	53.2 Å²	53.2	3%	0.034	28%	0.276	C	S	.	.	H	α-helix	trans	-57.9	-46.5	178.5	-66.4	0	0	0	0	111.8	V1420 H1422 G1428 R1429 F1444	V1420-C1424 WeakPolarHBondContact O-CB 3.19Å; V1420-C1424 PolarHBondContact O-N 3.17Å; V1420-C1424 PolarHBondContact O-SG 2.88Å; H1422-C1424 VanDerWaalsContact C-N 3.29Å; H1422-C1424 PolarHBondContact O-N 3.2Å; C1424-G1428 CarbonylContact O-C 3.44Å; C1424-G1428 WeakPolarHBondContact O-CA 3.43Å; C1424-G1428 PolarHBondContact O-N 3.27Å; C1424-R1429 CarbonylContact C-O 3.42Å; C1424-R1429 VanDerWaalsContact CB-O 3.32Å; C1424-R1429 WeakPolarHBondContact CB-O 3.48Å; C1424-R1429 PolarHBondContact O-N 2.81Å; C1424-F1444 WeakPolarHBondContact SG-CZ 3.4Å
1425	K	87.1	Confident	82.9	Confident	122 Å²	122	52 Å²	52	53%	0.53	28%	0.275	S	S	.	.	H	α-helix	trans	-68.7	-36.6	178.1	-68.9	172.3	-173.5	175.6	0	113	V1339 E1421 H1422 I1423	V1339-K1425 HydrophobicContact CG2-CB 3.72Å; E1421-K1425 WeakPolarHBondContact O-CG 3.47Å; E1421-K1425 PolarHBondContact O-N 2.94Å; E1421-K1425 VanDerWaalsContact O-N 3.15Å; E1421-K1425 WeakPolarHBondContact OE1-CE 3.5Å; E1421-K1425 IonicContact OE1-NZ 3.19Å; E1421-K1425 PolarHBondContact OE1-NZ 2.91Å; H1422-K1425 PolarHBondContact O-N 3.34Å; H1422-K1425 VanDerWaalsContact O-N 3.15Å; I1423-K1425 PolarHBondContact O-N 3.02Å
1426	V	85.9	Confident	81.2	Confident	8 Å²	8	54.1 Å²	54.1	5%	0.048	30%	0.296	C	S	.	.	H	α-helix	trans	-68.8	-35.5	178.8	165.2	0	0	0	0	112.8	H1336 N1337 V1339 H1422 I1423	H1336-V1426 HydrophobicContact CB-CG2 3.87Å; H1336-V1426 VanDerWaalsContact CD2-CG1 3.41Å; H1336-V1426 WeakPolarHBondContact CD2-CG1 3.44Å; H1336-V1426 WeakPolarHBondContact NE2-CG1 3.39Å; N1337-V1426 HydrophobicContact CB-CG1 4.06Å; N1337-V1426 VanDerWaalsContact CB-O 3.29Å; N1337-V1426 WeakPolarHBondContact CB-O 3.49Å; N1337-V1426 WeakPolarHBondContact ND2-CG1 3.27Å; N1337-V1426 PolarHBondContact ND2-O 3.18Å; N1337-V1426 VanDerWaalsContact ND2-O 3.17Å; V1339-V1426 HydrophobicContact CB-CG2 4.15Å; V1339-V1426 HydrophobicContact CG2-CG2 3.83Å; H1422-V1426 VanDerWaalsContact CD2-CG2 3.48Å; H1422-V1426 WeakPolarHBondContact CD2-CG2 3.21Å; H1422-V1426 WeakPolarHBondContact O-CB 3.3Å; H1422-V1426 VanDerWaalsContact O-CG2 3.25Å; H1422-V1426 WeakPolarHBondContact O-CG2 3.37Å; H1422-V1426 PolarHBondContact O-N 3.32Å; I1423-V1426 PolarHBondContact O-N 2.91Å
1427	H	83.6	Confident	79.2	Confident	82 Å²	82	62.6 Å²	62.6	38%	0.38	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.8	7.5	-177	-63.8	-83.5	0	0	0	113.7	I1423 R1429 L1446	I1423-H1427 PolarHBondContact O-CD2 3.4Å; I1423-H1427 VanDerWaalsContact O-CD2 3.27Å; I1423-H1427 PolarHBondContact O-N 3.02Å; H1427-R1429 HydrophobicContact CB-CG 4.12Å; H1427-R1429 PolarHBondContact O-N 3.25Å; H1427-R1429 VanDerWaalsContact O-N 3.13Å; H1427-L1446 VanDerWaalsContact NE2-CD2 3.34Å; H1427-L1446 WeakPolarHBondContact NE2-CD2 3.39Å
1428	G	78.3	Confident	77.6	Confident	71 Å²	71	60.6 Å²	60.6	73%	0.732	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.3	15.5	-177.7	0	0	0	0	0	114.9	C1424	C1424-G1428 CarbonylContact O-C 3.44Å; C1424-G1428 WeakPolarHBondContact O-CA 3.43Å; C1424-G1428 PolarHBondContact O-N 3.27Å
1429	R	80.2	Confident	75.7	Confident	92 Å²	92	63.4 Å²	63.4	35%	0.347	36%	0.356	S	S	.	.	P	Polyproline II helix	trans	-82	144.1	-179.1	-61.9	-172	-171.8	176.8	8.6	110	C1424 H1427 T1445	C1424-R1429 CarbonylContact C-O 3.42Å; C1424-R1429 VanDerWaalsContact CB-O 3.32Å; C1424-R1429 WeakPolarHBondContact CB-O 3.48Å; C1424-R1429 PolarHBondContact O-N 2.81Å; H1427-R1429 HydrophobicContact CB-CG 4.12Å; H1427-R1429 PolarHBondContact O-N 3.25Å; H1427-R1429 VanDerWaalsContact O-N 3.13Å; R1429-T1445 PolarHBondContact NH1-O 3.41Å; R1429-T1445 PolarHBondContact NH2-O 2.84Å
1430	P	75	Confident	74	Confident	119 Å²	119	68.5 Å²	68.5	77%	0.773	38%	0.383	S	S	*	.	P	Polyproline II helix	trans	-63	140.1	175.3	26.9	-34.5	0	0	0	111	P1432	P1430-P1432 WeakPolarHBondContact O-CD 3.4Å
1431	Y	80.4	Confident	72.7	Confident	68 Å²	68	69.3 Å²	69.3	27%	0.267	39%	0.387	S	S	.	.	P	Polyproline II helix	trans	-72.8	121.3	179.4	177.5	-113.5	0	0	0	110.8	V1420 E1421 Y1433 T1434	V1420-Y1431 HydrophobicContact CG1-CD2 4.06Å; V1420-Y1431 HydrophobicContact CG1-CE2 3.91Å; E1421-Y1431 HydrophobicContact CB-CD2 3.99Å; E1421-Y1431 HydrophobicContact CB-CE2 3.65Å; E1421-Y1431 HydrophobicContact CG-CD2 4.14Å; E1421-Y1431 HydrophobicContact CG-CE2 4.07Å; Y1431-Y1433 VanDerWaalsContact C-N 3.29Å; Y1431-Y1433 AromaticContact CE2-CD2 3.91Å; Y1431-Y1433 HydrophobicContact CE2-CD2 3.91Å; Y1431-Y1433 AromaticContact CZ-CD2 3.89Å; Y1431-Y1433 PolarHBondContact O-N 3.11Å; Y1431-T1434 WeakPolarHBondContact O-CG2 3.48Å
1432	P	73.2	Confident	71.3	Confident	53 Å²	53	66.9 Å²	66.9	34%	0.344	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.3	3.9	-166.7	32.2	-36.6	0	0	0	115	V1420 P1430 A1442 F1444	V1420-P1432 HydrophobicContact CG1-CG 4.16Å; P1430-P1432 WeakPolarHBondContact O-CD 3.4Å; P1432-A1442 HydrophobicContact CB-CB 4.17Å; P1432-A1442 HydrophobicContact CG-CB 3.4Å; P1432-A1442 VanDerWaalsContact CG-CB 3.4Å; P1432-F1444 HydrophobicContact CG-CE2 4.22Å; P1432-F1444 HydrophobicContact CG-CZ 3.84Å
1433	Y	71.1	Confident	69.4	Low	18 Å²	18	69.3 Å²	69.3	7%	0.071	39%	0.394	C	S	.	.	T	Hydrogen-bonded Turn	trans	-114.2	33.2	179.6	-57.6	-67.1	0	0	0	112.4	R1417 V1420 Y1431 D1435 G1436 S1438 D1440 A1442	R1417-Y1433 HydrophobicContact CG-CD2 3.89Å; R1417-Y1433 HydrophobicContact CG-CE2 3.95Å; R1417-Y1433 HydrophobicContact CG-CG 4.41Å; V1420-Y1433 HydrophobicContact CB-CE2 4.39Å; V1420-Y1433 HydrophobicContact CG1-CD2 4.15Å; V1420-Y1433 HydrophobicContact CG1-CE2 3.89Å; V1420-Y1433 HydrophobicContact CG2-CE2 4.49Å; Y1431-Y1433 VanDerWaalsContact C-N 3.29Å; Y1431-Y1433 AromaticContact CE2-CD2 3.91Å; Y1431-Y1433 HydrophobicContact CE2-CD2 3.91Å; Y1431-Y1433 AromaticContact CZ-CD2 3.89Å; Y1431-Y1433 PolarHBondContact O-N 3.11Å; Y1433-D1435 PolarHBondContact O-N 3.24Å; Y1433-G1436 PolarHBondContact O-N 2.95Å; Y1433-S1438 WeakPolarHBondContact CD1-O 3.26Å; Y1433-D1440 WeakPolarHBondContact CE1-O 3.39Å; Y1433-D1440 PolarHBondContact OH-O 3.19Å; Y1433-A1442 HydrophobicContact CE2-CB 4.09Å; Y1433-A1442 PolarHBondContact OH-N 2.75Å
1434	T	65.4	Low	67.7	Low	128 Å²	128	69.8 Å²	69.8	79%	0.785	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-23.5	177.1	38.8	0	0	0	0	114	Y1431	Y1431-T1434 WeakPolarHBondContact O-CG2 3.48Å
1435	D	60.4	Low	65.3	Low	88 Å²	88	74.5 Å²	74.5	47%	0.471	43%	0.425	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86	-6.3	-177	71.6	-12.8	0	0	0	114.2	Y1433 K1437 S1438	Y1433-D1435 PolarHBondContact O-N 3.24Å; D1435-K1437 PolarHBondContact O-N 3.08Å; D1435-K1437 PolarHBondContact OD1-N 3.21Å; D1435-S1438 WeakPolarHBondContact OD1-CB 3.37Å; D1435-S1438 PolarHBondContact OD1-N 3.3Å; D1435-S1438 PolarHBondContact OD2-N 2.59Å
1436	G	55.1	Low	62.8	Low	45 Å²	45	74.9 Å²	74.9	46%	0.464	43%	0.432	S	S	.	.	S	Bend	trans	67.6	-35.2	-172.3	0	0	0	0	0	115.3	R1417 Y1433	R1417-G1436 PolarHBondContact NH2-O 2.92Å; Y1433-G1436 PolarHBondContact O-N 2.95Å
1437	K	51.5	Low	61.6	Low	182 Å²	182	78.3 Å²	78.3	79%	0.791	45%	0.452	S	S	*	.			trans	-81.8	-26.3	-170.2	-68.2	168.1	-175.7	169.8	0	113.5	D1435 T1439	D1435-K1437 PolarHBondContact O-N 3.08Å; D1435-K1437 PolarHBondContact OD1-N 3.21Å; K1437-T1439 PolarHBondContact O-N 3.42Å; K1437-T1439 VanDerWaalsContact O-N 3.15Å
1438	S	54.5	Low	60.4	Low	31 Å²	31	78.1 Å²	78.1	22%	0.217	46%	0.455	C	S	.	.			trans	-59.7	116.2	-179.6	172.9	0	0	0	0	112.4	R1417 Y1433 D1435	R1417-S1438 PolarHBondContact NH2-O 3.15Å; Y1433-S1438 WeakPolarHBondContact CD1-O 3.26Å; D1435-S1438 WeakPolarHBondContact OD1-CB 3.37Å; D1435-S1438 PolarHBondContact OD1-N 3.3Å; D1435-S1438 PolarHBondContact OD2-N 2.59Å
1439	T	51.7	Low	59.4	Low	127 Å²	127	78.4 Å²	78.4	78%	0.779	44%	0.44	S	S	*	.			trans	-96.2	-9.7	179.1	51	0	0	0	0	114.1	K1437	K1437-T1439 PolarHBondContact O-N 3.42Å; K1437-T1439 VanDerWaalsContact O-N 3.15Å
1440	D	56.3	Low	58.2	Low	107 Å²	107	77.6 Å²	77.6	57%	0.572	45%	0.446	S	S	*	.	S	Bend	trans	-73.8	151.9	-173	-70.7	-37.7	0	0	0	111.9	Y1433 A1442	Y1433-D1440 WeakPolarHBondContact CE1-O 3.39Å; Y1433-D1440 PolarHBondContact OH-O 3.19Å; D1440-A1442 PolarHBondContact O-N 3.47Å
1441	I	61.4	Low	57.2	Low	17 Å²	17	75.1 Å²	75.1	9%	0.087	43%	0.425	C	S	.	.			trans	-75.2	114.4	172.7	-65.1	-170.3	0	0	0	107.4	D1396 Y1397 L1400 Y1416 V1443	D1396-I1441 HydrophobicContact CB-CD1 4.41Å; Y1397-I1441 HydrophobicContact CD1-CD1 3.35Å; Y1397-I1441 HydrophobicContact CD1-CG1 4.03Å; Y1397-I1441 HydrophobicContact CD2-CD1 3.72Å; Y1397-I1441 HydrophobicContact CD2-CG1 4.47Å; Y1397-I1441 HydrophobicContact CE1-CB 4.3Å; Y1397-I1441 HydrophobicContact CE1-CD1 3.53Å; Y1397-I1441 HydrophobicContact CE1-CG1 3.65Å; Y1397-I1441 HydrophobicContact CE2-CB 3.96Å; Y1397-I1441 HydrophobicContact CE2-CD1 3.85Å; Y1397-I1441 HydrophobicContact CE2-CG1 4.11Å; Y1397-I1441 HydrophobicContact CG-CD1 3.43Å; Y1397-I1441 VanDerWaalsContact CG-CD1 3.43Å; Y1397-I1441 HydrophobicContact CG-CG1 4.41Å; L1400-I1441 HydrophobicContact CD1-CD1 3.39Å; L1400-I1441 HydrophobicContact CD1-CG1 3.91Å; Y1416-I1441 HydrophobicContact CE1-CG2 4.22Å; Y1416-I1441 VanDerWaalsContact OH-CG2 3.31Å; Y1416-I1441 WeakPolarHBondContact OH-CG2 3.42Å; I1441-V1443 PolarHBondContact O-N 3.22Å; I1441-V1443 VanDerWaalsContact O-N 3.07Å
1442	A	59.6	Low	55.6	Low	16 Å²	16	75.5 Å²	75.5	13%	0.132	44%	0.436	C	S	.	.			trans	-64.7	108.3	173.1	0	0	0	0	0	109.1	P1432 Y1433 D1440 F1444	P1432-A1442 HydrophobicContact CB-CB 4.17Å; P1432-A1442 HydrophobicContact CG-CB 3.4Å; P1432-A1442 VanDerWaalsContact CG-CB 3.4Å; Y1433-A1442 HydrophobicContact CE2-CB 4.09Å; Y1433-A1442 PolarHBondContact OH-N 2.75Å; D1440-A1442 PolarHBondContact O-N 3.47Å; A1442-F1444 HydrophobicContact CB-CD2 4.19Å; A1442-F1444 HydrophobicContact CB-CE2 3.47Å; A1442-F1444 VanDerWaalsContact CB-CE2 3.47Å; A1442-F1444 HydrophobicContact CB-CZ 4.18Å; A1442-F1444 VanDerWaalsContact O-CD2 3.23Å; A1442-F1444 WeakPolarHBondContact O-CD2 3.39Å; A1442-F1444 PolarHBondContact O-N 2.84Å
1443	V	50.1	Low	54.4	Low	73 Å²	73	77.1 Å²	77.1	44%	0.442	44%	0.442	S	S	.	.			trans	-75.8	97.3	-178.6	-176	0	0	0	0	108.7	K1393 I1441 T1445	K1393-V1443 HydrophobicContact CD-CG2 3.7Å; K1393-V1443 HydrophobicContact CG-CG2 4.22Å; I1441-V1443 PolarHBondContact O-N 3.22Å; I1441-V1443 VanDerWaalsContact O-N 3.07Å; V1443-T1445 PolarHBondContact O-N 2.95Å
1444	F	53	Low	53.1	Low	14 Å²	14	81.7 Å²	81.7	6%	0.061	47%	0.471	C	S	.	.			trans	-85.8	89.9	165.8	-66.5	-84.9	0	0	0	109	V1420 I1423 C1424 P1432 A1442 L1446	V1420-F1444 HydrophobicContact CB-CE2 4.04Å; V1420-F1444 HydrophobicContact CG1-CD2 4.42Å; V1420-F1444 HydrophobicContact CG1-CE2 3.36Å; V1420-F1444 HydrophobicContact CG1-CZ 3.67Å; V1420-F1444 HydrophobicContact CG2-CD2 4.08Å; V1420-F1444 HydrophobicContact CG2-CE2 3.73Å; I1423-F1444 HydrophobicContact CG2-CB 4.32Å; I1423-F1444 HydrophobicContact CG2-CD1 3.66Å; I1423-F1444 HydrophobicContact CG2-CE1 4.17Å; I1423-F1444 HydrophobicContact CG2-CG 3.92Å; C1424-F1444 WeakPolarHBondContact SG-CZ 3.4Å; P1432-F1444 HydrophobicContact CG-CE2 4.22Å; P1432-F1444 HydrophobicContact CG-CZ 3.84Å; A1442-F1444 HydrophobicContact CB-CD2 4.19Å; A1442-F1444 HydrophobicContact CB-CE2 3.47Å; A1442-F1444 VanDerWaalsContact CB-CE2 3.47Å; A1442-F1444 HydrophobicContact CB-CZ 4.18Å; A1442-F1444 VanDerWaalsContact O-CD2 3.23Å; A1442-F1444 WeakPolarHBondContact O-CD2 3.39Å; A1442-F1444 PolarHBondContact O-N 2.84Å; F1444-L1446 VanDerWaalsContact C-N 3.32Å; F1444-L1446 PolarHBondContact O-N 3.4Å
1445	T	37.5	Very low	52.1	Low	104 Å²	104	77.8 Å²	77.8	64%	0.638	45%	0.445	S	S	*	.			trans	-60.2	104.1	148.3	40.5	0	0	0	0	107.5	R1429 V1443	R1429-T1445 PolarHBondContact NH1-O 3.41Å; R1429-T1445 PolarHBondContact NH2-O 2.84Å; V1443-T1445 PolarHBondContact O-N 2.95Å
1446	L	33.6	Very low	51.3	Low	130 Å²	130	76.9 Å²	76.9	68%	0.681	44%	0.442	S	S	*	.			trans	-75.7	0	162.9	-72.7	170.9	0	0	0	108.1	I1423 H1427 F1444	I1423-L1446 HydrophobicContact CG2-CD2 4.2Å; H1427-L1446 VanDerWaalsContact NE2-CD2 3.34Å; H1427-L1446 WeakPolarHBondContact NE2-CD2 3.39Å; F1444-L1446 VanDerWaalsContact C-N 3.32Å; F1444-L1446 PolarHBondContact O-N 3.4Å

Retrieved 1,446 of 1,446 residues in 219.2 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).