A0A077Z6C8_TRITR Loading...

Pecanex-like protein

AlphaFold DB , UniProt , Accession A0A077Z6C8, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 1,508 aa.

						>A0A077Z6C8_TRITR|A0A077Z6C8
MYDPRQSLFCNTVHMYLWLILFAAPMMISMFFTINVFLMTVYSTMVGIVFVITKTIVWLLNYVFDKYEPSDELPMSSVIVVDDCNLKDGVPKEHLKECMIEEIKRLLEEIIESHPEALQAIESVRQSKLKSAGLMDLNKYPKDLLDSLIQDRLIGHHENKADSCQLSAISSTSSEVGSDSFHKILMLHICVFKDLEGNWWSYTFSSNGTGTAQSLGTCRELKSRLQRFYDAQPSGPSSSRRLTVYRRHSAGNGSTSSEESLLAGMPSSVFHPIGSEVAGNPARAQNVATSRGRRAFAMPGRSVRTGLNQMRVFGNMALLFRRPNVSGSEIATKKVCYSVPLPVRLFGRKHLKIHFDRLRLSSLFDRNLTWISLSADVALAVVVSVIAFLLLMKPYYRDFGTLFLCFSAAGAQFCLLKSVQPDAASPVHGYNSIVPYSRPVYFSVFGTLIILIDPLHSSLLTLRDDLPDWHSRLDSISAGLNLCQEVLVRLILFLPLLFTLGVLPQLNTFCCYLLEQVDMHIFGGTACFSLVSAIYCCARSILCVAVLFLFGYLSISRTGSSQSVLFSAFCGFMAFFSYLLSRSTSNPKPLFGCLRSIFQTRIPLSKKRQARRPSDRKELIGNRILELRLRNNFFLASCIGLLAFALHCSTVFTMFPTILGFGFSIAVVIIGAVAHYLLPQLRKHTPCIFLSRPVLKTKEYGLFDVNDIAKVMWFERLFAWLHCIECHVFYPTVIISFVTNNSGSLFLSLGFSLLVTLADGSLPASHLILTFYLCSMLLPKLRELILKLRFIFAYVAPWQISWGSAFHAFAQPCAISHSAFTLVITAVSSLLSAPLNPFMGSSVFLMSYVRPVKFWEKDYNTRHLDNSNTRLATQIDRGPTTDDSNLNAIFYEHLTRSLQQHLAGDLALGRFASELEPGDCFILASFYLNCLIHVIEIGNGFVTFQLRGLEFRGTYCQQREVEAITEDISDVDGCCCAGDVCRLPGFVTWNAAWNMRWLAWEIKTARYILDGYSVTDNSAISLFQVSHLIELRKLLITLYVKCIIYFAIKSNRITDWLQLESIIDVLDLVQYNPEYVDVDPTFCYQNDEDYDVKRNGISYESFCVVYLSWITCCADRSPKSLTEETKYGNQVRKMVVALCYLLSLFGRRLLGAAAQSHTTNAESFLYGLHALFKGDFRITCSRDEWVFSDIDILSGVVAPAVRMALKLHQDQFTYAEDFDDNVCLYNLINGEGSTVFISHENDPAWRDAVLSNTAKLLALRHVSEDGLDDFKIIMLNKRFVSFRVIKLNRECVRAFWAGQQQELVFLRNGNPERGSIQNARQVLRNIINSSADQPIGYPIYVSPLTTSYSETHPQISSILGPVDLFKAVSDKVILLWRYLQLNCGMSGSSAINTVDQGFCQRSCTLPAVAIELQHIKGRTPTECSTLRRSNLSLPMIEEGRSTASSLLHRSSTHPVDRSISAQMLIRSSHVTVGCCRQCILSTAIQNRNSCAHSLCSKQCCTKSSAVTW
					

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	54.1	Low	68.6	Low	117 Å²	117	89.7 Å²	89.7	58%	0.576	43%	0.432	S	S	*	.				0	-62.5	0	-151.7	155	-121.4	0	0	107.9	D3 W18 F413	M1-D3 PolarHBondContact O-N 3.31Å; M1-W18 HydrophobicContact CE-CB 3.57Å; M1-W18 HydrophobicContact CE-CD2 4.27Å; M1-W18 HydrophobicContact CE-CG 3.48Å; M1-W18 VanDerWaalsContact CE-CG 3.48Å; M1-W18 HydrophobicContact SD-CB 3.95Å; M1-W18 HydrophobicContact SD-CD2 4.08Å; M1-W18 HydrophobicContact SD-CE3 4.49Å; M1-W18 HydrophobicContact SD-CG 3.83Å; M1-F413 HydrophobicContact CE-CB 4.31Å; M1-F413 HydrophobicContact CE-CD1 3.38Å; M1-F413 HydrophobicContact CE-CD2 3.96Å; M1-F413 HydrophobicContact CE-CE1 3.58Å; M1-F413 HydrophobicContact CE-CE2 4.12Å; M1-F413 HydrophobicContact CE-CG 3.6Å; M1-F413 HydrophobicContact CE-CZ 3.95Å
2	Y	60.8	Low	70	Confident	152 Å²	152	86.7 Å²	86.7	60%	0.596	42%	0.423	S	S	*	.			trans	-60	128.1	154.3	-171.2	-106.2	0	0	0	110.4	P4 N11	Y2-P4 HydrophobicContact CE1-CB 3.99Å; Y2-N11 VanDerWaalsContact CA-OD1 3.3Å; Y2-N11 WeakPolarHBondContact CA-OD1 3.46Å; Y2-N11 HydrophobicContact CD2-CB 4.07Å; Y2-N11 HydrophobicContact CE2-CB 4.39Å
3	D	63.5	Low	71.1	Confident	50 Å²	50	83 Å²	83	27%	0.267	41%	0.408	S	S	.	.			trans	-121.4	116.2	166.6	177.3	-3.6	0	0	0	107.9	M1 R5 Q6 N11	M1-D3 PolarHBondContact O-N 3.31Å; D3-R5 PolarHBondContact O-N 3.43Å; D3-R5 VanDerWaalsContact O-N 3.1Å; D3-R5 WeakPolarHBondContact OD1-CB 3.46Å; D3-R5 PolarHBondContact OD1-N 3.39Å; D3-Q6 HydrophobicContact CB-CB 4.33Å; D3-Q6 HydrophobicContact CB-CG 4.06Å; D3-Q6 PolarHBondContact O-N 3.08Å; D3-Q6 VanDerWaalsContact O-N 3.12Å; D3-Q6 WeakPolarHBondContact OD2-CG 3.28Å; D3-Q6 PolarHBondContact OD2-NE2 3.34Å; D3-N11 PolarHBondContact N-OD1 2.68Å; D3-N11 PolarHBondContact O-ND2 2.86Å
4	P	61.9	Low	72.1	Confident	95 Å²	95	77.5 Å²	77.5	62%	0.617	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-9.8	-178.3	28.8	-36	0	0	0	113.9	Y2	Y2-P4 HydrophobicContact CE1-CB 3.99Å
5	R	58.9	Low	72.9	Confident	199 Å²	199	78.5 Å²	78.5	75%	0.751	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.6	-13	176.1	-59.5	177.8	173	-162.1	-6.3	113.4	D3	D3-R5 PolarHBondContact O-N 3.43Å; D3-R5 VanDerWaalsContact O-N 3.1Å; D3-R5 WeakPolarHBondContact OD1-CB 3.46Å; D3-R5 PolarHBondContact OD1-N 3.39Å
6	Q	66.5	Low	73.9	Confident	41 Å²	41	82.1 Å²	82.1	19%	0.192	40%	0.395	C	S	.	.	S	Bend	trans	-97	149.5	-178.8	-67.3	-179.1	50.3	0	0	110.9	D3 C10 N11 S362	D3-Q6 HydrophobicContact CB-CB 4.33Å; D3-Q6 HydrophobicContact CB-CG 4.06Å; D3-Q6 PolarHBondContact O-N 3.08Å; D3-Q6 VanDerWaalsContact O-N 3.12Å; D3-Q6 WeakPolarHBondContact OD2-CG 3.28Å; D3-Q6 PolarHBondContact OD2-NE2 3.34Å; Q6-C10 HydrophobicContact CB-CB 4.24Å; Q6-N11 PolarHBondContact O-ND2 3.02Å; Q6-N11 VanDerWaalsContact O-ND2 3.08Å; Q6-S362 PolarHBondContact OE1-O 3.01Å
7	S	73.5	Confident	74.6	Confident	61 Å²	61	79.5 Å²	79.5	43%	0.427	38%	0.384	S	S	.	.			trans	-60.6	150.8	179.3	69.4	0	0	0	0	111.2	F9 C10 N11	S7-F9 PolarHBondContact O-N 2.9Å; S7-F9 VanDerWaalsContact O-N 3.17Å; S7-C10 PolarHBondContact O-N 3.01Å; S7-C10 PolarHBondContact OG-SG 2.85Å; S7-N11 PolarHBondContact O-N 3.32Å; S7-N11 PolarHBondContact O-ND2 3.34Å
8	L	77	Confident	75.3	Confident	133 Å²	133	77.4 Å²	77.4	70%	0.696	37%	0.372	S	S	*	.	H	α-helix	trans	-51.4	-43.2	-179.5	-175.2	64.5	0	0	0	111.2	C10 N11 T12	L8-C10 PolarHBondContact O-N 3.35Å; L8-N11 PolarHBondContact O-N 2.96Å; L8-T12 WeakPolarHBondContact O-CB 3.46Å; L8-T12 PolarHBondContact O-N 3.42Å; L8-T12 PolarHBondContact O-OG1 2.91Å
9	F	80.5	Confident	76	Confident	125 Å²	125	77.8 Å²	77.8	55%	0.548	38%	0.375	S	S	.	.	H	α-helix	trans	-52.9	-45.4	174.9	179.8	-98.2	0	0	0	113.7	S7 T12 V13 L363	S7-F9 PolarHBondContact O-N 2.9Å; S7-F9 VanDerWaalsContact O-N 3.17Å; F9-T12 PolarHBondContact O-N 3.24Å; F9-V13 HydrophobicContact CD1-CG2 4.41Å; F9-V13 HydrophobicContact CD2-CG2 4.49Å; F9-V13 HydrophobicContact CE1-CG2 4.04Å; F9-V13 HydrophobicContact CE2-CG2 4.12Å; F9-V13 HydrophobicContact CZ-CG2 3.88Å; F9-V13 WeakPolarHBondContact O-CG2 3.31Å; F9-V13 PolarHBondContact O-N 3.26Å; F9-L363 HydrophobicContact CE1-CD1 4.14Å
10	C	77	Confident	76.6	Confident	2 Å²	2	79.2 Å²	79.2	1%	0.014	38%	0.384	C	S	.	.	H	α-helix	trans	-64.3	-48.2	179.3	-59.3	0	0	0	0	110.9	Q6 S7 L8 T12 V13 H14 L363	Q6-C10 HydrophobicContact CB-CB 4.24Å; S7-C10 PolarHBondContact O-N 3.01Å; S7-C10 PolarHBondContact OG-SG 2.85Å; L8-C10 PolarHBondContact O-N 3.35Å; C10-T12 VanDerWaalsContact C-N 3.33Å; C10-T12 PolarHBondContact O-N 2.97Å; C10-V13 PolarHBondContact O-N 3.32Å; C10-H14 VanDerWaalsContact O-CG 3.28Å; C10-H14 PolarHBondContact O-N 3.09Å; C10-L363 HydrophobicContact CB-CD2 4.13Å; C10-L363 HydrophobicContact CB-CG 4.34Å
11	N	81.3	Confident	77.1	Confident	12 Å²	12	76.2 Å²	76.2	6%	0.064	37%	0.37	C	S	.	.	H	α-helix	trans	-59.2	-41.1	177	-76.7	-61.4	0	0	0	112.3	Y2 D3 Q6 S7 L8 M15	Y2-N11 VanDerWaalsContact CA-OD1 3.3Å; Y2-N11 WeakPolarHBondContact CA-OD1 3.46Å; Y2-N11 HydrophobicContact CD2-CB 4.07Å; Y2-N11 HydrophobicContact CE2-CB 4.39Å; D3-N11 PolarHBondContact N-OD1 2.68Å; D3-N11 PolarHBondContact O-ND2 2.86Å; Q6-N11 PolarHBondContact O-ND2 3.02Å; Q6-N11 VanDerWaalsContact O-ND2 3.08Å; S7-N11 PolarHBondContact O-N 3.32Å; S7-N11 PolarHBondContact O-ND2 3.34Å; L8-N11 PolarHBondContact O-N 2.96Å; N11-M15 WeakPolarHBondContact O-CB 3.15Å; N11-M15 PolarHBondContact O-N 2.9Å
12	T	85	Confident	78.7	Confident	53 Å²	53	72.2 Å²	72.2	33%	0.325	35%	0.349	S	S	.	.	H	α-helix	trans	-65.3	-45.2	175.9	-58.7	0	0	0	0	112	L8 F9 C10 M15 Y16	L8-T12 WeakPolarHBondContact O-CB 3.46Å; L8-T12 PolarHBondContact O-N 3.42Å; L8-T12 PolarHBondContact O-OG1 2.91Å; F9-T12 PolarHBondContact O-N 3.24Å; C10-T12 VanDerWaalsContact C-N 3.33Å; C10-T12 PolarHBondContact O-N 2.97Å; T12-M15 PolarHBondContact O-N 3.39Å; T12-Y16 HydrophobicContact CG2-CD2 3.77Å; T12-Y16 HydrophobicContact CG2-CE2 3.54Å; T12-Y16 VanDerWaalsContact O-CD2 3.3Å; T12-Y16 WeakPolarHBondContact O-CD2 3.22Å; T12-Y16 PolarHBondContact O-N 2.94Å
13	V	84.5	Confident	80	Confident	39 Å²	39	66.2 Å²	66.2	24%	0.236	33%	0.331	C	S	.	.	H	α-helix	trans	-63.4	-43.1	177	169.5	0	0	0	0	111.1	F9 C10 M15 Y16 L17 L363	F9-V13 HydrophobicContact CD1-CG2 4.41Å; F9-V13 HydrophobicContact CD2-CG2 4.49Å; F9-V13 HydrophobicContact CE1-CG2 4.04Å; F9-V13 HydrophobicContact CE2-CG2 4.12Å; F9-V13 HydrophobicContact CZ-CG2 3.88Å; F9-V13 WeakPolarHBondContact O-CG2 3.31Å; F9-V13 PolarHBondContact O-N 3.26Å; C10-V13 PolarHBondContact O-N 3.32Å; V13-M15 PolarHBondContact O-N 3.33Å; V13-Y16 PolarHBondContact O-N 3.37Å; V13-L17 HydrophobicContact CG1-CD1 3.74Å; V13-L17 HydrophobicContact CG1-CG 4.33Å; V13-L17 WeakPolarHBondContact O-CB 3.2Å; V13-L17 VanDerWaalsContact O-CG 3.3Å; V13-L17 WeakPolarHBondContact O-CG 3.37Å; V13-L17 PolarHBondContact O-N 2.82Å; V13-L363 HydrophobicContact CB-CD2 3.86Å; V13-L363 HydrophobicContact CG1-CD2 3.77Å; V13-L363 HydrophobicContact CG2-CD2 4.42Å
14	H	84.8	Confident	81	Confident	6 Å²	6	65.6 Å²	65.6	3%	0.028	33%	0.333	C	S	.	.	H	α-helix	trans	-59.6	-43.8	174.5	-69.9	165.5	0	0	0	112.5	C10 W18 S362 L363 F413	C10-H14 VanDerWaalsContact O-CG 3.28Å; C10-H14 PolarHBondContact O-N 3.09Å; H14-W18 PolarHBondContact O-N 2.9Å; H14-W18 VanDerWaalsContact O-N 3.08Å; H14-S362 PolarHBondContact CE1-O 2.95Å; H14-L363 PolarHBondContact NE2-O 2.92Å; H14-F413 HydrophobicContact CB-CE2 4.13Å; H14-F413 HydrophobicContact CB-CZ 3.77Å; H14-F413 AromaticContact CD2-CZ 3.83Å; H14-F413 AromaticContact CG-CZ 3.8Å; H14-F413 WeakPolarHBondContact O-CE2 3.23Å
15	M	84.7	Confident	82	Confident	92 Å²	92	61.2 Å²	61.2	45%	0.453	30%	0.304	S	S	.	.	H	α-helix	trans	-61	-49.7	177.7	-174	-166.1	77.6	0	0	111.8	N11 T12 V13 W18 L19	N11-M15 WeakPolarHBondContact O-CB 3.15Å; N11-M15 PolarHBondContact O-N 2.9Å; T12-M15 PolarHBondContact O-N 3.39Å; V13-M15 PolarHBondContact O-N 3.33Å; M15-W18 PolarHBondContact O-N 2.96Å; M15-L19 VanDerWaalsContact O-CB 3.31Å; M15-L19 WeakPolarHBondContact O-CB 3.32Å; M15-L19 PolarHBondContact O-N 3.3Å
16	Y	88.7	Confident	83.2	Confident	136 Å²	136	53.8 Å²	53.8	53%	0.533	28%	0.279	S	S	.	.	H	α-helix	trans	-66.2	-41.8	-179.8	-77.5	-60.2	0	0	0	112.7	T12 V13 W18 L19 I20	T12-Y16 HydrophobicContact CG2-CD2 3.77Å; T12-Y16 HydrophobicContact CG2-CE2 3.54Å; T12-Y16 VanDerWaalsContact O-CD2 3.3Å; T12-Y16 WeakPolarHBondContact O-CD2 3.22Å; T12-Y16 PolarHBondContact O-N 2.94Å; V13-Y16 PolarHBondContact O-N 3.37Å; Y16-W18 PolarHBondContact O-N 3.27Å; Y16-L19 PolarHBondContact O-N 3.31Å; Y16-I20 VanDerWaalsContact O-CG1 3.3Å; Y16-I20 WeakPolarHBondContact O-CG1 3.45Å; Y16-I20 PolarHBondContact O-N 2.9Å
17	L	86	Confident	84.1	Confident	39 Å²	39	56.2 Å²	56.2	20%	0.204	29%	0.291	C	S	.	.	H	α-helix	trans	-59.3	-45.5	176.6	-74.9	170.3	0	0	0	111.7	V13 L21 F364 F413	V13-L17 HydrophobicContact CG1-CD1 3.74Å; V13-L17 HydrophobicContact CG1-CG 4.33Å; V13-L17 WeakPolarHBondContact O-CB 3.2Å; V13-L17 VanDerWaalsContact O-CG 3.3Å; V13-L17 WeakPolarHBondContact O-CG 3.37Å; V13-L17 PolarHBondContact O-N 2.82Å; L17-L21 WeakPolarHBondContact O-CG 3.37Å; L17-L21 PolarHBondContact O-N 3.33Å; L17-F364 HydrophobicContact CD1-CE1 3.92Å; L17-F364 HydrophobicContact CD1-CZ 3.84Å; L17-F413 HydrophobicContact CB-CE2 4.36Å
18	W	87.3	Confident	84.5	Confident	42 Å²	42	54.5 Å²	54.5	16%	0.159	28%	0.277	C	S	.	.	H	α-helix	trans	-68.1	-40	176.7	179.9	78.8	0	0	0	112.7	M1 H14 M15 Y16 I20 L21 F22 F406 F413	M1-W18 HydrophobicContact CE-CB 3.57Å; M1-W18 HydrophobicContact CE-CD2 4.27Å; M1-W18 HydrophobicContact CE-CG 3.48Å; M1-W18 VanDerWaalsContact CE-CG 3.48Å; M1-W18 HydrophobicContact SD-CB 3.95Å; M1-W18 HydrophobicContact SD-CD2 4.08Å; M1-W18 HydrophobicContact SD-CE3 4.49Å; M1-W18 HydrophobicContact SD-CG 3.83Å; H14-W18 PolarHBondContact O-N 2.9Å; H14-W18 VanDerWaalsContact O-N 3.08Å; M15-W18 PolarHBondContact O-N 2.96Å; Y16-W18 PolarHBondContact O-N 3.27Å; W18-I20 VanDerWaalsContact C-N 3.28Å; W18-I20 PolarHBondContact O-N 3.22Å; W18-L21 PolarHBondContact O-N 3.4Å; W18-L21 VanDerWaalsContact O-N 3.14Å; W18-F22 HydrophobicContact CH2-CB 4.21Å; W18-F22 HydrophobicContact CH2-CD1 4.46Å; W18-F22 HydrophobicContact CH2-CD2 4.35Å; W18-F22 HydrophobicContact CH2-CG 4.08Å; W18-F22 HydrophobicContact CZ2-CB 4.18Å; W18-F22 HydrophobicContact CZ2-CD2 4.38Å; W18-F22 HydrophobicContact CZ2-CG 4.33Å; W18-F22 HydrophobicContact CZ3-CB 4.43Å; W18-F22 WeakPolarHBondContact O-CB 3.36Å; W18-F22 PolarHBondContact O-N 2.93Å; W18-F406 AromaticContact CH2-CD2 3.56Å; W18-F406 HydrophobicContact CH2-CD2 3.56Å; W18-F406 AromaticContact CH2-CE2 3.54Å; W18-F406 HydrophobicContact CH2-CE2 3.54Å; W18-F406 AromaticContact CZ2-CD2 3.44Å; W18-F406 HydrophobicContact CZ2-CD2 3.44Å; W18-F406 VanDerWaalsContact CZ2-CD2 3.44Å; W18-F406 AromaticContact CZ2-CE2 3.52Å; W18-F406 HydrophobicContact CZ2-CE2 3.52Å; W18-F406 HydrophobicContact CZ2-CG 4.05Å; W18-F406 HydrophobicContact CZ2-CZ 4.2Å; W18-F413 HydrophobicContact CB-CD2 3.89Å; W18-F413 HydrophobicContact CB-CE2 4.38Å; W18-F413 HydrophobicContact CB-CG 4.4Å
19	L	87.5	Confident	84.7	Confident	85 Å²	85	49.5 Å²	49.5	45%	0.445	25%	0.253	S	S	.	.	H	α-helix	trans	-63.3	-34.7	178.6	-172.5	142.9	0	0	0	112.1	M15 Y16 A23	M15-L19 VanDerWaalsContact O-CB 3.31Å; M15-L19 WeakPolarHBondContact O-CB 3.32Å; M15-L19 PolarHBondContact O-N 3.3Å; Y16-L19 PolarHBondContact O-N 3.31Å; L19-A23 WeakPolarHBondContact O-CB 3.19Å; L19-A23 PolarHBondContact O-N 3.34Å
20	I	87.9	Confident	84.7	Confident	105 Å²	105	49.9 Å²	49.9	54%	0.538	26%	0.258	S	S	.	.	H	α-helix	trans	-64.8	-47.6	171.4	-68.8	163.3	0	0	0	111	Y16 W18 F22 A23 A24	Y16-I20 VanDerWaalsContact O-CG1 3.3Å; Y16-I20 WeakPolarHBondContact O-CG1 3.45Å; Y16-I20 PolarHBondContact O-N 2.9Å; W18-I20 VanDerWaalsContact C-N 3.28Å; W18-I20 PolarHBondContact O-N 3.22Å; I20-F22 VanDerWaalsContact C-N 3.27Å; I20-F22 PolarHBondContact O-N 3.17Å; I20-A23 PolarHBondContact O-N 2.84Å; I20-A24 WeakPolarHBondContact O-CB 3.47Å; I20-A24 PolarHBondContact O-N 2.94Å
21	L	87.3	Confident	84.9	Confident	17 Å²	17	56.3 Å²	56.3	9%	0.089	29%	0.286	C	S	.	.	H	α-helix	trans	-64.1	-30.7	179	-65.6	171	0	0	0	112.7	L17 W18 P25 F50 A409 Q412 F413	L17-L21 WeakPolarHBondContact O-CG 3.37Å; L17-L21 PolarHBondContact O-N 3.33Å; W18-L21 PolarHBondContact O-N 3.4Å; W18-L21 VanDerWaalsContact O-N 3.14Å; L21-P25 WeakPolarHBondContact O-CD 3.44Å; L21-P25 WeakPolarHBondContact O-CG 3.39Å; L21-F50 HydrophobicContact CD2-CE2 4.21Å; L21-A409 HydrophobicContact CB-CB 4.01Å; L21-Q412 HydrophobicContact CD1-CB 4.08Å; L21-F413 HydrophobicContact CD1-CB 4.32Å
22	F	89	Confident	84.9	Confident	32 Å²	32	61.8 Å²	61.8	14%	0.14	31%	0.309	C	S	.	.	H	α-helix	trans	-77	-47.6	174.1	170.8	-107.5	0	0	0	112.6	W18 I20 P25 M26 L402 C405 F406 A409	W18-F22 HydrophobicContact CH2-CB 4.21Å; W18-F22 HydrophobicContact CH2-CD1 4.46Å; W18-F22 HydrophobicContact CH2-CD2 4.35Å; W18-F22 HydrophobicContact CH2-CG 4.08Å; W18-F22 HydrophobicContact CZ2-CB 4.18Å; W18-F22 HydrophobicContact CZ2-CD2 4.38Å; W18-F22 HydrophobicContact CZ2-CG 4.33Å; W18-F22 HydrophobicContact CZ3-CB 4.43Å; W18-F22 WeakPolarHBondContact O-CB 3.36Å; W18-F22 PolarHBondContact O-N 2.93Å; I20-F22 VanDerWaalsContact C-N 3.27Å; I20-F22 PolarHBondContact O-N 3.17Å; F22-P25 WeakPolarHBondContact O-CD 3.28Å; F22-M26 HydrophobicContact CE1-CE 4.22Å; F22-M26 HydrophobicContact CE1-SD 4.01Å; F22-M26 HydrophobicContact CZ-SD 3.8Å; F22-L402 HydrophobicContact CE2-CD2 4.26Å; F22-L402 HydrophobicContact CE2-CG 4.36Å; F22-L402 HydrophobicContact CZ-CD2 4.1Å; F22-L402 HydrophobicContact CZ-CG 4.05Å; F22-C405 HydrophobicContact CD2-CB 4.11Å; F22-C405 HydrophobicContact CE2-CB 4.1Å; F22-F406 HydrophobicContact CD2-CB 4.32Å; F22-F406 HydrophobicContact CE2-CB 4.16Å; F22-A409 HydrophobicContact CB-CB 3.84Å
23	A	86.5	Confident	84.5	Confident	27 Å²	27	64.9 Å²	64.9	22%	0.223	33%	0.328	C	S	.	.	H	α-helix	trans	-70.2	-37.2	-175.2	0	0	0	0	0	112.8	L19 I20 M26 M27	L19-A23 WeakPolarHBondContact O-CB 3.19Å; L19-A23 PolarHBondContact O-N 3.34Å; I20-A23 PolarHBondContact O-N 2.84Å; A23-M26 PolarHBondContact O-N 3.19Å; A23-M27 WeakPolarHBondContact O-CB 3.41Å; A23-M27 WeakPolarHBondContact O-CG 3.2Å; A23-M27 PolarHBondContact O-N 2.98Å
24	A	84.8	Confident	84.1	Confident	37 Å²	37	65.2 Å²	65.2	31%	0.306	33%	0.328	S	S	.	.	H	α-helix	trans	-56.4	-56.7	-176.7	0	0	0	0	0	114.3	I20 M26 I28 Y42	I20-A24 WeakPolarHBondContact O-CB 3.47Å; I20-A24 PolarHBondContact O-N 2.94Å; A24-M26 VanDerWaalsContact C-N 3.33Å; A24-M26 PolarHBondContact O-N 3.36Å; A24-I28 WeakPolarHBondContact O-CD1 3.46Å; A24-I28 VanDerWaalsContact O-CG1 3.28Å; A24-I28 WeakPolarHBondContact O-CG1 3.33Å; A24-I28 PolarHBondContact O-N 3.3Å; A24-I28 VanDerWaalsContact O-N 3.11Å; A24-Y42 HydrophobicContact CB-CE2 4.05Å
25	P	84.3	Confident	84	Confident	3 Å²	3	68.9 Å²	68.9	2%	0.019	35%	0.348	C	S	.	.	H	α-helix	trans	-66.7	-33.7	177.8	27.4	-34.8	0	0	0	112.4	L21 F22 I28 S29 Y42 L391 C405	L21-P25 WeakPolarHBondContact O-CD 3.44Å; L21-P25 WeakPolarHBondContact O-CG 3.39Å; F22-P25 WeakPolarHBondContact O-CD 3.28Å; P25-I28 PolarHBondContact O-N 3.25Å; P25-S29 WeakPolarHBondContact O-CB 3.35Å; P25-S29 PolarHBondContact O-N 3.01Å; P25-S29 PolarHBondContact O-OG 3.3Å; P25-Y42 HydrophobicContact CB-CE1 4.42Å; P25-L391 HydrophobicContact CB-CD1 4.43Å; P25-C405 HydrophobicContact CG-CB 4.4Å
26	M	84	Confident	83.9	Confident	43 Å²	43	69 Å²	69	21%	0.212	35%	0.354	C	S	.	.	H	α-helix	trans	-63.6	-51.6	177.5	-172.8	-178.5	74.1	0	0	111.5	F22 A23 A24 I28 S29 M30	F22-M26 HydrophobicContact CE1-CE 4.22Å; F22-M26 HydrophobicContact CE1-SD 4.01Å; F22-M26 HydrophobicContact CZ-SD 3.8Å; A23-M26 PolarHBondContact O-N 3.19Å; A24-M26 VanDerWaalsContact C-N 3.33Å; A24-M26 PolarHBondContact O-N 3.36Å; M26-I28 VanDerWaalsContact C-N 3.3Å; M26-I28 PolarHBondContact O-N 3.32Å; M26-S29 PolarHBondContact O-N 3.16Å; M26-S29 VanDerWaalsContact O-N 3.14Å; M26-S29 PolarHBondContact O-OG 3.27Å; M26-M30 HydrophobicContact CG-SD 4.12Å; M26-M30 WeakPolarHBondContact O-CG 3.45Å; M26-M30 PolarHBondContact O-N 3.16Å
27	M	84.7	Confident	83.8	Confident	91 Å²	91	70.4 Å²	70.4	45%	0.448	36%	0.363	S	S	.	.	H	α-helix	trans	-57.9	-42.5	176	-70.5	-66.2	-66.9	0	0	111.4	A23 S29 M30 F31	A23-M27 WeakPolarHBondContact O-CB 3.41Å; A23-M27 WeakPolarHBondContact O-CG 3.2Å; A23-M27 PolarHBondContact O-N 2.98Å; M27-S29 PolarHBondContact O-N 3.21Å; M27-M30 PolarHBondContact O-N 2.98Å; M27-F31 HydrophobicContact CE-CD2 3.66Å; M27-F31 HydrophobicContact CE-CE2 3.41Å; M27-F31 VanDerWaalsContact CE-CE2 3.41Å; M27-F31 HydrophobicContact CE-CZ 4.22Å; M27-F31 WeakPolarHBondContact O-CB 3.35Å; M27-F31 WeakPolarHBondContact O-CD2 3.29Å; M27-F31 PolarHBondContact O-N 3.02Å; M27-F31 HydrophobicContact SD-CD2 4.08Å; M27-F31 HydrophobicContact SD-CE2 3.68Å
28	I	81.9	Confident	83.7	Confident	26 Å²	26	70 Å²	70	13%	0.133	36%	0.361	C	S	.	.	H	α-helix	trans	-61	-45.7	176.4	-70.6	165.2	0	0	0	111.2	A24 P25 M26 M30 F32 L38 Y42 F388	A24-I28 WeakPolarHBondContact O-CD1 3.46Å; A24-I28 VanDerWaalsContact O-CG1 3.28Å; A24-I28 WeakPolarHBondContact O-CG1 3.33Å; A24-I28 PolarHBondContact O-N 3.3Å; A24-I28 VanDerWaalsContact O-N 3.11Å; P25-I28 PolarHBondContact O-N 3.25Å; M26-I28 VanDerWaalsContact C-N 3.3Å; M26-I28 PolarHBondContact O-N 3.32Å; I28-M30 VanDerWaalsContact C-N 3.28Å; I28-M30 PolarHBondContact O-N 3.23Å; I28-F32 PolarHBondContact O-N 3.44Å; I28-L38 HydrophobicContact CG2-CD2 3.61Å; I28-L38 HydrophobicContact CG2-CG 3.9Å; I28-Y42 HydrophobicContact CD1-CD2 3.8Å; I28-Y42 HydrophobicContact CD1-CG 4Å; I28-F388 HydrophobicContact CG2-CE2 3.79Å; I28-F388 HydrophobicContact CG2-CZ 4.47Å
29	S	80	Confident	83.6	Confident	27 Å²	27	69.5 Å²	69.5	19%	0.189	36%	0.361	C	S	.	.	H	α-helix	trans	-67.3	-23.6	179.6	70.5	0	0	0	0	114.7	P25 M26 M27	P25-S29 WeakPolarHBondContact O-CB 3.35Å; P25-S29 PolarHBondContact O-N 3.01Å; P25-S29 PolarHBondContact O-OG 3.3Å; M26-S29 PolarHBondContact O-N 3.16Å; M26-S29 VanDerWaalsContact O-N 3.14Å; M26-S29 PolarHBondContact O-OG 3.27Å; M27-S29 PolarHBondContact O-N 3.21Å
30	M	81.8	Confident	83.5	Confident	133 Å²	133	68.9 Å²	68.9	66%	0.655	36%	0.361	S	S	*	.	H	α-helix	trans	-93.9	-33.9	-178.1	-69.6	-177	72.4	0	0	113.9	M26 M27 I28	M26-M30 HydrophobicContact CG-SD 4.12Å; M26-M30 WeakPolarHBondContact O-CG 3.45Å; M26-M30 PolarHBondContact O-N 3.16Å; M27-M30 PolarHBondContact O-N 2.98Å; I28-M30 VanDerWaalsContact C-N 3.28Å; I28-M30 PolarHBondContact O-N 3.23Å
31	F	81.9	Confident	83.5	Confident	138 Å²	138	66.5 Å²	66.5	61%	0.605	35%	0.351	S	S	*	.	H	α-helix	trans	-105.9	-13	-170.8	-72.3	-84	0	0	0	114.7	M27	M27-F31 HydrophobicContact CE-CD2 3.66Å; M27-F31 HydrophobicContact CE-CE2 3.41Å; M27-F31 VanDerWaalsContact CE-CE2 3.41Å; M27-F31 HydrophobicContact CE-CZ 4.22Å; M27-F31 WeakPolarHBondContact O-CB 3.35Å; M27-F31 WeakPolarHBondContact O-CD2 3.29Å; M27-F31 PolarHBondContact O-N 3.02Å; M27-F31 HydrophobicContact SD-CD2 4.08Å; M27-F31 HydrophobicContact SD-CE2 3.68Å
32	F	79.4	Confident	83.6	Confident	126 Å²	126	66.3 Å²	66.3	55%	0.553	35%	0.349	S	S	*	.	S	Bend	trans	-130.6	144.4	-175.5	-62.8	-87.4	0	0	0	112	I28 I34 L38	I28-F32 PolarHBondContact O-N 3.44Å; F32-I34 PolarHBondContact O-N 3.47Å; F32-L38 HydrophobicContact CB-CD2 3.54Å; F32-L38 HydrophobicContact CG-CD2 4.03Å
33	T	77.1	Confident	83.6	Confident	118 Å²	118	65.2 Å²	65.2	72%	0.724	35%	0.346	S	S	*	.			trans	-65.3	119.8	166.8	46	0	0	0	0	108.9	N35	T33-N35 PolarHBondContact O-N 2.93Å; T33-N35 PolarHBondContact O-ND2 3.14Å; T33-N35 PolarHBondContact OG1-ND2 3.26Å
34	I	77.2	Confident	83.7	Confident	46 Å²	46	67.4 Å²	67.4	24%	0.236	36%	0.356	C	S	.	.			trans	-69.5	123.8	-169.6	-42.1	-176.4	0	0	0	108.6	F32 F388 L391 M392	F32-I34 PolarHBondContact O-N 3.47Å; I34-F388 HydrophobicContact CG2-CD1 4.01Å; I34-F388 HydrophobicContact CG2-CE1 3.3Å; I34-F388 HydrophobicContact CG2-CE2 4.13Å; I34-F388 HydrophobicContact CG2-CZ 3.37Å; I34-L391 HydrophobicContact CD1-CB 4.2Å; I34-L391 WeakPolarHBondContact CD1-O 3.44Å; I34-M392 HydrophobicContact CB-SD 3.73Å; I34-M392 HydrophobicContact CG2-CG 3.91Å; I34-M392 HydrophobicContact CG2-SD 3.4Å; I34-M392 WeakPolarHBondContact CG2-SD 3.37Å
35	N	82.6	Confident	84	Confident	84 Å²	84	71.4 Å²	71.4	45%	0.449	37%	0.37	S	S	.	.			trans	-144.9	151.3	-166.9	-88.5	-68.5	0	0	0	111.8	T33 F37 L38 M39 F388	T33-N35 PolarHBondContact O-N 2.93Å; T33-N35 PolarHBondContact O-ND2 3.14Å; T33-N35 PolarHBondContact OG1-ND2 3.26Å; N35-F37 VanDerWaalsContact C-N 3.28Å; N35-F37 PolarHBondContact O-N 3.47Å; N35-L38 WeakPolarHBondContact O-CB 3.47Å; N35-L38 PolarHBondContact O-N 3.1Å; N35-M39 PolarHBondContact O-N 3.35Å; N35-F388 WeakPolarHBondContact O-CE1 3.48Å
36	V	82.7	Confident	84.2	Confident	95 Å²	95	71.8 Å²	71.8	58%	0.576	37%	0.372	S	S	*	.	H	α-helix	trans	-61.9	-31.8	-177.8	-176.1	0	0	0	0	113	M39 T40	V36-M39 HydrophobicContact CG1-CE 4.26Å; V36-M39 WeakPolarHBondContact O-CB 3.4Å; V36-M39 PolarHBondContact O-N 2.95Å; V36-T40 PolarHBondContact O-N 3.38Å; V36-T40 PolarHBondContact O-OG1 3.37Å
37	F	85.3	Confident	84.5	Confident	164 Å²	164	70.1 Å²	70.1	72%	0.719	37%	0.366	S	S	*	.	H	α-helix	trans	-61.2	-46.8	171.3	177.5	-100.8	0	0	0	111.5	N35 M39 T40 V41	N35-F37 VanDerWaalsContact C-N 3.28Å; N35-F37 PolarHBondContact O-N 3.47Å; F37-M39 VanDerWaalsContact C-N 3.33Å; F37-M39 PolarHBondContact O-N 2.92Å; F37-T40 WeakPolarHBondContact O-CB 3.45Å; F37-T40 PolarHBondContact O-N 2.81Å; F37-T40 VanDerWaalsContact O-N 3.12Å; F37-V41 HydrophobicContact CD1-CG2 4.35Å; F37-V41 HydrophobicContact CE1-CG2 3.91Å; F37-V41 HydrophobicContact CE2-CG2 4.5Å; F37-V41 HydrophobicContact CZ-CG2 3.99Å; F37-V41 PolarHBondContact O-N 2.94Å
38	L	84.3	Confident	84.8	Confident	32 Å²	32	70.4 Å²	70.4	17%	0.168	37%	0.369	C	S	.	.	H	α-helix	trans	-70.7	-30	-178.4	-170.2	56.5	0	0	0	112.1	I28 F32 N35 V41 Y42 F388	I28-L38 HydrophobicContact CG2-CD2 3.61Å; I28-L38 HydrophobicContact CG2-CG 3.9Å; F32-L38 HydrophobicContact CB-CD2 3.54Å; F32-L38 HydrophobicContact CG-CD2 4.03Å; N35-L38 WeakPolarHBondContact O-CB 3.47Å; N35-L38 PolarHBondContact O-N 3.1Å; L38-V41 PolarHBondContact O-N 2.79Å; L38-Y42 WeakPolarHBondContact O-CB 3.49Å; L38-Y42 PolarHBondContact O-N 3.41Å; L38-F388 HydrophobicContact CB-CZ 4.05Å; L38-F388 HydrophobicContact CG-CE2 4.36Å; L38-F388 HydrophobicContact CG-CZ 4.24Å
39	M	85	Confident	85.1	Confident	31 Å²	31	72.5 Å²	72.5	15%	0.153	38%	0.382	C	S	.	.	H	α-helix	trans	-57.3	-47.9	167	-170	-175.4	75.2	0	0	111.4	N35 V36 F37 Y42 S43 V385 F388 L389	N35-M39 PolarHBondContact O-N 3.35Å; V36-M39 HydrophobicContact CG1-CE 4.26Å; V36-M39 WeakPolarHBondContact O-CB 3.4Å; V36-M39 PolarHBondContact O-N 2.95Å; F37-M39 VanDerWaalsContact C-N 3.33Å; F37-M39 PolarHBondContact O-N 2.92Å; M39-Y42 PolarHBondContact O-N 3.28Å; M39-S43 WeakPolarHBondContact O-CB 3.23Å; M39-S43 PolarHBondContact O-N 2.83Å; M39-S43 PolarHBondContact O-OG 3.23Å; M39-V385 HydrophobicContact CE-CG1 4.41Å; M39-V385 HydrophobicContact SD-CG1 4.04Å; M39-F388 HydrophobicContact CB-CD1 3.43Å; M39-F388 VanDerWaalsContact CB-CD1 3.43Å; M39-F388 HydrophobicContact CB-CD2 4.44Å; M39-F388 HydrophobicContact CB-CE1 3.44Å; M39-F388 VanDerWaalsContact CB-CE1 3.44Å; M39-F388 HydrophobicContact CB-CE2 4.43Å; M39-F388 HydrophobicContact CB-CG 3.96Å; M39-F388 HydrophobicContact CB-CZ 3.97Å; M39-F388 HydrophobicContact CG-CB 3.98Å; M39-F388 HydrophobicContact CG-CD1 3.52Å; M39-F388 HydrophobicContact CG-CE1 4.09Å; M39-F388 HydrophobicContact CG-CG 3.78Å; M39-F388 VanDerWaalsContact N-CZ 3.26Å; M39-F388 HydrophobicContact SD-CD1 4.24Å; M39-L389 HydrophobicContact SD-CD2 3.87Å; M39-L389 HydrophobicContact SD-CG 4.04Å
40	T	86.3	Confident	85.6	Confident	71 Å²	71	71.2 Å²	71.2	44%	0.436	37%	0.373	S	S	.	.	H	α-helix	trans	-65.6	-41.5	-179.5	-53.5	0	0	0	0	111	V36 F37 S43 T44	V36-T40 PolarHBondContact O-N 3.38Å; V36-T40 PolarHBondContact O-OG1 3.37Å; F37-T40 WeakPolarHBondContact O-CB 3.45Å; F37-T40 PolarHBondContact O-N 2.81Å; F37-T40 VanDerWaalsContact O-N 3.12Å; T40-S43 PolarHBondContact O-OG 2.9Å; T40-T44 HydrophobicContact CG2-CG2 4.39Å; T40-T44 WeakPolarHBondContact O-CB 3.27Å; T40-T44 VanDerWaalsContact O-CG2 3.26Å; T40-T44 WeakPolarHBondContact O-CG2 3.48Å; T40-T44 PolarHBondContact O-N 2.72Å; T40-T44 PolarHBondContact O-OG1 2.91Å
41	V	87.7	Confident	86	Confident	56 Å²	56	68 Å²	68	34%	0.339	36%	0.361	S	S	.	.	H	α-helix	trans	-64	-49.6	175.7	176.1	0	0	0	0	111.4	F37 L38 T44 M45	F37-V41 HydrophobicContact CD1-CG2 4.35Å; F37-V41 HydrophobicContact CE1-CG2 3.91Å; F37-V41 HydrophobicContact CE2-CG2 4.5Å; F37-V41 HydrophobicContact CZ-CG2 3.99Å; F37-V41 PolarHBondContact O-N 2.94Å; L38-V41 PolarHBondContact O-N 2.79Å; V41-T44 PolarHBondContact O-OG1 2.87Å; V41-T44 VanDerWaalsContact O-OG1 3.09Å; V41-M45 WeakPolarHBondContact O-CG 3.22Å; V41-M45 PolarHBondContact O-N 3.34Å
42	Y	88.8	Confident	86.4	Confident	12 Å²	12	65.7 Å²	65.7	5%	0.047	35%	0.354	C	S	.	.	H	α-helix	trans	-60.4	-49.5	178.8	172	-118.6	0	0	0	112.5	A24 P25 I28 L38 M39 T44 M45 V46 F388 Q412	A24-Y42 HydrophobicContact CB-CE2 4.05Å; P25-Y42 HydrophobicContact CB-CE1 4.42Å; I28-Y42 HydrophobicContact CD1-CD2 3.8Å; I28-Y42 HydrophobicContact CD1-CG 4Å; L38-Y42 WeakPolarHBondContact O-CB 3.49Å; L38-Y42 PolarHBondContact O-N 3.41Å; M39-Y42 PolarHBondContact O-N 3.28Å; Y42-T44 PolarHBondContact O-N 3.45Å; Y42-M45 PolarHBondContact O-N 2.77Å; Y42-V46 HydrophobicContact CD2-CG2 4.13Å; Y42-V46 HydrophobicContact CE2-CG2 3.63Å; Y42-V46 WeakPolarHBondContact O-CG2 3.41Å; Y42-V46 PolarHBondContact O-N 3.41Å; Y42-F388 HydrophobicContact CD1-CD2 4Å; Y42-Q412 PolarHBondContact OH-NE2 2.91Å
43	S	89.5	Confident	86.8	Confident	10 Å²	10	61 Å²	61	7%	0.07	34%	0.336	C	S	.	.	H	α-helix	trans	-68	-35.9	-177.2	55.9	0	0	0	0	113.1	M39 T40 G47 S384	M39-S43 WeakPolarHBondContact O-CB 3.23Å; M39-S43 PolarHBondContact O-N 2.83Å; M39-S43 PolarHBondContact O-OG 3.23Å; T40-S43 PolarHBondContact O-OG 2.9Å; S43-G47 PolarHBondContact O-N 3.35Å; S43-S384 WeakPolarHBondContact CA-OG 3.26Å; S43-S384 VanDerWaalsContact CB-OG 3.24Å; S43-S384 WeakPolarHBondContact CB-OG 3.41Å
44	T	89.6	Confident	87.3	Confident	73 Å²	73	55.6 Å²	55.6	45%	0.448	30%	0.302	S	S	.	.	H	α-helix	trans	-69.3	-39.2	172.9	53.1	0	0	0	0	112.3	T40 V41 Y42 G47 I48	T40-T44 HydrophobicContact CG2-CG2 4.39Å; T40-T44 WeakPolarHBondContact O-CB 3.27Å; T40-T44 VanDerWaalsContact O-CG2 3.26Å; T40-T44 WeakPolarHBondContact O-CG2 3.48Å; T40-T44 PolarHBondContact O-N 2.72Å; T40-T44 PolarHBondContact O-OG1 2.91Å; V41-T44 PolarHBondContact O-OG1 2.87Å; V41-T44 VanDerWaalsContact O-OG1 3.09Å; Y42-T44 PolarHBondContact O-N 3.45Å; T44-G47 PolarHBondContact O-N 3.46Å; T44-I48 VanDerWaalsContact O-CG1 3.3Å; T44-I48 WeakPolarHBondContact O-CG1 3.4Å; T44-I48 PolarHBondContact O-N 3.48Å
45	M	89.8	Confident	87.7	Confident	121 Å²	121	55.9 Å²	55.9	60%	0.596	31%	0.306	S	S	*	.	H	α-helix	trans	-62.4	-43.9	174.1	-73.4	-149.8	78.6	0	0	112.3	V41 Y42 G47 I48 V49	V41-M45 WeakPolarHBondContact O-CG 3.22Å; V41-M45 PolarHBondContact O-N 3.34Å; Y42-M45 PolarHBondContact O-N 2.77Å; M45-G47 VanDerWaalsContact C-N 3.34Å; M45-G47 PolarHBondContact O-N 2.88Å; M45-I48 PolarHBondContact O-N 2.92Å; M45-V49 WeakPolarHBondContact O-CG2 3.31Å; M45-V49 PolarHBondContact O-N 3.08Å
46	V	89.1	Confident	87.9	Confident	11 Å²	11	56.1 Å²	56.1	7%	0.067	31%	0.306	C	S	.	.	H	α-helix	trans	-59.2	-46.1	173.3	172.4	0	0	0	0	110.5	Y42 I48 V49 F50 A380	Y42-V46 HydrophobicContact CD2-CG2 4.13Å; Y42-V46 HydrophobicContact CE2-CG2 3.63Å; Y42-V46 WeakPolarHBondContact O-CG2 3.41Å; Y42-V46 PolarHBondContact O-N 3.41Å; V46-I48 PolarHBondContact O-N 3.45Å; V46-V49 PolarHBondContact O-N 2.89Å; V46-F50 HydrophobicContact CG1-CD2 3.93Å; V46-F50 HydrophobicContact CG1-CE2 4.11Å; V46-F50 WeakPolarHBondContact O-CD2 3.28Å; V46-F50 PolarHBondContact O-N 3.48Å; V46-A380 HydrophobicContact CG1-CB 4.43Å
47	G	89.6	Confident	88	Confident	8 Å²	8	51.7 Å²	51.7	8%	0.082	28%	0.28	C	S	.	.	H	α-helix	trans	-56.6	-47.7	176.3	0	0	0	0	0	113.3	S43 T44 M45 F50 V51	S43-G47 PolarHBondContact O-N 3.35Å; T44-G47 PolarHBondContact O-N 3.46Å; M45-G47 VanDerWaalsContact C-N 3.34Å; M45-G47 PolarHBondContact O-N 2.88Å; G47-F50 PolarHBondContact O-N 3.39Å; G47-V51 VanDerWaalsContact O-CG2 3.31Å; G47-V51 WeakPolarHBondContact O-CG2 3.45Å; G47-V51 PolarHBondContact O-N 2.94Å
48	I	90.9	Very high	88	Confident	97 Å²	97	46.7 Å²	46.7	50%	0.497	26%	0.256	S	S	.	.	H	α-helix	trans	-61.1	-46.1	178.9	-69.9	163.2	0	0	0	111.3	T44 M45 V46 F50 V51 I52	T44-I48 VanDerWaalsContact O-CG1 3.3Å; T44-I48 WeakPolarHBondContact O-CG1 3.4Å; T44-I48 PolarHBondContact O-N 3.48Å; M45-I48 PolarHBondContact O-N 2.92Å; V46-I48 PolarHBondContact O-N 3.45Å; I48-F50 PolarHBondContact O-N 3.49Å; I48-V51 PolarHBondContact O-N 2.84Å; I48-I52 HydrophobicContact CG2-CD1 3.7Å; I48-I52 HydrophobicContact CG2-CG1 4.46Å; I48-I52 WeakPolarHBondContact O-CG1 3.32Å; I48-I52 PolarHBondContact O-N 2.94Å
49	V	89	Confident	87.9	Confident	69 Å²	69	49.7 Å²	49.7	42%	0.418	27%	0.272	S	S	.	.	H	α-helix	trans	-59.8	-47.3	177.7	170.8	0	0	0	0	110.8	M45 V46 I52 T53	M45-V49 WeakPolarHBondContact O-CG2 3.31Å; M45-V49 PolarHBondContact O-N 3.08Å; V46-V49 PolarHBondContact O-N 2.89Å; V49-I52 PolarHBondContact O-N 3.42Å; V49-T53 WeakPolarHBondContact O-CB 3.31Å; V49-T53 PolarHBondContact O-N 3.5Å; V49-T53 PolarHBondContact O-OG1 2.97Å; V49-T53 VanDerWaalsContact O-OG1 3.11Å
50	F	90.1	Very high	87.8	Confident	1 Å²	1	49.9 Å²	49.9	0%	0.004	27%	0.273	C	S	.	.	H	α-helix	trans	-64.1	-41.6	178.7	-90.3	-98.5	0	0	0	112.7	L21 V46 G47 I48 K54 V377 A380 Q412 L415 L416	L21-F50 HydrophobicContact CD2-CE2 4.21Å; V46-F50 HydrophobicContact CG1-CD2 3.93Å; V46-F50 HydrophobicContact CG1-CE2 4.11Å; V46-F50 WeakPolarHBondContact O-CD2 3.28Å; V46-F50 PolarHBondContact O-N 3.48Å; G47-F50 PolarHBondContact O-N 3.39Å; I48-F50 PolarHBondContact O-N 3.49Å; F50-K54 VanDerWaalsContact O-CB 3.27Å; F50-K54 WeakPolarHBondContact O-CB 3.47Å; F50-K54 PolarHBondContact O-N 3.26Å; F50-V377 HydrophobicContact CB-CG2 4.36Å; F50-A380 HydrophobicContact CB-CB 4.47Å; F50-A380 HydrophobicContact CD1-CB 3.81Å; F50-A380 HydrophobicContact CD2-CB 3.93Å; F50-A380 HydrophobicContact CE1-CB 3.97Å; F50-A380 HydrophobicContact CE2-CB 4.08Å; F50-A380 HydrophobicContact CG-CB 3.78Å; F50-A380 HydrophobicContact CZ-CB 4.11Å; F50-Q412 HydrophobicContact CZ-CB 4.24Å; F50-Q412 WeakPolarHBondContact CZ-O 3.45Å; F50-L415 HydrophobicContact CE1-CB 3.91Å; F50-L416 HydrophobicContact CD1-CD2 3.88Å; F50-L416 HydrophobicContact CD1-CG 4.46Å; F50-L416 HydrophobicContact CE1-CD1 4.38Å; F50-L416 HydrophobicContact CE1-CD2 3.54Å; F50-L416 HydrophobicContact CE1-CG 3.63Å; F50-L416 HydrophobicContact CZ-CD1 4.11Å; F50-L416 HydrophobicContact CZ-CD2 4.08Å; F50-L416 HydrophobicContact CZ-CG 3.81Å
51	V	90.3	Very high	87.5	Confident	65 Å²	65	47.1 Å²	47.1	39%	0.394	26%	0.256	S	S	.	.	H	α-helix	trans	-58.5	-51.5	174.2	169.3	0	0	0	0	110.7	G47 I48 T55 V377	G47-V51 VanDerWaalsContact O-CG2 3.31Å; G47-V51 WeakPolarHBondContact O-CG2 3.45Å; G47-V51 PolarHBondContact O-N 2.94Å; I48-V51 PolarHBondContact O-N 2.84Å; V51-T55 HydrophobicContact CG1-CG2 4.3Å; V51-T55 VanDerWaalsContact O-CB 3.29Å; V51-T55 WeakPolarHBondContact O-CB 3.4Å; V51-T55 VanDerWaalsContact O-CG2 3.25Å; V51-T55 WeakPolarHBondContact O-CG2 3.18Å; V51-T55 PolarHBondContact O-N 3.28Å; V51-T55 PolarHBondContact O-OG1 3.49Å; V51-V377 HydrophobicContact CG2-CB 4.36Å; V51-V377 HydrophobicContact CG2-CG1 3.6Å; V51-V377 HydrophobicContact CG2-CG2 3.8Å
52	I	90.5	Very high	87.1	Confident	90 Å²	90	49.8 Å²	49.8	46%	0.462	26%	0.261	S	S	.	.	H	α-helix	trans	-62.8	-51.7	-177.8	-67.2	169.5	0	0	0	110.7	I48 V49 K54 T55 I56	I48-I52 HydrophobicContact CG2-CD1 3.7Å; I48-I52 HydrophobicContact CG2-CG1 4.46Å; I48-I52 WeakPolarHBondContact O-CG1 3.32Å; I48-I52 PolarHBondContact O-N 2.94Å; V49-I52 PolarHBondContact O-N 3.42Å; I52-K54 PolarHBondContact O-N 3.48Å; I52-T55 PolarHBondContact O-OG1 3.36Å; I52-T55 VanDerWaalsContact O-OG1 3.13Å; I52-I56 HydrophobicContact CG2-CD1 3.78Å; I52-I56 WeakPolarHBondContact O-CD1 3.42Å; I52-I56 VanDerWaalsContact O-CG1 3.27Å; I52-I56 WeakPolarHBondContact O-CG1 3.22Å; I52-I56 PolarHBondContact O-N 2.98Å; I52-I56 VanDerWaalsContact O-N 3.1Å
53	T	86.9	Confident	86.6	Confident	27 Å²	27	50 Å²	50	17%	0.166	26%	0.263	C	S	.	.	H	α-helix	trans	-60.8	-47.7	-178.6	-57.7	0	0	0	0	111.6	V49 I56 V57 F364 L416	V49-T53 WeakPolarHBondContact O-CB 3.31Å; V49-T53 PolarHBondContact O-N 3.5Å; V49-T53 PolarHBondContact O-OG1 2.97Å; V49-T53 VanDerWaalsContact O-OG1 3.11Å; T53-I56 PolarHBondContact O-N 3.33Å; T53-V57 VanDerWaalsContact O-CG2 3.29Å; T53-V57 WeakPolarHBondContact O-CG2 3.48Å; T53-V57 PolarHBondContact O-N 2.77Å; T53-F364 HydrophobicContact CG2-CD1 4.35Å; T53-F364 HydrophobicContact CG2-CE1 3.76Å; T53-F364 HydrophobicContact CG2-CE2 4.07Å; T53-F364 HydrophobicContact CG2-CZ 3.59Å; T53-L416 HydrophobicContact CG2-CD2 4.14Å
54	K	88.3	Confident	85.9	Confident	4 Å²	4	50 Å²	50	2%	0.017	26%	0.262	C	S	.	.	H	α-helix	trans	-75.3	-31.2	-175.9	-73.5	-80.5	-171.5	150.3	0	113.6	F50 I52 V57 W58 N367 L373 D376 L415 L416	F50-K54 VanDerWaalsContact O-CB 3.27Å; F50-K54 WeakPolarHBondContact O-CB 3.47Å; F50-K54 PolarHBondContact O-N 3.26Å; I52-K54 PolarHBondContact O-N 3.48Å; K54-V57 PolarHBondContact O-N 2.96Å; K54-W58 WeakPolarHBondContact O-CB 3.47Å; K54-W58 PolarHBondContact O-N 3.19Å; K54-N367 PolarHBondContact NZ-OD1 2.89Å; K54-L373 HydrophobicContact CB-CD1 3.32Å; K54-L373 HydrophobicContact CG-CD1 4.37Å; K54-D376 WeakPolarHBondContact CE-OD2 3.28Å; K54-D376 IonicContact NZ-OD2 2.59Å; K54-D376 PolarHBondContact NZ-OD2 2.75Å; K54-L415 WeakPolarHBondContact CE-O 3.35Å; K54-L415 PolarHBondContact NZ-O 3.47Å; K54-L416 HydrophobicContact CG-CD2 4.5Å
55	T	86.5	Confident	85.1	Confident	52 Å²	52	50.4 Å²	50.4	32%	0.319	26%	0.261	S	S	.	.	H	α-helix	trans	-68.1	-38.4	172.4	51.9	0	0	0	0	112	V51 I52 W58 L59 L373	V51-T55 HydrophobicContact CG1-CG2 4.3Å; V51-T55 VanDerWaalsContact O-CB 3.29Å; V51-T55 WeakPolarHBondContact O-CB 3.4Å; V51-T55 VanDerWaalsContact O-CG2 3.25Å; V51-T55 WeakPolarHBondContact O-CG2 3.18Å; V51-T55 PolarHBondContact O-N 3.28Å; V51-T55 PolarHBondContact O-OG1 3.49Å; I52-T55 PolarHBondContact O-OG1 3.36Å; I52-T55 VanDerWaalsContact O-OG1 3.13Å; T55-W58 PolarHBondContact O-N 2.84Å; T55-L59 VanDerWaalsContact O-CB 3.29Å; T55-L59 WeakPolarHBondContact O-CB 3.3Å; T55-L59 PolarHBondContact O-N 2.89Å; T55-L373 HydrophobicContact CG2-CD2 4.1Å
56	I	86.2	Confident	84.3	Confident	89 Å²	89	50.2 Å²	50.2	46%	0.456	26%	0.257	S	S	.	.	H	α-helix	trans	-62.5	-46.5	172.1	-68.6	168	0	0	0	110.9	I52 T53 W58 L59 L60	I52-I56 HydrophobicContact CG2-CD1 3.78Å; I52-I56 WeakPolarHBondContact O-CD1 3.42Å; I52-I56 VanDerWaalsContact O-CG1 3.27Å; I52-I56 WeakPolarHBondContact O-CG1 3.22Å; I52-I56 PolarHBondContact O-N 2.98Å; I52-I56 VanDerWaalsContact O-N 3.1Å; T53-I56 PolarHBondContact O-N 3.33Å; I56-W58 VanDerWaalsContact C-N 3.34Å; I56-W58 PolarHBondContact O-N 3.47Å; I56-L59 PolarHBondContact O-N 3.09Å; I56-L60 HydrophobicContact CG2-CD1 3.87Å; I56-L60 HydrophobicContact CG2-CG 4.38Å; I56-L60 WeakPolarHBondContact O-CB 3.43Å; I56-L60 WeakPolarHBondContact O-CG 3.32Å; I56-L60 PolarHBondContact O-N 3.49Å
57	V	85.2	Confident	83.4	Confident	3 Å²	3	52.9 Å²	52.9	2%	0.018	27%	0.266	C	S	.	.	H	α-helix	trans	-61.2	-41.7	177.1	171.4	0	0	0	0	111.6	T53 K54 N61 L360 F364	T53-V57 VanDerWaalsContact O-CG2 3.29Å; T53-V57 WeakPolarHBondContact O-CG2 3.48Å; T53-V57 PolarHBondContact O-N 2.77Å; K54-V57 PolarHBondContact O-N 2.96Å; V57-N61 PolarHBondContact O-N 3.36Å; V57-N61 VanDerWaalsContact O-N 3.08Å; V57-N61 PolarHBondContact O-ND2 3.22Å; V57-L360 HydrophobicContact CG2-CD1 4.29Å; V57-F364 HydrophobicContact CG1-CB 4.04Å; V57-F364 HydrophobicContact CG2-CB 3.7Å; V57-F364 HydrophobicContact CG2-CD2 3.45Å; V57-F364 VanDerWaalsContact CG2-CD2 3.45Å; V57-F364 HydrophobicContact CG2-CE2 4.23Å; V57-F364 HydrophobicContact CG2-CG 3.7Å
58	W	84	Confident	82.2	Confident	59 Å²	59	60.7 Å²	60.7	22%	0.223	30%	0.301	C	S	.	.	H	α-helix	trans	-64.4	-47.1	175.8	178.7	84.3	0	0	0	111.8	K54 T55 I56 L60 N61 Y62 W370	K54-W58 WeakPolarHBondContact O-CB 3.47Å; K54-W58 PolarHBondContact O-N 3.19Å; T55-W58 PolarHBondContact O-N 2.84Å; I56-W58 VanDerWaalsContact C-N 3.34Å; I56-W58 PolarHBondContact O-N 3.47Å; W58-L60 PolarHBondContact O-N 3.45Å; W58-N61 PolarHBondContact O-N 3.45Å; W58-Y62 HydrophobicContact CH2-CG 4.45Å; W58-Y62 PolarHBondContact O-N 3.36Å; W58-W370 HydrophobicContact CD2-CH2 4.35Å; W58-W370 HydrophobicContact CD2-CZ2 4.26Å; W58-W370 AromaticContact CE2-CZ2 3.93Å; W58-W370 HydrophobicContact CE3-CH2 4.02Å; W58-W370 HydrophobicContact CE3-CZ2 4.11Å; W58-W370 HydrophobicContact CH2-CH2 4.07Å; W58-W370 AromaticContact CH2-CZ2 3.37Å; W58-W370 HydrophobicContact CH2-CZ2 3.37Å; W58-W370 AromaticContact CZ2-CE2 3.77Å; W58-W370 HydrophobicContact CZ2-CH2 4.34Å; W58-W370 AromaticContact CZ2-CZ2 3.49Å; W58-W370 HydrophobicContact CZ2-CZ2 3.49Å; W58-W370 VanDerWaalsContact CZ2-CZ2 3.49Å; W58-W370 AromaticContact CZ2-NE1 3.87Å; W58-W370 AromaticContact CZ3-CH2 3.88Å; W58-W370 HydrophobicContact CZ3-CH2 3.88Å; W58-W370 AromaticContact CZ3-CZ2 3.68Å; W58-W370 HydrophobicContact CZ3-CZ2 3.68Å
59	L	83.4	Confident	80.9	Confident	95 Å²	95	59.6 Å²	59.6	50%	0.497	30%	0.3	S	S	.	.	H	α-helix	trans	-62.7	-42.5	179.9	-179.4	62.6	0	0	0	111.9	T55 I56 Y62 V63	T55-L59 VanDerWaalsContact O-CB 3.29Å; T55-L59 WeakPolarHBondContact O-CB 3.3Å; T55-L59 PolarHBondContact O-N 2.89Å; I56-L59 PolarHBondContact O-N 3.09Å; L59-Y62 PolarHBondContact O-N 3.01Å; L59-V63 WeakPolarHBondContact O-CB 3.39Å; L59-V63 WeakPolarHBondContact O-CG2 3.35Å; L59-V63 PolarHBondContact O-N 2.92Å
60	L	81.8	Confident	79.4	Confident	35 Å²	35	58.4 Å²	58.4	18%	0.183	30%	0.295	C	S	.	.	H	α-helix	trans	-65	-40.5	175.6	-72.1	171.6	0	0	0	112	I56 W58 V63 F64 I353 L360	I56-L60 HydrophobicContact CG2-CD1 3.87Å; I56-L60 HydrophobicContact CG2-CG 4.38Å; I56-L60 WeakPolarHBondContact O-CB 3.43Å; I56-L60 WeakPolarHBondContact O-CG 3.32Å; I56-L60 PolarHBondContact O-N 3.49Å; W58-L60 PolarHBondContact O-N 3.45Å; L60-V63 WeakPolarHBondContact O-CB 3.5Å; L60-V63 PolarHBondContact O-N 3.08Å; L60-F64 HydrophobicContact CB-CE2 4.22Å; L60-F64 WeakPolarHBondContact O-CD2 3.25Å; L60-F64 WeakPolarHBondContact O-CG 3.46Å; L60-F64 PolarHBondContact O-N 3.4Å; L60-I353 HydrophobicContact CD2-CD1 4.09Å; L60-L360 HydrophobicContact CB-CD2 3.54Å; L60-L360 HydrophobicContact CD1-CD1 4.22Å; L60-L360 HydrophobicContact CD1-CD2 4.2Å
61	N	80.6	Confident	77.8	Confident	13 Å²	13	62.9 Å²	62.9	7%	0.07	32%	0.319	C	S	.	.	H	α-helix	trans	-64.5	-40.2	173.5	-84.5	-89.5	0	0	0	112	V57 W58 V63 F64 D65 L360	V57-N61 PolarHBondContact O-N 3.36Å; V57-N61 VanDerWaalsContact O-N 3.08Å; V57-N61 PolarHBondContact O-ND2 3.22Å; W58-N61 PolarHBondContact O-N 3.45Å; N61-V63 VanDerWaalsContact C-N 3.32Å; N61-V63 PolarHBondContact O-N 2.86Å; N61-F64 PolarHBondContact O-N 2.81Å; N61-D65 WeakPolarHBondContact O-CB 3.48Å; N61-D65 PolarHBondContact O-N 2.9Å; N61-L360 WeakPolarHBondContact ND2-CD2 3.2Å
62	Y	79.6	Confident	75.8	Confident	112 Å²	112	63.2 Å²	63.2	44%	0.439	32%	0.316	S	S	.	.	H	α-helix	trans	-63.3	-37.1	174.4	176.4	-98.8	0	0	0	112.2	W58 L59 K66	W58-Y62 HydrophobicContact CH2-CG 4.45Å; W58-Y62 PolarHBondContact O-N 3.36Å; L59-Y62 PolarHBondContact O-N 3.01Å; Y62-K66 HydrophobicContact CE1-CD 4.02Å; Y62-K66 VanDerWaalsContact O-CB 3.26Å; Y62-K66 WeakPolarHBondContact O-CB 3.41Å; Y62-K66 PolarHBondContact O-N 3.23Å
63	V	77.3	Confident	73.3	Confident	15 Å²	15	65.2 Å²	65.2	9%	0.091	33%	0.327	C	S	.	.	H	α-helix	trans	-64.4	-49.1	172.2	161.1	0	0	0	0	111.3	L59 L60 N61 D65 K66 Y67 V339 I353	L59-V63 WeakPolarHBondContact O-CB 3.39Å; L59-V63 WeakPolarHBondContact O-CG2 3.35Å; L59-V63 PolarHBondContact O-N 2.92Å; L60-V63 WeakPolarHBondContact O-CB 3.5Å; L60-V63 PolarHBondContact O-N 3.08Å; N61-V63 VanDerWaalsContact C-N 3.32Å; N61-V63 PolarHBondContact O-N 2.86Å; V63-D65 VanDerWaalsContact C-N 3.25Å; V63-D65 PolarHBondContact O-N 3.39Å; V63-K66 PolarHBondContact O-N 3.32Å; V63-Y67 HydrophobicContact CB-CD2 4.46Å; V63-Y67 HydrophobicContact CG1-CD2 4.04Å; V63-Y67 WeakPolarHBondContact O-CD2 3.45Å; V63-Y67 PolarHBondContact O-N 2.94Å; V63-V339 HydrophobicContact CG1-CG2 3.5Å; V63-I353 HydrophobicContact CG1-CD1 4.34Å
64	F	74.8	Confident	70.9	Confident	10 Å²	10	67.9 Å²	67.9	4%	0.044	35%	0.345	C	S	.	.	H	α-helix	trans	-70.3	-16.1	179.4	-59.5	-36.5	0	0	0	114.4	L60 N61 Y337 I353 F355 R357 L360	L60-F64 HydrophobicContact CB-CE2 4.22Å; L60-F64 WeakPolarHBondContact O-CD2 3.25Å; L60-F64 WeakPolarHBondContact O-CG 3.46Å; L60-F64 PolarHBondContact O-N 3.4Å; N61-F64 PolarHBondContact O-N 2.81Å; F64-Y337 AromaticContact CD1-CD1 3.86Å; F64-Y337 HydrophobicContact CD1-CD1 3.86Å; F64-Y337 AromaticContact CD1-CD2 3.83Å; F64-Y337 HydrophobicContact CD1-CD2 3.83Å; F64-Y337 AromaticContact CD1-CE1 3.85Å; F64-Y337 HydrophobicContact CD1-CE1 3.85Å; F64-Y337 AromaticContact CD1-CE2 3.83Å; F64-Y337 HydrophobicContact CD1-CE2 3.83Å; F64-Y337 AromaticContact CD1-CG 3.84Å; F64-Y337 HydrophobicContact CD1-CG 3.84Å; F64-Y337 AromaticContact CD1-CZ 3.83Å; F64-Y337 HydrophobicContact CE1-CD1 4.32Å; F64-Y337 AromaticContact CE1-CD2 3.48Å; F64-Y337 HydrophobicContact CE1-CD2 3.48Å; F64-Y337 VanDerWaalsContact CE1-CD2 3.48Å; F64-Y337 HydrophobicContact CE1-CE1 4.49Å; F64-Y337 AromaticContact CE1-CE2 3.71Å; F64-Y337 HydrophobicContact CE1-CE2 3.71Å; F64-Y337 AromaticContact CE1-CG 3.82Å; F64-Y337 HydrophobicContact CE1-CG 3.82Å; F64-I353 HydrophobicContact CE1-CG2 4.39Å; F64-I353 HydrophobicContact CZ-CG2 4.45Å; F64-F355 WeakPolarHBondContact CE1-O 3.37Å; F64-F355 WeakPolarHBondContact CZ-O 3.25Å; F64-R357 HydrophobicContact CB-CG 4.41Å; F64-R357 HydrophobicContact CD2-CB 4.05Å; F64-R357 HydrophobicContact CD2-CG 4.18Å; F64-R357 HydrophobicContact CE2-CB 4.5Å; F64-R357 HydrophobicContact CG-CB 4.37Å; F64-R357 PolarHBondContact O-NH1 3.47Å; F64-L360 HydrophobicContact CD2-CD2 4.14Å; F64-L360 HydrophobicContact CE2-CB 4.24Å; F64-L360 HydrophobicContact CE2-CD2 3.71Å
65	D	73.3	Confident	68.3	Low	83 Å²	83	76.2 Å²	76.2	44%	0.444	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.5	-6.2	169.8	-79.4	-18.5	0	0	0	113.1	N61 V63 R357 R366	N61-D65 WeakPolarHBondContact O-CB 3.48Å; N61-D65 PolarHBondContact O-N 2.9Å; V63-D65 VanDerWaalsContact C-N 3.25Å; V63-D65 PolarHBondContact O-N 3.39Å; D65-R357 IonicContact OD1-CZ 2.88Å; D65-R357 IonicContact OD1-NH1 3.8Å; D65-R357 PolarHBondContact OD1-NH1 2.95Å; D65-R357 IonicContact OD1-NH2 3.18Å; D65-R357 PolarHBondContact OD1-NH2 2.94Å; D65-R357 IonicContact OD2-NH2 3.36Å; D65-R366 IonicContact OD1-NH1 2.7Å; D65-R366 IonicContact OD2-CZ 3.53Å; D65-R366 IonicContact OD2-NH1 2.84Å; D65-R366 PolarHBondContact OD2-NH1 3.27Å; D65-R366 IonicContact OD2-NH2 3.63Å; D65-R366 PolarHBondContact OD2-NH2 2.96Å
66	K	73.3	Confident	65.8	Low	117 Å²	117	79 Å²	79	51%	0.509	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.1	-28.4	-175.8	-177.2	172.2	-179.6	178.1	0	114.5	Y62 V63	Y62-K66 HydrophobicContact CE1-CD 4.02Å; Y62-K66 VanDerWaalsContact O-CB 3.26Å; Y62-K66 WeakPolarHBondContact O-CB 3.41Å; Y62-K66 PolarHBondContact O-N 3.23Å; V63-K66 PolarHBondContact O-N 3.32Å
67	Y	70.1	Confident	63.2	Low	66 Å²	66	79.1 Å²	79.1	26%	0.259	42%	0.416	S	S	.	.	S	Bend	trans	-121	129.2	-175.9	-59.2	-75	0	0	0	111.1	V63 Y337 V339 P340	V63-Y67 HydrophobicContact CB-CD2 4.46Å; V63-Y67 HydrophobicContact CG1-CD2 4.04Å; V63-Y67 WeakPolarHBondContact O-CD2 3.45Å; V63-Y67 PolarHBondContact O-N 2.94Å; Y67-Y337 WeakPolarHBondContact O-CD1 3.42Å; Y67-V339 HydrophobicContact CD2-CG1 4.33Å; Y67-V339 HydrophobicContact CD2-CG2 4.47Å; Y67-V339 HydrophobicContact CE2-CG1 3.88Å; Y67-P340 VanDerWaalsContact CE1-CD 3.48Å; Y67-P340 HydrophobicContact CE1-CG 3.78Å
68	E	63.5	Low	60.6	Low	172 Å²	172	83.5 Å²	83.5	80%	0.804	44%	0.443	S	S	*	.	P	Polyproline II helix	trans	-70.4	150.2	176	-67.1	-174.3	149.1	0	0	111.7
69	P	64	Low	58	Low	75 Å²	75	87.8 Å²	87.8	49%	0.487	47%	0.468	S	S	.	.	P	Polyproline II helix	trans	-63.5	134.9	176.4	25.8	-34.2	0	0	0	111.5	V335 Y337	P69-V335 HydrophobicContact CB-CG1 3.42Å; P69-V335 VanDerWaalsContact CB-CG1 3.42Å; P69-Y337 HydrophobicContact CB-CE1 4.14Å
70	S	58.6	Low	55.4	Low	43 Å²	43	87.8 Å²	87.8	30%	0.301	47%	0.472	S	S	.	.	B	Isolated β-bridge	trans	-94	119.9	169.6	-51.4	0	0	0	0	109.4	E72 C336 S338	S70-E72 PolarHBondContact O-N 2.8Å; S70-C336 WeakPolarHBondContact CA-O 3.32Å; S70-C336 VanDerWaalsContact CB-O 3.27Å; S70-C336 WeakPolarHBondContact CB-O 3.46Å; S70-C336 PolarHBondContact N-O 3.21Å; S70-C336 PolarHBondContact O-N 3.26Å; S70-S338 PolarHBondContact OG-OG 2.94Å
71	D	54.8	Low	52.9	Low	96 Å²	96	92.3 Å²	92.3	51%	0.513	50%	0.501	S	S	.	.			trans	-76.3	101.6	178.4	-117.9	29.1	0	0	0	109.9	L73 K333	D71-L73 PolarHBondContact O-N 3.33Å; D71-L73 VanDerWaalsContact O-N 3.14Å; D71-K333 IonicContact OD2-NZ 3.67Å; D71-K333 PolarHBondContact OD2-NZ 2.86Å
72	E	49.1	Very low	50.4	Low	72 Å²	72	97.7 Å²	97.7	34%	0.336	53%	0.53	S	S	.	.			trans	-76.1	97.2	167.5	-70.3	-166.1	157.5	0	0	109.5	S70 C336 K352 H354	S70-E72 PolarHBondContact O-N 2.8Å; E72-C336 HydrophobicContact CG-CB 4.02Å; E72-K352 WeakPolarHBondContact OE1-CD 3.37Å; E72-K352 VanDerWaalsContact OE1-CE 3.27Å; E72-K352 WeakPolarHBondContact OE1-CE 3.36Å; E72-K352 IonicContact OE1-NZ 2.8Å; E72-K352 PolarHBondContact OE1-NZ 2.96Å; E72-H354 IonicContact OE2-NE2 2.68Å
73	L	39	Very low	48	Very low	131 Å²	131	100.3 Å²	100.3	69%	0.686	55%	0.551	S	S	*	*			trans	-56.9	132.9	158.6	-75.6	165.2	0	0	0	108.6	D71 M75	D71-L73 PolarHBondContact O-N 3.33Å; D71-L73 VanDerWaalsContact O-N 3.14Å; L73-M75 PolarHBondContact O-N 3.23Å
74	P	36.6	Very low	45.7	Very low	83 Å²	83	105.8 Å²	105.8	54%	0.539	59%	0.589	S	S	.	*			trans	-64.8	126	179.2	26.7	-33.5	0	0	0	109.9	S76 S77	P74-S76 PolarHBondContact O-N 2.87Å; P74-S77 PolarHBondContact O-OG 3.26Å
75	M	33.1	Very low	43.5	Very low	180 Å²	180	112 Å²	112	89%	0.887	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75	46.3	174.9	-63.5	-155.8	-49.1	0	0	112.6	L73	L73-M75 PolarHBondContact O-N 3.23Å
76	S	34.2	Very low	41.3	Very low	109 Å²	109	114.5 Å²	114.5	76%	0.762	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.9	2.6	167.3	59.7	0	0	0	0	112.1	P74	P74-S76 PolarHBondContact O-N 2.87Å
77	S	31	Very low	39.1	Very low	92 Å²	92	116.9 Å²	116.9	64%	0.643	65%	0.645	S	S	*	*	S	Bend	trans	-127.9	4.8	178.1	58.7	0	0	0	0	114.3	P74	P74-S77 PolarHBondContact O-OG 3.26Å
78	V	31.2	Very low	37.2	Very low	95 Å²	95	120.7 Å²	120.7	58%	0.576	67%	0.67	S	S	*	*			trans	-105	92.5	173	-176.4	0	0	0	0	108.5	V80	V78-V80 HydrophobicContact CG1-CG2 4.22Å; V78-V80 PolarHBondContact O-N 2.61Å; V78-V80 VanDerWaalsContact O-N 3.17Å
79	I	28.6	Very low	36	Very low	149 Å²	149	116.2 Å²	116.2	76%	0.764	67%	0.671	S	S	*	*			trans	-69.6	107.3	160.3	-61.3	177.9	0	0	0	106.2	V81	I79-V81 HydrophobicContact CG2-CG2 3.9Å; I79-V81 PolarHBondContact O-N 3.49Å; I79-V81 VanDerWaalsContact O-N 3.12Å
80	V	28.5	Very low	34.6	Very low	96 Å²	96	119 Å²	119	58%	0.582	69%	0.686	S	S	*	*			trans	-70.8	102.3	163.9	-178.7	0	0	0	0	106.4	V78 D82	V78-V80 HydrophobicContact CG1-CG2 4.22Å; V78-V80 PolarHBondContact O-N 2.61Å; V78-V80 VanDerWaalsContact O-N 3.17Å; V80-D82 HydrophobicContact CG1-CB 4.41Å; V80-D82 WeakPolarHBondContact CG1-OD1 3.06Å; V80-D82 PolarHBondContact O-N 3.35Å; V80-D82 VanDerWaalsContact O-N 3.09Å
81	V	29.8	Very low	33.8	Very low	129 Å²	129	121.7 Å²	121.7	78%	0.782	70%	0.703	S	S	*	*			trans	-79.7	80.7	165.2	-175.5	0	0	0	0	106.6	I79	I79-V81 HydrophobicContact CG2-CG2 3.9Å; I79-V81 PolarHBondContact O-N 3.49Å; I79-V81 VanDerWaalsContact O-N 3.12Å
82	D	27.8	Very low	33	Very low	127 Å²	127	126.1 Å²	126.1	68%	0.679	72%	0.717	S	S	*	*			trans	-63.9	158	166	-82.3	-36.5	0	0	0	110	V80 C84	V80-D82 HydrophobicContact CG1-CB 4.41Å; V80-D82 WeakPolarHBondContact CG1-OD1 3.06Å; V80-D82 PolarHBondContact O-N 3.35Å; V80-D82 VanDerWaalsContact O-N 3.09Å; D82-C84 PolarHBondContact O-N 2.69Å
83	D	28.5	Very low	32.6	Very low	166 Å²	166	129.8 Å²	129.8	89%	0.888	73%	0.734	S	S	*	*			trans	-49.2	122.7	-166.6	-69.2	-61.2	0	0	0	115
84	C	31	Very low	32.9	Very low	130 Å²	130	129.5 Å²	129.5	88%	0.878	73%	0.729	S	S	*	*			trans	-141.8	134.4	162	-132.9	0	0	0	0	111	D82	D82-C84 PolarHBondContact O-N 2.69Å
85	N	26.8	Very low	33.1	Very low	142 Å²	142	131.8 Å²	131.8	76%	0.759	74%	0.736	S	S	*	*			trans	-94.1	139.4	-161.5	-94.7	-65.6	0	0	0	114.5
86	L	28.5	Very low	33.5	Very low	135 Å²	135	130 Å²	130	71%	0.707	72%	0.723	S	S	*	*			trans	68.5	141.9	148.4	-91.8	81.5	0	0	0	121.4
87	K	27.1	Very low	33.9	Very low	166 Å²	166	130.3 Å²	130.3	72%	0.722	71%	0.713	S	S	*	*			trans	84.8	117.5	146.5	-74.2	173.1	171.2	178.5	0	121.2
88	D	29.7	Very low	34.6	Very low	146 Å²	146	129.4 Å²	129.4	78%	0.781	71%	0.706	S	S	*	*				63.5	89.4	126.8	-47.7	-21.5	0	0	0	119.8
89	G	37.3	Very low	35	Very low	79 Å²	79	130.2 Å²	130.2	81%	0.814	71%	0.705	S	S	*	*			trans	94.9	82	135.7	0	0	0	0	0	118.9
90	V	36.2	Very low	35.8	Very low	134 Å²	134	127.6 Å²	127.6	81%	0.812	69%	0.691	S	S	*	*			trans	-134.4	133.8	162.8	-176.3	0	0	0	0	109.6
91	P	40.3	Very low	36.7	Very low	99 Å²	99	128 Å²	128	64%	0.643	69%	0.687	S	S	*	*			trans	-78.6	155.1	-173.4	30.7	-35.7	0	0	0	114.3	E93	P91-E93 PolarHBondContact O-N 3.03Å
92	K	38.2	Very low	37.3	Very low	188 Å²	188	127.5 Å²	127.5	82%	0.817	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.3	-3.2	-172.3	-71.3	-178.8	175.3	177.1	0	116.3
93	E	42.1	Very low	38.2	Very low	150 Å²	150	126.5 Å²	126.5	70%	0.701	67%	0.669	S	S	*	*	H	α-helix	trans	-79.5	-38.8	-169.8	-63.2	-173.9	128.6	0	0	112.6	P91 L95 K96 E97	P91-E93 PolarHBondContact O-N 3.03Å; E93-L95 VanDerWaalsContact C-N 3.25Å; E93-L95 PolarHBondContact O-N 3.12Å; E93-K96 WeakPolarHBondContact O-CB 3.26Å; E93-K96 PolarHBondContact O-N 3.5Å; E93-E97 PolarHBondContact O-N 3.17Å
94	H	44.9	Very low	39	Very low	125 Å²	125	123 Å²	123	58%	0.579	65%	0.646	S	S	*	*	H	α-helix	trans	-65.2	-29	-179.3	-151.4	47.1	0	0	0	112.9	K96 E97 C98	H94-K96 VanDerWaalsContact C-N 3.29Å; H94-K96 PolarHBondContact O-N 2.94Å; H94-E97 IonicContact CE1-OE2 2.68Å; H94-E97 IonicContact CG-OE2 3.15Å; H94-E97 IonicContact ND1-OE2 3.37Å; H94-E97 PolarHBondContact ND1-OE2 3.46Å; H94-E97 PolarHBondContact O-N 3.47Å; H94-C98 PolarHBondContact O-N 2.98Å; H94-C98 VanDerWaalsContact O-N 3.09Å
95	L	41.2	Very low	40.1	Very low	131 Å²	131	124.9 Å²	124.9	69%	0.686	64%	0.635	S	S	*	*	H	α-helix	trans	-68.5	-26.8	173.6	-162.4	74	0	0	0	112.5	E93 M99	E93-L95 VanDerWaalsContact C-N 3.25Å; E93-L95 PolarHBondContact O-N 3.12Å; L95-M99 WeakPolarHBondContact O-CG 3.42Å; L95-M99 PolarHBondContact O-N 3.32Å
96	K	40.4	Very low	40.9	Very low	142 Å²	142	122.5 Å²	122.5	62%	0.617	62%	0.622	S	S	*	*	H	α-helix	trans	-73.1	-42.3	170.4	-80.9	-178.2	172.6	177.5	0	111.2	E93 H94 M99 I100	E93-K96 WeakPolarHBondContact O-CB 3.26Å; E93-K96 PolarHBondContact O-N 3.5Å; H94-K96 VanDerWaalsContact C-N 3.29Å; H94-K96 PolarHBondContact O-N 2.94Å; K96-M99 PolarHBondContact O-N 2.7Å; K96-I100 HydrophobicContact CB-CD1 4.45Å; K96-I100 WeakPolarHBondContact O-CB 3.42Å; K96-I100 WeakPolarHBondContact O-CD1 3.39Å; K96-I100 VanDerWaalsContact O-CG1 3.24Å; K96-I100 WeakPolarHBondContact O-CG1 3.33Å; K96-I100 PolarHBondContact O-N 3.44Å
97	E	43.7	Very low	41.5	Very low	115 Å²	115	120.8 Å²	120.8	54%	0.537	61%	0.613	S	S	.	*	H	α-helix	trans	-60.4	-49.4	179.7	-65.5	-178.6	130.2	0	0	111.3	E93 H94 M99 I100 E101	E93-E97 PolarHBondContact O-N 3.17Å; H94-E97 IonicContact CE1-OE2 2.68Å; H94-E97 IonicContact CG-OE2 3.15Å; H94-E97 IonicContact ND1-OE2 3.37Å; H94-E97 PolarHBondContact ND1-OE2 3.46Å; H94-E97 PolarHBondContact O-N 3.47Å; E97-M99 PolarHBondContact O-N 3.09Å; E97-I100 PolarHBondContact O-N 3.02Å; E97-I100 VanDerWaalsContact O-N 3.13Å; E97-E101 PolarHBondContact O-N 2.97Å
98	C	44.6	Very low	42.6	Very low	74 Å²	74	118.6 Å²	118.6	50%	0.5	61%	0.605	S	S	.	*	H	α-helix	trans	-57.8	-44.1	175.8	-67.6	0	0	0	0	112.7	H94 I100 E101 E102	H94-C98 PolarHBondContact O-N 2.98Å; H94-C98 VanDerWaalsContact O-N 3.09Å; C98-I100 PolarHBondContact O-N 2.93Å; C98-E101 PolarHBondContact O-N 3.42Å; C98-E102 WeakPolarHBondContact O-CB 3.49Å; C98-E102 PolarHBondContact O-N 2.84Å
99	M	40.2	Very low	43.4	Very low	111 Å²	111	117.5 Å²	117.5	55%	0.547	60%	0.595	S	S	.	*	H	α-helix	trans	-66.2	-35.8	176.2	-74.1	-160.7	-53.5	0	0	113.2	L95 K96 E97 I103	L95-M99 WeakPolarHBondContact O-CG 3.42Å; L95-M99 PolarHBondContact O-N 3.32Å; K96-M99 PolarHBondContact O-N 2.7Å; E97-M99 PolarHBondContact O-N 3.09Å; M99-I103 VanDerWaalsContact O-CB 3.24Å; M99-I103 WeakPolarHBondContact O-CB 3.4Å; M99-I103 WeakPolarHBondContact O-CD1 3.46Å; M99-I103 WeakPolarHBondContact O-CG1 3.4Å; M99-I103 PolarHBondContact O-N 2.94Å
100	I	44.4	Very low	43.6	Very low	94 Å²	94	118.4 Å²	118.4	48%	0.482	58%	0.581	S	S	.	*	H	α-helix	trans	-68.9	-40	179.2	-73.4	165.4	0	0	0	110.7	K96 E97 C98 I103 K104	K96-I100 HydrophobicContact CB-CD1 4.45Å; K96-I100 WeakPolarHBondContact O-CB 3.42Å; K96-I100 WeakPolarHBondContact O-CD1 3.39Å; K96-I100 VanDerWaalsContact O-CG1 3.24Å; K96-I100 WeakPolarHBondContact O-CG1 3.33Å; K96-I100 PolarHBondContact O-N 3.44Å; E97-I100 PolarHBondContact O-N 3.02Å; E97-I100 VanDerWaalsContact O-N 3.13Å; C98-I100 PolarHBondContact O-N 2.93Å; I100-I103 PolarHBondContact O-N 3.4Å; I100-K104 PolarHBondContact O-N 2.83Å
101	E	47.9	Very low	44.1	Very low	105 Å²	105	115.8 Å²	115.8	49%	0.491	56%	0.561	S	S	.	*	H	α-helix	trans	-73.5	-36.7	178.9	-131	62.7	-170.9	0	0	111.9	E97 C98 K104 R105	E97-E101 PolarHBondContact O-N 2.97Å; C98-E101 PolarHBondContact O-N 3.42Å; E101-K104 PolarHBondContact O-N 3.08Å; E101-K104 IonicContact OE1-NZ 2.69Å; E101-K104 PolarHBondContact OE1-NZ 2.95Å; E101-K104 WeakPolarHBondContact OE2-CE 3.44Å; E101-K104 IonicContact OE2-NZ 2.79Å; E101-K104 PolarHBondContact OE2-NZ 3.36Å; E101-R105 WeakPolarHBondContact O-CB 3.3Å; E101-R105 PolarHBondContact O-N 2.82Å
102	E	43.2	Very low	44.3	Very low	119 Å²	119	119.4 Å²	119.4	56%	0.556	57%	0.57	S	S	*	*	H	α-helix	trans	-64.4	-41.2	171.5	-154.8	75.2	-175.6	0	0	111.3	C98 R105 L106	C98-E102 WeakPolarHBondContact O-CB 3.49Å; C98-E102 PolarHBondContact O-N 2.84Å; E102-R105 PolarHBondContact O-N 2.81Å; E102-L106 WeakPolarHBondContact O-CG 3.34Å; E102-L106 PolarHBondContact O-N 3.08Å
103	I	45.3	Very low	44.5	Very low	105 Å²	105	113.8 Å²	113.8	54%	0.538	55%	0.554	S	S	.	*	H	α-helix	trans	-66.8	-42.1	175.4	-74.1	164.3	0	0	0	111.4	M99 I100 R105 L107	M99-I103 VanDerWaalsContact O-CB 3.24Å; M99-I103 WeakPolarHBondContact O-CB 3.4Å; M99-I103 WeakPolarHBondContact O-CD1 3.46Å; M99-I103 WeakPolarHBondContact O-CG1 3.4Å; M99-I103 PolarHBondContact O-N 2.94Å; I100-I103 PolarHBondContact O-N 3.4Å; I103-R105 VanDerWaalsContact C-N 3.34Å; I103-R105 PolarHBondContact O-N 3.23Å; I103-L107 WeakPolarHBondContact O-CB 3.35Å; I103-L107 PolarHBondContact O-N 3.06Å
104	K	47.1	Very low	44.5	Very low	93 Å²	93	112.3 Å²	112.3	40%	0.404	55%	0.547	S	S	.	.	H	α-helix	trans	-55.1	-50.9	172.2	-85.8	179.6	-176.2	153.3	0	110.6	I100 E101 L106 L107 E108	I100-K104 PolarHBondContact O-N 2.83Å; E101-K104 PolarHBondContact O-N 3.08Å; E101-K104 IonicContact OE1-NZ 2.69Å; E101-K104 PolarHBondContact OE1-NZ 2.95Å; E101-K104 WeakPolarHBondContact OE2-CE 3.44Å; E101-K104 IonicContact OE2-NZ 2.79Å; E101-K104 PolarHBondContact OE2-NZ 3.36Å; K104-L106 VanDerWaalsContact C-N 3.35Å; K104-L106 PolarHBondContact O-N 3.28Å; K104-L107 CarbonylContact O-C 3.55Å; K104-L107 WeakPolarHBondContact O-CA 3.5Å; K104-L107 VanDerWaalsContact O-CB 3.32Å; K104-L107 WeakPolarHBondContact O-CB 3.48Å; K104-L107 PolarHBondContact O-N 3.2Å; K104-E108 WeakPolarHBondContact O-CG 3.28Å; K104-E108 PolarHBondContact O-N 2.95Å
105	R	53.7	Low	44.6	Very low	169 Å²	169	110.6 Å²	110.6	64%	0.638	55%	0.547	S	S	*	.	H	α-helix	trans	-61.1	-43.7	-175.2	-162.2	177.3	-165.1	167.7	5.7	111.9	E101 E102 I103 L107 E108 E109	E101-R105 WeakPolarHBondContact O-CB 3.3Å; E101-R105 PolarHBondContact O-N 2.82Å; E102-R105 PolarHBondContact O-N 2.81Å; I103-R105 VanDerWaalsContact C-N 3.34Å; I103-R105 PolarHBondContact O-N 3.23Å; R105-L107 VanDerWaalsContact C-N 3.34Å; R105-E108 PolarHBondContact O-N 3Å; R105-E109 PolarHBondContact O-N 3.32Å
106	L	42.5	Very low	44.7	Very low	93 Å²	93	112.5 Å²	112.5	49%	0.487	55%	0.552	S	S	.	*	H	α-helix	trans	-64.2	-36	171.5	-73.8	168	0	0	0	112.5	E102 K104 I110	E102-L106 WeakPolarHBondContact O-CG 3.34Å; E102-L106 PolarHBondContact O-N 3.08Å; K104-L106 VanDerWaalsContact C-N 3.35Å; K104-L106 PolarHBondContact O-N 3.28Å; L106-I110 WeakPolarHBondContact O-CB 3.38Å; L106-I110 WeakPolarHBondContact O-CD1 3.21Å; L106-I110 WeakPolarHBondContact O-CG1 3.44Å; L106-I110 PolarHBondContact O-N 2.98Å; L106-I110 VanDerWaalsContact O-N 3.1Å
107	L	42.1	Very low	44.8	Very low	99 Å²	99	107.6 Å²	107.6	52%	0.518	54%	0.538	S	S	.	.	H	α-helix	trans	-67.9	-40.1	176	-143.3	78.3	0	0	0	111.7	I103 K104 R105 I110 I111	I103-L107 WeakPolarHBondContact O-CB 3.35Å; I103-L107 PolarHBondContact O-N 3.06Å; K104-L107 CarbonylContact O-C 3.55Å; K104-L107 WeakPolarHBondContact O-CA 3.5Å; K104-L107 VanDerWaalsContact O-CB 3.32Å; K104-L107 WeakPolarHBondContact O-CB 3.48Å; K104-L107 PolarHBondContact O-N 3.2Å; R105-L107 VanDerWaalsContact C-N 3.34Å; L107-I110 PolarHBondContact O-N 2.82Å; L107-I111 HydrophobicContact CD2-CD1 4.33Å; L107-I111 HydrophobicContact CG-CD1 4.21Å; L107-I111 WeakPolarHBondContact O-CB 3.45Å; L107-I111 WeakPolarHBondContact O-CD1 3.33Å; L107-I111 WeakPolarHBondContact O-CG1 3.25Å; L107-I111 PolarHBondContact O-N 3.41Å
108	E	49.7	Very low	44.8	Very low	119 Å²	119	105.9 Å²	105.9	56%	0.556	53%	0.532	S	S	*	.	H	α-helix	trans	-67.1	-44.7	178.4	-73.1	169.9	175.5	0	0	111.1	K104 R105 I110 I111 E112	K104-E108 WeakPolarHBondContact O-CG 3.28Å; K104-E108 PolarHBondContact O-N 2.95Å; R105-E108 PolarHBondContact O-N 3Å; E108-I110 VanDerWaalsContact C-N 3.3Å; E108-I110 PolarHBondContact O-N 3.14Å; E108-I111 PolarHBondContact O-N 3.41Å; E108-I111 VanDerWaalsContact O-N 3.15Å; E108-E112 PolarHBondContact O-N 3Å
109	E	47.8	Very low	44.6	Very low	124 Å²	124	109.9 Å²	109.9	58%	0.579	54%	0.543	S	S	*	.	H	α-helix	trans	-59.1	-37.9	170.9	-73.9	-173	146.5	0	0	112.6	R105 S113	R105-E109 PolarHBondContact O-N 3.32Å; E109-S113 VanDerWaalsContact O-CB 3.31Å; E109-S113 WeakPolarHBondContact O-CB 3.41Å; E109-S113 PolarHBondContact O-N 2.86Å; E109-S113 VanDerWaalsContact O-N 3.11Å; E109-S113 PolarHBondContact O-OG 3.31Å
110	I	40.7	Very low	44.6	Very low	98 Å²	98	107.2 Å²	107.2	50%	0.503	54%	0.539	S	S	.	.	H	α-helix	trans	-70.7	-34.4	176.2	-71.7	167.3	0	0	0	111.8	L106 L107 E108 S113 H114	L106-I110 WeakPolarHBondContact O-CB 3.38Å; L106-I110 WeakPolarHBondContact O-CD1 3.21Å; L106-I110 WeakPolarHBondContact O-CG1 3.44Å; L106-I110 PolarHBondContact O-N 2.98Å; L106-I110 VanDerWaalsContact O-N 3.1Å; L107-I110 PolarHBondContact O-N 2.82Å; E108-I110 VanDerWaalsContact C-N 3.3Å; E108-I110 PolarHBondContact O-N 3.14Å; I110-S113 WeakPolarHBondContact CA-OG 3.35Å; I110-S113 PolarHBondContact O-OG 3.44Å; I110-H114 PolarHBondContact O-N 3.32Å
111	I	46.2	Very low	44.5	Very low	79 Å²	79	107.8 Å²	107.8	41%	0.405	54%	0.542	S	S	.	.	H	α-helix	trans	-73.8	-40.7	179.1	-73.4	163.1	0	0	0	111.3	L107 E108 L118	L107-I111 HydrophobicContact CD2-CD1 4.33Å; L107-I111 HydrophobicContact CG-CD1 4.21Å; L107-I111 WeakPolarHBondContact O-CB 3.45Å; L107-I111 WeakPolarHBondContact O-CD1 3.33Å; L107-I111 WeakPolarHBondContact O-CG1 3.25Å; L107-I111 PolarHBondContact O-N 3.41Å; E108-I111 PolarHBondContact O-N 3.41Å; E108-I111 VanDerWaalsContact O-N 3.15Å; I111-L118 HydrophobicContact CG1-CD1 4.43Å
112	E	43.9	Very low	44.2	Very low	175 Å²	175	105.9 Å²	105.9	82%	0.818	53%	0.533	S	S	*	.	H	α-helix	trans	-69	-35.9	174.5	-71	-158.9	138.2	0	0	112.6	E108	E108-E112 PolarHBondContact O-N 3Å
113	S	43.2	Very low	44.1	Very low	69 Å²	69	103.4 Å²	103.4	48%	0.483	53%	0.529	S	S	.	.	H	α-helix	trans	-77.3	-26.8	-178.4	54	0	0	0	0	114.6	E109 I110	E109-S113 VanDerWaalsContact O-CB 3.31Å; E109-S113 WeakPolarHBondContact O-CB 3.41Å; E109-S113 PolarHBondContact O-N 2.86Å; E109-S113 VanDerWaalsContact O-N 3.11Å; E109-S113 PolarHBondContact O-OG 3.31Å; I110-S113 WeakPolarHBondContact CA-OG 3.35Å; I110-S113 PolarHBondContact O-OG 3.44Å
114	H	43.1	Very low	43.9	Very low	120 Å²	120	101.6 Å²	101.6	56%	0.556	52%	0.522	S	S	*	.			trans	-137.4	69.3	-174.5	-65.4	-58.2	0	0	0	114.2	I110 E116 A117	I110-H114 PolarHBondContact O-N 3.32Å; H114-E116 PolarHBondContact O-N 2.91Å; H114-E116 VanDerWaalsContact O-N 3.15Å; H114-A117 HydrophobicContact CB-CB 4.01Å; H114-A117 WeakPolarHBondContact O-CB 3.25Å; H114-A117 PolarHBondContact O-N 2.92Å
115	P	46.1	Very low	43.5	Very low	89 Å²	89	104.4 Å²	104.4	58%	0.578	53%	0.53	S	S	*	.	H	α-helix	trans	-60.7	-26.2	179.8	24.1	-34.8	0	0	0	114.2	A117 L118	P115-A117 VanDerWaalsContact C-N 3.35Å; P115-L118 VanDerWaalsContact O-CB 3.3Å; P115-L118 WeakPolarHBondContact O-CB 3.42Å; P115-L118 PolarHBondContact O-N 2.92Å
116	E	42.2	Very low	42.8	Very low	171 Å²	171	100.9 Å²	100.9	80%	0.799	52%	0.521	S	S	*	.	H	α-helix	trans	-69.7	-31.3	175.7	-63.2	-179.4	178.7	0	0	112.4	H114 L118 Q119 A120	H114-E116 PolarHBondContact O-N 2.91Å; H114-E116 VanDerWaalsContact O-N 3.15Å; E116-L118 PolarHBondContact O-N 2.83Å; E116-Q119 PolarHBondContact O-N 3.29Å; E116-A120 PolarHBondContact O-N 3.44Å
117	A	43.4	Very low	42.6	Very low	39 Å²	39	99.7 Å²	99.7	32%	0.322	52%	0.52	S	S	.	.	H	α-helix	trans	-65	-27.3	174.6	0	0	0	0	0	111.7	H114 P115 Q119 A120 I121	H114-A117 HydrophobicContact CB-CB 4.01Å; H114-A117 WeakPolarHBondContact O-CB 3.25Å; H114-A117 PolarHBondContact O-N 2.92Å; P115-A117 VanDerWaalsContact C-N 3.35Å; A117-Q119 PolarHBondContact O-N 2.93Å; A117-A120 PolarHBondContact O-N 3.13Å; A117-I121 WeakPolarHBondContact O-CB 3.34Å; A117-I121 VanDerWaalsContact O-CG1 3.3Å; A117-I121 WeakPolarHBondContact O-CG1 3.5Å; A117-I121 PolarHBondContact O-N 2.95Å
118	L	43.5	Very low	42.4	Very low	79 Å²	79	101.9 Å²	101.9	41%	0.414	53%	0.526	S	S	.	.	H	α-helix	trans	-62.3	-42.3	175.6	-157.3	76.8	0	0	0	111.1	I111 P115 E116 A120 I121 E122	I111-L118 HydrophobicContact CG1-CD1 4.43Å; P115-L118 VanDerWaalsContact O-CB 3.3Å; P115-L118 WeakPolarHBondContact O-CB 3.42Å; P115-L118 PolarHBondContact O-N 2.92Å; E116-L118 PolarHBondContact O-N 2.83Å; L118-A120 PolarHBondContact O-N 2.98Å; L118-I121 PolarHBondContact O-N 2.97Å; L118-E122 WeakPolarHBondContact O-CB 3.43Å; L118-E122 PolarHBondContact O-N 3.44Å
119	Q	40.6	Very low	41.7	Very low	158 Å²	158	101.6 Å²	101.6	74%	0.738	53%	0.528	S	S	*	.	H	α-helix	trans	-67.2	-34.8	175.4	-69.3	-167.5	0.8	0	0	112.8	E116 A117 S123	E116-Q119 PolarHBondContact O-N 3.29Å; A117-Q119 PolarHBondContact O-N 2.93Å; Q119-S123 VanDerWaalsContact O-CB 3.25Å; Q119-S123 WeakPolarHBondContact O-CB 3.34Å; Q119-S123 PolarHBondContact O-N 3.14Å; Q119-S123 PolarHBondContact O-OG 3.38Å
120	A	40.3	Very low	41	Very low	54 Å²	54	103.5 Å²	103.5	45%	0.446	53%	0.534	S	S	.	.	H	α-helix	trans	-65.8	-40.8	173.1	0	0	0	0	0	111.8	E116 A117 L118 S123 V124	E116-A120 PolarHBondContact O-N 3.44Å; A117-A120 PolarHBondContact O-N 3.13Å; L118-A120 PolarHBondContact O-N 2.98Å; A120-S123 WeakPolarHBondContact CA-OG 3.36Å; A120-S123 PolarHBondContact O-OG 3.33Å; A120-S123 VanDerWaalsContact O-OG 3.05Å; A120-V124 WeakPolarHBondContact O-CB 3.42Å; A120-V124 VanDerWaalsContact O-CG2 3.28Å; A120-V124 WeakPolarHBondContact O-CG2 3.15Å; A120-V124 PolarHBondContact O-N 3.32Å
121	I	42.4	Very low	40.8	Very low	107 Å²	107	103.6 Å²	103.6	55%	0.549	54%	0.543	S	S	.	.	H	α-helix	trans	-71.4	-43.9	177.9	-68.8	166.6	0	0	0	110.8	A117 L118 S123 V124 R125	A117-I121 WeakPolarHBondContact O-CB 3.34Å; A117-I121 VanDerWaalsContact O-CG1 3.3Å; A117-I121 WeakPolarHBondContact O-CG1 3.5Å; A117-I121 PolarHBondContact O-N 2.95Å; L118-I121 PolarHBondContact O-N 2.97Å; I121-S123 VanDerWaalsContact C-N 3.34Å; I121-S123 PolarHBondContact O-N 3.42Å; I121-V124 PolarHBondContact O-N 2.8Å; I121-R125 VanDerWaalsContact O-CB 3.3Å; I121-R125 WeakPolarHBondContact O-CB 3.41Å; I121-R125 PolarHBondContact O-N 2.84Å
122	E	41.6	Very low	40	Very low	65 Å²	65	102.7 Å²	102.7	30%	0.304	55%	0.547	S	S	.	.	H	α-helix	trans	-67.6	-32.7	178.3	-139.5	69.6	-117.5	0	0	111.9	L118 R125 Q126	L118-E122 WeakPolarHBondContact O-CB 3.43Å; L118-E122 PolarHBondContact O-N 3.44Å; E122-R125 PolarHBondContact O-N 2.86Å; E122-R125 WeakPolarHBondContact OE1-CD 3.17Å; E122-R125 IonicContact OE1-CZ 3.64Å; E122-R125 IonicContact OE1-NE 3.02Å; E122-R125 IonicContact OE1-NH1 3.61Å; E122-R125 PolarHBondContact OE1-NH1 3.01Å; E122-Q126 VanDerWaalsContact O-CB 3.28Å; E122-Q126 WeakPolarHBondContact O-CB 3.22Å; E122-Q126 WeakPolarHBondContact O-CG 3.39Å; E122-Q126 PolarHBondContact O-N 3.3Å
123	S	42	Very low	39.3	Very low	67 Å²	67	98 Å²	98	47%	0.469	55%	0.546	S	S	.	.	H	α-helix	trans	-75	-33.7	172.9	59	0	0	0	0	113	Q119 A120 I121 S127	Q119-S123 VanDerWaalsContact O-CB 3.25Å; Q119-S123 WeakPolarHBondContact O-CB 3.34Å; Q119-S123 PolarHBondContact O-N 3.14Å; Q119-S123 PolarHBondContact O-OG 3.38Å; A120-S123 WeakPolarHBondContact CA-OG 3.36Å; A120-S123 PolarHBondContact O-OG 3.33Å; A120-S123 VanDerWaalsContact O-OG 3.05Å; I121-S123 VanDerWaalsContact C-N 3.34Å; I121-S123 PolarHBondContact O-N 3.42Å; S123-S127 VanDerWaalsContact O-CB 3.27Å; S123-S127 WeakPolarHBondContact O-CB 3.49Å; S123-S127 PolarHBondContact O-N 2.98Å; S123-S127 PolarHBondContact O-OG 3.16Å
124	V	39.1	Very low	38.5	Very low	66 Å²	66	102.3 Å²	102.3	40%	0.4	56%	0.563	S	S	.	*	H	α-helix	trans	-66.6	-37	167.7	169.1	0	0	0	0	111.4	A120 I121 S127 K128	A120-V124 WeakPolarHBondContact O-CB 3.42Å; A120-V124 VanDerWaalsContact O-CG2 3.28Å; A120-V124 WeakPolarHBondContact O-CG2 3.15Å; A120-V124 PolarHBondContact O-N 3.32Å; I121-V124 PolarHBondContact O-N 2.8Å; V124-S127 WeakPolarHBondContact CA-OG 3.34Å; V124-S127 PolarHBondContact O-OG 2.69Å; V124-S127 VanDerWaalsContact O-OG 3.11Å; V124-K128 WeakPolarHBondContact O-CB 3.42Å; V124-K128 WeakPolarHBondContact O-CG 3.35Å; V124-K128 PolarHBondContact O-N 3.02Å; V124-K128 VanDerWaalsContact O-N 3.08Å
125	R	39.1	Very low	37.9	Very low	152 Å²	152	105 Å²	105	57%	0.574	58%	0.578	S	S	*	*	H	α-helix	trans	-68	-47.9	174.9	-167.2	-167.8	-170	172.7	2.4	111.3	I121 E122 K128 L129	I121-R125 VanDerWaalsContact O-CB 3.3Å; I121-R125 WeakPolarHBondContact O-CB 3.41Å; I121-R125 PolarHBondContact O-N 2.84Å; E122-R125 PolarHBondContact O-N 2.86Å; E122-R125 WeakPolarHBondContact OE1-CD 3.17Å; E122-R125 IonicContact OE1-CZ 3.64Å; E122-R125 IonicContact OE1-NE 3.02Å; E122-R125 IonicContact OE1-NH1 3.61Å; E122-R125 PolarHBondContact OE1-NH1 3.01Å; R125-K128 PolarHBondContact O-N 3.36Å; R125-L129 HydrophobicContact CG-CD1 4.09Å; R125-L129 WeakPolarHBondContact O-CB 3.47Å; R125-L129 WeakPolarHBondContact O-CG 3.29Å; R125-L129 PolarHBondContact O-N 3.06Å
126	Q	38.9	Very low	37.1	Very low	95 Å²	95	108.1 Å²	108.1	44%	0.444	59%	0.59	S	S	.	*	H	α-helix	trans	-67.9	-35.5	177.6	-78.6	-164	30.9	0	0	113.2	E122 L129 K130	E122-Q126 VanDerWaalsContact O-CB 3.28Å; E122-Q126 WeakPolarHBondContact O-CB 3.22Å; E122-Q126 WeakPolarHBondContact O-CG 3.39Å; E122-Q126 PolarHBondContact O-N 3.3Å; Q126-L129 PolarHBondContact O-N 2.94Å; Q126-K130 VanDerWaalsContact O-CB 3.25Å; Q126-K130 WeakPolarHBondContact O-CB 3.4Å; Q126-K130 VanDerWaalsContact O-CG 3.28Å; Q126-K130 WeakPolarHBondContact O-CG 3.27Å; Q126-K130 PolarHBondContact O-N 3.43Å
127	S	38.9	Very low	36.3	Very low	68 Å²	68	107.2 Å²	107.2	48%	0.476	59%	0.59	S	S	.	*	H	α-helix	trans	-68.6	-40.5	174.3	51.9	0	0	0	0	111.3	S123 V124 K130 S131	S123-S127 VanDerWaalsContact O-CB 3.27Å; S123-S127 WeakPolarHBondContact O-CB 3.49Å; S123-S127 PolarHBondContact O-N 2.98Å; S123-S127 PolarHBondContact O-OG 3.16Å; V124-S127 WeakPolarHBondContact CA-OG 3.34Å; V124-S127 PolarHBondContact O-OG 2.69Å; V124-S127 VanDerWaalsContact O-OG 3.11Å; S127-K130 PolarHBondContact O-N 3.41Å; S127-S131 PolarHBondContact O-N 3.41Å; S127-S131 PolarHBondContact O-OG 3.23Å
128	K	37	Very low	35.5	Very low	145 Å²	145	112.6 Å²	112.6	63%	0.63	61%	0.613	S	S	*	*	H	α-helix	trans	-62.6	-42.9	170.7	-78.1	-172.9	172.1	-171.5	0	112.8	V124 R125 S131 A132	V124-K128 WeakPolarHBondContact O-CB 3.42Å; V124-K128 WeakPolarHBondContact O-CG 3.35Å; V124-K128 PolarHBondContact O-N 3.02Å; V124-K128 VanDerWaalsContact O-N 3.08Å; R125-K128 PolarHBondContact O-N 3.36Å; K128-S131 WeakPolarHBondContact CA-OG 3.23Å; K128-S131 PolarHBondContact O-N 3.05Å; K128-S131 PolarHBondContact O-OG 3.28Å; K128-A132 PolarHBondContact O-N 3.03Å
129	L	34.8	Very low	34.7	Very low	114 Å²	114	117.6 Å²	117.6	60%	0.597	63%	0.632	S	S	*	*	H	α-helix	trans	-65.6	-36.2	174.8	-75.2	164.9	0	0	0	112.6	R125 Q126 A132	R125-L129 HydrophobicContact CG-CD1 4.09Å; R125-L129 WeakPolarHBondContact O-CB 3.47Å; R125-L129 WeakPolarHBondContact O-CG 3.29Å; R125-L129 PolarHBondContact O-N 3.06Å; Q126-L129 PolarHBondContact O-N 2.94Å; L129-A132 PolarHBondContact O-N 3.43Å
130	K	35.1	Very low	34.1	Very low	164 Å²	164	120.3 Å²	120.3	71%	0.713	64%	0.636	S	S	*	*	H	α-helix	trans	-75.2	-21.9	175	-75.8	167	175.5	160.8	0	113.3	Q126 S127 A132	Q126-K130 VanDerWaalsContact O-CB 3.25Å; Q126-K130 WeakPolarHBondContact O-CB 3.4Å; Q126-K130 VanDerWaalsContact O-CG 3.28Å; Q126-K130 WeakPolarHBondContact O-CG 3.27Å; Q126-K130 PolarHBondContact O-N 3.43Å; S127-K130 PolarHBondContact O-N 3.41Å; K130-A132 VanDerWaalsContact C-N 3.27Å
131	S	35.4	Very low	33.7	Very low	100 Å²	100	122 Å²	122	70%	0.699	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.9	-7.2	169.2	65.8	0	0	0	0	114.1	S127 K128	S127-S131 PolarHBondContact O-N 3.41Å; S127-S131 PolarHBondContact O-OG 3.23Å; K128-S131 WeakPolarHBondContact CA-OG 3.23Å; K128-S131 PolarHBondContact O-N 3.05Å; K128-S131 PolarHBondContact O-OG 3.28Å
132	A	29.3	Very low	33	Very low	59 Å²	59	125.7 Å²	125.7	49%	0.488	66%	0.655	S	S	.	*	S	Bend	trans	-117.8	77.9	179.1	0	0	0	0	0	110.5	K128 L129 K130 L134	K128-A132 PolarHBondContact O-N 3.03Å; L129-A132 PolarHBondContact O-N 3.43Å; K130-A132 VanDerWaalsContact C-N 3.27Å; A132-L134 PolarHBondContact O-N 2.91Å
133	G	30.2	Very low	32.4	Very low	77 Å²	77	128.9 Å²	128.9	79%	0.794	67%	0.674	S	S	*	*			trans	-62.4	128.2	172	0	0	0	0	0	111.1
134	L	26.5	Very low	31.9	Very low	159 Å²	159	132.2 Å²	132.2	83%	0.832	69%	0.686	S	S	*	*			trans	-68.1	137.7	-178.5	-77.6	74.3	0	0	0	111.7	A132	A132-L134 PolarHBondContact O-N 2.91Å
135	M	28.9	Very low	31.5	Very low	176 Å²	176	134.6 Å²	134.6	87%	0.867	70%	0.696	S	S	*	*				-159.8	167.5	105	-102.8	174.9	-176.2	0	0	111.5
136	D	29.5	Very low	31	Very low	156 Å²	156	132.3 Å²	132.3	83%	0.834	70%	0.695	S	S	*	*			trans	60	85.4	172.2	-61.6	-3.8	0	0	0	118.8
137	L	25.9	Very low	30.5	Very low	152 Å²	152	130.4 Å²	130.4	80%	0.796	69%	0.692	S	S	*	*			trans	-69.7	173.8	149.1	-88.7	84.8	0	0	0	111.4
138	N	25.6	Very low	30	Very low	152 Å²	152	133.4 Å²	133.4	81%	0.813	70%	0.702	S	S	*	*			trans	80.8	49.7	161	-57.6	-22.5	0	0	0	118.2
139	K	27.3	Very low	29.7	Very low	184 Å²	184	131.1 Å²	131.1	80%	0.8	70%	0.696	S	S	*	*			trans	-153.9	91.8	142.3	-116.6	169	-173.3	175.7	0	113
140	Y	27.5	Very low	29.4	Very low	214 Å²	214	132.7 Å²	132.7	84%	0.839	70%	0.7	S	S	*	*				165.9	146.3	119.2	-93.6	-76.9	0	0	0	110
141	P	32.6	Very low	29.1	Very low	90 Å²	90	132.1 Å²	132.1	58%	0.584	71%	0.705	S	S	*	*			trans	-105.1	158.5	-167.9	39.2	-31.5	0	0	0	114.6	D143	P141-D143 VanDerWaalsContact C-N 3.29Å; P141-D143 PolarHBondContact O-N 3.14Å
142	K	27.4	Very low	28.7	Very low	184 Å²	184	138.4 Å²	138.4	80%	0.8	71%	0.713	S	S	*	*	S	Bend	trans	49.9	-40.4	150.3	-67.1	-173	173.5	-173.9	0	121.9	L144 L145	K142-L144 VanDerWaalsContact C-N 3.26Å; K142-L144 PolarHBondContact O-N 3.31Å; K142-L144 VanDerWaalsContact O-N 3.08Å; K142-L145 PolarHBondContact O-N 3.14Å
143	D	29.4	Very low	28.5	Very low	132 Å²	132	142.5 Å²	142.5	71%	0.706	73%	0.726	S	S	*	*	H	α-helix	trans	-75.7	-7.2	-158.7	-54.5	-20.9	0	0	0	115	P141	P141-D143 VanDerWaalsContact C-N 3.29Å; P141-D143 PolarHBondContact O-N 3.14Å
144	L	31.4	Very low	28.2	Very low	138 Å²	138	147.1 Å²	147.1	72%	0.723	73%	0.731	S	S	*	*	H	α-helix	trans	-91.8	-8.5	177.3	-157	72.6	0	0	0	113.8	K142 S147	K142-L144 VanDerWaalsContact C-N 3.26Å; K142-L144 PolarHBondContact O-N 3.31Å; K142-L144 VanDerWaalsContact O-N 3.08Å; L144-S147 PolarHBondContact O-OG 3Å
145	L	29.9	Very low	28.1	Very low	115 Å²	115	143.3 Å²	143.3	60%	0.602	73%	0.73	S	S	*	*	H	α-helix	trans	-87.4	-35.5	-179.1	-171.9	58.5	0	0	0	112.3	K142 I149	K142-L145 PolarHBondContact O-N 3.14Å; L145-I149 HydrophobicContact CD1-CD1 4.23Å; L145-I149 HydrophobicContact CG-CD1 4.08Å; L145-I149 WeakPolarHBondContact O-CD1 3.2Å; L145-I149 WeakPolarHBondContact O-CG1 3.32Å; L145-I149 PolarHBondContact O-N 3.36Å
146	D	29.6	Very low	27.8	Very low	105 Å²	105	143.9 Å²	143.9	56%	0.561	73%	0.73	S	S	*	*	H	α-helix	trans	-73	-34.6	-179.2	-69.3	-36	0	0	0	112.4	L148 I149 Q150	D146-L148 PolarHBondContact O-N 2.96Å; D146-I149 PolarHBondContact O-N 3.25Å; D146-I149 VanDerWaalsContact O-N 3.1Å; D146-Q150 PolarHBondContact O-N 3.42Å
147	S	28.9	Very low	27.5	Very low	55 Å²	55	144.8 Å²	144.8	39%	0.385	73%	0.729	S	S	.	*	H	α-helix	trans	-63.8	-38.7	176.6	55.7	0	0	0	0	112.9	L144 I149	L144-S147 PolarHBondContact O-OG 3Å; S147-I149 PolarHBondContact O-N 3.42Å
148	L	28.8	Very low	27.4	Very low	131 Å²	131	145.3 Å²	145.3	69%	0.686	73%	0.727	S	S	*	*	H	α-helix	trans	-75.1	-8.3	175.1	-77.4	169.3	0	0	0	114.2	D146	D146-L148 PolarHBondContact O-N 2.96Å
149	I	29.9	Very low	27.4	Very low	96 Å²	96	145.3 Å²	145.3	49%	0.492	73%	0.727	S	S	.	*	H	α-helix	trans	-101.5	-25.1	178.1	-70.2	173.2	0	0	0	111.7	L145 D146 S147	L145-I149 HydrophobicContact CD1-CD1 4.23Å; L145-I149 HydrophobicContact CG-CD1 4.08Å; L145-I149 WeakPolarHBondContact O-CD1 3.2Å; L145-I149 WeakPolarHBondContact O-CG1 3.32Å; L145-I149 PolarHBondContact O-N 3.36Å; D146-I149 PolarHBondContact O-N 3.25Å; D146-I149 VanDerWaalsContact O-N 3.1Å; S147-I149 PolarHBondContact O-N 3.42Å
150	Q	27.8	Very low	27.2	Very low	147 Å²	147	146 Å²	146	69%	0.687	73%	0.73	S	S	*	*	H	α-helix	trans	-74.6	-38.8	177.1	-73.7	-179.9	-37.1	0	0	113.3	D146 R152	D146-Q150 PolarHBondContact O-N 3.42Å; Q150-R152 PolarHBondContact O-N 3.16Å
151	D	28.5	Very low	27	Very low	153 Å²	153	140 Å²	140	82%	0.818	73%	0.725	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.7	16.8	-174.5	-90.8	1.1	0	0	0	116.2
152	R	28	Very low	26.6	Very low	231 Å²	231	143.2 Å²	143.2	87%	0.872	74%	0.737	S	S	*	*	T	Hydrogen-bonded Turn	trans	-137.6	6.1	179.6	-80.6	-164.6	174	-154	-2.2	116.9	Q150	Q150-R152 PolarHBondContact O-N 3.16Å
153	L	24.1	Very low	26.4	Very low	145 Å²	145	139.3 Å²	139.3	76%	0.759	73%	0.733	S	S	*	*	S	Bend	trans	-131	11.7	-172	-90.9	170.2	0	0	0	116.9
154	I	24	Very low	26.1	Very low	175 Å²	175	137.9 Å²	137.9	90%	0.897	73%	0.733	S	S	*	*	S	Bend	trans	-132.9	118.5	169.7	-54.7	179	0	0	0	108.3
155	G	25.1	Very low	25.7	Very low	78 Å²	78	139.9 Å²	139.9	80%	0.804	74%	0.738	S	S	*	*			trans	146.2	36	179.3	0	0	0	0	0	116.7
156	H	23.3	Very low	25.5	Very low	189 Å²	189	143.1 Å²	143.1	88%	0.875	76%	0.755	S	S	*	*			trans	-138.8	84.4	175.7	-126.7	-51.3	0	0	0	112
157	H	23.3	Very low	25.2	Very low	175 Å²	175	142.1 Å²	142.1	81%	0.81	76%	0.757	S	S	*	*			trans	-161.6	143.3	152.8	-120.5	-92.1	0	0	0	109
158	E	23.8	Very low	24.9	Very low	163 Å²	163	143.5 Å²	143.5	76%	0.762	77%	0.771	S	S	*	*			trans	59.7	110.8	173.1	-53.9	-175.9	175.9	0	0	115.4
159	N	25.4	Very low	24.8	Very low	152 Å²	152	145.7 Å²	145.7	81%	0.813	78%	0.782	S	S	*	*			cis	-153.5	178.2	47.8	-99.2	-62.2	0	0	0	114.7
160	K	22.6	Very low	24.4	Very low	197 Å²	197	145.9 Å²	145.9	86%	0.857	79%	0.791	S	S	*	*			trans	-93.5	166.7	168.9	-69.7	173.9	178.8	170.1	0	110.8
161	A	23.1	Very low	24.2	Very low	88 Å²	88	144 Å²	144	73%	0.727	80%	0.795	S	S	*	*			trans	73.7	145.5	-165.9	0	0	0	0	0	111.9
162	D	24.5	Very low	23.9	Very low	158 Å²	158	143.8 Å²	143.8	85%	0.845	80%	0.799	S	S	*	*			cis	-109.8	143.5	15.2	-73	-52.1	0	0	0	116.3
163	S	23.2	Very low	23.8	Very low	102 Å²	102	138.6 Å²	138.6	71%	0.713	80%	0.798	S	S	*	*			trans	-92.6	155.4	148	57.6	0	0	0	0	109
164	C	22.8	Very low	23.7	Very low	103 Å²	103	137 Å²	137	70%	0.696	80%	0.8	S	S	*	*			trans	71.1	84.7	-179.9	-53.3	0	0	0	0	116.9
165	Q	23.2	Very low	23.6	Very low	179 Å²	179	137.6 Å²	137.6	84%	0.836	80%	0.798	S	S	*	*			trans	-152.4	64.8	139.3	-121	171.6	76.8	0	0	113.2
166	L	25.5	Very low	23.6	Very low	183 Å²	183	141 Å²	141	96%	0.958	80%	0.803	S	S	*	*	S	Bend	trans	-127.3	39.9	159.1	-149.1	94.7	0	0	0	110.8
167	S	22.6	Very low	23.7	Very low	85 Å²	85	135 Å²	135	59%	0.594	79%	0.793	S	S	*	*			trans	-141.9	53.1	-171.5	57	0	0	0	0	110.4
168	A	23.8	Very low	23.7	Very low	84 Å²	84	132.9 Å²	132.9	69%	0.694	80%	0.798	S	S	*	*			trans	-134.7	24.3	-172.1	0	0	0	0	0	114.1
169	I	25.7	Very low	23.7	Very low	176 Å²	176	132 Å²	132	90%	0.903	80%	0.798	S	S	*	*	S	Bend	trans	-133	61.4	165.2	-47.5	-179.6	0	0	0	108.6
170	S	22.7	Very low	23.7	Very low	100 Å²	100	129 Å²	129	70%	0.699	79%	0.79	S	S	*	*	S	Bend	trans	-153.8	38.3	-176.2	63.3	0	0	0	0	114.9
171	S	22.1	Very low	23.8	Very low	108 Å²	108	128.4 Å²	128.4	76%	0.755	79%	0.787	S	S	*	*	S	Bend	trans	-165.8	63.2	174.4	59	0	0	0	0	116.7
172	T	23.3	Very low	24	Very low	149 Å²	149	133.3 Å²	133.3	91%	0.914	80%	0.795	S	S	*	*	S	Bend	trans	-163.8	47.5	165	23.8	0	0	0	0	115.5
173	S	25.1	Very low	24	Very low	122 Å²	122	134.1 Å²	134.1	85%	0.853	79%	0.791	S	S	*	*			trans	-168.4	123.9	156.2	48.8	0	0	0	0	110.5
174	S	22.1	Very low	24.2	Very low	112 Å²	112	134.9 Å²	134.9	78%	0.783	79%	0.785	S	S	*	*			trans	-87.6	157.6	179.3	51.5	0	0	0	0	112.6
175	E	22.7	Very low	24.5	Very low	186 Å²	186	137 Å²	137	87%	0.869	79%	0.789	S	S	*	*			trans	57.9	82.9	162.8	-56.9	-168.5	155.4	0	0	119.7
176	V	25	Very low	24.7	Very low	149 Å²	149	136.5 Å²	136.5	90%	0.903	79%	0.789	S	S	*	*			trans	-151.6	120.1	130.5	175.7	0	0	0	0	111.7
177	G	25.7	Very low	25.1	Very low	65 Å²	65	132.1 Å²	132.1	67%	0.67	77%	0.766	S	S	*	*			trans	40.5	93.2	141.9	0	0	0	0	0	121	D179	G177-D179 PolarHBondContact O-N 2.97Å
178	S	22.3	Very low	25.7	Very low	129 Å²	129	134.3 Å²	134.3	90%	0.902	77%	0.766	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.6	86.2	169.4	57.9	0	0	0	0	113.7
179	D	23.8	Very low	26.6	Very low	144 Å²	144	134.1 Å²	134.1	77%	0.77	75%	0.753	S	S	*	*	T	Hydrogen-bonded Turn	trans	-151.5	-5.4	171	-143.6	6.5	0	0	0	114.5	G177	G177-D179 PolarHBondContact O-N 2.97Å
180	S	26	Very low	27.4	Very low	91 Å²	91	128.2 Å²	128.2	64%	0.636	73%	0.727	S	S	*	*	S	Bend	trans	-103.4	-25.1	-172.4	-64.8	0	0	0	0	115	H182	S180-H182 PolarHBondContact O-N 2.83Å
181	F	25.2	Very low	28.6	Very low	184 Å²	184	127.1 Å²	127.1	81%	0.807	72%	0.716	S	S	*	*	G	3₁₀ helix	trans	-67.6	-33.3	-169.7	-130.5	-97.5	0	0	0	113.5	K183 I184	F181-K183 PolarHBondContact O-N 3.42Å; F181-K183 VanDerWaalsContact O-N 3.08Å; F181-I184 PolarHBondContact O-N 3.17Å
182	H	25.7	Very low	29.9	Very low	191 Å²	191	126.2 Å²	126.2	88%	0.884	70%	0.698	S	S	*	*	G	3₁₀ helix	trans	-71.5	-4	-174.3	-136.7	54.5	0	0	0	114.6	S180	S180-H182 PolarHBondContact O-N 2.83Å
183	K	24.8	Very low	31.3	Very low	175 Å²	175	124.8 Å²	124.8	76%	0.761	68%	0.679	S	S	*	*	G	3₁₀ helix	trans	-99.7	-13	176.3	-75	175.3	179.1	163.6	0	114.4	F181	F181-K183 PolarHBondContact O-N 3.42Å; F181-K183 VanDerWaalsContact O-N 3.08Å
184	I	28.9	Very low	32.9	Very low	118 Å²	118	120.9 Å²	120.9	61%	0.605	65%	0.649	S	S	*	*	G	3₁₀ helix	trans	-81	-29.1	-174.6	-62.8	175.8	0	0	0	111.4	F181 M186	F181-I184 PolarHBondContact O-N 3.17Å; I184-M186 PolarHBondContact O-N 3.06Å
185	L	27.7	Very low	33.8	Very low	146 Å²	146	123.7 Å²	123.7	76%	0.764	65%	0.654	S	S	*	*	G	3₁₀ helix	trans	-72.7	-7.8	-176.7	-139.6	77.8	0	0	0	114.7	L187	L185-L187 PolarHBondContact O-N 2.89Å; L185-L187 VanDerWaalsContact O-N 3.15Å
186	M	27.5	Very low	35	Very low	170 Å²	170	122.7 Å²	122.7	84%	0.837	65%	0.649	S	S	*	*	G	3₁₀ helix	trans	-84.1	17.9	-168.4	-123.7	-178.1	-174.9	0	0	115.6	I184	I184-M186 PolarHBondContact O-N 3.06Å
187	L	34.4	Very low	36.2	Very low	90 Å²	90	116.2 Å²	116.2	47%	0.471	61%	0.613	S	S	.	*			trans	-134.2	72.5	176.6	-94.9	131.7	0	0	0	110.6	L185 I189 R870	L185-L187 PolarHBondContact O-N 2.89Å; L185-L187 VanDerWaalsContact O-N 3.15Å; L187-I189 PolarHBondContact O-N 3.5Å; L187-R870 VanDerWaalsContact CB-NH2 3.32Å
188	H	35.3	Very low	37.5	Very low	132 Å²	132	114.6 Å²	114.6	61%	0.611	59%	0.589	S	S	*	*			trans	-58	118.4	160.8	-87.6	-103.9	0	0	0	109.1
189	I	42.7	Very low	39.2	Very low	79 Å²	79	112 Å²	112	41%	0.405	56%	0.56	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-90.6	114.7	156.6	-54.6	-175.1	0	0	0	105.4	L187 V191 Y202 T203	L187-I189 PolarHBondContact O-N 3.5Å; I189-V191 HydrophobicContact CG2-CG2 4.11Å; I189-Y202 WeakPolarHBondContact CA-O 3.36Å; I189-T203 HydrophobicContact CG1-CG2 4.25Å; I189-T203 HydrophobicContact CG2-CG2 4.4Å
190	C	41.9	Very low	40.6	Very low	53 Å²	53	109 Å²	109	36%	0.358	54%	0.537	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	119.1	171.7	-66.4	0	0	0	0	107.9	Y202	C190-Y202 PolarHBondContact N-O 3.2Å; C190-Y202 PolarHBondContact O-N 3.36Å
191	V	49.2	Very low	41.9	Very low	77 Å²	77	105.3 Å²	105.3	47%	0.467	51%	0.512	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	125.6	171.7	179.5	0	0	0	0	108	I189 W199 W200 L215	I189-V191 HydrophobicContact CG2-CG2 4.11Å; V191-W199 HydrophobicContact CG1-CE3 3.83Å; V191-W199 HydrophobicContact CG1-CZ3 4.38Å; V191-W200 VanDerWaalsContact CA-O 3.3Å; V191-W200 WeakPolarHBondContact CA-O 3.24Å; V191-L215 HydrophobicContact CG1-CD1 4.05Å
192	F	49.4	Very low	42.9	Very low	89 Å²	89	100.6 Å²	100.6	39%	0.39	49%	0.489	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	163	176.8	61	-102	0	0	0	110.9	W199 W200 Y202	F192-W199 CarbonylContact O-C 3.55Å; F192-W199 WeakPolarHBondContact O-CA 3.47Å; F192-W200 HydrophobicContact CD2-CB 4.05Å; F192-W200 HydrophobicContact CE1-CB 4.49Å; F192-W200 HydrophobicContact CE2-CB 3.69Å; F192-W200 HydrophobicContact CE2-CG 4.03Å; F192-W200 HydrophobicContact CZ-CB 3.95Å; F192-W200 PolarHBondContact N-O 2.85Å; F192-W200 PolarHBondContact O-N 3.16Å; F192-Y202 HydrophobicContact CD1-CD2 4.44Å; F192-Y202 AromaticContact CE1-CD2 3.31Å; F192-Y202 HydrophobicContact CE1-CD2 3.31Å; F192-Y202 AromaticContact CE1-CE2 3.67Å; F192-Y202 HydrophobicContact CE1-CE2 3.67Å; F192-Y202 AromaticContact CE1-CG 3.95Å; F192-Y202 HydrophobicContact CE1-CG 3.95Å; F192-Y202 AromaticContact CZ-CD2 3.62Å; F192-Y202 HydrophobicContact CZ-CD2 3.62Å; F192-Y202 AromaticContact CZ-CE2 3.49Å; F192-Y202 HydrophobicContact CZ-CE2 3.49Å; F192-Y202 VanDerWaalsContact CZ-CE2 3.49Å
193	K	51.9	Low	43.8	Very low	118 Å²	118	93.8 Å²	93.8	51%	0.513	46%	0.461	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	133.8	176	-172.3	-178.9	168.3	-170.3	0	108.4	N198 W199	K193-N198 CarbonylContact C-O 3.57Å; K193-N198 VanDerWaalsContact CA-O 3.31Å; K193-N198 WeakPolarHBondContact CA-O 3.47Å; K193-W199 HydrophobicContact CB-CD2 4.15Å; K193-W199 HydrophobicContact CB-CE3 3.84Å; K193-W199 HydrophobicContact CB-CH2 4.39Å; K193-W199 HydrophobicContact CB-CZ3 3.98Å; K193-W199 HydrophobicContact CD-CZ2 4.32Å; K193-W199 HydrophobicContact CG-CD2 4.42Å
194	D	58.5	Low	44.6	Very low	40 Å²	40	90 Å²	90	21%	0.214	45%	0.445	C	S	.	.			trans	-80.8	-176.9	175.3	68.7	16.3	0	0	0	112.1	E196 G197 N198 W200	D194-E196 VanDerWaalsContact C-N 3.32Å; D194-E196 WeakPolarHBondContact OD1-CA 3.27Å; D194-E196 PolarHBondContact OD1-N 3.39Å; D194-G197 PolarHBondContact O-N 2.88Å; D194-G197 PolarHBondContact OD1-N 2.93Å; D194-N198 PolarHBondContact N-O 2.89Å; D194-N198 PolarHBondContact OD1-N 3.05Å; D194-N198 WeakPolarHBondContact OD2-CB 3.29Å; D194-N198 PolarHBondContact OD2-ND2 3.27Å; D194-N198 VanDerWaalsContact OD2-ND2 3.16Å; D194-W200 PolarHBondContact OD2-NE1 3.33Å
195	L	41.5	Very low	45.1	Very low	172 Å²	172	86.9 Å²	86.9	90%	0.901	43%	0.434	S	S	*	.	S	Bend	trans	-72.3	-24.6	179.8	-63.7	171.8	0	0	0	113	G197	L195-G197 VanDerWaalsContact C-N 3.32Å
196	E	47.2	Very low	45.5	Very low	164 Å²	164	85.7 Å²	85.7	77%	0.766	44%	0.438	S	S	*	.	S	Bend	trans	-83.1	-14.4	177.8	-66.9	161.6	-151.4	0	0	112	D194 N198	D194-E196 VanDerWaalsContact C-N 3.32Å; D194-E196 WeakPolarHBondContact OD1-CA 3.27Å; D194-E196 PolarHBondContact OD1-N 3.39Å; E196-N198 PolarHBondContact OE2-ND2 2.78Å
197	G	49.9	Very low	45.9	Very low	14 Å²	14	83.9 Å²	83.9	14%	0.144	43%	0.432	C	S	.	.	S	Bend	trans	94	12.7	177.4	0	0	0	0	0	115.1	D194 L195 C218	D194-G197 PolarHBondContact O-N 2.88Å; D194-G197 PolarHBondContact OD1-N 2.93Å; L195-G197 VanDerWaalsContact C-N 3.32Å; G197-C218 PolarHBondContact O-N 3.47Å
198	N	53.5	Low	46	Very low	30 Å²	30	82.5 Å²	82.5	16%	0.16	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	140.2	167.4	-49.4	-68.9	0	0	0	110.5	K193 D194 E196 G216 T217	K193-N198 CarbonylContact C-O 3.57Å; K193-N198 VanDerWaalsContact CA-O 3.31Å; K193-N198 WeakPolarHBondContact CA-O 3.47Å; D194-N198 PolarHBondContact N-O 2.89Å; D194-N198 PolarHBondContact OD1-N 3.05Å; D194-N198 WeakPolarHBondContact OD2-CB 3.29Å; D194-N198 PolarHBondContact OD2-ND2 3.27Å; D194-N198 VanDerWaalsContact OD2-ND2 3.16Å; E196-N198 PolarHBondContact OE2-ND2 2.78Å; N198-G216 WeakPolarHBondContact CA-O 3.26Å; N198-T217 VanDerWaalsContact OD1-CG2 3.31Å; N198-T217 WeakPolarHBondContact OD1-CG2 3.33Å; N198-T217 PolarHBondContact OD1-N 3.47Å
199	W	57.9	Low	46.1	Very low	75 Å²	75	79.3 Å²	79.3	28%	0.284	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	143.1	167.3	-67.2	99	0	0	0	109.6	V191 F192 K193 L215 G216 L221	V191-W199 HydrophobicContact CG1-CE3 3.83Å; V191-W199 HydrophobicContact CG1-CZ3 4.38Å; F192-W199 CarbonylContact O-C 3.55Å; F192-W199 WeakPolarHBondContact O-CA 3.47Å; K193-W199 HydrophobicContact CB-CD2 4.15Å; K193-W199 HydrophobicContact CB-CE3 3.84Å; K193-W199 HydrophobicContact CB-CH2 4.39Å; K193-W199 HydrophobicContact CB-CZ3 3.98Å; K193-W199 HydrophobicContact CD-CZ2 4.32Å; K193-W199 HydrophobicContact CG-CD2 4.42Å; W199-L215 HydrophobicContact CB-CB 3.92Å; W199-L215 HydrophobicContact CB-CD1 4.16Å; W199-L215 WeakPolarHBondContact O-CA 3.43Å; W199-L215 WeakPolarHBondContact O-CB 3.34Å; W199-L215 PolarHBondContact O-N 3.29Å; W199-G216 PolarHBondContact N-O 3.34Å; W199-L221 HydrophobicContact CB-CD2 4.18Å; W199-L221 VanDerWaalsContact CD1-CD2 3.43Å; W199-L221 HydrophobicContact CD2-CD2 4.29Å; W199-L221 HydrophobicContact CG-CD2 3.73Å
200	W	54.1	Low	46.2	Very low	80 Å²	80	77.3 Å²	77.3	30%	0.303	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	135.1	177.4	-69.7	82.9	0	0	0	109	V191 F192 D194 A212 Q213	V191-W200 VanDerWaalsContact CA-O 3.3Å; V191-W200 WeakPolarHBondContact CA-O 3.24Å; F192-W200 HydrophobicContact CD2-CB 4.05Å; F192-W200 HydrophobicContact CE1-CB 4.49Å; F192-W200 HydrophobicContact CE2-CB 3.69Å; F192-W200 HydrophobicContact CE2-CG 4.03Å; F192-W200 HydrophobicContact CZ-CB 3.95Å; F192-W200 PolarHBondContact N-O 2.85Å; F192-W200 PolarHBondContact O-N 3.16Å; D194-W200 PolarHBondContact OD2-NE1 3.33Å; W200-A212 HydrophobicContact CE3-CB 4.21Å; W200-A212 HydrophobicContact CZ3-CB 4.35Å; W200-Q213 WeakPolarHBondContact CA-O 3.35Å
201	S	53.5	Low	46.1	Very low	15 Å²	15	79.5 Å²	79.5	11%	0.105	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	139.6	165.6	65.9	0	0	0	0	110.2	A212 Q213	S201-A212 WeakPolarHBondContact O-CA 3.41Å; S201-Q213 PolarHBondContact N-O 2.98Å; S201-Q213 PolarHBondContact O-N 2.8Å; S201-Q213 PolarHBondContact OG-O 2.89Å
202	Y	45.3	Very low	45.9	Very low	84 Å²	84	78.1 Å²	78.1	33%	0.329	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	127.9	168.6	-102.3	-115.2	0	0	0	109.1	I189 C190 F192 F204 A212	I189-Y202 WeakPolarHBondContact CA-O 3.36Å; C190-Y202 PolarHBondContact N-O 3.2Å; C190-Y202 PolarHBondContact O-N 3.36Å; F192-Y202 HydrophobicContact CD1-CD2 4.44Å; F192-Y202 AromaticContact CE1-CD2 3.31Å; F192-Y202 HydrophobicContact CE1-CD2 3.31Å; F192-Y202 AromaticContact CE1-CE2 3.67Å; F192-Y202 HydrophobicContact CE1-CE2 3.67Å; F192-Y202 AromaticContact CE1-CG 3.95Å; F192-Y202 HydrophobicContact CE1-CG 3.95Å; F192-Y202 AromaticContact CZ-CD2 3.62Å; F192-Y202 HydrophobicContact CZ-CD2 3.62Å; F192-Y202 AromaticContact CZ-CE2 3.49Å; F192-Y202 HydrophobicContact CZ-CE2 3.49Å; F192-Y202 VanDerWaalsContact CZ-CE2 3.49Å; Y202-F204 HydrophobicContact CD1-CZ 4.33Å; Y202-A212 HydrophobicContact CD2-CB 3.88Å; Y202-A212 HydrophobicContact CE1-CB 4.47Å; Y202-A212 HydrophobicContact CE2-CB 3.23Å
203	T	44.1	Very low	45.8	Very low	48 Å²	48	78.9 Å²	78.9	29%	0.294	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	131.5	174.2	56.4	0	0	0	0	109.1	I189 G210 T211	I189-T203 HydrophobicContact CG1-CG2 4.25Å; I189-T203 HydrophobicContact CG2-CG2 4.4Å; T203-G210 CarbonylContact O-C 3.55Å; T203-G210 WeakPolarHBondContact O-CA 3.47Å; T203-T211 PolarHBondContact N-O 2.98Å; T203-T211 PolarHBondContact O-N 3.21Å; T203-T211 VanDerWaalsContact O-N 3.12Å; T203-T211 PolarHBondContact OG1-OG1 3.27Å
204	F	41.8	Very low	45.9	Very low	95 Å²	95	75.6 Å²	75.6	42%	0.417	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	136.9	177.8	-64.4	-82.7	0	0	0	111	Y202	Y202-F204 HydrophobicContact CD1-CZ 4.33Å
205	S	39.8	Very low	45.4	Very low	53 Å²	53	75 Å²	75	37%	0.371	43%	0.429	S	S	.	.			trans	-81.4	165	164.7	74.2	0	0	0	0	111.2	N207 G208 T209	S205-N207 PolarHBondContact O-N 3.18Å; S205-N207 PolarHBondContact OG-N 2.81Å; S205-G208 PolarHBondContact O-N 3.47Å; S205-G208 VanDerWaalsContact O-N 3.12Å; S205-T209 WeakPolarHBondContact CB-O 3.48Å; S205-T209 PolarHBondContact N-O 3.12Å; S205-T209 PolarHBondContact OG-O 2.84Å; S205-T209 PolarHBondContact OG-OG1 2.7Å
206	S	36.1	Very low	46.3	Very low	121 Å²	121	67.3 Å²	67.3	85%	0.846	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	-15.3	172.9	55.5	0	0	0	0	114.5
207	N	36.9	Very low	47.3	Very low	133 Å²	133	62 Å²	62	71%	0.711	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.3	12.1	-174	-60.8	21.6	0	0	0	112	S205 T209	S205-N207 PolarHBondContact O-N 3.18Å; S205-N207 PolarHBondContact OG-N 2.81Å; N207-T209 PolarHBondContact O-N 3.02Å
208	G	36.7	Very low	47.4	Very low	60 Å²	60	64.6 Å²	64.6	62%	0.619	39%	0.386	S	S	*	.	S	Bend	trans	78.6	-8.7	174.6	0	0	0	0	0	115.8	S205	S205-G208 PolarHBondContact O-N 3.47Å; S205-G208 VanDerWaalsContact O-N 3.12Å
209	T	37	Very low	47.7	Very low	65 Å²	65	72.7 Å²	72.7	40%	0.399	41%	0.414	S	S	.	.			trans	-75.4	138.6	164.5	53.8	0	0	0	0	109.7	S205 N207	S205-T209 WeakPolarHBondContact CB-O 3.48Å; S205-T209 PolarHBondContact N-O 3.12Å; S205-T209 PolarHBondContact OG-O 2.84Å; S205-T209 PolarHBondContact OG-OG1 2.7Å; N207-T209 PolarHBondContact O-N 3.02Å
210	G	43.8	Very low	47.6	Very low	38 Å²	38	72.8 Å²	72.8	39%	0.392	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	152.7	178.7	0	0	0	0	0	112.2	T203	T203-G210 CarbonylContact O-C 3.55Å; T203-G210 WeakPolarHBondContact O-CA 3.47Å
211	T	41.2	Very low	47.6	Very low	99 Å²	99	70.8 Å²	70.8	61%	0.607	41%	0.413	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.2	130.8	-179.7	45.7	0	0	0	0	110.8	T203	T203-T211 PolarHBondContact N-O 2.98Å; T203-T211 PolarHBondContact O-N 3.21Å; T203-T211 VanDerWaalsContact O-N 3.12Å; T203-T211 PolarHBondContact OG1-OG1 3.27Å
212	A	43.6	Very low	47.6	Very low	47 Å²	47	76.4 Å²	76.4	39%	0.388	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	138	170	0	0	0	0	0	110	W200 S201 Y202	W200-A212 HydrophobicContact CE3-CB 4.21Å; W200-A212 HydrophobicContact CZ3-CB 4.35Å; S201-A212 WeakPolarHBondContact O-CA 3.41Å; Y202-A212 HydrophobicContact CD2-CB 3.88Å; Y202-A212 HydrophobicContact CE1-CB 4.47Å; Y202-A212 HydrophobicContact CE2-CB 3.23Å
213	Q	47.8	Very low	48.1	Very low	106 Å²	106	74.3 Å²	74.3	50%	0.495	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	125.2	170.4	-173.1	171.4	-7.5	0	0	109.6	W200 S201	W200-Q213 WeakPolarHBondContact CA-O 3.35Å; S201-Q213 PolarHBondContact N-O 2.98Å; S201-Q213 PolarHBondContact O-N 2.8Å; S201-Q213 PolarHBondContact OG-O 2.89Å
214	S	53	Low	48.3	Very low	49 Å²	49	77.9 Å²	77.9	34%	0.343	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	131.1	175	-175.7	0	0	0	0	109.9	G216	S214-G216 PolarHBondContact OG-N 3.45Å; S214-G216 VanDerWaalsContact OG-N 3.17Å
215	L	49	Very low	48.5	Very low	26 Å²	26	77.8 Å²	77.8	14%	0.136	44%	0.444	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	-1.6	171.1	-57.2	171.5	0	0	0	111.2	V191 W199 L221	V191-L215 HydrophobicContact CG1-CD1 4.05Å; W199-L215 HydrophobicContact CB-CB 3.92Å; W199-L215 HydrophobicContact CB-CD1 4.16Å; W199-L215 WeakPolarHBondContact O-CA 3.43Å; W199-L215 WeakPolarHBondContact O-CB 3.34Å; W199-L215 PolarHBondContact O-N 3.29Å; L215-L221 HydrophobicContact CB-CD1 4.33Å
216	G	60.9	Low	48.9	Very low	11 Å²	11	79.7 Å²	79.7	11%	0.113	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	77	179.9	-179	0	0	0	0	0	114.3	N198 W199 S214	N198-G216 WeakPolarHBondContact CA-O 3.26Å; W199-G216 PolarHBondContact N-O 3.34Å; S214-G216 PolarHBondContact OG-N 3.45Å; S214-G216 VanDerWaalsContact OG-N 3.17Å
217	T	67.4	Low	49.4	Very low	54 Å²	54	81.2 Å²	81.2	33%	0.331	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-53.2	159.1	179	71.9	0	0	0	0	112.3	N198 R219 E220 L221	N198-T217 VanDerWaalsContact OD1-CG2 3.31Å; N198-T217 WeakPolarHBondContact OD1-CG2 3.33Å; N198-T217 PolarHBondContact OD1-N 3.47Å; T217-R219 PolarHBondContact O-N 3.14Å; T217-R219 PolarHBondContact OG1-N 3.09Å; T217-E220 WeakPolarHBondContact O-CA 3.37Å; T217-E220 VanDerWaalsContact O-CB 3.26Å; T217-E220 WeakPolarHBondContact O-CB 3.46Å; T217-E220 PolarHBondContact O-N 3.45Å; T217-E220 PolarHBondContact OG1-N 3.04Å; T217-L221 PolarHBondContact O-N 2.91Å
218	C	52.3	Low	49.4	Very low	68 Å²	68	79 Å²	79	46%	0.459	42%	0.419	S	S	.	.	H	α-helix	trans	-54.9	-26.9	173.3	-161.6	0	0	0	0	113.4	G197 K222	G197-C218 PolarHBondContact O-N 3.47Å; C218-K222 WeakPolarHBondContact O-CB 3.26Å; C218-K222 PolarHBondContact O-N 3.48Å
219	R	60.4	Low	49.4	Very low	200 Å²	200	84.7 Å²	84.7	76%	0.755	42%	0.423	S	S	*	.	H	α-helix	trans	-77.9	-38	173.5	-168.2	176.6	-177.1	-174.9	-2.7	112.2	T217 S223	T217-R219 PolarHBondContact O-N 3.14Å; T217-R219 PolarHBondContact OG1-N 3.09Å; R219-S223 WeakPolarHBondContact O-CB 3.48Å; R219-S223 PolarHBondContact O-N 3.35Å
220	E	55.7	Low	49.6	Very low	77 Å²	77	87.3 Å²	87.3	36%	0.36	43%	0.434	S	S	.	.	H	α-helix	trans	-59.6	-56	172.1	-159.1	63.1	-138.6	0	0	110.3	T217 K222 S223 R224	T217-E220 WeakPolarHBondContact O-CA 3.37Å; T217-E220 VanDerWaalsContact O-CB 3.26Å; T217-E220 WeakPolarHBondContact O-CB 3.46Å; T217-E220 PolarHBondContact O-N 3.45Å; T217-E220 PolarHBondContact OG1-N 3.04Å; E220-K222 PolarHBondContact O-N 3.44Å; E220-S223 CarbonylContact O-C 3.52Å; E220-S223 WeakPolarHBondContact O-CA 3.25Å; E220-S223 WeakPolarHBondContact O-CB 3.31Å; E220-S223 PolarHBondContact O-N 2.97Å; E220-S223 PolarHBondContact O-OG 3.37Å; E220-R224 WeakPolarHBondContact O-CG 3.49Å; E220-R224 PolarHBondContact O-N 3.1Å
221	L	52.5	Low	49.2	Very low	38 Å²	38	88.5 Å²	88.5	20%	0.199	44%	0.441	C	S	.	.	H	α-helix	trans	-57.5	-46.4	177.2	178.7	65	0	0	0	111.3	W199 L215 T217 S223 R224 L225	W199-L221 HydrophobicContact CB-CD2 4.18Å; W199-L221 VanDerWaalsContact CD1-CD2 3.43Å; W199-L221 HydrophobicContact CD2-CD2 4.29Å; W199-L221 HydrophobicContact CG-CD2 3.73Å; L215-L221 HydrophobicContact CB-CD1 4.33Å; T217-L221 PolarHBondContact O-N 2.91Å; L221-S223 VanDerWaalsContact C-N 3.31Å; L221-S223 PolarHBondContact O-N 2.98Å; L221-R224 PolarHBondContact O-N 3.38Å; L221-R224 VanDerWaalsContact O-N 3.17Å; L221-L225 HydrophobicContact CD1-CD1 4.13Å; L221-L225 HydrophobicContact CD1-CG 4.28Å; L221-L225 HydrophobicContact CG-CD1 3.96Å; L221-L225 HydrophobicContact CG-CG 4.5Å; L221-L225 WeakPolarHBondContact O-CB 3.36Å; L221-L225 WeakPolarHBondContact O-CG 3.48Å; L221-L225 PolarHBondContact O-N 2.94Å
222	K	53.7	Low	48.6	Very low	133 Å²	133	89.5 Å²	89.5	58%	0.578	44%	0.438	S	S	*	.	H	α-helix	trans	-62.6	-37.1	174.4	-173.3	169.7	-179	175.6	0	111.6	C218 E220 R224 Q226	C218-K222 WeakPolarHBondContact O-CB 3.26Å; C218-K222 PolarHBondContact O-N 3.48Å; E220-K222 PolarHBondContact O-N 3.44Å; K222-R224 VanDerWaalsContact C-N 3.31Å; K222-R224 PolarHBondContact O-N 2.7Å; K222-Q226 WeakPolarHBondContact O-CA 3.4Å; K222-Q226 WeakPolarHBondContact O-CB 3.48Å; K222-Q226 PolarHBondContact O-N 3.47Å
223	S	57.4	Low	48.1	Very low	39 Å²	39	93.2 Å²	93.2	27%	0.273	46%	0.459	S	S	.	.	H	α-helix	trans	-68.5	-27.6	175.5	87	0	0	0	0	113.5	R219 E220 L221 R227	R219-S223 WeakPolarHBondContact O-CB 3.48Å; R219-S223 PolarHBondContact O-N 3.35Å; E220-S223 CarbonylContact O-C 3.52Å; E220-S223 WeakPolarHBondContact O-CA 3.25Å; E220-S223 WeakPolarHBondContact O-CB 3.31Å; E220-S223 PolarHBondContact O-N 2.97Å; E220-S223 PolarHBondContact O-OG 3.37Å; L221-S223 VanDerWaalsContact C-N 3.31Å; L221-S223 PolarHBondContact O-N 2.98Å; S223-R227 VanDerWaalsContact O-CB 3.23Å; S223-R227 WeakPolarHBondContact O-CB 3.31Å; S223-R227 VanDerWaalsContact O-CG 3.24Å; S223-R227 WeakPolarHBondContact O-CG 3.24Å; S223-R227 PolarHBondContact O-N 2.89Å; S223-R227 PolarHBondContact O-NE 3.39Å; S223-R227 PolarHBondContact OG-NH2 2.95Å
224	R	47.7	Very low	47.1	Very low	124 Å²	124	93.7 Å²	93.7	47%	0.468	47%	0.473	S	S	.	.	H	α-helix	trans	-78	-47	175.1	-68.1	178.9	-176.1	-153.2	2.5	111.1	E220 L221 K222 Q226 R227 F228	E220-R224 WeakPolarHBondContact O-CG 3.49Å; E220-R224 PolarHBondContact O-N 3.1Å; L221-R224 PolarHBondContact O-N 3.38Å; L221-R224 VanDerWaalsContact O-N 3.17Å; K222-R224 VanDerWaalsContact C-N 3.31Å; K222-R224 PolarHBondContact O-N 2.7Å; R224-Q226 VanDerWaalsContact C-N 3.32Å; R224-Q226 PolarHBondContact O-N 3.23Å; R224-R227 PolarHBondContact O-N 3.47Å; R224-F228 WeakPolarHBondContact O-CB 3.37Å; R224-F228 PolarHBondContact O-N 3.29Å
225	L	45.8	Very low	45.8	Very low	92 Å²	92	94.9 Å²	94.9	48%	0.482	49%	0.493	S	S	.	.	H	α-helix	trans	-62.8	-37.9	173.1	-71.9	170.8	0	0	0	112.1	L221 F228 Y229	L221-L225 HydrophobicContact CD1-CD1 4.13Å; L221-L225 HydrophobicContact CD1-CG 4.28Å; L221-L225 HydrophobicContact CG-CD1 3.96Å; L221-L225 HydrophobicContact CG-CG 4.5Å; L221-L225 WeakPolarHBondContact O-CB 3.36Å; L221-L225 WeakPolarHBondContact O-CG 3.48Å; L221-L225 PolarHBondContact O-N 2.94Å; L225-F228 WeakPolarHBondContact O-CB 3.39Å; L225-F228 PolarHBondContact O-N 3.15Å; L225-Y229 WeakPolarHBondContact O-CD2 3.34Å; L225-Y229 PolarHBondContact O-N 3.34Å
226	Q	49	Very low	45	Very low	93 Å²	93	100 Å²	100	44%	0.435	53%	0.528	S	S	.	.	H	α-helix	trans	-74	-41.6	178.1	-165.8	153.6	-5.1	0	0	110.7	K222 R224 F228 Y229 D230	K222-Q226 WeakPolarHBondContact O-CA 3.4Å; K222-Q226 WeakPolarHBondContact O-CB 3.48Å; K222-Q226 PolarHBondContact O-N 3.47Å; R224-Q226 VanDerWaalsContact C-N 3.32Å; R224-Q226 PolarHBondContact O-N 3.23Å; Q226-F228 PolarHBondContact O-N 2.93Å; Q226-F228 VanDerWaalsContact O-N 3.12Å; Q226-Y229 PolarHBondContact O-N 3.48Å; Q226-Y229 VanDerWaalsContact O-N 3.11Å; Q226-D230 VanDerWaalsContact O-CB 3.31Å; Q226-D230 WeakPolarHBondContact O-CB 3.3Å; Q226-D230 PolarHBondContact O-N 2.97Å; Q226-D230 VanDerWaalsContact O-OD2 3.1Å
227	R	45.8	Very low	43.3	Very low	154 Å²	154	104.7 Å²	104.7	58%	0.581	56%	0.559	S	S	*	*	H	α-helix	trans	-54.7	-28.6	165	-84.3	178.9	-90.4	-171.3	-8	113.6	S223 R224 A231	S223-R227 VanDerWaalsContact O-CB 3.23Å; S223-R227 WeakPolarHBondContact O-CB 3.31Å; S223-R227 VanDerWaalsContact O-CG 3.24Å; S223-R227 WeakPolarHBondContact O-CG 3.24Å; S223-R227 PolarHBondContact O-N 2.89Å; S223-R227 PolarHBondContact O-NE 3.39Å; S223-R227 PolarHBondContact OG-NH2 2.95Å; R224-R227 PolarHBondContact O-N 3.47Å; R227-A231 WeakPolarHBondContact O-CB 3.41Å; R227-A231 PolarHBondContact O-N 3.5Å; R227-A231 VanDerWaalsContact O-N 3.17Å
228	F	36.6	Very low	41.3	Very low	86 Å²	86	107.3 Å²	107.3	38%	0.377	58%	0.58	S	S	.	*	H	α-helix	trans	-78.4	-41.3	175.5	-173.4	-89.3	0	0	0	112.7	R224 L225 Q226 A231 Q232 I875	R224-F228 WeakPolarHBondContact O-CB 3.37Å; R224-F228 PolarHBondContact O-N 3.29Å; L225-F228 WeakPolarHBondContact O-CB 3.39Å; L225-F228 PolarHBondContact O-N 3.15Å; Q226-F228 PolarHBondContact O-N 2.93Å; Q226-F228 VanDerWaalsContact O-N 3.12Å; F228-A231 PolarHBondContact O-N 3.01Å; F228-Q232 PolarHBondContact O-N 2.97Å; F228-I875 HydrophobicContact CD2-CG2 4.2Å; F228-I875 HydrophobicContact CE2-CD1 3.62Å; F228-I875 HydrophobicContact CE2-CG1 4.18Å; F228-I875 HydrophobicContact CE2-CG2 4.23Å; F228-I875 HydrophobicContact CZ-CD1 4.06Å
229	Y	36.6	Very low	39.9	Very low	179 Å²	179	109.7 Å²	109.7	70%	0.702	60%	0.597	S	S	*	*	H	α-helix	trans	-63.5	-46.4	170.3	-91.4	-82.1	0	0	0	111.6	L225 Q226 A231 Q232	L225-Y229 WeakPolarHBondContact O-CD2 3.34Å; L225-Y229 PolarHBondContact O-N 3.34Å; Q226-Y229 PolarHBondContact O-N 3.48Å; Q226-Y229 VanDerWaalsContact O-N 3.11Å; Y229-A231 PolarHBondContact O-N 3.25Å; Y229-Q232 PolarHBondContact O-N 3.35Å
230	D	42	Very low	38.3	Very low	121 Å²	121	111.9 Å²	111.9	65%	0.647	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.3	-18.8	176.7	-56.7	-26.4	0	0	0	112.1	Q226	Q226-D230 VanDerWaalsContact O-CB 3.31Å; Q226-D230 WeakPolarHBondContact O-CB 3.3Å; Q226-D230 PolarHBondContact O-N 2.97Å; Q226-D230 VanDerWaalsContact O-OD2 3.1Å
231	A	35.9	Very low	36.8	Very low	63 Å²	63	118.9 Å²	118.9	52%	0.521	63%	0.628	S	S	.	*	T	Hydrogen-bonded Turn	trans	-91.8	-4.3	173.7	0	0	0	0	0	114.2	R227 F228 Y229 P233	R227-A231 WeakPolarHBondContact O-CB 3.41Å; R227-A231 PolarHBondContact O-N 3.5Å; R227-A231 VanDerWaalsContact O-N 3.17Å; F228-A231 PolarHBondContact O-N 3.01Å; Y229-A231 PolarHBondContact O-N 3.25Å; A231-P233 WeakPolarHBondContact O-CD 3.44Å
232	Q	28.2	Very low	35.3	Very low	119 Å²	119	125.6 Å²	125.6	56%	0.556	66%	0.664	S	S	*	*	S	Bend	trans	-102.1	104.4	169.1	-70.7	-158.9	-7.6	0	0	110.2	F228 Y229 S234	F228-Q232 PolarHBondContact O-N 2.97Å; Y229-Q232 PolarHBondContact O-N 3.35Å; Q232-S234 PolarHBondContact O-N 3.47Å
233	P	31.9	Very low	33.9	Very low	126 Å²	126	124.8 Å²	124.8	82%	0.818	67%	0.67	S	S	*	*			trans	-76.3	88.5	179.8	31.4	-34.7	0	0	0	111.3	A231	A231-P233 WeakPolarHBondContact O-CD 3.44Å
234	S	26.5	Very low	32.2	Very low	115 Å²	115	129 Å²	129	80%	0.804	69%	0.694	S	S	*	*			trans	-66.8	151.4	151	54.6	0	0	0	0	110.1	Q232	Q232-S234 PolarHBondContact O-N 3.47Å
235	G	27.6	Very low	31.1	Very low	74 Å²	74	133 Å²	133	76%	0.763	71%	0.71	S	S	*	*			trans	-61.1	175	-165.5	0	0	0	0	0	118.5
236	P	30.6	Very low	29.9	Very low	133 Å²	133	139.1 Å²	139.1	86%	0.864	73%	0.727	S	S	*	*			trans	-114.2	150.2	-131.7	38.4	-33.3	0	0	0	116.2
237	S	25.2	Very low	28.7	Very low	111 Å²	111	144.2 Å²	144.2	78%	0.776	74%	0.743	S	S	*	*			trans	-156.3	127.2	160.7	58.9	0	0	0	0	114.7
238	S	25.7	Very low	27.6	Very low	109 Å²	109	145.4 Å²	145.4	76%	0.762	75%	0.754	S	S	*	*			trans	51.1	98	154.4	62.4	0	0	0	0	121.1
239	S	23.3	Very low	27	Very low	117 Å²	117	147.3 Å²	147.3	82%	0.818	78%	0.778	S	S	*	*			trans	22.8	116.2	131.5	-57.5	0	0	0	0	121
240	R	27	Very low	26.3	Very low	247 Å²	247	143.7 Å²	143.7	93%	0.932	79%	0.785	S	S	*	*			trans	-157.7	109.9	132.9	-111.5	165	-159.6	-160.2	5	114.1
241	R	24.3	Very low	25.4	Very low	223 Å²	223	141.1 Å²	141.1	84%	0.842	79%	0.787	S	S	*	*			trans	25.5	115.8	156.4	-66.9	-179.4	175.3	164.6	-1.1	118.8	T243	R241-T243 HydrophobicContact CB-CG2 4.47Å
242	L	21.4	Very low	24.8	Very low	180 Å²	180	146.4 Å²	146.4	94%	0.942	81%	0.807	S	S	*	*			trans	-61.8	132.7	141.1	-78.5	94.3	0	0	0	109.3
243	T	23	Very low	24.6	Very low	115 Å²	115	143.9 Å²	143.9	71%	0.706	81%	0.813	S	S	*	*			trans	-131.8	117.6	160.8	44.9	0	0	0	0	109.9	R241	R241-T243 HydrophobicContact CB-CG2 4.47Å
244	V	22.1	Very low	24.1	Very low	129 Å²	129	143.8 Å²	143.8	78%	0.782	82%	0.815	S	S	*	*			trans	-40.2	132.6	172.4	174.7	0	0	0	0	112.6
245	Y	24	Very low	23.9	Very low	206 Å²	206	144.3 Å²	144.3	81%	0.808	81%	0.814	S	S	*	*			trans	-134.3	107	152.5	-112.4	-82.6	0	0	0	112.4
246	R	21.4	Very low	23.6	Very low	222 Å²	222	145.6 Å²	145.6	84%	0.838	81%	0.811	S	S	*	*			trans	-108.4	116.8	168.5	179.4	-165.3	-146.5	162.7	9.1	107.8
247	R	23.4	Very low	23.2	Very low	200 Å²	200	144.6 Å²	144.6	76%	0.755	81%	0.807	S	S	*	*			trans	-161.4	117	159.1	-105.3	157.9	-172.4	-179.6	4.1	108.1
248	H	22.6	Very low	23.1	Very low	179 Å²	179	148.6 Å²	148.6	83%	0.829	81%	0.813	S	S	*	*				61.7	103.5	92.6	-77.2	-83.1	0	0	0	113
249	S	23.5	Very low	22.9	Very low	126 Å²	126	152.2 Å²	152.2	88%	0.881	82%	0.818	S	S	*	*			trans	-114.1	132.5	160.2	-56.4	0	0	0	0	108.3
250	A	22.6	Very low	23	Very low	103 Å²	103	152.6 Å²	152.6	85%	0.851	82%	0.821	S	S	*	*			trans	-150.4	131.1	175.6	0	0	0	0	0	110.1
251	G	22.4	Very low	22.7	Very low	66 Å²	66	147.6 Å²	147.6	68%	0.68	81%	0.812	S	S	*	*			trans	85.1	102.6	163.2	0	0	0	0	0	117.4
252	N	24.1	Very low	22.7	Very low	175 Å²	175	144.1 Å²	144.1	94%	0.936	81%	0.809	S	S	*	*			trans	58.4	133.1	139.4	-49.7	-12.9	0	0	0	120.4
253	G	23.5	Very low	22.8	Very low	66 Å²	66	139.9 Å²	139.9	68%	0.68	80%	0.8	S	S	*	*			cis	153.1	137.3	-10.1	0	0	0	0	0	114
254	S	21.9	Very low	22.7	Very low	123 Å²	123	137.9 Å²	137.9	86%	0.86	80%	0.803	S	S	*	*			trans	63.8	142.7	176.5	75.9	0	0	0	0	115.2
255	T	22.5	Very low	22.7	Very low	127 Å²	127	137.7 Å²	137.7	78%	0.779	80%	0.795	S	S	*	*			cis	-140.7	157.5	10.2	43.6	0	0	0	0	109.6
256	S	21.9	Very low	22.7	Very low	101 Å²	101	132.8 Å²	132.8	71%	0.706	79%	0.788	S	S	*	*			cis	-171.6	-167.4	-8	49.3	0	0	0	0	110.1
257	S	21.6	Very low	22.7	Very low	111 Å²	111	127.4 Å²	127.4	78%	0.776	78%	0.784	S	S	*	*			trans	69.8	141.4	170.5	49.4	0	0	0	0	119.2
258	E	22.4	Very low	22.6	Very low	195 Å²	195	123.1 Å²	123.1	91%	0.911	79%	0.785	S	S	*	*			trans	53.9	63.7	167.7	-52.4	-148	143.7	0	0	119.6
259	E	22.9	Very low	22.6	Very low	185 Å²	185	120.4 Å²	120.4	86%	0.864	78%	0.781	S	S	*	*			trans	-154.4	126.8	134.7	-124.9	172.9	-157.2	0	0	111.5	L261	E259-L261 PolarHBondContact O-N 3.35Å
260	S	24.1	Very low	22.6	Very low	126 Å²	126	122.8 Å²	122.8	88%	0.881	78%	0.776	S	S	*	*			trans	-92.4	78	-173	60.1	0	0	0	0	113
261	L	22.1	Very low	22.6	Very low	141 Å²	141	125.8 Å²	125.8	74%	0.738	77%	0.772	S	S	*	*			trans	-50.8	153.6	151	-57.3	174.4	0	0	0	110.4	E259	E259-L261 PolarHBondContact O-N 3.35Å
262	L	23.2	Very low	22.7	Very low	150 Å²	150	128.3 Å²	128.3	79%	0.785	78%	0.776	S	S	*	*			cis	-158.6	172.9	-3.2	-124.3	170.5	0	0	0	110.9
263	A	22.9	Very low	22.6	Very low	91 Å²	91	128.4 Å²	128.4	75%	0.752	78%	0.775	S	S	*	*			trans	-55.5	162.4	174.3	0	0	0	0	0	115.7
264	G	21.3	Very low	22.5	Very low	74 Å²	74	128.5 Å²	128.5	76%	0.763	78%	0.776	S	S	*	*			trans	-157.1	87.5	155.7	0	0	0	0	0	112.3
265	M	23	Very low	22.6	Very low	125 Å²	125	128 Å²	128	62%	0.616	77%	0.772	S	S	*	*			trans	-160.1	148.4	151.6	-91.8	-64	175.9	0	0	108.7	Y955	M265-Y955 HydrophobicContact CB-CD2 4.41Å; M265-Y955 HydrophobicContact CB-CE2 3.73Å; M265-Y955 HydrophobicContact CE-CD1 4.07Å; M265-Y955 HydrophobicContact CE-CD2 4.2Å; M265-Y955 HydrophobicContact CE-CE1 4.31Å; M265-Y955 HydrophobicContact CE-CE2 4.46Å; M265-Y955 HydrophobicContact CE-CG 3.99Å; M265-Y955 HydrophobicContact CG-CD2 3.63Å; M265-Y955 HydrophobicContact CG-CE2 3.35Å; M265-Y955 HydrophobicContact CG-CG 4.35Å; M265-Y955 HydrophobicContact SD-CD1 4.42Å; M265-Y955 HydrophobicContact SD-CD2 4.27Å; M265-Y955 HydrophobicContact SD-CE1 4.09Å; M265-Y955 HydrophobicContact SD-CE2 3.94Å; M265-Y955 HydrophobicContact SD-CG 4.49Å
266	P	23.3	Very low	22.6	Very low	102 Å²	102	131.4 Å²	131.4	66%	0.662	78%	0.779	S	S	*	*			trans	-89.6	162.1	-171.4	35.9	-35.8	0	0	0	114
267	S	20.6	Very low	22.8	Very low	109 Å²	109	132.8 Å²	132.8	76%	0.762	78%	0.783	S	S	*	*			trans	-73.1	163.6	175.4	48.5	0	0	0	0	113.9
268	S	22.1	Very low	23	Very low	111 Å²	111	132.6 Å²	132.6	78%	0.776	79%	0.788	S	S	*	*			trans	69.7	98.6	172.9	68.6	0	0	0	0	118.5
269	V	23.4	Very low	23.1	Very low	121 Å²	121	126.9 Å²	126.9	73%	0.733	78%	0.782	S	S	*	*				-141.4	110.5	129.5	-178.3	0	0	0	0	108.5
270	F	22.4	Very low	23.4	Very low	177 Å²	177	125.9 Å²	125.9	78%	0.776	78%	0.782	S	S	*	*			trans	-93.2	131.9	151.7	-92	-94	0	0	0	107
271	H	22.7	Very low	23.8	Very low	165 Å²	165	125.2 Å²	125.2	76%	0.764	78%	0.775	S	S	*	*			trans	-90.7	147.8	163.9	-89.6	-72.8	0	0	0	109.9
272	P	24.7	Very low	23.8	Very low	119 Å²	119	123.3 Å²	123.3	77%	0.773	78%	0.78	S	S	*	*				-127.6	168.6	123.3	36.8	-31.5	0	0	0	113.4
273	I	21.5	Very low	23.9	Very low	178 Å²	178	127.2 Å²	127.2	91%	0.913	78%	0.784	S	S	*	*			trans	-66.4	135.4	179.5	-64.3	154.4	0	0	0	110.7
274	G	22.6	Very low	23.9	Very low	68 Å²	68	126.3 Å²	126.3	70%	0.701	78%	0.776	S	S	*	*			trans	175.1	108.9	170	0	0	0	0	0	116.7
275	S	24.1	Very low	24.1	Very low	112 Å²	112	131 Å²	131	78%	0.783	78%	0.778	S	S	*	*			trans	68.2	102.7	160.3	-159.1	0	0	0	0	118.8
276	E	22	Very low	24.1	Very low	198 Å²	198	131.5 Å²	131.5	93%	0.925	78%	0.783	S	S	*	*			trans	-73.5	129.5	156	-63.2	179.8	133	0	0	110.2
277	V	26.7	Very low	24.3	Very low	130 Å²	130	133.3 Å²	133.3	79%	0.788	79%	0.793	S	S	*	*			trans	-137.6	113.3	159.1	-179.2	0	0	0	0	108.4
278	A	24	Very low	24.4	Very low	107 Å²	107	131.8 Å²	131.8	88%	0.884	79%	0.786	S	S	*	*			trans	-75.7	137.7	-177.6	0	0	0	0	0	112.5
279	G	25.8	Very low	24.4	Very low	75 Å²	75	133.1 Å²	133.1	77%	0.773	79%	0.79	S	S	*	*			trans	-144.9	113.9	172.1	0	0	0	0	0	110.3
280	N	28	Very low	24.6	Very low	165 Å²	165	133.3 Å²	133.3	88%	0.882	80%	0.797	S	S	*	*			trans	-75.8	155.8	-166.5	-110.2	-5.2	0	0	0	114.4
281	P	33.2	Very low	24.7	Very low	111 Å²	111	137.1 Å²	137.1	72%	0.721	81%	0.806	S	S	*	*			trans	-91.6	173.1	-169.5	37	-37.5	0	0	0	115.3
282	A	23.3	Very low	24.9	Very low	102 Å²	102	132.7 Å²	132.7	84%	0.843	80%	0.804	S	S	*	*			trans	72	152.6	179.1	0	0	0	0	0	114.8
283	R	24	Very low	24.9	Very low	232 Å²	232	139.3 Å²	139.3	88%	0.875	81%	0.814	S	S	*	*			cis	-153.7	126.8	21.3	179.8	174.8	176.5	166.1	-1.1	113.4
284	A	24.1	Very low	25.1	Very low	71 Å²	71	141.5 Å²	141.5	59%	0.587	81%	0.811	S	S	*	*			trans	54.2	141.7	145.6	0	0	0	0	0	123.2
285	Q	24	Very low	25.1	Very low	173 Å²	173	143 Å²	143	81%	0.808	82%	0.816	S	S	*	*			trans	69	146.7	141.9	-72.3	166.3	-12.1	0	0	117.8
286	N	23.4	Very low	25.2	Very low	135 Å²	135	146.5 Å²	146.5	72%	0.722	82%	0.818	S	S	*	*			cis	-155.6	-166.4	5.4	-124.6	-18.5	0	0	0	110.9
287	V	27	Very low	25.4	Very low	141 Å²	141	141.5 Å²	141.5	86%	0.855	81%	0.811	S	S	*	*			trans	84.3	138.3	171.7	-171	0	0	0	0	115.9
288	A	23.5	Very low	25.3	Very low	76 Å²	76	143.6 Å²	143.6	63%	0.628	81%	0.814	S	S	*	*				-172.7	152.2	-57.9	0	0	0	0	0	110.2
289	T	23	Very low	25.5	Very low	139 Å²	139	144.6 Å²	144.6	85%	0.853	81%	0.811	S	S	*	*			trans	38.3	106	152.5	56	0	0	0	0	120.4
290	S	27	Very low	25.4	Very low	125 Å²	125	144.4 Å²	144.4	87%	0.874	81%	0.809	S	S	*	*				-153.7	163.4	126.7	65.6	0	0	0	0	111.3
291	R	23.7	Very low	25.3	Very low	258 Å²	258	148.1 Å²	148.1	97%	0.974	81%	0.811	S	S	*	*			trans	-83.2	120.2	-172.7	-69.3	168.5	169.2	151.9	-6.9	111.1
292	G	27.9	Very low	25	Very low	71 Å²	71	147.6 Å²	147.6	73%	0.732	81%	0.81	S	S	*	*			trans	-146.4	127.5	171.8	0	0	0	0	0	112	R294	G292-R294 PolarHBondContact O-N 2.9Å
293	R	24.1	Very low	25.2	Very low	258 Å²	258	150.3 Å²	150.3	97%	0.974	82%	0.816	S	S	*	*			trans	-66.9	119.6	-178.4	-71.1	174.4	172.5	165.4	-4.3	111
294	R	25.3	Very low	25.2	Very low	225 Å²	225	149.8 Å²	149.8	85%	0.849	81%	0.814	S	S	*	*			trans	-119.8	98	155.3	-75.8	-168.7	-179.8	-176.2	1.4	109.6	G292 F296	G292-R294 PolarHBondContact O-N 2.9Å; R294-F296 PolarHBondContact O-N 3.33Å
295	A	23.4	Very low	25.4	Very low	98 Å²	98	151.4 Å²	151.4	81%	0.81	82%	0.817	S	S	*	*			trans	-81	88.6	169.2	0	0	0	0	0	109.2	A297	A295-A297 PolarHBondContact O-N 3.45Å
296	F	26.1	Very low	25.5	Very low	186 Å²	186	147.6 Å²	147.6	82%	0.816	82%	0.823	S	S	*	*			trans	-74.5	99.9	158	-100.3	-85.9	0	0	0	107.6	R294 M298	R294-F296 PolarHBondContact O-N 3.33Å; F296-M298 PolarHBondContact O-N 2.91Å
297	A	25.7	Very low	25.7	Very low	94 Å²	94	148.8 Å²	148.8	78%	0.777	83%	0.829	S	S	*	*			trans	-74.1	89.9	-175.9	0	0	0	0	0	110.9	A295 P299	A295-A297 PolarHBondContact O-N 3.45Å; A297-P299 VanDerWaalsContact O-CD 3.24Å; A297-P299 WeakPolarHBondContact O-CD 3.36Å
298	M	25.1	Very low	25.7	Very low	174 Å²	174	148.1 Å²	148.1	86%	0.857	82%	0.82	S	S	*	*			trans	-72.6	114.2	160.1	-76	-86.2	-89.7	0	0	108.9	F296 G300	F296-M298 PolarHBondContact O-N 2.91Å; M298-G300 PolarHBondContact O-N 3.05Å
299	P	27.7	Very low	25.9	Very low	128 Å²	128	152.2 Å²	152.2	83%	0.831	83%	0.827	S	S	*	*			trans	-77.6	65.9	169.8	34.1	-35.1	0	0	0	109.9	A297 R301	A297-P299 VanDerWaalsContact O-CD 3.24Å; A297-P299 WeakPolarHBondContact O-CD 3.36Å; P299-R301 PolarHBondContact O-N 3Å; P299-R301 VanDerWaalsContact O-N 3.11Å
300	G	23.3	Very low	26.2	Very low	71 Å²	71	153.4 Å²	153.4	73%	0.732	82%	0.824	S	S	*	*			trans	-68.5	105.4	176.3	0	0	0	0	0	111.2	M298	M298-G300 PolarHBondContact O-N 3.05Å
301	R	25.8	Very low	26.3	Very low	242 Å²	242	156.8 Å²	156.8	91%	0.913	82%	0.818	S	S	*	*			trans	-139.7	126.1	168	-114.5	179.5	178.5	-176.3	-0.8	112.4	P299	P299-R301 PolarHBondContact O-N 3Å; P299-R301 VanDerWaalsContact O-N 3.11Å
302	S	28.5	Very low	26.7	Very low	101 Å²	101	149.8 Å²	149.8	71%	0.706	80%	0.804	S	S	*	*			trans	64.3	59.7	169.7	-147.4	0	0	0	0	118.2	R304	S302-R304 PolarHBondContact O-N 3.32Å
303	V	26.4	Very low	26.7	Very low	158 Å²	158	156.1 Å²	156.1	96%	0.958	81%	0.812	S	S	*	*			trans	-71.2	79.1	151.5	-179.2	0	0	0	0	108.3
304	R	24.6	Very low	26.9	Very low	222 Å²	222	145.3 Å²	145.3	84%	0.838	78%	0.781	S	S	*	*			trans	-154.4	47.7	-178.7	-134.9	179.3	-164.7	-166.8	4.4	115.4	S302	S302-R304 PolarHBondContact O-N 3.32Å
305	T	27.6	Very low	27.2	Very low	105 Å²	105	140.1 Å²	140.1	64%	0.644	77%	0.77	S	S	*	*			trans	-150.3	24.9	170.8	-1.5	0	0	0	0	115	L307	T305-L307 PolarHBondContact O-N 3.01Å
306	G	26.9	Very low	27.5	Very low	92 Å²	92	142 Å²	142	95%	0.948	76%	0.764	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.7	38.2	178.2	0	0	0	0	0	115.6
307	L	27.8	Very low	27.7	Very low	161 Å²	161	136.7 Å²	136.7	84%	0.843	75%	0.754	S	S	*	*	T	Hydrogen-bonded Turn	trans	-140.6	0.6	-171.2	-120	152.7	0	0	0	114.2	T305	T305-L307 PolarHBondContact O-N 3.01Å
308	N	25.4	Very low	27.9	Very low	126 Å²	126	137.4 Å²	137.4	67%	0.674	74%	0.744	S	S	*	*			trans	-102	3.8	-179.3	-83.7	-17.3	0	0	0	115.1
309	Q	29.5	Very low	28.4	Very low	162 Å²	162	135.4 Å²	135.4	76%	0.757	74%	0.736	S	S	*	*	S	Bend	trans	-83.1	-3.3	179.7	-82.9	-173.9	-20.6	0	0	115.1
310	M	27.8	Very low	28.6	Very low	164 Å²	164	136.6 Å²	136.6	81%	0.808	73%	0.728	S	S	*	*			trans	-100.3	57.6	170.4	-75.7	-167.5	171.4	0	0	112.9
311	R	28.8	Very low	28.8	Very low	196 Å²	196	142.8 Å²	142.8	74%	0.74	73%	0.73	S	S	*	*			trans	-134	56.3	163.5	-83.1	-166.6	172.7	-178.8	-1.1	112.2	F313 G314	R311-F313 PolarHBondContact O-N 3.22Å; R311-G314 WeakPolarHBondContact O-CA 3.44Å; R311-G314 PolarHBondContact O-N 3.35Å
312	V	33.8	Very low	28.9	Very low	112 Å²	112	141 Å²	141	68%	0.679	72%	0.723	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.5	-29.3	170.8	179	0	0	0	0	111.7
313	F	27.9	Very low	28.8	Very low	203 Å²	203	141.3 Å²	141.3	89%	0.89	72%	0.723	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.7	-6.1	169.7	-85.9	-86.9	0	0	0	115.1	R311	R311-F313 PolarHBondContact O-N 3.22Å
314	G	27.7	Very low	28.7	Very low	32 Å²	32	140.9 Å²	140.9	33%	0.33	72%	0.715	S	S	.	*	T	Hydrogen-bonded Turn	trans	-82.4	-30.3	-176.3	0	0	0	0	0	114.7	R311 M316 A317	R311-G314 WeakPolarHBondContact O-CA 3.44Å; R311-G314 PolarHBondContact O-N 3.35Å; G314-M316 PolarHBondContact O-N 3.25Å; G314-A317 PolarHBondContact O-N 3.3Å
315	N	30.7	Very low	28.9	Very low	115 Å²	115	136.1 Å²	136.1	62%	0.615	71%	0.71	S	S	*	*	G	3₁₀ helix	trans	-73.2	-8.7	-172.4	-76	-4	0	0	0	114.3	A317 L318	N315-A317 PolarHBondContact O-N 2.94Å; N315-L318 PolarHBondContact O-N 3.43Å; N315-L318 VanDerWaalsContact O-N 3.16Å
316	M	31.2	Very low	28.8	Very low	139 Å²	139	136.4 Å²	136.4	69%	0.685	72%	0.717	S	S	*	*	G	3₁₀ helix	trans	-64.1	-23.7	173	-139.9	170	-164.2	0	0	112.3	G314 F320	G314-M316 PolarHBondContact O-N 3.25Å; M316-F320 WeakPolarHBondContact O-CD2 3.28Å
317	A	28.6	Very low	28.8	Very low	73 Å²	73	135.4 Å²	135.4	60%	0.603	71%	0.706	S	S	*	*	G	3₁₀ helix	trans	-73.9	-28.6	174.5	0	0	0	0	0	113.6	G314 N315 L319 F320	G314-A317 PolarHBondContact O-N 3.3Å; N315-A317 PolarHBondContact O-N 2.94Å; A317-L319 VanDerWaalsContact C-N 3.3Å; A317-L319 PolarHBondContact O-N 3.06Å; A317-F320 PolarHBondContact O-N 3.09Å
318	L	31.5	Very low	28.7	Very low	109 Å²	109	132.3 Å²	132.3	57%	0.571	70%	0.698	S	S	*	*	G	3₁₀ helix	trans	-74.6	-20	179.4	-83.3	168.6	0	0	0	113.1	N315 F320 R321	N315-L318 PolarHBondContact O-N 3.43Å; N315-L318 VanDerWaalsContact O-N 3.16Å; L318-F320 PolarHBondContact O-N 3.21Å; L318-R321 HydrophobicContact CD2-CB 4.46Å; L318-R321 PolarHBondContact O-N 3.36Å
319	L	34.9	Very low	28.9	Very low	132 Å²	132	135.5 Å²	135.5	69%	0.691	71%	0.709	S	S	*	*	G	3₁₀ helix	trans	-65	-13.4	170.1	-73.8	167.1	0	0	0	113.6	A317	A317-L319 VanDerWaalsContact C-N 3.3Å; A317-L319 PolarHBondContact O-N 3.06Å
320	F	31.1	Very low	29.1	Very low	153 Å²	153	133.7 Å²	133.7	67%	0.671	70%	0.703	S	S	*	*	G	3₁₀ helix	trans	-107.9	4.4	179	-63.8	-75.6	0	0	0	113.9	M316 A317 L318 R322	M316-F320 WeakPolarHBondContact O-CD2 3.28Å; A317-F320 PolarHBondContact O-N 3.09Å; L318-F320 PolarHBondContact O-N 3.21Å; F320-R322 PolarHBondContact O-N 3.31Å
321	R	28.2	Very low	29.4	Very low	201 Å²	201	130.4 Å²	130.4	76%	0.758	70%	0.702	S	S	*	*			trans	-75.9	92.6	177.8	-167.8	175.5	-170.4	175.3	2.9	110.4	L318	L318-R321 HydrophobicContact CD2-CB 4.46Å; L318-R321 PolarHBondContact O-N 3.36Å
322	R	26.9	Very low	29.9	Very low	205 Å²	205	125.8 Å²	125.8	77%	0.774	70%	0.695	S	S	*	*			trans	-49.8	131.4	166.2	-68.9	-177.3	178.9	-180	-0.8	109.8	F320	F320-R322 PolarHBondContact O-N 3.31Å
323	P	27.1	Very low	30.4	Very low	108 Å²	108	127.1 Å²	127.1	70%	0.701	69%	0.692	S	S	*	*			trans	-67.6	126.9	146.3	31.1	-29.9	0	0	0	107.1	V325	P323-V325 HydrophobicContact CB-CG2 4.39Å; P323-V325 PolarHBondContact O-N 2.92Å
324	N	23.8	Very low	31.4	Very low	149 Å²	149	125 Å²	125	80%	0.797	68%	0.683	S	S	*	*			trans	-76.7	71.9	169.7	-87.4	1.6	0	0	0	109.1	S326	N324-S326 PolarHBondContact O-N 2.87Å
325	V	29	Very low	32.9	Very low	122 Å²	122	125.5 Å²	125.5	74%	0.739	68%	0.679	S	S	*	*			trans	-79.9	101.1	157.9	-177.8	0	0	0	0	105.9	P323 G327	P323-V325 HydrophobicContact CB-CG2 4.39Å; P323-V325 PolarHBondContact O-N 2.92Å; V325-G327 PolarHBondContact O-N 2.83Å
326	S	26.3	Very low	34.5	Very low	111 Å²	111	120.1 Å²	120.1	78%	0.776	65%	0.65	S	S	*	*			trans	-57	119.7	164.7	43.2	0	0	0	0	108.2	N324 S328	N324-S326 PolarHBondContact O-N 2.87Å; S326-S328 PolarHBondContact O-N 3.41Å
327	G	26.7	Very low	36.2	Very low	70 Å²	70	114.3 Å²	114.3	72%	0.722	62%	0.621	S	S	*	*			trans	-67.3	98.7	-172.8	0	0	0	0	0	112.2	V325 E329	V325-G327 PolarHBondContact O-N 2.83Å; G327-E329 PolarHBondContact O-N 3.02Å
328	S	26.6	Very low	38.1	Very low	97 Å²	97	112.7 Å²	112.7	68%	0.678	61%	0.605	S	S	*	*			trans	-61.8	115	145.1	172.8	0	0	0	0	106.9	S326 I330	S326-S328 PolarHBondContact O-N 3.41Å; S328-I330 PolarHBondContact O-N 3.43Å
329	E	29	Very low	39.8	Very low	193 Å²	193	108.3 Å²	108.3	90%	0.902	58%	0.583	S	S	*	*			trans	-73.9	72	170.9	-72.3	-158.1	123.6	0	0	109.5	G327 A331	G327-E329 PolarHBondContact O-N 3.02Å; E329-A331 PolarHBondContact O-N 3.2Å
330	I	33.2	Very low	41.4	Very low	124 Å²	124	104.6 Å²	104.6	64%	0.636	57%	0.567	S	S	*	*			trans	-53.7	113.2	169.6	-60.3	177.3	0	0	0	107.1	S328 T332	S328-I330 PolarHBondContact O-N 3.43Å; I330-T332 VanDerWaalsContact C-N 3.32Å; I330-T332 PolarHBondContact O-N 3.31Å
331	A	33.6	Very low	43	Very low	95 Å²	95	100.5 Å²	100.5	79%	0.785	55%	0.552	S	S	*	*			trans	-67.8	85.3	-168.8	0	0	0	0	0	111.5	E329 K333	E329-A331 PolarHBondContact O-N 3.2Å; A331-K333 PolarHBondContact O-N 2.83Å; A331-K333 VanDerWaalsContact O-N 3.12Å
332	T	39.1	Very low	44.5	Very low	98 Å²	98	97.2 Å²	97.2	60%	0.601	56%	0.556	S	S	*	*			trans	-56.5	118.8	179	58.5	0	0	0	0	109.7	I330 K334	I330-T332 VanDerWaalsContact C-N 3.32Å; I330-T332 PolarHBondContact O-N 3.31Å; T332-K334 PolarHBondContact O-N 3.46Å; T332-K334 VanDerWaalsContact O-N 3.09Å
333	K	45.1	Very low	46.1	Very low	141 Å²	141	92.2 Å²	92.2	61%	0.613	55%	0.548	S	S	*	.			trans	-43.8	119	174.2	-91.8	-168.2	168.8	-168.8	0	109.9	D71 A331 V335	D71-K333 IonicContact OD2-NZ 3.67Å; D71-K333 PolarHBondContact OD2-NZ 2.86Å; A331-K333 PolarHBondContact O-N 2.83Å; A331-K333 VanDerWaalsContact O-N 3.12Å; K333-V335 VanDerWaalsContact C-N 3.3Å; K333-V335 PolarHBondContact O-N 2.91Å
334	K	48.7	Very low	47.5	Very low	159 Å²	159	96.7 Å²	96.7	69%	0.691	55%	0.551	S	S	*	*			trans	-79.9	81.6	179.5	-70.6	179.2	-177.4	169.9	0	109.4	T332 C336	T332-K334 PolarHBondContact O-N 3.46Å; T332-K334 VanDerWaalsContact O-N 3.09Å; K334-C336 PolarHBondContact O-N 3.28Å
335	V	59.2	Low	48.9	Very low	42 Å²	42	94.8 Å²	94.8	26%	0.255	54%	0.54	S	S	.	.			trans	-55.3	126.1	172.8	177.8	0	0	0	0	109.6	P69 K333 Y337	P69-V335 HydrophobicContact CB-CG1 3.42Å; P69-V335 VanDerWaalsContact CB-CG1 3.42Å; K333-V335 VanDerWaalsContact C-N 3.3Å; K333-V335 PolarHBondContact O-N 2.91Å; V335-Y337 HydrophobicContact CG1-CE2 3.94Å
336	C	64.3	Low	50.3	Low	1 Å²	1	98.5 Å²	98.5	1%	0.007	55%	0.547	C	S	.	.	B	Isolated β-bridge	trans	-127	127.8	-172.7	-168.6	0	0	0	0	110.2	S70 E72 K334	S70-C336 WeakPolarHBondContact CA-O 3.32Å; S70-C336 VanDerWaalsContact CB-O 3.27Å; S70-C336 WeakPolarHBondContact CB-O 3.46Å; S70-C336 PolarHBondContact N-O 3.21Å; S70-C336 PolarHBondContact O-N 3.26Å; E72-C336 HydrophobicContact CG-CB 4.02Å; K334-C336 PolarHBondContact O-N 3.28Å
337	Y	68.4	Low	52	Low	18 Å²	18	96.6 Å²	96.6	7%	0.071	54%	0.544	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	122.2	178.8	-65.1	-95.7	0	0	0	110	F64 Y67 P69 V335 V339 I353	F64-Y337 AromaticContact CD1-CD1 3.86Å; F64-Y337 HydrophobicContact CD1-CD1 3.86Å; F64-Y337 AromaticContact CD1-CD2 3.83Å; F64-Y337 HydrophobicContact CD1-CD2 3.83Å; F64-Y337 AromaticContact CD1-CE1 3.85Å; F64-Y337 HydrophobicContact CD1-CE1 3.85Å; F64-Y337 AromaticContact CD1-CE2 3.83Å; F64-Y337 HydrophobicContact CD1-CE2 3.83Å; F64-Y337 AromaticContact CD1-CG 3.84Å; F64-Y337 HydrophobicContact CD1-CG 3.84Å; F64-Y337 AromaticContact CD1-CZ 3.83Å; F64-Y337 HydrophobicContact CE1-CD1 4.32Å; F64-Y337 AromaticContact CE1-CD2 3.48Å; F64-Y337 HydrophobicContact CE1-CD2 3.48Å; F64-Y337 VanDerWaalsContact CE1-CD2 3.48Å; F64-Y337 HydrophobicContact CE1-CE1 4.49Å; F64-Y337 AromaticContact CE1-CE2 3.71Å; F64-Y337 HydrophobicContact CE1-CE2 3.71Å; F64-Y337 AromaticContact CE1-CG 3.82Å; F64-Y337 HydrophobicContact CE1-CG 3.82Å; Y67-Y337 WeakPolarHBondContact O-CD1 3.42Å; P69-Y337 HydrophobicContact CB-CE1 4.14Å; V335-Y337 HydrophobicContact CG1-CE2 3.94Å; Y337-V339 PolarHBondContact O-N 3.35Å; Y337-I353 PolarHBondContact N-O 3.43Å; Y337-I353 PolarHBondContact O-N 3.47Å
338	S	67.9	Low	53.4	Low	39 Å²	39	102.2 Å²	102.2	27%	0.273	54%	0.544	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	60.8	-169.3	55.3	0	0	0	0	113.3	S70 P340 H350	S70-S338 PolarHBondContact OG-OG 2.94Å; S338-P340 WeakPolarHBondContact O-CD 3.05Å; S338-H350 PolarHBondContact O-ND1 3.08Å
339	V	67	Low	55.2	Low	16 Å²	16	104.6 Å²	104.6	10%	0.097	54%	0.542	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.3	119.1	-170.5	-170.2	0	0	0	0	111.8	V63 Y67 Y337 L341 H350 L351 I353	V63-V339 HydrophobicContact CG1-CG2 3.5Å; Y67-V339 HydrophobicContact CD2-CG1 4.33Å; Y67-V339 HydrophobicContact CD2-CG2 4.47Å; Y67-V339 HydrophobicContact CE2-CG1 3.88Å; Y337-V339 PolarHBondContact O-N 3.35Å; V339-L341 PolarHBondContact O-N 3.02Å; V339-H350 CarbonylContact O-C 3.34Å; V339-H350 VanDerWaalsContact O-CA 3.27Å; V339-H350 WeakPolarHBondContact O-CA 3.31Å; V339-L351 PolarHBondContact N-O 3.16Å; V339-L351 PolarHBondContact O-N 3.11Å; V339-I353 HydrophobicContact CG2-CD1 3.68Å; V339-I353 HydrophobicContact CG2-CG1 4.21Å
340	P	67.4	Low	56.9	Low	54 Å²	54	99.8 Å²	99.8	35%	0.351	52%	0.519	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	131.3	175.6	28.2	-33.6	0	0	0	110.8	Y67 S338	Y67-P340 VanDerWaalsContact CE1-CD 3.48Å; Y67-P340 HydrophobicContact CE1-CG 3.78Å; S338-P340 WeakPolarHBondContact O-CD 3.05Å
341	L	64.6	Low	58.8	Low	68 Å²	68	98.2 Å²	98.2	36%	0.356	51%	0.512	S	S	.	.	P	Polyproline II helix	trans	-90.2	135.9	176.2	-73.1	171.6	0	0	0	110.7	V339 V343 K349 L351	V339-L341 PolarHBondContact O-N 3.02Å; L341-V343 PolarHBondContact O-N 2.97Å; L341-K349 PolarHBondContact N-O 3.27Å; L341-L351 HydrophobicContact CD1-CB 4.27Å; L341-L351 HydrophobicContact CD2-CB 4.43Å; L341-L351 HydrophobicContact CG-CB 4.23Å
342	P	60.9	Low	60.5	Low	131 Å²	131	99.2 Å²	99.2	85%	0.851	50%	0.498	S	S	*	.	S	Bend	trans	-71.7	-14.1	178.7	29.6	-35.3	0	0	0	113.6
343	V	60.5	Low	62	Low	101 Å²	101	95.9 Å²	95.9	61%	0.612	48%	0.477	S	S	*	.	S	Bend	trans	-136	139.5	179.4	-174.4	0	0	0	0	109.2	L341 L345	L341-V343 PolarHBondContact O-N 2.97Å; V343-L345 HydrophobicContact CG1-CD1 4.45Å; V343-L345 PolarHBondContact O-N 3.48Å
344	R	55.6	Low	63.1	Low	202 Å²	202	94.8 Å²	94.8	76%	0.762	47%	0.474	S	S	*	.			trans	-74.7	76.1	-178.5	-63	-174	-170.8	178.5	4.6	112.7
345	L	53	Low	64	Low	109 Å²	109	90.4 Å²	90.4	57%	0.571	46%	0.455	S	S	*	.	G	3₁₀ helix	trans	-70.9	130.4	163.3	-99.2	71.1	0	0	0	110.1	V343 G347 R348	V343-L345 HydrophobicContact CG1-CD1 4.45Å; V343-L345 PolarHBondContact O-N 3.48Å; L345-G347 PolarHBondContact O-N 2.89Å; L345-G347 VanDerWaalsContact O-N 3.09Å; L345-R348 PolarHBondContact O-N 2.66Å
346	F	59.5	Low	64.5	Low	200 Å²	200	90.6 Å²	90.6	88%	0.877	45%	0.454	S	S	*	.	G	3₁₀ helix	trans	46.8	41	173.7	-62.6	-81.6	0	0	0	115	R348	F346-R348 PolarHBondContact O-N 2.96Å
347	G	62.4	Low	64.9	Low	70 Å²	70	94.3 Å²	94.3	72%	0.722	47%	0.468	S	S	*	.	G	3₁₀ helix	trans	71.1	-10.9	172.1	0	0	0	0	0	116.8	L345	L345-G347 PolarHBondContact O-N 2.89Å; L345-G347 VanDerWaalsContact O-N 3.09Å
348	R	55.9	Low	64.9	Low	188 Å²	188	99.4 Å²	99.4	71%	0.709	50%	0.496	S	S	*	.			trans	-87.9	132.2	-178.4	-68.7	-176.9	174	-177.9	-2.2	111.3	L345 F346	L345-R348 PolarHBondContact O-N 2.66Å; F346-R348 PolarHBondContact O-N 2.96Å
349	K	63.2	Low	65	Low	148 Å²	148	104 Å²	104	64%	0.643	51%	0.507	S	S	*	.	S	Bend	trans	-78.6	-26	174.7	-66.3	-179.2	-177.1	176.1	0	113.2	L341	L341-K349 PolarHBondContact N-O 3.27Å
350	H	65.9	Low	65.5	Low	92 Å²	92	103.6 Å²	103.6	43%	0.426	50%	0.504	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	138.8	-176.7	-59.8	-100.6	0	0	0	111.3	S338 V339	S338-H350 PolarHBondContact O-ND1 3.08Å; V339-H350 CarbonylContact O-C 3.34Å; V339-H350 VanDerWaalsContact O-CA 3.27Å; V339-H350 WeakPolarHBondContact O-CA 3.31Å
351	L	72.4	Confident	65.9	Low	91 Å²	91	104 Å²	104	48%	0.476	51%	0.508	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	114.1	168.4	-178.4	66.6	0	0	0	108.9	V339 L341 I353	V339-L351 PolarHBondContact N-O 3.16Å; V339-L351 PolarHBondContact O-N 3.11Å; L341-L351 HydrophobicContact CD1-CB 4.27Å; L341-L351 HydrophobicContact CD2-CB 4.43Å; L341-L351 HydrophobicContact CG-CB 4.23Å; L351-I353 HydrophobicContact CD2-CD1 4.36Å; L351-I353 HydrophobicContact CD2-CG1 4.19Å; L351-I353 HydrophobicContact CG-CG1 4.15Å; L351-I353 PolarHBondContact O-N 3.34Å
352	K	69.5	Low	66.2	Low	115 Å²	115	102 Å²	102	50%	0.5	50%	0.5	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	96.8	177.1	-78	-169.5	173.2	-170	0	111.1	E72 H354	E72-K352 WeakPolarHBondContact OE1-CD 3.37Å; E72-K352 VanDerWaalsContact OE1-CE 3.27Å; E72-K352 WeakPolarHBondContact OE1-CE 3.36Å; E72-K352 IonicContact OE1-NZ 2.8Å; E72-K352 PolarHBondContact OE1-NZ 2.96Å; K352-H354 PolarHBondContact O-N 3.28Å; K352-H354 PolarHBondContact O-ND1 3.47Å
353	I	70.8	Confident	67	Low	29 Å²	29	96.1 Å²	96.1	15%	0.149	46%	0.461	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	102.9	177	-58.7	-178.8	0	0	0	108.7	L60 V63 F64 Y337 V339 L351 F355	L60-I353 HydrophobicContact CD2-CD1 4.09Å; V63-I353 HydrophobicContact CG1-CD1 4.34Å; F64-I353 HydrophobicContact CE1-CG2 4.39Å; F64-I353 HydrophobicContact CZ-CG2 4.45Å; Y337-I353 PolarHBondContact N-O 3.43Å; Y337-I353 PolarHBondContact O-N 3.47Å; V339-I353 HydrophobicContact CG2-CD1 3.68Å; V339-I353 HydrophobicContact CG2-CG1 4.21Å; L351-I353 HydrophobicContact CD2-CD1 4.36Å; L351-I353 HydrophobicContact CD2-CG1 4.19Å; L351-I353 HydrophobicContact CG-CG1 4.15Å; L351-I353 PolarHBondContact O-N 3.34Å; I353-F355 HydrophobicContact CG2-CB 3.67Å; I353-F355 PolarHBondContact O-N 3.05Å
354	H	68	Low	68.1	Low	118 Å²	118	92.7 Å²	92.7	55%	0.546	44%	0.438	S	S	.	.			trans	-82.4	38.6	177.9	-60.5	70.1	0	0	0	111.6	E72 K352	E72-H354 IonicContact OE2-NE2 2.68Å; K352-H354 PolarHBondContact O-N 3.28Å; K352-H354 PolarHBondContact O-ND1 3.47Å
355	F	67.8	Low	69.2	Low	67 Å²	67	83.5 Å²	83.5	29%	0.294	40%	0.404	S	S	.	.			trans	-128.2	124.4	-171.3	-151.6	-93.8	0	0	0	109.6	F64 I353 R359 L360 L363	F64-F355 WeakPolarHBondContact CE1-O 3.37Å; F64-F355 WeakPolarHBondContact CZ-O 3.25Å; I353-F355 HydrophobicContact CG2-CB 3.67Å; I353-F355 PolarHBondContact O-N 3.05Å; F355-R359 HydrophobicContact CE1-CB 4.23Å; F355-R359 HydrophobicContact CZ-CB 4.41Å; F355-L360 HydrophobicContact CD1-CB 4.32Å; F355-L360 HydrophobicContact CE1-CB 3.99Å; F355-L360 HydrophobicContact CE1-CD1 4.35Å; F355-L363 HydrophobicContact CE1-CD1 4.29Å; F355-L363 HydrophobicContact CZ-CD1 3.65Å
356	D	69.2	Low	70.3	Confident	45 Å²	45	82.5 Å²	82.5	24%	0.241	39%	0.393	C	S	.	.			trans	-88.4	146.7	-174.2	173.9	41	0	0	0	112.2	L358 R359 L360	D356-L358 VanDerWaalsContact C-N 3.3Å; D356-L358 PolarHBondContact O-N 2.85Å; D356-L358 VanDerWaalsContact OD2-CB 3.27Å; D356-L358 WeakPolarHBondContact OD2-CB 3.26Å; D356-L358 PolarHBondContact OD2-N 3.48Å; D356-R359 HydrophobicContact CB-CB 4.46Å; D356-R359 HydrophobicContact CB-CG 4.25Å; D356-R359 PolarHBondContact O-N 2.94Å; D356-L360 PolarHBondContact O-N 3.39Å
357	R	72.3	Confident	71	Confident	79 Å²	79	73.4 Å²	73.4	30%	0.298	35%	0.353	S	S	.	.	H	α-helix	trans	-58.1	-40.8	178	-175	-177.9	-174	133.5	19	111.9	F64 D65 L360 S361 R366	F64-R357 HydrophobicContact CB-CG 4.41Å; F64-R357 HydrophobicContact CD2-CB 4.05Å; F64-R357 HydrophobicContact CD2-CG 4.18Å; F64-R357 HydrophobicContact CE2-CB 4.5Å; F64-R357 HydrophobicContact CG-CB 4.37Å; F64-R357 PolarHBondContact O-NH1 3.47Å; D65-R357 IonicContact OD1-CZ 2.88Å; D65-R357 IonicContact OD1-NH1 3.8Å; D65-R357 PolarHBondContact OD1-NH1 2.95Å; D65-R357 IonicContact OD1-NH2 3.18Å; D65-R357 PolarHBondContact OD1-NH2 2.94Å; D65-R357 IonicContact OD2-NH2 3.36Å; R357-L360 PolarHBondContact O-N 3.35Å; R357-S361 PolarHBondContact O-N 3.09Å; R357-R366 VanDerWaalsContact NH2-NH1 3.1Å
358	L	68.6	Low	71.1	Confident	125 Å²	125	75.4 Å²	75.4	65%	0.654	35%	0.347	S	S	*	.	H	α-helix	trans	-65.9	-44.2	178.6	-58.3	170.8	0	0	0	110.4	D356 L360 S361 S362	D356-L358 VanDerWaalsContact C-N 3.3Å; D356-L358 PolarHBondContact O-N 2.85Å; D356-L358 VanDerWaalsContact OD2-CB 3.27Å; D356-L358 WeakPolarHBondContact OD2-CB 3.26Å; D356-L358 PolarHBondContact OD2-N 3.48Å; L358-L360 VanDerWaalsContact C-N 3.32Å; L358-L360 PolarHBondContact O-N 3.49Å; L358-S361 PolarHBondContact O-N 3.44Å; L358-S361 VanDerWaalsContact O-N 3.08Å; L358-S361 PolarHBondContact O-OG 3.38Å; L358-S362 PolarHBondContact O-N 2.85Å; L358-S362 PolarHBondContact O-OG 3.47Å
359	R	70.8	Confident	72.1	Confident	137 Å²	137	69.8 Å²	69.8	52%	0.517	33%	0.333	S	S	.	.	H	α-helix	trans	-61.3	-35.9	175.4	-65	-175.5	-179.9	-169.3	0	113	F355 D356 S362 L363	F355-R359 HydrophobicContact CE1-CB 4.23Å; F355-R359 HydrophobicContact CZ-CB 4.41Å; D356-R359 HydrophobicContact CB-CB 4.46Å; D356-R359 HydrophobicContact CB-CG 4.25Å; D356-R359 PolarHBondContact O-N 2.94Å; R359-S362 WeakPolarHBondContact CA-OG 3.49Å; R359-S362 PolarHBondContact O-OG 2.84Å; R359-L363 PolarHBondContact O-N 3.38Å
360	L	78.1	Confident	72.9	Confident	7 Å²	7	70.2 Å²	70.2	4%	0.037	33%	0.331	C	S	.	.	H	α-helix	trans	-65.8	-43.5	171.9	-175.7	61.5	0	0	0	111.4	V57 L60 N61 F64 F355 D356 R357 L358 S362 L363 F364	V57-L360 HydrophobicContact CG2-CD1 4.29Å; L60-L360 HydrophobicContact CB-CD2 3.54Å; L60-L360 HydrophobicContact CD1-CD1 4.22Å; L60-L360 HydrophobicContact CD1-CD2 4.2Å; N61-L360 WeakPolarHBondContact ND2-CD2 3.2Å; F64-L360 HydrophobicContact CD2-CD2 4.14Å; F64-L360 HydrophobicContact CE2-CB 4.24Å; F64-L360 HydrophobicContact CE2-CD2 3.71Å; F355-L360 HydrophobicContact CD1-CB 4.32Å; F355-L360 HydrophobicContact CE1-CB 3.99Å; F355-L360 HydrophobicContact CE1-CD1 4.35Å; D356-L360 PolarHBondContact O-N 3.39Å; R357-L360 PolarHBondContact O-N 3.35Å; L358-L360 VanDerWaalsContact C-N 3.32Å; L358-L360 PolarHBondContact O-N 3.49Å; L360-S362 VanDerWaalsContact C-N 3.35Å; L360-S362 PolarHBondContact O-N 3.29Å; L360-L363 PolarHBondContact O-N 3.28Å; L360-F364 HydrophobicContact CD1-CD2 4.47Å; L360-F364 PolarHBondContact O-N 3.39Å
361	S	74.3	Confident	73.7	Confident	61 Å²	61	72.1 Å²	72.1	43%	0.427	34%	0.343	S	S	.	.	H	α-helix	trans	-69.3	-26.1	-179.4	74.8	0	0	0	0	114.4	R357 L358 K417	R357-S361 PolarHBondContact O-N 3.09Å; L358-S361 PolarHBondContact O-N 3.44Å; L358-S361 VanDerWaalsContact O-N 3.08Å; L358-S361 PolarHBondContact O-OG 3.38Å; S361-K417 PolarHBondContact O-NZ 3.24Å
362	S	72.5	Confident	74.2	Confident	26 Å²	26	69 Å²	69	18%	0.182	33%	0.329	C	S	.	.	H	α-helix	trans	-72.1	-41	169.2	53	0	0	0	0	111.6	Q6 H14 L358 R359 L360 K417	Q6-S362 PolarHBondContact OE1-O 3.01Å; H14-S362 PolarHBondContact CE1-O 2.95Å; L358-S362 PolarHBondContact O-N 2.85Å; L358-S362 PolarHBondContact O-OG 3.47Å; R359-S362 WeakPolarHBondContact CA-OG 3.49Å; R359-S362 PolarHBondContact O-OG 2.84Å; L360-S362 VanDerWaalsContact C-N 3.35Å; L360-S362 PolarHBondContact O-N 3.29Å; S362-K417 WeakPolarHBondContact O-CD 3.48Å; S362-K417 WeakPolarHBondContact O-CE 3.33Å
363	L	77	Confident	75	Confident	9 Å²	9	64.1 Å²	64.1	5%	0.047	31%	0.308	C	S	.	.	H	α-helix	trans	-68	-48	179.2	-82.3	161.4	0	0	0	113.8	F9 C10 V13 H14 F355 R359 L360	F9-L363 HydrophobicContact CE1-CD1 4.14Å; C10-L363 HydrophobicContact CB-CD2 4.13Å; C10-L363 HydrophobicContact CB-CG 4.34Å; V13-L363 HydrophobicContact CB-CD2 3.86Å; V13-L363 HydrophobicContact CG1-CD2 3.77Å; V13-L363 HydrophobicContact CG2-CD2 4.42Å; H14-L363 PolarHBondContact NE2-O 2.92Å; F355-L363 HydrophobicContact CE1-CD1 4.29Å; F355-L363 HydrophobicContact CZ-CD1 3.65Å; R359-L363 PolarHBondContact O-N 3.38Å; L360-L363 PolarHBondContact O-N 3.28Å
364	F	84	Confident	75.8	Confident	28 Å²	28	66.1 Å²	66.1	12%	0.123	33%	0.325	C	S	.	.	S	Bend	trans	-139.2	148.1	-174.6	-62.9	-66.8	0	0	0	111.7	L17 T53 V57 L360 L416	L17-F364 HydrophobicContact CD1-CE1 3.92Å; L17-F364 HydrophobicContact CD1-CZ 3.84Å; T53-F364 HydrophobicContact CG2-CD1 4.35Å; T53-F364 HydrophobicContact CG2-CE1 3.76Å; T53-F364 HydrophobicContact CG2-CE2 4.07Å; T53-F364 HydrophobicContact CG2-CZ 3.59Å; V57-F364 HydrophobicContact CG1-CB 4.04Å; V57-F364 HydrophobicContact CG2-CB 3.7Å; V57-F364 HydrophobicContact CG2-CD2 3.45Å; V57-F364 VanDerWaalsContact CG2-CD2 3.45Å; V57-F364 HydrophobicContact CG2-CE2 4.23Å; V57-F364 HydrophobicContact CG2-CG 3.7Å; L360-F364 HydrophobicContact CD1-CD2 4.47Å; L360-F364 PolarHBondContact O-N 3.39Å; F364-L416 HydrophobicContact CD1-CB 4.05Å; F364-L416 HydrophobicContact CE1-CB 4.13Å; F364-L416 HydrophobicContact CE1-CD1 4.45Å; F364-L416 HydrophobicContact CE1-CD2 4.38Å
365	D	78.3	Confident	76.7	Confident	9 Å²	9	62.4 Å²	62.4	5%	0.048	31%	0.314	C	S	.	.			trans	-78	146.4	175.9	-74.3	-21.1	0	0	0	112.5	N367 L416 K417 S418 Y430	D365-N367 PolarHBondContact O-N 2.9Å; D365-L416 PolarHBondContact N-O 2.67Å; D365-L416 VanDerWaalsContact N-O 3.15Å; D365-K417 WeakPolarHBondContact OD1-CD 3.27Å; D365-K417 WeakPolarHBondContact OD1-CE 3.49Å; D365-K417 IonicContact OD1-NZ 3.8Å; D365-K417 PolarHBondContact OD1-NZ 2.87Å; D365-S418 WeakPolarHBondContact OD2-CB 3.33Å; D365-S418 PolarHBondContact OD2-N 3.2Å; D365-S418 PolarHBondContact OD2-OG 2.97Å; D365-Y430 HydrophobicContact CB-CE2 3.91Å
366	R	76.1	Confident	77.7	Confident	89 Å²	89	59.3 Å²	59.3	34%	0.336	30%	0.301	S	S	.	.			trans	-78.8	113.8	-174.8	-179.8	-175.8	170.6	151.9	12.1	111.7	D65 R357 L368	D65-R366 IonicContact OD1-NH1 2.7Å; D65-R366 IonicContact OD2-CZ 3.53Å; D65-R366 IonicContact OD2-NH1 2.84Å; D65-R366 PolarHBondContact OD2-NH1 3.27Å; D65-R366 IonicContact OD2-NH2 3.63Å; D65-R366 PolarHBondContact OD2-NH2 2.96Å; R357-R366 VanDerWaalsContact NH2-NH1 3.1Å; R366-L368 PolarHBondContact O-N 3.43Å
367	N	73.4	Confident	78.8	Confident	9 Å²	9	58.4 Å²	58.4	5%	0.048	30%	0.297	C	S	.	.			trans	-76.2	113.7	166.7	-69.7	30.3	0	0	0	110.1	K54 D365 L373 D376	K54-N367 PolarHBondContact NZ-OD1 2.89Å; D365-N367 PolarHBondContact O-N 2.9Å; N367-L373 WeakPolarHBondContact ND2-CA 3.48Å; N367-D376 PolarHBondContact ND2-OD2 2.75Å; N367-D376 PolarHBondContact OD1-OD2 3.25Å
368	L	65.6	Low	79.7	Confident	112 Å²	112	57.3 Å²	57.3	59%	0.586	31%	0.305	S	S	*	.			trans	-82.2	-22.4	-178.1	-76.7	160.9	0	0	0	113.6	R366	R366-L368 PolarHBondContact O-N 3.43Å
369	T	77	Confident	80.8	Confident	69 Å²	69	52.6 Å²	52.6	42%	0.423	28%	0.28	S	S	.	.	S	Bend	trans	-138	154.6	-176.6	67.9	0	0	0	0	112.7	I371 S372 L373	T369-I371 PolarHBondContact O-N 3.03Å; T369-S372 PolarHBondContact N-OG 3.48Å; T369-S372 VanDerWaalsContact N-OG 3.07Å; T369-S372 PolarHBondContact O-N 3Å; T369-S372 PolarHBondContact O-OG 3.16Å; T369-S372 PolarHBondContact OG1-N 2.91Å; T369-S372 PolarHBondContact OG1-OG 2.87Å; T369-L373 PolarHBondContact O-N 3.19Å; T369-L373 VanDerWaalsContact O-N 3.08Å
370	W	79.3	Confident	81.8	Confident	157 Å²	157	46 Å²	46	60%	0.595	26%	0.255	S	S	*	.	H	α-helix	trans	-57.6	-32.4	168.7	-71.7	105.5	0	0	0	112.5	W58 L373 S374	W58-W370 HydrophobicContact CD2-CH2 4.35Å; W58-W370 HydrophobicContact CD2-CZ2 4.26Å; W58-W370 AromaticContact CE2-CZ2 3.93Å; W58-W370 HydrophobicContact CE3-CH2 4.02Å; W58-W370 HydrophobicContact CE3-CZ2 4.11Å; W58-W370 HydrophobicContact CH2-CH2 4.07Å; W58-W370 AromaticContact CH2-CZ2 3.37Å; W58-W370 HydrophobicContact CH2-CZ2 3.37Å; W58-W370 AromaticContact CZ2-CE2 3.77Å; W58-W370 HydrophobicContact CZ2-CH2 4.34Å; W58-W370 AromaticContact CZ2-CZ2 3.49Å; W58-W370 HydrophobicContact CZ2-CZ2 3.49Å; W58-W370 VanDerWaalsContact CZ2-CZ2 3.49Å; W58-W370 AromaticContact CZ2-NE1 3.87Å; W58-W370 AromaticContact CZ3-CH2 3.88Å; W58-W370 HydrophobicContact CZ3-CH2 3.88Å; W58-W370 AromaticContact CZ3-CZ2 3.68Å; W58-W370 HydrophobicContact CZ3-CZ2 3.68Å; W370-L373 HydrophobicContact CE3-CD2 3.68Å; W370-L373 HydrophobicContact CZ3-CD2 3.66Å; W370-L373 WeakPolarHBondContact O-CB 3.35Å; W370-L373 PolarHBondContact O-N 3.12Å; W370-S374 PolarHBondContact O-N 3.32Å; W370-S374 PolarHBondContact O-OG 3.32Å
371	I	82.9	Confident	82.5	Confident	133 Å²	133	47.8 Å²	47.8	68%	0.682	27%	0.266	S	S	*	.	H	α-helix	trans	-63.1	-50.3	175.4	-57.1	176.1	0	0	0	110	T369 L373 S374 A375	T369-I371 PolarHBondContact O-N 3.03Å; I371-L373 VanDerWaalsContact C-N 3.3Å; I371-L373 PolarHBondContact O-N 3.06Å; I371-S374 PolarHBondContact O-N 3.23Å; I371-S374 VanDerWaalsContact O-N 3.15Å; I371-S374 PolarHBondContact O-OG 3.4Å; I371-A375 WeakPolarHBondContact O-CB 3.39Å; I371-A375 PolarHBondContact O-N 2.9Å
372	S	82.3	Confident	83.5	Confident	24 Å²	24	48 Å²	48	17%	0.168	27%	0.265	C	S	.	.	H	α-helix	trans	-59.3	-38.1	175	46.8	0	0	0	0	112.9	T369 A375 D376 Y436	T369-S372 PolarHBondContact N-OG 3.48Å; T369-S372 VanDerWaalsContact N-OG 3.07Å; T369-S372 PolarHBondContact O-N 3Å; T369-S372 PolarHBondContact O-OG 3.16Å; T369-S372 PolarHBondContact OG1-N 2.91Å; T369-S372 PolarHBondContact OG1-OG 2.87Å; S372-A375 PolarHBondContact O-N 2.94Å; S372-D376 PolarHBondContact O-N 3.29Å; S372-D376 VanDerWaalsContact O-OD1 3.09Å; S372-Y436 PolarHBondContact O-OH 3.14Å
373	L	86.7	Confident	84.5	Confident	13 Å²	13	46.8 Å²	46.8	7%	0.068	26%	0.256	C	S	.	.	H	α-helix	trans	-61.2	-46.4	173.4	177.5	63.9	0	0	0	112.5	K54 T55 N367 T369 W370 I371 A375 D376 V377	K54-L373 HydrophobicContact CB-CD1 3.32Å; K54-L373 HydrophobicContact CG-CD1 4.37Å; T55-L373 HydrophobicContact CG2-CD2 4.1Å; N367-L373 WeakPolarHBondContact ND2-CA 3.48Å; T369-L373 PolarHBondContact O-N 3.19Å; T369-L373 VanDerWaalsContact O-N 3.08Å; W370-L373 HydrophobicContact CE3-CD2 3.68Å; W370-L373 HydrophobicContact CZ3-CD2 3.66Å; W370-L373 WeakPolarHBondContact O-CB 3.35Å; W370-L373 PolarHBondContact O-N 3.12Å; I371-L373 VanDerWaalsContact C-N 3.3Å; I371-L373 PolarHBondContact O-N 3.06Å; L373-A375 VanDerWaalsContact C-N 3.33Å; L373-A375 PolarHBondContact O-N 2.97Å; L373-D376 PolarHBondContact O-N 2.81Å; L373-V377 WeakPolarHBondContact O-CG2 3.37Å; L373-V377 PolarHBondContact O-N 3.49Å
374	S	87.1	Confident	85.2	Confident	71 Å²	71	46.3 Å²	46.3	50%	0.497	25%	0.254	S	S	.	.	H	α-helix	trans	-65.8	-35.9	178	66.7	0	0	0	0	112.6	W370 I371 A378	W370-S374 PolarHBondContact O-N 3.32Å; W370-S374 PolarHBondContact O-OG 3.32Å; I371-S374 PolarHBondContact O-N 3.23Å; I371-S374 VanDerWaalsContact O-N 3.15Å; I371-S374 PolarHBondContact O-OG 3.4Å; S374-A378 VanDerWaalsContact O-CB 3.25Å; S374-A378 WeakPolarHBondContact O-CB 3.47Å; S374-A378 PolarHBondContact O-N 3.33Å
375	A	88.1	Confident	85.5	Confident	40 Å²	40	46.7 Å²	46.7	33%	0.331	26%	0.258	S	S	.	.	H	α-helix	trans	-66.8	-42.9	177.5	0	0	0	0	0	112.2	I371 S372 L373 L379 Y436	I371-A375 WeakPolarHBondContact O-CB 3.39Å; I371-A375 PolarHBondContact O-N 2.9Å; S372-A375 PolarHBondContact O-N 2.94Å; L373-A375 VanDerWaalsContact C-N 3.33Å; L373-A375 PolarHBondContact O-N 2.97Å; A375-L379 WeakPolarHBondContact O-CB 3.29Å; A375-L379 PolarHBondContact O-N 2.94Å; A375-Y436 HydrophobicContact CB-CE1 4.21Å
376	D	88.7	Confident	86.2	Confident	2 Å²	2	46.7 Å²	46.7	1%	0.011	26%	0.258	C	S	.	.	H	α-helix	trans	-57.5	-50.3	175.6	-66.8	-2.7	0	0	0	111.5	K54 N367 S372 L373 A380 Y436	K54-D376 WeakPolarHBondContact CE-OD2 3.28Å; K54-D376 IonicContact NZ-OD2 2.59Å; K54-D376 PolarHBondContact NZ-OD2 2.75Å; N367-D376 PolarHBondContact ND2-OD2 2.75Å; N367-D376 PolarHBondContact OD1-OD2 3.25Å; S372-D376 PolarHBondContact O-N 3.29Å; S372-D376 VanDerWaalsContact O-OD1 3.09Å; L373-D376 PolarHBondContact O-N 2.81Å; D376-A380 WeakPolarHBondContact O-CB 3.32Å; D376-A380 PolarHBondContact O-N 3.49Å; D376-Y436 WeakPolarHBondContact OD1-CE1 3.21Å; D376-Y436 PolarHBondContact OD1-OH 3.48Å
377	V	90.7	Very high	86.8	Confident	27 Å²	27	42.6 Å²	42.6	16%	0.164	24%	0.243	C	C	.	.	H	α-helix	trans	-65.9	-48.7	-177.5	173.5	0	0	0	0	110.6	F50 V51 L373 L379 A380 V381	F50-V377 HydrophobicContact CB-CG2 4.36Å; V51-V377 HydrophobicContact CG2-CB 4.36Å; V51-V377 HydrophobicContact CG2-CG1 3.6Å; V51-V377 HydrophobicContact CG2-CG2 3.8Å; L373-V377 WeakPolarHBondContact O-CG2 3.37Å; L373-V377 PolarHBondContact O-N 3.49Å; V377-L379 VanDerWaalsContact C-N 3.32Å; V377-L379 PolarHBondContact O-N 3.41Å; V377-A380 PolarHBondContact O-N 3.12Å; V377-V381 WeakPolarHBondContact O-CG2 2.99Å; V377-V381 PolarHBondContact O-N 3.17Å; V377-V381 VanDerWaalsContact O-N 3.09Å
378	A	92	Very high	87.5	Confident	56 Å²	56	42.3 Å²	42.3	46%	0.463	24%	0.242	S	C	.	.	H	α-helix	trans	-59.5	-43.8	179.3	0	0	0	0	0	111.5	S374 V381 V382	S374-A378 VanDerWaalsContact O-CB 3.25Å; S374-A378 WeakPolarHBondContact O-CB 3.47Å; S374-A378 PolarHBondContact O-N 3.33Å; A378-V381 PolarHBondContact O-N 3.3Å; A378-V382 VanDerWaalsContact O-CG2 3.31Å; A378-V382 WeakPolarHBondContact O-CG2 3.34Å; A378-V382 PolarHBondContact O-N 3.05Å
379	L	92	Very high	88.6	Confident	25 Å²	25	40 Å²	40	13%	0.131	23%	0.23	C	C	.	.	H	α-helix	trans	-72.9	-34.7	-178.4	-170.6	61.8	0	0	0	112.6	A375 V377 V381 V382 V383 L415 Y436 P439 V440	A375-L379 WeakPolarHBondContact O-CB 3.29Å; A375-L379 PolarHBondContact O-N 2.94Å; V377-L379 VanDerWaalsContact C-N 3.32Å; V377-L379 PolarHBondContact O-N 3.41Å; L379-V381 VanDerWaalsContact C-N 3.32Å; L379-V381 PolarHBondContact O-N 2.96Å; L379-V382 PolarHBondContact O-N 2.9Å; L379-V383 WeakPolarHBondContact O-CG2 3.44Å; L379-V383 PolarHBondContact O-N 3.32Å; L379-L415 HydrophobicContact CB-CD1 4.29Å; L379-L415 HydrophobicContact CD2-CD2 4.27Å; L379-L415 HydrophobicContact CG-CD1 4.43Å; L379-Y436 HydrophobicContact CD2-CD1 4.04Å; L379-P439 HydrophobicContact CD2-CB 3.79Å; L379-P439 HydrophobicContact CD2-CG 3.67Å; L379-P439 HydrophobicContact CG-CB 3.93Å; L379-P439 HydrophobicContact CG-CG 4.32Å; L379-V440 HydrophobicContact CD1-CG2 4.18Å; L379-V440 HydrophobicContact CD2-CG2 3.64Å
380	A	92.2	Very high	89.2	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-61.1	-40.9	171.8	0	0	0	0	0	112	V46 F50 D376 V377 S384 L415	V46-A380 HydrophobicContact CG1-CB 4.43Å; F50-A380 HydrophobicContact CB-CB 4.47Å; F50-A380 HydrophobicContact CD1-CB 3.81Å; F50-A380 HydrophobicContact CD2-CB 3.93Å; F50-A380 HydrophobicContact CE1-CB 3.97Å; F50-A380 HydrophobicContact CE2-CB 4.08Å; F50-A380 HydrophobicContact CG-CB 3.78Å; F50-A380 HydrophobicContact CZ-CB 4.11Å; D376-A380 WeakPolarHBondContact O-CB 3.32Å; D376-A380 PolarHBondContact O-N 3.49Å; V377-A380 PolarHBondContact O-N 3.12Å; A380-S384 PolarHBondContact O-N 3.44Å; A380-L415 HydrophobicContact CB-CD1 3.96Å
381	V	93.1	Very high	89.6	Confident	43 Å²	43	30.4 Å²	30.4	26%	0.261	19%	0.187	S	C	.	.	H	α-helix	trans	-66.7	-46.4	174.5	173.3	0	0	0	0	111.1	V377 A378 L379 V383 S384 V385	V377-V381 WeakPolarHBondContact O-CG2 2.99Å; V377-V381 PolarHBondContact O-N 3.17Å; V377-V381 VanDerWaalsContact O-N 3.09Å; A378-V381 PolarHBondContact O-N 3.3Å; L379-V381 VanDerWaalsContact C-N 3.32Å; L379-V381 PolarHBondContact O-N 2.96Å; V381-V383 VanDerWaalsContact C-N 3.33Å; V381-V383 PolarHBondContact O-N 3.48Å; V381-S384 WeakPolarHBondContact CA-OG 3.47Å; V381-S384 PolarHBondContact O-N 2.99Å; V381-S384 VanDerWaalsContact O-N 3.1Å; V381-S384 PolarHBondContact O-OG 3.49Å; V381-V385 HydrophobicContact CG1-CG2 4.45Å; V381-V385 WeakPolarHBondContact O-CG2 3.45Å; V381-V385 PolarHBondContact O-N 3.36Å
382	V	94	Very high	89.7	Confident	66 Å²	66	28 Å²	28	40%	0.4	17%	0.174	S	C	.	.	H	α-helix	trans	-59.2	-41.6	176.7	168.8	0	0	0	0	111.9	A378 L379 V385 I386	A378-V382 VanDerWaalsContact O-CG2 3.31Å; A378-V382 WeakPolarHBondContact O-CG2 3.34Å; A378-V382 PolarHBondContact O-N 3.05Å; L379-V382 PolarHBondContact O-N 2.9Å; V382-V385 PolarHBondContact O-N 3.24Å; V382-I386 HydrophobicContact CG1-CD1 3.56Å; V382-I386 HydrophobicContact CG1-CG1 4.44Å; V382-I386 WeakPolarHBondContact O-CB 3.37Å; V382-I386 WeakPolarHBondContact O-CD1 3.3Å; V382-I386 VanDerWaalsContact O-CG1 3.26Å; V382-I386 WeakPolarHBondContact O-CG1 3.38Å; V382-I386 PolarHBondContact O-N 2.97Å
383	V	93.8	Very high	89.7	Confident	0 Å²	0	30.8 Å²	30.8	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-63.8	-42	173.8	170.5	0	0	0	0	111.7	L379 V381 I386 A387 A411 Q412 P439 F442	L379-V383 WeakPolarHBondContact O-CG2 3.44Å; L379-V383 PolarHBondContact O-N 3.32Å; V381-V383 VanDerWaalsContact C-N 3.33Å; V381-V383 PolarHBondContact O-N 3.48Å; V383-I386 PolarHBondContact O-N 3.25Å; V383-A387 VanDerWaalsContact O-CB 3.28Å; V383-A387 WeakPolarHBondContact O-CB 3.49Å; V383-A387 PolarHBondContact O-N 3.19Å; V383-A411 HydrophobicContact CG1-CB 4.26Å; V383-Q412 HydrophobicContact CB-CG 4.32Å; V383-Q412 HydrophobicContact CG1-CG 3.79Å; V383-P439 HydrophobicContact CG2-CB 3.62Å; V383-F442 HydrophobicContact CB-CD1 4.49Å; V383-F442 HydrophobicContact CG1-CD1 3.85Å; V383-F442 HydrophobicContact CG1-CE1 4.01Å; V383-F442 HydrophobicContact CG2-CD1 4.32Å
384	S	91.3	Very high	89.5	Confident	0 Å²	0	35.2 Å²	35.2	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-64.3	-40.3	178.4	72.6	0	0	0	0	112.9	S43 A380 V381 F388	S43-S384 WeakPolarHBondContact CA-OG 3.26Å; S43-S384 VanDerWaalsContact CB-OG 3.24Å; S43-S384 WeakPolarHBondContact CB-OG 3.41Å; A380-S384 PolarHBondContact O-N 3.44Å; V381-S384 WeakPolarHBondContact CA-OG 3.47Å; V381-S384 PolarHBondContact O-N 2.99Å; V381-S384 VanDerWaalsContact O-N 3.1Å; V381-S384 PolarHBondContact O-OG 3.49Å; S384-F388 WeakPolarHBondContact O-CB 3.48Å; S384-F388 PolarHBondContact O-N 2.92Å; S384-F388 VanDerWaalsContact O-N 3.15Å
385	V	91.6	Very high	89.2	Confident	36 Å²	36	34.5 Å²	34.5	22%	0.218	20%	0.2	C	C	.	.	H	α-helix	trans	-66.9	-47.7	175.9	171	0	0	0	0	110.8	M39 V381 V382 F388 L389	M39-V385 HydrophobicContact CE-CG1 4.41Å; M39-V385 HydrophobicContact SD-CG1 4.04Å; V381-V385 HydrophobicContact CG1-CG2 4.45Å; V381-V385 WeakPolarHBondContact O-CG2 3.45Å; V381-V385 PolarHBondContact O-N 3.36Å; V382-V385 PolarHBondContact O-N 3.24Å; V385-F388 PolarHBondContact O-N 2.99Å; V385-L389 HydrophobicContact CG1-CD1 3.87Å; V385-L389 HydrophobicContact CG1-CG 4.36Å; V385-L389 WeakPolarHBondContact O-CG 3.21Å; V385-L389 PolarHBondContact O-N 2.86Å
386	I	91.5	Very high	89	Confident	9 Å²	9	33.6 Å²	33.6	5%	0.046	19%	0.188	C	C	.	.	H	α-helix	trans	-65.1	-42.4	-179.2	-69.6	167.1	0	0	0	111.5	V382 V383 F388 L389 L390 F442 T447	V382-I386 HydrophobicContact CG1-CD1 3.56Å; V382-I386 HydrophobicContact CG1-CG1 4.44Å; V382-I386 WeakPolarHBondContact O-CB 3.37Å; V382-I386 WeakPolarHBondContact O-CD1 3.3Å; V382-I386 VanDerWaalsContact O-CG1 3.26Å; V382-I386 WeakPolarHBondContact O-CG1 3.38Å; V382-I386 PolarHBondContact O-N 2.97Å; V383-I386 PolarHBondContact O-N 3.25Å; I386-F388 VanDerWaalsContact C-N 3.28Å; I386-F388 PolarHBondContact O-N 2.99Å; I386-L389 PolarHBondContact O-N 3.44Å; I386-L390 HydrophobicContact CG2-CD1 4.14Å; I386-L390 HydrophobicContact CG2-CG 4.49Å; I386-L390 WeakPolarHBondContact O-CG 3.36Å; I386-L390 PolarHBondContact O-N 3.47Å; I386-F442 HydrophobicContact CG2-CE1 4.13Å; I386-T447 HydrophobicContact CD1-CG2 3.7Å; I386-T447 HydrophobicContact CG1-CG2 4.3Å
387	A	90	Very high	88.5	Confident	2 Å²	2	42.7 Å²	42.7	2%	0.017	22%	0.222	C	C	.	.	H	α-helix	trans	-58.8	-42.4	174.9	0	0	0	0	0	111.4	V383 L390 L391 A408 F442	V383-A387 VanDerWaalsContact O-CB 3.28Å; V383-A387 WeakPolarHBondContact O-CB 3.49Å; V383-A387 PolarHBondContact O-N 3.19Å; A387-L390 PolarHBondContact O-N 2.93Å; A387-L391 VanDerWaalsContact O-CG 3.29Å; A387-L391 WeakPolarHBondContact O-CG 3.15Å; A387-L391 PolarHBondContact O-N 3.42Å; A387-A408 HydrophobicContact CB-CB 3.85Å; A387-F442 HydrophobicContact CB-CE1 4.02Å; A387-F442 HydrophobicContact CB-CZ 3.96Å
388	F	88.7	Confident	88.2	Confident	4 Å²	4	47.8 Å²	47.8	2%	0.018	25%	0.248	C	C	.	.	H	α-helix	trans	-67.8	-40.1	177.6	-160.9	-79.5	0	0	0	112.8	I28 I34 N35 L38 M39 Y42 S384 V385 I386 L390 L391 M392	I28-F388 HydrophobicContact CG2-CE2 3.79Å; I28-F388 HydrophobicContact CG2-CZ 4.47Å; I34-F388 HydrophobicContact CG2-CD1 4.01Å; I34-F388 HydrophobicContact CG2-CE1 3.3Å; I34-F388 HydrophobicContact CG2-CE2 4.13Å; I34-F388 HydrophobicContact CG2-CZ 3.37Å; N35-F388 WeakPolarHBondContact O-CE1 3.48Å; L38-F388 HydrophobicContact CB-CZ 4.05Å; L38-F388 HydrophobicContact CG-CE2 4.36Å; L38-F388 HydrophobicContact CG-CZ 4.24Å; M39-F388 HydrophobicContact CB-CD1 3.43Å; M39-F388 VanDerWaalsContact CB-CD1 3.43Å; M39-F388 HydrophobicContact CB-CD2 4.44Å; M39-F388 HydrophobicContact CB-CE1 3.44Å; M39-F388 VanDerWaalsContact CB-CE1 3.44Å; M39-F388 HydrophobicContact CB-CE2 4.43Å; M39-F388 HydrophobicContact CB-CG 3.96Å; M39-F388 HydrophobicContact CB-CZ 3.97Å; M39-F388 HydrophobicContact CG-CB 3.98Å; M39-F388 HydrophobicContact CG-CD1 3.52Å; M39-F388 HydrophobicContact CG-CE1 4.09Å; M39-F388 HydrophobicContact CG-CG 3.78Å; M39-F388 VanDerWaalsContact N-CZ 3.26Å; M39-F388 HydrophobicContact SD-CD1 4.24Å; Y42-F388 HydrophobicContact CD1-CD2 4Å; S384-F388 WeakPolarHBondContact O-CB 3.48Å; S384-F388 PolarHBondContact O-N 2.92Å; S384-F388 VanDerWaalsContact O-N 3.15Å; V385-F388 PolarHBondContact O-N 2.99Å; I386-F388 VanDerWaalsContact C-N 3.28Å; I386-F388 PolarHBondContact O-N 2.99Å; F388-L390 VanDerWaalsContact C-N 3.32Å; F388-L390 PolarHBondContact O-N 3.02Å; F388-L391 WeakPolarHBondContact O-CB 3.29Å; F388-L391 PolarHBondContact O-N 2.91Å; F388-L391 VanDerWaalsContact O-N 3.15Å; F388-M392 HydrophobicContact CD1-CG 4.05Å; F388-M392 HydrophobicContact CE1-CG 4.14Å; F388-M392 HydrophobicContact CE1-SD 4.09Å; F388-M392 WeakPolarHBondContact O-CG 3.47Å; F388-M392 PolarHBondContact O-N 2.87Å
389	L	88.7	Confident	87.8	Confident	64 Å²	64	52.5 Å²	52.5	34%	0.335	26%	0.259	S	S	.	.	H	α-helix	trans	-66.2	-32.5	175.1	-70.3	172.6	0	0	0	112.7	M39 V385 I386 I450	M39-L389 HydrophobicContact SD-CD2 3.87Å; M39-L389 HydrophobicContact SD-CG 4.04Å; V385-L389 HydrophobicContact CG1-CD1 3.87Å; V385-L389 HydrophobicContact CG1-CG 4.36Å; V385-L389 WeakPolarHBondContact O-CG 3.21Å; V385-L389 PolarHBondContact O-N 2.86Å; I386-L389 PolarHBondContact O-N 3.44Å; L389-I450 HydrophobicContact CB-CD1 3.75Å; L389-I450 HydrophobicContact CD1-CD1 4.35Å
390	L	89	Confident	87.4	Confident	0 Å²	0	52 Å²	52	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-71.5	-29.5	171.4	-70.2	173.2	0	0	0	112.6	I386 A387 F388 Y395 Y396 L404 F442 I449 I450 I491	I386-L390 HydrophobicContact CG2-CD1 4.14Å; I386-L390 HydrophobicContact CG2-CG 4.49Å; I386-L390 WeakPolarHBondContact O-CG 3.36Å; I386-L390 PolarHBondContact O-N 3.47Å; A387-L390 PolarHBondContact O-N 2.93Å; F388-L390 VanDerWaalsContact C-N 3.32Å; F388-L390 PolarHBondContact O-N 3.02Å; L390-Y395 HydrophobicContact CD2-CD2 4.5Å; L390-Y396 HydrophobicContact CB-CE2 4.37Å; L390-L404 HydrophobicContact CB-CD2 3.94Å; L390-L404 HydrophobicContact CD1-CD1 4.04Å; L390-F442 HydrophobicContact CD1-CZ 4.44Å; L390-I449 HydrophobicContact CD2-CB 4.3Å; L390-I449 HydrophobicContact CD2-CD1 4.49Å; L390-I449 HydrophobicContact CD2-CG2 4.01Å; L390-I450 HydrophobicContact CD2-CD1 4.25Å; L390-I450 HydrophobicContact CD2-CG1 4.05Å; L390-I450 HydrophobicContact CG-CD1 4.36Å; L390-I491 HydrophobicContact CD1-CD1 4.13Å
391	L	86.8	Confident	87.2	Confident	24 Å²	24	53.3 Å²	53.3	13%	0.126	27%	0.267	C	S	.	.	H	α-helix	trans	-75.6	-30.4	173	-70.3	167.1	0	0	0	113	P25 I34 A387 F388 K393 T401 L404	P25-L391 HydrophobicContact CB-CD1 4.43Å; I34-L391 HydrophobicContact CD1-CB 4.2Å; I34-L391 WeakPolarHBondContact CD1-O 3.44Å; A387-L391 VanDerWaalsContact O-CG 3.29Å; A387-L391 WeakPolarHBondContact O-CG 3.15Å; A387-L391 PolarHBondContact O-N 3.42Å; F388-L391 WeakPolarHBondContact O-CB 3.29Å; F388-L391 PolarHBondContact O-N 2.91Å; F388-L391 VanDerWaalsContact O-N 3.15Å; L391-K393 PolarHBondContact O-N 3.37Å; L391-T401 HydrophobicContact CD2-CG2 3.63Å; L391-L404 HydrophobicContact CD2-CD2 3.89Å; L391-L404 HydrophobicContact CG-CD2 3.99Å
392	M	84.8	Confident	86.9	Confident	83 Å²	83	54.6 Å²	54.6	41%	0.409	27%	0.272	S	S	.	.	S	Bend	trans	-63.6	-23.6	172.5	-74.3	-75.2	-58.7	0	0	113.3	I34 F388	I34-M392 HydrophobicContact CB-SD 3.73Å; I34-M392 HydrophobicContact CG2-CG 3.91Å; I34-M392 HydrophobicContact CG2-SD 3.4Å; I34-M392 WeakPolarHBondContact CG2-SD 3.37Å; F388-M392 HydrophobicContact CD1-CG 4.05Å; F388-M392 HydrophobicContact CE1-CG 4.14Å; F388-M392 HydrophobicContact CE1-SD 4.09Å; F388-M392 WeakPolarHBondContact O-CG 3.47Å; F388-M392 PolarHBondContact O-N 2.87Å
393	K	82.8	Confident	86.7	Confident	81 Å²	81	56.4 Å²	56.4	35%	0.352	28%	0.275	S	S	.	.	S	Bend	trans	-103.4	141.7	-175	-73.5	-82.8	-176.3	169.4	0	110.7	L391 Y395 D453	L391-K393 PolarHBondContact O-N 3.37Å; K393-Y395 HydrophobicContact CB-CD2 3.48Å; K393-Y395 VanDerWaalsContact CB-CD2 3.48Å; K393-Y395 HydrophobicContact CB-CE2 3.34Å; K393-Y395 HydrophobicContact CB-CG 4.34Å; K393-Y395 HydrophobicContact CD-CE2 4.26Å; K393-Y395 HydrophobicContact CG-CD2 4.41Å; K393-Y395 HydrophobicContact CG-CE2 3.8Å; K393-Y395 PolarHBondContact O-N 2.83Å; K393-D453 IonicContact NZ-OD2 2.83Å; K393-D453 PolarHBondContact NZ-OD2 3.22Å
394	P	82.5	Confident	86.5	Confident	107 Å²	107	56.5 Å²	56.5	70%	0.695	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.7	28.7	-172.3	33.3	-37.9	0	0	0	114.9	Y396	P394-Y396 VanDerWaalsContact C-N 3.32Å
395	Y	81.7	Confident	86.4	Confident	55 Å²	55	56.6 Å²	56.6	22%	0.216	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-26.7	178.6	-57.3	-55.3	0	0	0	113.1	L390 K393 I449 D453 Q484 V488	L390-Y395 HydrophobicContact CD2-CD2 4.5Å; K393-Y395 HydrophobicContact CB-CD2 3.48Å; K393-Y395 VanDerWaalsContact CB-CD2 3.48Å; K393-Y395 HydrophobicContact CB-CE2 3.34Å; K393-Y395 HydrophobicContact CB-CG 4.34Å; K393-Y395 HydrophobicContact CD-CE2 4.26Å; K393-Y395 HydrophobicContact CG-CD2 4.41Å; K393-Y395 HydrophobicContact CG-CE2 3.8Å; K393-Y395 PolarHBondContact O-N 2.83Å; Y395-I449 HydrophobicContact CD2-CG2 4.07Å; Y395-I449 HydrophobicContact CE2-CG2 3.76Å; Y395-D453 VanDerWaalsContact OH-CG 3.32Å; Y395-D453 PolarHBondContact OH-OD1 3.41Å; Y395-D453 VanDerWaalsContact OH-OD1 3.04Å; Y395-Q484 PolarHBondContact OH-NE2 3.05Å; Y395-V488 HydrophobicContact CD1-CG2 4.45Å; Y395-V488 HydrophobicContact CG-CG2 4.34Å
396	Y	82.3	Confident	86.3	Confident	21 Å²	21	58.9 Å²	58.9	8%	0.082	28%	0.283	C	S	.	.			trans	-123.3	135.6	-173.4	-59.5	-68.3	0	0	0	110.9	L390 P394 L404 V488 L492	L390-Y396 HydrophobicContact CB-CE2 4.37Å; P394-Y396 VanDerWaalsContact C-N 3.32Å; Y396-L404 HydrophobicContact CD2-CD2 3.74Å; Y396-L404 HydrophobicContact CE2-CD1 4.18Å; Y396-L404 HydrophobicContact CE2-CD2 3.95Å; Y396-L404 HydrophobicContact CG-CD2 4.47Å; Y396-V488 HydrophobicContact CD1-CG1 4.38Å; Y396-V488 HydrophobicContact CE1-CG1 3.61Å; Y396-V488 WeakPolarHBondContact CE1-O 3.24Å; Y396-V488 WeakPolarHBondContact OH-CA 3.5Å; Y396-V488 PolarHBondContact OH-O 2.97Å; Y396-L492 HydrophobicContact CD1-CD1 4.08Å; Y396-L492 HydrophobicContact CD1-CD2 3.87Å; Y396-L492 HydrophobicContact CD1-CG 4.3Å; Y396-L492 HydrophobicContact CE1-CD1 3.84Å; Y396-L492 HydrophobicContact CE1-CD2 3.52Å; Y396-L492 HydrophobicContact CE1-CG 3.72Å
397	R	80.1	Confident	86.3	Confident	194 Å²	194	58.8 Å²	58.8	73%	0.732	28%	0.283	S	S	*	.			trans	-131	151.5	172.9	-63.3	-173.6	-176.7	-173.2	0.4	109.7	F399 G400	R397-F399 PolarHBondContact O-N 3.43Å; R397-F399 VanDerWaalsContact O-N 3.16Å; R397-G400 WeakPolarHBondContact O-CA 3.36Å; R397-G400 PolarHBondContact O-N 3.36Å
398	D	82.9	Confident	86.3	Confident	133 Å²	133	58.7 Å²	58.7	71%	0.711	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.7	-113.6	171.1	-43.7	-42.9	0	0	0	112.9	G400 T401 L402	D398-G400 PolarHBondContact O-N 2.98Å; D398-T401 WeakPolarHBondContact O-CB 3.46Å; D398-T401 PolarHBondContact O-N 3.2Å; D398-T401 VanDerWaalsContact O-N 3.16Å; D398-L402 PolarHBondContact O-N 3.34Å
399	F	84.1	Confident	86.4	Confident	156 Å²	156	58.5 Å²	58.5	68%	0.684	28%	0.281	S	S	*	.	H	α-helix	trans	-59.5	-30.3	178.1	-62.9	-75.7	0	0	0	113.8	R397 T401 L402 F403	R397-F399 PolarHBondContact O-N 3.43Å; R397-F399 VanDerWaalsContact O-N 3.16Å; F399-T401 VanDerWaalsContact C-N 3.31Å; F399-T401 PolarHBondContact O-N 3.15Å; F399-L402 PolarHBondContact O-N 2.75Å; F399-F403 HydrophobicContact CB-CD2 4.33Å; F399-F403 HydrophobicContact CB-CE2 4.2Å; F399-F403 WeakPolarHBondContact O-CD2 3.43Å; F399-F403 PolarHBondContact O-N 2.92Å
400	G	84.6	Confident	86.4	Confident	13 Å²	13	56.2 Å²	56.2	13%	0.134	27%	0.274	C	S	.	.	H	α-helix	trans	-61.7	-40.1	176.4	0	0	0	0	0	112.2	R397 D398 F403 L404 L492	R397-G400 WeakPolarHBondContact O-CA 3.36Å; R397-G400 PolarHBondContact O-N 3.36Å; D398-G400 PolarHBondContact O-N 2.98Å; G400-F403 PolarHBondContact O-N 3.02Å; G400-L404 WeakPolarHBondContact O-CB 3.4Å; G400-L404 PolarHBondContact O-N 3.05Å; G400-L492 WeakPolarHBondContact O-CD2 3.49Å
401	T	86.1	Confident	86.4	Confident	29 Å²	29	56.3 Å²	56.3	18%	0.178	28%	0.275	C	S	.	.	H	α-helix	trans	-63	-43	174.9	-53.4	0	0	0	0	111.1	L391 D398 F399 L404 C405	L391-T401 HydrophobicContact CD2-CG2 3.63Å; D398-T401 WeakPolarHBondContact O-CB 3.46Å; D398-T401 PolarHBondContact O-N 3.2Å; D398-T401 VanDerWaalsContact O-N 3.16Å; F399-T401 VanDerWaalsContact C-N 3.31Å; F399-T401 PolarHBondContact O-N 3.15Å; T401-L404 PolarHBondContact O-N 2.93Å; T401-C405 PolarHBondContact O-N 3.08Å; T401-C405 PolarHBondContact O-SG 3.31Å
402	L	88.3	Confident	86.6	Confident	70 Å²	70	55.2 Å²	55.2	37%	0.366	27%	0.269	S	S	.	.	H	α-helix	trans	-64.1	-46.4	177.4	-166.6	158.6	0	0	0	111.6	F22 D398 F399 L404 C405 F406	F22-L402 HydrophobicContact CE2-CD2 4.26Å; F22-L402 HydrophobicContact CE2-CG 4.36Å; F22-L402 HydrophobicContact CZ-CD2 4.1Å; F22-L402 HydrophobicContact CZ-CG 4.05Å; D398-L402 PolarHBondContact O-N 3.34Å; F399-L402 PolarHBondContact O-N 2.75Å; L402-L404 PolarHBondContact O-N 2.86Å; L402-C405 PolarHBondContact O-N 2.68Å; L402-F406 WeakPolarHBondContact O-CB 3.09Å; L402-F406 PolarHBondContact O-N 3.48Å
403	F	88.8	Confident	86.8	Confident	104 Å²	104	51.8 Å²	51.8	46%	0.456	25%	0.252	S	S	.	.	H	α-helix	trans	-66.4	-33.9	176.7	-73.7	-59.3	0	0	0	112.9	F399 G400 F406 S407 L492	F399-F403 HydrophobicContact CB-CD2 4.33Å; F399-F403 HydrophobicContact CB-CE2 4.2Å; F399-F403 WeakPolarHBondContact O-CD2 3.43Å; F399-F403 PolarHBondContact O-N 2.92Å; G400-F403 PolarHBondContact O-N 3.02Å; F403-F406 PolarHBondContact O-N 3.3Å; F403-S407 WeakPolarHBondContact O-CB 3.39Å; F403-S407 PolarHBondContact O-N 3.02Å; F403-L492 HydrophobicContact CB-CB 4.33Å; F403-L492 HydrophobicContact CB-CD2 3.92Å
404	L	90.1	Very high	87	Confident	1 Å²	1	48.1 Å²	48.1	1%	0.005	24%	0.236	C	C	.	.	H	α-helix	trans	-62.8	-49.6	172	-179.4	68.3	0	0	0	111.3	L390 L391 Y396 G400 T401 L402 F406 S407 A408 F442 I491 L492	L390-L404 HydrophobicContact CB-CD2 3.94Å; L390-L404 HydrophobicContact CD1-CD1 4.04Å; L391-L404 HydrophobicContact CD2-CD2 3.89Å; L391-L404 HydrophobicContact CG-CD2 3.99Å; Y396-L404 HydrophobicContact CD2-CD2 3.74Å; Y396-L404 HydrophobicContact CE2-CD1 4.18Å; Y396-L404 HydrophobicContact CE2-CD2 3.95Å; Y396-L404 HydrophobicContact CG-CD2 4.47Å; G400-L404 WeakPolarHBondContact O-CB 3.4Å; G400-L404 PolarHBondContact O-N 3.05Å; T401-L404 PolarHBondContact O-N 2.93Å; L402-L404 PolarHBondContact O-N 2.86Å; L404-F406 VanDerWaalsContact C-N 3.32Å; L404-F406 PolarHBondContact O-N 2.94Å; L404-S407 WeakPolarHBondContact O-CB 3.29Å; L404-S407 PolarHBondContact O-N 3.31Å; L404-A408 WeakPolarHBondContact O-CB 2.99Å; L404-A408 PolarHBondContact O-N 3.48Å; L404-F442 HydrophobicContact CD1-CE2 3.94Å; L404-F442 HydrophobicContact CD1-CZ 3.99Å; L404-I491 HydrophobicContact CD1-CG2 3.7Å; L404-L492 HydrophobicContact CB-CD2 4.2Å
405	C	89.6	Confident	87.2	Confident	2 Å²	2	43.1 Å²	43.1	1%	0.014	20%	0.203	C	C	.	.	H	α-helix	trans	-61	-39.1	176.1	-72	0	0	0	0	112.2	F22 P25 T401 L402 A408 A409	F22-C405 HydrophobicContact CD2-CB 4.11Å; F22-C405 HydrophobicContact CE2-CB 4.1Å; P25-C405 HydrophobicContact CG-CB 4.4Å; T401-C405 PolarHBondContact O-N 3.08Å; T401-C405 PolarHBondContact O-SG 3.31Å; L402-C405 PolarHBondContact O-N 2.68Å; C405-A408 PolarHBondContact O-N 3.37Å; C405-A409 VanDerWaalsContact O-CB 3.28Å; C405-A409 WeakPolarHBondContact O-CB 3.46Å; C405-A409 PolarHBondContact O-N 3.37Å
406	F	89.6	Confident	87.4	Confident	85 Å²	85	40.7 Å²	40.7	37%	0.373	19%	0.194	S	C	.	.	H	α-helix	trans	-61.2	-44.8	173.9	-174.4	-79.4	0	0	0	111.8	W18 F22 L402 F403 L404 G410 P495	W18-F406 AromaticContact CH2-CD2 3.56Å; W18-F406 HydrophobicContact CH2-CD2 3.56Å; W18-F406 AromaticContact CH2-CE2 3.54Å; W18-F406 HydrophobicContact CH2-CE2 3.54Å; W18-F406 AromaticContact CZ2-CD2 3.44Å; W18-F406 HydrophobicContact CZ2-CD2 3.44Å; W18-F406 VanDerWaalsContact CZ2-CD2 3.44Å; W18-F406 AromaticContact CZ2-CE2 3.52Å; W18-F406 HydrophobicContact CZ2-CE2 3.52Å; W18-F406 HydrophobicContact CZ2-CG 4.05Å; W18-F406 HydrophobicContact CZ2-CZ 4.2Å; F22-F406 HydrophobicContact CD2-CB 4.32Å; F22-F406 HydrophobicContact CE2-CB 4.16Å; L402-F406 WeakPolarHBondContact O-CB 3.09Å; L402-F406 PolarHBondContact O-N 3.48Å; F403-F406 PolarHBondContact O-N 3.3Å; L404-F406 VanDerWaalsContact C-N 3.32Å; L404-F406 PolarHBondContact O-N 2.94Å; F406-G410 PolarHBondContact O-N 2.97Å; F406-P495 HydrophobicContact CD1-CB 4.44Å; F406-P495 HydrophobicContact CD1-CG 3.89Å; F406-P495 HydrophobicContact CE1-CB 4.05Å; F406-P495 HydrophobicContact CE1-CG 4.01Å
407	S	90.1	Very high	87.5	Confident	6 Å²	6	41.1 Å²	41.1	4%	0.042	20%	0.197	C	C	.	.	H	α-helix	trans	-63.9	-46.5	177.7	-165.8	0	0	0	0	111.7	F403 L404 G410 A411 I491	F403-S407 WeakPolarHBondContact O-CB 3.39Å; F403-S407 PolarHBondContact O-N 3.02Å; L404-S407 WeakPolarHBondContact O-CB 3.29Å; L404-S407 PolarHBondContact O-N 3.31Å; S407-G410 PolarHBondContact O-N 2.95Å; S407-A411 WeakPolarHBondContact O-CB 3.43Å; S407-A411 PolarHBondContact O-N 3.4Å; S407-I491 PolarHBondContact OG-O 3.15Å
408	A	91.4	Very high	87.4	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-63.3	-45.8	177.6	0	0	0	0	0	112.8	A387 L404 C405 G410 A411 Q412 F442	A387-A408 HydrophobicContact CB-CB 3.85Å; L404-A408 WeakPolarHBondContact O-CB 2.99Å; L404-A408 PolarHBondContact O-N 3.48Å; C405-A408 PolarHBondContact O-N 3.37Å; A408-G410 VanDerWaalsContact C-N 3.35Å; A408-G410 PolarHBondContact O-N 3.09Å; A408-A411 WeakPolarHBondContact O-CB 3.26Å; A408-A411 PolarHBondContact O-N 3.47Å; A408-Q412 WeakPolarHBondContact O-CG 3.45Å; A408-Q412 PolarHBondContact O-N 2.91Å; A408-F442 HydrophobicContact CB-CE1 4.38Å; A408-F442 HydrophobicContact CB-CE2 4.12Å; A408-F442 HydrophobicContact CB-CZ 3.81Å
409	A	90.1	Very high	86.8	Confident	0 Å²	0	28.8 Å²	28.8	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-65.2	-38.4	176.4	0	0	0	0	0	112	L21 F22 C405 F413	L21-A409 HydrophobicContact CB-CB 4.01Å; F22-A409 HydrophobicContact CB-CB 3.84Å; C405-A409 VanDerWaalsContact O-CB 3.28Å; C405-A409 WeakPolarHBondContact O-CB 3.46Å; C405-A409 PolarHBondContact O-N 3.37Å; A409-F413 VanDerWaalsContact O-CB 3.29Å; A409-F413 WeakPolarHBondContact O-CB 3.44Å; A409-F413 PolarHBondContact O-N 3.39Å
410	G	88.1	Confident	86	Confident	17 Å²	17	26.3 Å²	26.3	18%	0.175	14%	0.138	C	C	.	.	H	α-helix	trans	-62.9	-39.4	172.3	0	0	0	0	0	112.9	F406 S407 A408 C414	F406-G410 PolarHBondContact O-N 2.97Å; S407-G410 PolarHBondContact O-N 2.95Å; A408-G410 VanDerWaalsContact C-N 3.35Å; A408-G410 PolarHBondContact O-N 3.09Å; G410-C414 PolarHBondContact O-N 3.15Å; G410-C414 PolarHBondContact O-SG 2.98Å
411	A	89.5	Confident	84.9	Confident	2 Å²	2	29.1 Å²	29.1	2%	0.017	15%	0.154	C	C	.	.	H	α-helix	trans	-66.7	-46.1	175.4	0	0	0	0	0	112.6	V383 S407 A408 C414 P439 F442	V383-A411 HydrophobicContact CG1-CB 4.26Å; S407-A411 WeakPolarHBondContact O-CB 3.43Å; S407-A411 PolarHBondContact O-N 3.4Å; A408-A411 WeakPolarHBondContact O-CB 3.26Å; A408-A411 PolarHBondContact O-N 3.47Å; A411-C414 PolarHBondContact O-N 3.03Å; A411-P439 HydrophobicContact CB-CB 4.19Å; A411-F442 HydrophobicContact CB-CB 4.25Å; A411-F442 HydrophobicContact CB-CG 4.5Å
412	Q	90.8	Very high	84	Confident	0 Å²	0	28.8 Å²	28.8	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-63.2	-46	176.2	-72.7	170.1	-14.1	0	0	111.7	L21 Y42 F50 V383 A408 C414 L415	L21-Q412 HydrophobicContact CD1-CB 4.08Å; Y42-Q412 PolarHBondContact OH-NE2 2.91Å; F50-Q412 HydrophobicContact CZ-CB 4.24Å; F50-Q412 WeakPolarHBondContact CZ-O 3.45Å; V383-Q412 HydrophobicContact CB-CG 4.32Å; V383-Q412 HydrophobicContact CG1-CG 3.79Å; A408-Q412 WeakPolarHBondContact O-CG 3.45Å; A408-Q412 PolarHBondContact O-N 2.91Å; Q412-C414 VanDerWaalsContact C-N 3.27Å; Q412-C414 PolarHBondContact O-N 3.06Å; Q412-L415 WeakPolarHBondContact O-CB 3.4Å; Q412-L415 PolarHBondContact O-N 3.49Å; Q412-L415 VanDerWaalsContact O-N 3.14Å
413	F	88.9	Confident	82.9	Confident	12 Å²	12	26 Å²	26	5%	0.053	14%	0.138	C	C	.	.	H	α-helix	trans	-61.4	-33.1	-179.1	-177	-86.4	0	0	0	113	M1 H14 L17 W18 L21 A409 L415 L416 K417	M1-F413 HydrophobicContact CE-CB 4.31Å; M1-F413 HydrophobicContact CE-CD1 3.38Å; M1-F413 HydrophobicContact CE-CD2 3.96Å; M1-F413 HydrophobicContact CE-CE1 3.58Å; M1-F413 HydrophobicContact CE-CE2 4.12Å; M1-F413 HydrophobicContact CE-CG 3.6Å; M1-F413 HydrophobicContact CE-CZ 3.95Å; H14-F413 HydrophobicContact CB-CE2 4.13Å; H14-F413 HydrophobicContact CB-CZ 3.77Å; H14-F413 AromaticContact CD2-CZ 3.83Å; H14-F413 AromaticContact CG-CZ 3.8Å; H14-F413 WeakPolarHBondContact O-CE2 3.23Å; L17-F413 HydrophobicContact CB-CE2 4.36Å; W18-F413 HydrophobicContact CB-CD2 3.89Å; W18-F413 HydrophobicContact CB-CE2 4.38Å; W18-F413 HydrophobicContact CB-CG 4.4Å; L21-F413 HydrophobicContact CD1-CB 4.32Å; A409-F413 VanDerWaalsContact O-CB 3.29Å; A409-F413 WeakPolarHBondContact O-CB 3.44Å; A409-F413 PolarHBondContact O-N 3.39Å; F413-L415 PolarHBondContact O-N 3.1Å; F413-L415 VanDerWaalsContact O-N 3.14Å; F413-L416 WeakPolarHBondContact O-CB 3.37Å; F413-L416 PolarHBondContact O-N 3.13Å; F413-K417 HydrophobicContact CE1-CB 3.99Å; F413-K417 HydrophobicContact CZ-CB 4.2Å; F413-K417 PolarHBondContact O-N 3.4Å
414	C	87.3	Confident	81.8	Confident	4 Å²	4	21.1 Å²	21.1	3%	0.027	12%	0.118	C	C	.	.	H	α-helix	trans	-60.5	-23.2	178	-72.6	0	0	0	0	114.1	G410 A411 Q412 K417 R438	G410-C414 PolarHBondContact O-N 3.15Å; G410-C414 PolarHBondContact O-SG 2.98Å; A411-C414 PolarHBondContact O-N 3.03Å; Q412-C414 VanDerWaalsContact C-N 3.27Å; Q412-C414 PolarHBondContact O-N 3.06Å; C414-K417 WeakPolarHBondContact CA-O 3.29Å; C414-K417 CarbonylContact O-C 3.59Å; C414-R438 VanDerWaalsContact SG-CD 3.56Å
415	L	87.4	Confident	80.4	Confident	1 Å²	1	21.7 Å²	21.7	1%	0.005	12%	0.121	C	C	.	.	H	α-helix	trans	-76	-28.5	173.8	-63.6	170.4	0	0	0	112.1	F50 K54 L379 A380 Q412 F413 Y436 P439	F50-L415 HydrophobicContact CE1-CB 3.91Å; K54-L415 WeakPolarHBondContact CE-O 3.35Å; K54-L415 PolarHBondContact NZ-O 3.47Å; L379-L415 HydrophobicContact CB-CD1 4.29Å; L379-L415 HydrophobicContact CD2-CD2 4.27Å; L379-L415 HydrophobicContact CG-CD1 4.43Å; A380-L415 HydrophobicContact CB-CD1 3.96Å; Q412-L415 WeakPolarHBondContact O-CB 3.4Å; Q412-L415 PolarHBondContact O-N 3.49Å; Q412-L415 VanDerWaalsContact O-N 3.14Å; F413-L415 PolarHBondContact O-N 3.1Å; F413-L415 VanDerWaalsContact O-N 3.14Å; L415-Y436 HydrophobicContact CD2-CD1 3.71Å; L415-Y436 HydrophobicContact CD2-CE1 3.94Å; L415-P439 HydrophobicContact CD1-CB 4.32Å; L415-P439 HydrophobicContact CD1-CG 4.15Å; L415-P439 HydrophobicContact CD2-CG 3.82Å; L415-P439 HydrophobicContact CG-CG 3.9Å
416	L	86.2	Confident	78.5	Confident	5 Å²	5	23.3 Å²	23.3	3%	0.026	13%	0.132	C	C	.	.	H	α-helix	trans	-77.8	-45.5	173.1	-62.7	178.2	0	0	0	111.3	F50 T53 K54 F364 D365 F413	F50-L416 HydrophobicContact CD1-CD2 3.88Å; F50-L416 HydrophobicContact CD1-CG 4.46Å; F50-L416 HydrophobicContact CE1-CD1 4.38Å; F50-L416 HydrophobicContact CE1-CD2 3.54Å; F50-L416 HydrophobicContact CE1-CG 3.63Å; F50-L416 HydrophobicContact CZ-CD1 4.11Å; F50-L416 HydrophobicContact CZ-CD2 4.08Å; F50-L416 HydrophobicContact CZ-CG 3.81Å; T53-L416 HydrophobicContact CG2-CD2 4.14Å; K54-L416 HydrophobicContact CG-CD2 4.5Å; F364-L416 HydrophobicContact CD1-CB 4.05Å; F364-L416 HydrophobicContact CE1-CB 4.13Å; F364-L416 HydrophobicContact CE1-CD1 4.45Å; F364-L416 HydrophobicContact CE1-CD2 4.38Å; D365-L416 PolarHBondContact N-O 2.67Å; D365-L416 VanDerWaalsContact N-O 3.15Å; F413-L416 WeakPolarHBondContact O-CB 3.37Å; F413-L416 PolarHBondContact O-N 3.13Å
417	K	82.8	Confident	76.8	Confident	30 Å²	30	23.2 Å²	23.2	13%	0.13	14%	0.138	C	C	.	.	S	Bend	trans	-146.2	118.4	179	-169.7	70	-171.6	164.2	0	111.2	S361 S362 D365 F413 C414	S361-K417 PolarHBondContact O-NZ 3.24Å; S362-K417 WeakPolarHBondContact O-CD 3.48Å; S362-K417 WeakPolarHBondContact O-CE 3.33Å; D365-K417 WeakPolarHBondContact OD1-CD 3.27Å; D365-K417 WeakPolarHBondContact OD1-CE 3.49Å; D365-K417 IonicContact OD1-NZ 3.8Å; D365-K417 PolarHBondContact OD1-NZ 2.87Å; F413-K417 HydrophobicContact CE1-CB 3.99Å; F413-K417 HydrophobicContact CZ-CB 4.2Å; F413-K417 PolarHBondContact O-N 3.4Å; C414-K417 WeakPolarHBondContact CA-O 3.29Å; C414-K417 CarbonylContact O-C 3.59Å
418	S	78.5	Confident	74.6	Confident	9 Å²	9	28 Å²	28	6%	0.063	16%	0.159	C	C	.	.			trans	-62.9	145.7	176.4	53.9	0	0	0	0	112.4	D365 Q420	D365-S418 WeakPolarHBondContact OD2-CB 3.33Å; D365-S418 PolarHBondContact OD2-N 3.2Å; D365-S418 PolarHBondContact OD2-OG 2.97Å; S418-Q420 PolarHBondContact O-N 2.92Å; S418-Q420 PolarHBondContact OG-NE2 3.45Å
419	V	70.7	Confident	72.7	Confident	59 Å²	59	29.5 Å²	29.5	36%	0.358	18%	0.176	S	C	.	.			trans	-80.1	120.1	172.6	179.9	0	0	0	0	108.9
420	Q	67.1	Low	71	Confident	103 Å²	103	33.9 Å²	33.9	48%	0.481	19%	0.193	S	C	.	.	S	Bend	trans	-131.6	141.6	177.3	-60.7	-179	29.8	0	0	109.9	S418	S418-Q420 PolarHBondContact O-N 2.92Å; S418-Q420 PolarHBondContact OG-NE2 3.45Å
421	P	62.4	Low	69.9	Low	73 Å²	73	35.5 Å²	35.5	47%	0.474	20%	0.197	S	C	.	.	S	Bend	cis	-67.3	146	-9.1	30.9	-35.3	0	0	0	112
422	D	65.6	Low	69	Low	22 Å²	22	38.3 Å²	38.3	12%	0.118	22%	0.217	C	C	.	.			trans	-93.3	128.1	172.8	169.9	29.7	0	0	0	109.6	A424 S425 V434 Q505	D422-A424 PolarHBondContact O-N 3.37Å; D422-A424 PolarHBondContact OD1-N 3.11Å; D422-S425 PolarHBondContact O-N 3.03Å; D422-S425 VanDerWaalsContact O-N 3.08Å; D422-S425 PolarHBondContact OD2-N 2.93Å; D422-V434 HydrophobicContact CB-CG1 4.17Å; D422-Q505 PolarHBondContact OD2-NE2 3.22Å
423	A	65.9	Low	68.4	Low	10 Å²	10	40.3 Å²	40.3	8%	0.083	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-24.3	176.9	0	0	0	0	0	112.8	S425 F1305	A423-S425 VanDerWaalsContact C-N 3.35Å; A423-F1305 HydrophobicContact CB-CD1 4.15Å; A423-F1305 HydrophobicContact CB-CD2 3.6Å; A423-F1305 HydrophobicContact CB-CE1 4.25Å; A423-F1305 HydrophobicContact CB-CE2 3.73Å; A423-F1305 HydrophobicContact CB-CG 3.82Å; A423-F1305 HydrophobicContact CB-CZ 4.04Å
424	A	65.4	Low	67.8	Low	3 Å²	3	40.3 Å²	40.3	3%	0.025	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.3	-3.7	175.8	0	0	0	0	0	114.1	D422 L503 Q505 Y848	D422-A424 PolarHBondContact O-N 3.37Å; D422-A424 PolarHBondContact OD1-N 3.11Å; A424-L503 WeakPolarHBondContact CB-O 3.35Å; A424-Q505 HydrophobicContact CB-CG 3.92Å; A424-Y848 HydrophobicContact CB-CD1 4.37Å; A424-Y848 HydrophobicContact CB-CE1 4.28Å; A424-Y848 PolarHBondContact O-OH 3.06Å; A424-Y848 VanDerWaalsContact O-OH 3.04Å
425	S	60.4	Low	67.4	Low	12 Å²	12	40.4 Å²	40.4	8%	0.084	23%	0.228	C	C	.	.			trans	-92.8	131.8	178.7	-165.1	0	0	0	0	112.3	D422 A423 V427 Q505 Q1300	D422-S425 PolarHBondContact O-N 3.03Å; D422-S425 VanDerWaalsContact O-N 3.08Å; D422-S425 PolarHBondContact OD2-N 2.93Å; A423-S425 VanDerWaalsContact C-N 3.35Å; S425-V427 PolarHBondContact OG-N 3.35Å; S425-V427 PolarHBondContact OG-O 3.42Å; S425-Q505 VanDerWaalsContact CA-NE2 3.27Å; S425-Q505 VanDerWaalsContact CB-NE2 3.28Å; S425-Q1300 VanDerWaalsContact C-NE2 3.26Å; S425-Q1300 PolarHBondContact O-NE2 3.35Å
426	P	51.2	Low	67.4	Low	37 Å²	37	42.5 Å²	42.5	24%	0.24	24%	0.237	C	C	.	.	S	Bend	trans	-86.6	-11.9	168.6	33.6	-32.9	0	0	0	113.1	W855	P426-W855 HydrophobicContact CB-CE3 4.05Å; P426-W855 HydrophobicContact CB-CZ3 3.71Å
427	V	52.6	Low	67.3	Low	82 Å²	82	42.7 Å²	42.7	50%	0.497	24%	0.238	S	C	.	.	S	Bend	trans	-115.3	130.5	-176.5	-179.5	0	0	0	0	110.3	S425 G429	S425-V427 PolarHBondContact OG-N 3.35Å; S425-V427 PolarHBondContact OG-O 3.42Å; V427-G429 PolarHBondContact O-N 3.11Å
428	H	45.1	Very low	67.5	Low	106 Å²	106	43.2 Å²	43.2	49%	0.491	24%	0.239	S	C	.	.	S	Bend	trans	-72.1	98.6	161.8	-79.9	-25.4	0	0	0	109.8	V1304	H428-V1304 PolarHBondContact CE1-O 3.37Å
429	G	50.8	Low	68.1	Low	33 Å²	33	42.8 Å²	42.8	34%	0.34	24%	0.236	S	C	.	.	S	Bend	trans	172.6	165.3	177.1	0	0	0	0	0	111.8	V427 N431	V427-G429 PolarHBondContact O-N 3.11Å; G429-N431 PolarHBondContact O-N 2.83Å
430	Y	53.5	Low	69.1	Low	92 Å²	92	41.9 Å²	41.9	36%	0.361	23%	0.231	S	C	.	.			trans	-72.6	96.5	175.1	177.7	-103.5	0	0	0	110.4	D365	D365-Y430 HydrophobicContact CB-CE2 3.91Å
431	N	66	Low	70.2	Confident	50 Å²	50	37.2 Å²	37.2	27%	0.267	21%	0.209	S	C	.	.			trans	-82.6	114.2	163.1	179.2	3.7	0	0	0	109	G429 I433 V434 Q505	G429-N431 PolarHBondContact O-N 2.83Å; N431-I433 PolarHBondContact O-N 2.95Å; N431-I433 WeakPolarHBondContact OD1-CB 3.42Å; N431-I433 PolarHBondContact OD1-N 3.38Å; N431-V434 HydrophobicContact CB-CG2 3.95Å; N431-V434 PolarHBondContact O-N 3.05Å; N431-V434 VanDerWaalsContact O-N 3.07Å; N431-Q505 PolarHBondContact ND2-OE1 3.48Å
432	S	71.2	Confident	71.6	Confident	61 Å²	61	33.7 Å²	33.7	43%	0.427	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.4	-13.6	177	60.3	0	0	0	0	115.6	P435 Y436	S432-P435 WeakPolarHBondContact O-CD 3.28Å; S432-Y436 VanDerWaalsContact O-CE2 3.3Å; S432-Y436 WeakPolarHBondContact O-CE2 3.44Å
433	I	77.1	Confident	72.9	Confident	42 Å²	42	33.2 Å²	33.2	22%	0.215	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.8	-19.2	-177.7	-56.6	179.7	0	0	0	112.3	N431 Y436 L506 N507	N431-I433 PolarHBondContact O-N 2.95Å; N431-I433 WeakPolarHBondContact OD1-CB 3.42Å; N431-I433 PolarHBondContact OD1-N 3.38Å; I433-Y436 PolarHBondContact O-N 3.45Å; I433-L506 HydrophobicContact CG2-CB 4.24Å; I433-N507 WeakPolarHBondContact CD1-ND2 3.31Å
434	V	76.1	Confident	74.1	Confident	13 Å²	13	36 Å²	36	8%	0.079	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-42.9	177.3	172.8	0	0	0	0	113.9	D422 N431 Y436 S437 Q505	D422-V434 HydrophobicContact CB-CG1 4.17Å; N431-V434 HydrophobicContact CB-CG2 3.95Å; N431-V434 PolarHBondContact O-N 3.05Å; N431-V434 VanDerWaalsContact O-N 3.07Å; V434-Y436 PolarHBondContact O-N 3.31Å; V434-S437 WeakPolarHBondContact O-CB 3.49Å; V434-S437 PolarHBondContact O-N 3.02Å; V434-S437 PolarHBondContact O-OG 3.48Å; V434-Q505 HydrophobicContact CG2-CG 4.46Å; V434-Q505 VanDerWaalsContact CG2-NE2 3.27Å
435	P	79.5	Confident	75.3	Confident	5 Å²	5	37.1 Å²	37.1	3%	0.032	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-50.5	-40.8	176.7	-25	29.7	0	0	0	114.1	S432 S437 P439	S432-P435 WeakPolarHBondContact O-CD 3.28Å; P435-S437 PolarHBondContact O-N 3.01Å; P435-P439 WeakPolarHBondContact O-CD 3.48Å
436	Y	86.5	Confident	76.7	Confident	46 Å²	46	36.6 Å²	36.6	18%	0.18	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-18.8	-174	-58.1	-68.7	0	0	0	113.9	S372 A375 D376 L379 L415 S432 I433 V434 P439 V440	S372-Y436 PolarHBondContact O-OH 3.14Å; A375-Y436 HydrophobicContact CB-CE1 4.21Å; D376-Y436 WeakPolarHBondContact OD1-CE1 3.21Å; D376-Y436 PolarHBondContact OD1-OH 3.48Å; L379-Y436 HydrophobicContact CD2-CD1 4.04Å; L415-Y436 HydrophobicContact CD2-CD1 3.71Å; L415-Y436 HydrophobicContact CD2-CE1 3.94Å; S432-Y436 VanDerWaalsContact O-CE2 3.3Å; S432-Y436 WeakPolarHBondContact O-CE2 3.44Å; I433-Y436 PolarHBondContact O-N 3.45Å; V434-Y436 PolarHBondContact O-N 3.31Å; Y436-P439 WeakPolarHBondContact O-CD 3.49Å; Y436-P439 WeakPolarHBondContact O-CG 3.37Å; Y436-V440 WeakPolarHBondContact O-CB 3.36Å; Y436-V440 WeakPolarHBondContact O-CG2 3.48Å; Y436-V440 PolarHBondContact O-N 2.74Å
437	S	85	Confident	78.7	Confident	8 Å²	8	38.2 Å²	38.2	6%	0.056	21%	0.21	C	C	.	.	H	α-helix	trans	-52	-65.1	-173.4	58.8	0	0	0	0	113.1	V434 P435 V440 Y441	V434-S437 WeakPolarHBondContact O-CB 3.49Å; V434-S437 PolarHBondContact O-N 3.02Å; V434-S437 PolarHBondContact O-OG 3.48Å; P435-S437 PolarHBondContact O-N 3.01Å; S437-V440 PolarHBondContact O-N 3.09Å; S437-Y441 WeakPolarHBondContact O-CD2 3.4Å; S437-Y441 PolarHBondContact O-N 3.03Å
438	R	87.8	Confident	80.5	Confident	41 Å²	41	37.8 Å²	37.8	16%	0.155	21%	0.205	C	C	.	.	H	α-helix	trans	-57.7	-49.9	-176.6	-47.1	-157.4	-177.6	-171.9	-6.3	113.8	C414 Y441 F442 F498	C414-R438 VanDerWaalsContact SG-CD 3.56Å; R438-Y441 PolarHBondContact O-N 3.23Å; R438-F442 WeakPolarHBondContact O-CB 3.41Å; R438-F442 PolarHBondContact O-N 2.97Å; R438-F498 HydrophobicContact CB-CD2 4.31Å; R438-F498 HydrophobicContact CB-CE2 3.66Å; R438-F498 HydrophobicContact CB-CZ 3.99Å; R438-F498 HydrophobicContact CG-CD1 4.34Å; R438-F498 HydrophobicContact CG-CD2 3.75Å; R438-F498 HydrophobicContact CG-CE1 4.16Å; R438-F498 HydrophobicContact CG-CE2 3.5Å; R438-F498 VanDerWaalsContact CG-CE2 3.5Å; R438-F498 HydrophobicContact CG-CG 4.18Å; R438-F498 HydrophobicContact CG-CZ 3.77Å
439	P	90.6	Very high	82.7	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-66.1	-37.5	178.6	24.9	-34	0	0	0	113.6	L379 V383 A411 L415 P435 Y436 F442 S443	L379-P439 HydrophobicContact CD2-CB 3.79Å; L379-P439 HydrophobicContact CD2-CG 3.67Å; L379-P439 HydrophobicContact CG-CB 3.93Å; L379-P439 HydrophobicContact CG-CG 4.32Å; V383-P439 HydrophobicContact CG2-CB 3.62Å; A411-P439 HydrophobicContact CB-CB 4.19Å; L415-P439 HydrophobicContact CD1-CB 4.32Å; L415-P439 HydrophobicContact CD1-CG 4.15Å; L415-P439 HydrophobicContact CD2-CG 3.82Å; L415-P439 HydrophobicContact CG-CG 3.9Å; P435-P439 WeakPolarHBondContact O-CD 3.48Å; Y436-P439 WeakPolarHBondContact O-CD 3.49Å; Y436-P439 WeakPolarHBondContact O-CG 3.37Å; P439-F442 PolarHBondContact O-N 3.39Å; P439-S443 WeakPolarHBondContact O-CB 3.36Å; P439-S443 PolarHBondContact O-N 2.95Å; P439-S443 PolarHBondContact O-OG 3.35Å; P439-S443 VanDerWaalsContact O-OG 3.05Å
440	V	90.8	Very high	84.5	Confident	41 Å²	41	33.6 Å²	33.6	25%	0.248	18%	0.178	C	C	.	.	H	α-helix	trans	-65.3	-43.9	174.2	175.7	0	0	0	0	111.4	L379 Y436 S437 F442 S443 V444 L506	L379-V440 HydrophobicContact CD1-CG2 4.18Å; L379-V440 HydrophobicContact CD2-CG2 3.64Å; Y436-V440 WeakPolarHBondContact O-CB 3.36Å; Y436-V440 WeakPolarHBondContact O-CG2 3.48Å; Y436-V440 PolarHBondContact O-N 2.74Å; S437-V440 PolarHBondContact O-N 3.09Å; V440-F442 PolarHBondContact O-N 2.95Å; V440-S443 PolarHBondContact O-N 3.48Å; V440-V444 HydrophobicContact CG1-CG2 4.08Å; V440-V444 WeakPolarHBondContact O-CB 3.28Å; V440-V444 WeakPolarHBondContact O-CG2 3.29Å; V440-V444 PolarHBondContact O-N 2.9Å; V440-L506 HydrophobicContact CB-CD1 3.89Å; V440-L506 HydrophobicContact CB-CD2 3.85Å; V440-L506 HydrophobicContact CG1-CD1 4.35Å; V440-L506 HydrophobicContact CG1-CD2 3.62Å; V440-L506 HydrophobicContact CG2-CD1 3.79Å
441	Y	89.9	Confident	86.3	Confident	4 Å²	4	34.2 Å²	34.2	2%	0.016	19%	0.187	C	C	.	.	H	α-helix	trans	-61.4	-43.4	176.1	-78.2	-64.5	0	0	0	112.4	S437 R438 S443 V444 F445 F498 L503 P504 L506 F509	S437-Y441 WeakPolarHBondContact O-CD2 3.4Å; S437-Y441 PolarHBondContact O-N 3.03Å; R438-Y441 PolarHBondContact O-N 3.23Å; Y441-S443 VanDerWaalsContact C-N 3.34Å; Y441-S443 PolarHBondContact O-N 3.07Å; Y441-V444 PolarHBondContact O-N 2.8Å; Y441-F445 AromaticContact CD1-CE2 3.97Å; Y441-F445 HydrophobicContact CD1-CE2 3.97Å; Y441-F445 AromaticContact CD1-CZ 3.99Å; Y441-F445 HydrophobicContact CD1-CZ 3.99Å; Y441-F445 HydrophobicContact CG-CE2 4.36Å; Y441-F445 WeakPolarHBondContact O-CD2 3.38Å; Y441-F445 WeakPolarHBondContact O-CG 3.27Å; Y441-F445 PolarHBondContact O-N 2.93Å; Y441-F498 AromaticContact CD2-CE1 3.86Å; Y441-F498 HydrophobicContact CD2-CE1 3.86Å; Y441-F498 AromaticContact CD2-CZ 3.64Å; Y441-F498 HydrophobicContact CD2-CZ 3.64Å; Y441-F498 HydrophobicContact CE2-CE1 4.21Å; Y441-F498 HydrophobicContact CE2-CZ 4.44Å; Y441-F498 HydrophobicContact CG-CZ 4.23Å; Y441-L503 HydrophobicContact CD2-CD1 4.42Å; Y441-L503 HydrophobicContact CE1-CD2 4.37Å; Y441-L503 HydrophobicContact CE2-CB 4.15Å; Y441-L503 HydrophobicContact CG-CD1 4.31Å; Y441-P504 VanDerWaalsContact CE2-O 3.22Å; Y441-P504 WeakPolarHBondContact CE2-O 3.35Å; Y441-P504 WeakPolarHBondContact OH-CD 3.35Å; Y441-P504 WeakPolarHBondContact OH-CG 3.35Å; Y441-P504 PolarHBondContact OH-O 3.4Å; Y441-L506 HydrophobicContact CE2-CD2 4.48Å; Y441-F509 HydrophobicContact CE1-CD1 4.34Å; Y441-F509 HydrophobicContact CE1-CD2 4.33Å; Y441-F509 HydrophobicContact CE1-CG 4.23Å; Y441-F509 WeakPolarHBondContact OH-CB 3.34Å
442	F	92.6	Very high	87.3	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-58.7	-45.6	174.7	-176.7	-87.1	0	0	0	111.4	V383 I386 A387 L390 L404 A408 A411 R438 P439 V440 G446 I491 L494	V383-F442 HydrophobicContact CB-CD1 4.49Å; V383-F442 HydrophobicContact CG1-CD1 3.85Å; V383-F442 HydrophobicContact CG1-CE1 4.01Å; V383-F442 HydrophobicContact CG2-CD1 4.32Å; I386-F442 HydrophobicContact CG2-CE1 4.13Å; A387-F442 HydrophobicContact CB-CE1 4.02Å; A387-F442 HydrophobicContact CB-CZ 3.96Å; L390-F442 HydrophobicContact CD1-CZ 4.44Å; L404-F442 HydrophobicContact CD1-CE2 3.94Å; L404-F442 HydrophobicContact CD1-CZ 3.99Å; A408-F442 HydrophobicContact CB-CE1 4.38Å; A408-F442 HydrophobicContact CB-CE2 4.12Å; A408-F442 HydrophobicContact CB-CZ 3.81Å; A411-F442 HydrophobicContact CB-CB 4.25Å; A411-F442 HydrophobicContact CB-CG 4.5Å; R438-F442 WeakPolarHBondContact O-CB 3.41Å; R438-F442 PolarHBondContact O-N 2.97Å; P439-F442 PolarHBondContact O-N 3.39Å; V440-F442 PolarHBondContact O-N 2.95Å; F442-G446 PolarHBondContact O-N 2.68Å; F442-I491 HydrophobicContact CD2-CG2 4.12Å; F442-I491 HydrophobicContact CE2-CG2 3.81Å; F442-L494 HydrophobicContact CB-CD2 4.09Å; F442-L494 HydrophobicContact CD2-CD2 4.23Å
443	S	92.5	Very high	87.9	Confident	11 Å²	11	31.5 Å²	31.5	8%	0.077	17%	0.167	C	C	.	.	H	α-helix	trans	-64.2	-44.4	176.9	-63.9	0	0	0	0	113	P439 V440 Y441 G446 T447	P439-S443 WeakPolarHBondContact O-CB 3.36Å; P439-S443 PolarHBondContact O-N 2.95Å; P439-S443 PolarHBondContact O-OG 3.35Å; P439-S443 VanDerWaalsContact O-OG 3.05Å; V440-S443 PolarHBondContact O-N 3.48Å; Y441-S443 VanDerWaalsContact C-N 3.34Å; Y441-S443 PolarHBondContact O-N 3.07Å; S443-G446 PolarHBondContact O-N 3.26Å; S443-T447 WeakPolarHBondContact O-CB 3.29Å; S443-T447 WeakPolarHBondContact O-CG2 3.49Å; S443-T447 PolarHBondContact O-N 3.03Å; S443-T447 PolarHBondContact O-OG1 2.96Å
444	V	90.7	Very high	88.4	Confident	68 Å²	68	32.7 Å²	32.7	41%	0.412	18%	0.178	S	C	.	.	H	α-helix	trans	-63.3	-51.4	179.2	169.5	0	0	0	0	111	V440 Y441 G446 T447 L448	V440-V444 HydrophobicContact CG1-CG2 4.08Å; V440-V444 WeakPolarHBondContact O-CB 3.28Å; V440-V444 WeakPolarHBondContact O-CG2 3.29Å; V440-V444 PolarHBondContact O-N 2.9Å; Y441-V444 PolarHBondContact O-N 2.8Å; V444-G446 VanDerWaalsContact C-N 3.34Å; V444-G446 PolarHBondContact O-N 3.21Å; V444-T447 PolarHBondContact O-OG1 3.44Å; V444-L448 WeakPolarHBondContact O-CB 3.27Å; V444-L448 PolarHBondContact O-N 3.45Å
445	F	91	Very high	88.9	Confident	28 Å²	28	35.8 Å²	35.8	12%	0.123	19%	0.193	C	C	.	.	H	α-helix	trans	-65.2	-38.4	178.8	-59.6	-45.1	0	0	0	112	Y441 L448 I449 L487 L490 I491 L494 L503	Y441-F445 AromaticContact CD1-CE2 3.97Å; Y441-F445 HydrophobicContact CD1-CE2 3.97Å; Y441-F445 AromaticContact CD1-CZ 3.99Å; Y441-F445 HydrophobicContact CD1-CZ 3.99Å; Y441-F445 HydrophobicContact CG-CE2 4.36Å; Y441-F445 WeakPolarHBondContact O-CD2 3.38Å; Y441-F445 WeakPolarHBondContact O-CG 3.27Å; Y441-F445 PolarHBondContact O-N 2.93Å; F445-L448 PolarHBondContact O-N 3.18Å; F445-I449 WeakPolarHBondContact O-CG1 3.49Å; F445-I449 PolarHBondContact O-N 3.28Å; F445-L487 HydrophobicContact CB-CD2 4.5Å; F445-L487 HydrophobicContact CD1-CD2 3.76Å; F445-L487 HydrophobicContact CE1-CD2 4.45Å; F445-L487 HydrophobicContact CG-CD2 4.43Å; F445-L490 HydrophobicContact CD2-CD2 3.64Å; F445-L490 HydrophobicContact CE1-CD2 4.43Å; F445-L490 HydrophobicContact CE2-CD2 3.47Å; F445-L490 VanDerWaalsContact CE2-CD2 3.47Å; F445-L490 HydrophobicContact CG-CD2 4.21Å; F445-L490 HydrophobicContact CZ-CD2 3.9Å; F445-I491 HydrophobicContact CB-CD1 3.78Å; F445-I491 HydrophobicContact CB-CG1 3.73Å; F445-L494 HydrophobicContact CD2-CD1 4.3Å; F445-L494 HydrophobicContact CE2-CD1 4.04Å; F445-L503 HydrophobicContact CE2-CD1 4.33Å; F445-L503 HydrophobicContact CZ-CD2 4.48Å
446	G	90.8	Very high	89.1	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-65.5	-46.5	177.6	0	0	0	0	0	113.3	F442 S443 V444 L448 I449 I450	F442-G446 PolarHBondContact O-N 2.68Å; S443-G446 PolarHBondContact O-N 3.26Å; V444-G446 VanDerWaalsContact C-N 3.34Å; V444-G446 PolarHBondContact O-N 3.21Å; G446-L448 VanDerWaalsContact C-N 3.3Å; G446-L448 PolarHBondContact O-N 3.24Å; G446-I449 PolarHBondContact O-N 2.95Å; G446-I450 WeakPolarHBondContact O-CD1 3.25Å; G446-I450 VanDerWaalsContact O-CG1 3.28Å; G446-I450 WeakPolarHBondContact O-CG1 3.29Å; G446-I450 PolarHBondContact O-N 2.93Å; G446-I450 VanDerWaalsContact O-N 3.14Å
447	T	92.2	Very high	89	Confident	72 Å²	72	38.1 Å²	38.1	44%	0.442	21%	0.213	S	C	.	.	H	α-helix	trans	-61.8	-37.4	173.5	52.2	0	0	0	0	112.3	I386 S443 V444 I450 L451	I386-T447 HydrophobicContact CD1-CG2 3.7Å; I386-T447 HydrophobicContact CG1-CG2 4.3Å; S443-T447 WeakPolarHBondContact O-CB 3.29Å; S443-T447 WeakPolarHBondContact O-CG2 3.49Å; S443-T447 PolarHBondContact O-N 3.03Å; S443-T447 PolarHBondContact O-OG1 2.96Å; V444-T447 PolarHBondContact O-OG1 3.44Å; T447-I450 PolarHBondContact O-N 3.39Å; T447-L451 VanDerWaalsContact O-CB 3.26Å; T447-L451 WeakPolarHBondContact O-CB 3.09Å; T447-L451 PolarHBondContact O-N 3.03Å
448	L	90.8	Very high	89	Confident	72 Å²	72	41 Å²	41	38%	0.377	23%	0.233	S	C	.	.	H	α-helix	trans	-65.8	-42.8	178.9	-171.9	59.3	0	0	0	112.1	V444 F445 G446 I450 L451 I452 L487	V444-L448 WeakPolarHBondContact O-CB 3.27Å; V444-L448 PolarHBondContact O-N 3.45Å; F445-L448 PolarHBondContact O-N 3.18Å; G446-L448 VanDerWaalsContact C-N 3.3Å; G446-L448 PolarHBondContact O-N 3.24Å; L448-I450 VanDerWaalsContact C-N 3.34Å; L448-I450 PolarHBondContact O-N 3.23Å; L448-L451 PolarHBondContact O-N 3.09Å; L448-I452 HydrophobicContact CG-CD1 4.21Å; L448-I452 WeakPolarHBondContact O-CD1 3.5Å; L448-I452 VanDerWaalsContact O-CG1 3.27Å; L448-I452 WeakPolarHBondContact O-CG1 3.4Å; L448-I452 PolarHBondContact O-N 2.74Å; L448-L487 HydrophobicContact CB-CD1 4.31Å; L448-L487 HydrophobicContact CD2-CD1 3.56Å; L448-L487 HydrophobicContact CD2-CD2 4.04Å; L448-L487 HydrophobicContact CD2-CG 4.46Å; L448-L487 HydrophobicContact CG-CD1 3.68Å
449	I	90.7	Very high	88.8	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-59.3	-46	173.6	-67.8	163	0	0	0	111	L390 Y395 F445 G446 L451 Q484 L487 V488 I491	L390-I449 HydrophobicContact CD2-CB 4.3Å; L390-I449 HydrophobicContact CD2-CD1 4.49Å; L390-I449 HydrophobicContact CD2-CG2 4.01Å; Y395-I449 HydrophobicContact CD2-CG2 4.07Å; Y395-I449 HydrophobicContact CE2-CG2 3.76Å; F445-I449 WeakPolarHBondContact O-CG1 3.49Å; F445-I449 PolarHBondContact O-N 3.28Å; G446-I449 PolarHBondContact O-N 2.95Å; I449-L451 VanDerWaalsContact C-N 3.31Å; I449-L451 PolarHBondContact O-N 2.84Å; I449-Q484 HydrophobicContact CG2-CG 4.16Å; I449-Q484 PolarHBondContact O-NE2 3.3Å; I449-Q484 VanDerWaalsContact O-NE2 3.09Å; I449-L487 HydrophobicContact CD1-CB 3.97Å; I449-L487 HydrophobicContact CG1-CB 3.58Å; I449-L487 HydrophobicContact CG1-CD1 4.4Å; I449-V488 HydrophobicContact CD1-CG2 3.9Å; I449-V488 HydrophobicContact CG1-CG2 4.14Å; I449-V488 HydrophobicContact CG2-CG2 3.87Å; I449-I491 HydrophobicContact CD1-CD1 3.42Å; I449-I491 VanDerWaalsContact CD1-CD1 3.42Å; I449-I491 HydrophobicContact CD1-CG1 4.22Å
450	I	89.8	Confident	88.3	Confident	52 Å²	52	43.6 Å²	43.6	27%	0.267	25%	0.249	S	C	.	.	H	α-helix	trans	-66.2	-32.2	-179.6	-66.9	165	0	0	0	111.6	L389 L390 G446 T447 L448 P454	L389-I450 HydrophobicContact CB-CD1 3.75Å; L389-I450 HydrophobicContact CD1-CD1 4.35Å; L390-I450 HydrophobicContact CD2-CD1 4.25Å; L390-I450 HydrophobicContact CD2-CG1 4.05Å; L390-I450 HydrophobicContact CG-CD1 4.36Å; G446-I450 WeakPolarHBondContact O-CD1 3.25Å; G446-I450 VanDerWaalsContact O-CG1 3.28Å; G446-I450 WeakPolarHBondContact O-CG1 3.29Å; G446-I450 PolarHBondContact O-N 2.93Å; G446-I450 VanDerWaalsContact O-N 3.14Å; T447-I450 PolarHBondContact O-N 3.39Å; L448-I450 VanDerWaalsContact C-N 3.34Å; L448-I450 PolarHBondContact O-N 3.23Å; I450-P454 WeakPolarHBondContact O-CD 3.45Å
451	L	89.9	Confident	88	Confident	105 Å²	105	45.6 Å²	45.6	55%	0.55	26%	0.262	S	S	.	.	H	α-helix	trans	-84.8	-25	-178.6	-172.4	142.8	0	0	0	113.6	T447 L448 I449 D453 P454 L455	T447-L451 VanDerWaalsContact O-CB 3.26Å; T447-L451 WeakPolarHBondContact O-CB 3.09Å; T447-L451 PolarHBondContact O-N 3.03Å; L448-L451 PolarHBondContact O-N 3.09Å; I449-L451 VanDerWaalsContact C-N 3.31Å; I449-L451 PolarHBondContact O-N 2.84Å; L451-D453 VanDerWaalsContact C-N 3.29Å; L451-D453 PolarHBondContact O-N 3.25Å; L451-P454 WeakPolarHBondContact O-CD 3.36Å; L451-P454 WeakPolarHBondContact O-CG 3.47Å; L451-L455 WeakPolarHBondContact O-CB 3.47Å; L451-L455 PolarHBondContact O-N 3.49Å
452	I	88.5	Confident	87.4	Confident	5 Å²	5	49.4 Å²	49.4	3%	0.026	28%	0.282	C	S	.	.	H	α-helix	trans	-65	-34.2	172.9	-69.8	161.2	0	0	0	111.4	L448 L455 H456 L480 Q484 L487	L448-I452 HydrophobicContact CG-CD1 4.21Å; L448-I452 WeakPolarHBondContact O-CD1 3.5Å; L448-I452 VanDerWaalsContact O-CG1 3.27Å; L448-I452 WeakPolarHBondContact O-CG1 3.4Å; L448-I452 PolarHBondContact O-N 2.74Å; I452-L455 PolarHBondContact O-N 3.12Å; I452-H456 WeakPolarHBondContact O-CB 3.41Å; I452-H456 PolarHBondContact O-N 3.13Å; I452-L480 HydrophobicContact CG2-CB 4.16Å; I452-Q484 HydrophobicContact CB-CG 4.44Å; I452-Q484 HydrophobicContact CD1-CB 4.21Å; I452-Q484 HydrophobicContact CD1-CG 4.48Å; I452-Q484 HydrophobicContact CG2-CB 4.05Å; I452-Q484 HydrophobicContact CG2-CG 4.28Å; I452-L487 HydrophobicContact CD1-CD1 3.72Å
453	D	83.9	Confident	86.7	Confident	48 Å²	48	52.3 Å²	52.3	26%	0.257	29%	0.293	S	S	.	.	H	α-helix	trans	-60.2	-51.7	-177.5	-161.9	70.3	0	0	0	114.3	K393 Y395 L451 S457	K393-D453 IonicContact NZ-OD2 2.83Å; K393-D453 PolarHBondContact NZ-OD2 3.22Å; Y395-D453 VanDerWaalsContact OH-CG 3.32Å; Y395-D453 PolarHBondContact OH-OD1 3.41Å; Y395-D453 VanDerWaalsContact OH-OD1 3.04Å; L451-D453 VanDerWaalsContact C-N 3.29Å; L451-D453 PolarHBondContact O-N 3.25Å; D453-S457 PolarHBondContact O-N 3.2Å; D453-S457 PolarHBondContact O-OG 2.73Å
454	P	87.2	Confident	86	Confident	68 Å²	68	57.3 Å²	57.3	44%	0.442	32%	0.319	S	S	.	.	H	α-helix	trans	-71.1	-32.3	171.2	29.3	-35.8	0	0	0	112.6	I450 L451 S457 S458	I450-P454 WeakPolarHBondContact O-CD 3.45Å; L451-P454 WeakPolarHBondContact O-CD 3.36Å; L451-P454 WeakPolarHBondContact O-CG 3.47Å; P454-S457 WeakPolarHBondContact O-CB 3.48Å; P454-S457 PolarHBondContact O-N 3.29Å; P454-S458 PolarHBondContact O-N 3.23Å; P454-S458 PolarHBondContact O-OG 2.79Å; P454-S458 VanDerWaalsContact O-OG 3.14Å
455	L	85.3	Confident	85.5	Confident	77 Å²	77	60 Å²	60	40%	0.403	33%	0.331	S	S	.	.	H	α-helix	trans	-64.2	-41.5	177.9	-178	66.6	0	0	0	112	L451 I452 S457 S458 L459 L480	L451-L455 WeakPolarHBondContact O-CB 3.47Å; L451-L455 PolarHBondContact O-N 3.49Å; I452-L455 PolarHBondContact O-N 3.12Å; L455-S457 VanDerWaalsContact C-N 3.33Å; L455-S458 PolarHBondContact O-N 3.24Å; L455-L459 HydrophobicContact CG-CD1 4.31Å; L455-L459 WeakPolarHBondContact O-CB 3.46Å; L455-L459 PolarHBondContact O-N 3.22Å; L455-L480 HydrophobicContact CD2-CD1 4.02Å; L455-L480 HydrophobicContact CD2-CD2 4.12Å; L455-L480 HydrophobicContact CG-CD1 4.19Å
456	H	83.7	Confident	84.7	Confident	35 Å²	35	62.3 Å²	62.3	16%	0.162	34%	0.344	C	S	.	.	H	α-helix	trans	-62.6	-43	173.7	-173.6	86.3	0	0	0	110.6	I452 S458 L459 L460 N481	I452-H456 WeakPolarHBondContact O-CB 3.41Å; I452-H456 PolarHBondContact O-N 3.13Å; H456-S458 PolarHBondContact O-N 2.96Å; H456-L459 PolarHBondContact O-N 3.11Å; H456-L460 WeakPolarHBondContact O-CG 3.3Å; H456-L460 PolarHBondContact O-N 3.3Å; H456-N481 PolarHBondContact CE1-ND2 3.47Å; H456-N481 PolarHBondContact CE1-OD1 3.41Å; H456-N481 PolarHBondContact ND1-OD1 3.28Å
457	S	85	Confident	83.5	Confident	65 Å²	65	66.7 Å²	66.7	46%	0.455	37%	0.373	S	S	.	.	H	α-helix	trans	-61.5	-43.8	176.5	-57.2	0	0	0	0	112	D453 P454 L455 L460 T461	D453-S457 PolarHBondContact O-N 3.2Å; D453-S457 PolarHBondContact O-OG 2.73Å; P454-S457 WeakPolarHBondContact O-CB 3.48Å; P454-S457 PolarHBondContact O-N 3.29Å; L455-S457 VanDerWaalsContact C-N 3.33Å; S457-L460 PolarHBondContact O-N 2.94Å; S457-T461 PolarHBondContact O-N 3.29Å; S457-T461 VanDerWaalsContact O-N 3.1Å
458	S	85.7	Confident	82.5	Confident	70 Å²	70	70.2 Å²	70.2	49%	0.49	39%	0.389	S	S	.	.	H	α-helix	trans	-67.2	-31.9	174.7	-60	0	0	0	0	113.4	P454 L455 H456 T461 L462	P454-S458 PolarHBondContact O-N 3.23Å; P454-S458 PolarHBondContact O-OG 2.79Å; P454-S458 VanDerWaalsContact O-OG 3.14Å; L455-S458 PolarHBondContact O-N 3.24Å; H456-S458 PolarHBondContact O-N 2.96Å; S458-T461 WeakPolarHBondContact CA-OG1 3.43Å; S458-T461 PolarHBondContact O-OG1 3.06Å; S458-L462 WeakPolarHBondContact O-CB 3.38Å; S458-L462 PolarHBondContact O-N 2.88Å
459	L	82.3	Confident	81.4	Confident	28 Å²	28	72.6 Å²	72.6	15%	0.147	39%	0.393	C	S	.	.	H	α-helix	trans	-71.9	-32.7	173.8	-83.5	162.7	0	0	0	112.5	L455 H456 R463 L473 I476 L480	L455-L459 HydrophobicContact CG-CD1 4.31Å; L455-L459 WeakPolarHBondContact O-CB 3.46Å; L455-L459 PolarHBondContact O-N 3.22Å; H456-L459 PolarHBondContact O-N 3.11Å; L459-R463 VanDerWaalsContact O-CB 3.25Å; L459-R463 WeakPolarHBondContact O-CB 3.44Å; L459-R463 PolarHBondContact O-N 3.41Å; L459-L473 HydrophobicContact CD2-CD2 3.7Å; L459-I476 HydrophobicContact CD1-CG2 3.93Å; L459-I476 HydrophobicContact CD2-CG2 4.48Å; L459-L480 HydrophobicContact CD1-CD1 3.28Å
460	L	81.4	Confident	80.6	Confident	66 Å²	66	75.4 Å²	75.4	35%	0.346	41%	0.406	S	S	.	.	H	α-helix	trans	-68.3	-43	172.6	-70.3	174.6	0	0	0	111.6	H456 S457 L462 R463 D464	H456-L460 WeakPolarHBondContact O-CG 3.3Å; H456-L460 PolarHBondContact O-N 3.3Å; S457-L460 PolarHBondContact O-N 2.94Å; L460-L462 PolarHBondContact O-N 2.82Å; L460-R463 WeakPolarHBondContact O-CB 3.26Å; L460-R463 PolarHBondContact O-N 3.04Å; L460-D464 PolarHBondContact O-N 2.91Å
461	T	83.9	Confident	79.8	Confident	84 Å²	84	77 Å²	77	52%	0.515	42%	0.422	S	S	.	.	H	α-helix	trans	-63.6	-41.7	173.3	53	0	0	0	0	111.8	S457 S458 R463 D464 D465	S457-T461 PolarHBondContact O-N 3.29Å; S457-T461 VanDerWaalsContact O-N 3.1Å; S458-T461 WeakPolarHBondContact CA-OG1 3.43Å; S458-T461 PolarHBondContact O-OG1 3.06Å; T461-R463 PolarHBondContact O-N 3.49Å; T461-D464 PolarHBondContact O-N 3.4Å; T461-D465 PolarHBondContact O-N 3.25Å; T461-D465 VanDerWaalsContact O-N 3.16Å
462	L	78.4	Confident	78.8	Confident	84 Å²	84	76 Å²	76	44%	0.44	41%	0.411	S	S	.	.	H	α-helix	trans	-68.4	-22.5	178.8	-153.1	97.5	0	0	0	113.2	S458 L460 L466	S458-L462 WeakPolarHBondContact O-CB 3.38Å; S458-L462 PolarHBondContact O-N 2.88Å; L460-L462 PolarHBondContact O-N 2.82Å; L462-L466 HydrophobicContact CD2-CD1 4.19Å; L462-L466 HydrophobicContact CG-CD1 4.08Å; L462-L466 WeakPolarHBondContact O-CB 3.27Å; L462-L466 PolarHBondContact O-N 2.9Å
463	R	76.7	Confident	78.3	Confident	61 Å²	61	76.4 Å²	76.4	23%	0.23	41%	0.413	C	S	.	.	H	α-helix	trans	-72.1	-45.4	174	168	-165.6	-164.6	-90.1	1	110.8	L459 L460 T461 D465 L466 H470 L473 D474	L459-R463 VanDerWaalsContact O-CB 3.25Å; L459-R463 WeakPolarHBondContact O-CB 3.44Å; L459-R463 PolarHBondContact O-N 3.41Å; L460-R463 WeakPolarHBondContact O-CB 3.26Å; L460-R463 PolarHBondContact O-N 3.04Å; T461-R463 PolarHBondContact O-N 3.49Å; R463-D465 VanDerWaalsContact C-N 3.28Å; R463-D465 PolarHBondContact O-N 2.87Å; R463-L466 CarbonylContact O-C 3.53Å; R463-L466 PolarHBondContact O-N 3.19Å; R463-H470 PolarHBondContact NH1-NE2 3.47Å; R463-H470 PolarHBondContact O-CE1 3.31Å; R463-H470 PolarHBondContact O-ND1 3.39Å; R463-H470 VanDerWaalsContact O-ND1 3.16Å; R463-L473 HydrophobicContact CB-CB 4.27Å; R463-L473 HydrophobicContact CB-CD1 3.97Å; R463-D474 IonicContact CZ-OD1 3.76Å; R463-D474 IonicContact CZ-OD2 2.72Å; R463-D474 IonicContact NE-OD1 2.81Å; R463-D474 PolarHBondContact NE-OD1 2.91Å; R463-D474 IonicContact NE-OD2 2.72Å; R463-D474 IonicContact NH2-OD1 3.77Å; R463-D474 PolarHBondContact NH2-OD1 2.94Å; R463-D474 IonicContact NH2-OD2 3.04Å; R463-D474 PolarHBondContact NH2-OD2 3.45Å
464	D	78.3	Confident	77.9	Confident	115 Å²	115	76.9 Å²	76.9	62%	0.615	42%	0.415	S	S	*	.	H	α-helix	trans	-65.6	-32.9	177.7	-62.2	-20.3	0	0	0	111.5	L460 T461	L460-D464 PolarHBondContact O-N 2.91Å; T461-D464 PolarHBondContact O-N 3.4Å
465	D	80.4	Confident	77.6	Confident	126 Å²	126	77.6 Å²	77.6	67%	0.674	42%	0.422	S	S	*	.	H	α-helix	trans	-71.6	-25.9	174	-73.2	-32	0	0	0	114.6	T461 R463	T461-D465 PolarHBondContact O-N 3.25Å; T461-D465 VanDerWaalsContact O-N 3.16Å; R463-D465 VanDerWaalsContact C-N 3.28Å; R463-D465 PolarHBondContact O-N 2.87Å
466	L	72.8	Confident	77.3	Confident	75 Å²	75	78.1 Å²	78.1	39%	0.393	42%	0.424	S	S	.	.			trans	-128.5	84.8	-170.1	-79.7	150.3	0	0	0	112.4	L462 R463 D468 W469	L462-L466 HydrophobicContact CD2-CD1 4.19Å; L462-L466 HydrophobicContact CG-CD1 4.08Å; L462-L466 WeakPolarHBondContact O-CB 3.27Å; L462-L466 PolarHBondContact O-N 2.9Å; R463-L466 CarbonylContact O-C 3.53Å; R463-L466 PolarHBondContact O-N 3.19Å; L466-D468 PolarHBondContact O-N 2.92Å; L466-W469 HydrophobicContact CB-CB 4.42Å; L466-W469 PolarHBondContact O-N 3.01Å
467	P	67.4	Low	77.3	Confident	93 Å²	93	77 Å²	77	60%	0.604	42%	0.421	S	S	*	.	G	3₁₀ helix	trans	-56.4	-43.3	-177.7	19.5	-31.7	0	0	0	113.5	W469 H470	P467-W469 PolarHBondContact O-N 3.5Å; P467-W469 VanDerWaalsContact O-N 3.08Å; P467-H470 WeakPolarHBondContact O-CB 3.32Å; P467-H470 PolarHBondContact O-N 3.13Å
468	D	69.4	Low	77.2	Confident	146 Å²	146	76.7 Å²	76.7	78%	0.781	42%	0.422	S	S	*	.	G	3₁₀ helix	trans	-61.4	-20.6	-177.6	-64.9	-21	0	0	0	114.5	L466	L466-D468 PolarHBondContact O-N 2.92Å
469	W	68.4	Low	77.2	Confident	121 Å²	121	75.3 Å²	75.3	46%	0.458	42%	0.418	S	S	.	.	G	3₁₀ helix	trans	-101.9	-1.4	-176.1	-76.2	77.2	0	0	0	114	L466 P467 S471 R472 L473	L466-W469 HydrophobicContact CB-CB 4.42Å; L466-W469 PolarHBondContact O-N 3.01Å; P467-W469 PolarHBondContact O-N 3.5Å; P467-W469 VanDerWaalsContact O-N 3.08Å; W469-S471 PolarHBondContact O-N 2.96Å; W469-R472 HydrophobicContact CE3-CB 4.13Å; W469-R472 VanDerWaalsContact CE3-CD 3.49Å; W469-R472 HydrophobicContact CE3-CG 4.42Å; W469-R472 WeakPolarHBondContact O-CB 3.42Å; W469-R472 PolarHBondContact O-N 2.78Å; W469-L473 HydrophobicContact CB-CD1 3.77Å; W469-L473 HydrophobicContact CB-CG 4.1Å; W469-L473 WeakPolarHBondContact O-CG 2.79Å; W469-L473 PolarHBondContact O-N 3.27Å
470	H	73.7	Confident	77.3	Confident	60 Å²	60	75.5 Å²	75.5	28%	0.278	42%	0.42	S	S	.	.	H	α-helix	trans	-44.5	-55.2	-175	-103	64.9	0	0	0	114.3	R463 P467 R472 L473 D474	R463-H470 PolarHBondContact NH1-NE2 3.47Å; R463-H470 PolarHBondContact O-CE1 3.31Å; R463-H470 PolarHBondContact O-ND1 3.39Å; R463-H470 VanDerWaalsContact O-ND1 3.16Å; P467-H470 WeakPolarHBondContact O-CB 3.32Å; P467-H470 PolarHBondContact O-N 3.13Å; H470-R472 VanDerWaalsContact C-N 3.27Å; H470-R472 PolarHBondContact O-N 2.65Å; H470-L473 PolarHBondContact O-N 3.36Å; H470-D474 WeakPolarHBondContact O-CB 3.47Å; H470-D474 PolarHBondContact O-N 3.38Å
471	S	73	Confident	77.5	Confident	85 Å²	85	75.5 Å²	75.5	59%	0.594	42%	0.42	S	S	*	.	H	α-helix	trans	-64.8	-29.5	-176.4	59.6	0	0	0	0	113.8	W469 S475	W469-S471 PolarHBondContact O-N 2.96Å; S471-S475 PolarHBondContact O-N 3.24Å; S471-S475 VanDerWaalsContact O-N 3.16Å; S471-S475 PolarHBondContact O-OG 3.09Å
472	R	70	Confident	77.8	Confident	84 Å²	84	76.8 Å²	76.8	32%	0.317	42%	0.423	S	S	.	.	H	α-helix	trans	-77.5	-42.3	175.7	-61.1	179.8	179.9	-158.9	0.3	110.7	W469 H470 D474 S475 I476 H766	W469-R472 HydrophobicContact CE3-CB 4.13Å; W469-R472 VanDerWaalsContact CE3-CD 3.49Å; W469-R472 HydrophobicContact CE3-CG 4.42Å; W469-R472 WeakPolarHBondContact O-CB 3.42Å; W469-R472 PolarHBondContact O-N 2.78Å; H470-R472 VanDerWaalsContact C-N 3.27Å; H470-R472 PolarHBondContact O-N 2.65Å; R472-D474 VanDerWaalsContact C-N 3.34Å; R472-S475 WeakPolarHBondContact O-CB 3.35Å; R472-S475 PolarHBondContact O-N 3.45Å; R472-I476 WeakPolarHBondContact O-CD1 3.26Å; R472-I476 VanDerWaalsContact O-CG1 3.27Å; R472-I476 WeakPolarHBondContact O-CG1 3.25Å; R472-I476 PolarHBondContact O-N 3.1Å; R472-H766 PolarHBondContact NH1-NE2 3.48Å; R472-H766 PolarHBondContact NH2-NE2 2.93Å; R472-H766 VanDerWaalsContact NH2-NE2 3.16Å
473	L	77	Confident	78.2	Confident	13 Å²	13	75.4 Å²	75.4	7%	0.068	42%	0.42	C	S	.	.	H	α-helix	trans	-66.5	-36.4	176.7	-66.7	170	0	0	0	111.4	L459 R463 W469 H470 I476 S477	L459-L473 HydrophobicContact CD2-CD2 3.7Å; R463-L473 HydrophobicContact CB-CB 4.27Å; R463-L473 HydrophobicContact CB-CD1 3.97Å; W469-L473 HydrophobicContact CB-CD1 3.77Å; W469-L473 HydrophobicContact CB-CG 4.1Å; W469-L473 WeakPolarHBondContact O-CG 2.79Å; W469-L473 PolarHBondContact O-N 3.27Å; H470-L473 PolarHBondContact O-N 3.36Å; L473-I476 PolarHBondContact O-N 3.13Å; L473-S477 VanDerWaalsContact O-CB 3.29Å; L473-S477 WeakPolarHBondContact O-CB 3.41Å; L473-S477 PolarHBondContact O-N 3.06Å; L473-S477 PolarHBondContact O-OG 3.11Å
474	D	76.9	Confident	78.8	Confident	58 Å²	58	73.8 Å²	73.8	31%	0.31	42%	0.415	S	S	.	.	H	α-helix	trans	-66.2	-38.7	171.5	-77.8	-22.3	0	0	0	112.5	R463 H470 R472 I476 S477 A478	R463-D474 IonicContact CZ-OD1 3.76Å; R463-D474 IonicContact CZ-OD2 2.72Å; R463-D474 IonicContact NE-OD1 2.81Å; R463-D474 PolarHBondContact NE-OD1 2.91Å; R463-D474 IonicContact NE-OD2 2.72Å; R463-D474 IonicContact NH2-OD1 3.77Å; R463-D474 PolarHBondContact NH2-OD1 2.94Å; R463-D474 IonicContact NH2-OD2 3.04Å; R463-D474 PolarHBondContact NH2-OD2 3.45Å; H470-D474 WeakPolarHBondContact O-CB 3.47Å; H470-D474 PolarHBondContact O-N 3.38Å; R472-D474 VanDerWaalsContact C-N 3.34Å; D474-I476 VanDerWaalsContact C-N 3.33Å; D474-I476 PolarHBondContact O-N 3.11Å; D474-S477 WeakPolarHBondContact CA-OG 3.19Å; D474-S477 PolarHBondContact O-N 2.93Å; D474-S477 PolarHBondContact O-OG 3.45Å; D474-A478 VanDerWaalsContact O-CB 3.23Å; D474-A478 WeakPolarHBondContact O-CB 3.39Å; D474-A478 PolarHBondContact O-N 2.92Å
475	S	79.4	Confident	79.3	Confident	84 Å²	84	73 Å²	73	59%	0.587	41%	0.407	S	S	*	.	H	α-helix	trans	-64.2	-39.1	173.5	-59.8	0	0	0	0	112	S471 R472 G479	S471-S475 PolarHBondContact O-N 3.24Å; S471-S475 VanDerWaalsContact O-N 3.16Å; S471-S475 PolarHBondContact O-OG 3.09Å; R472-S475 WeakPolarHBondContact O-CB 3.35Å; R472-S475 PolarHBondContact O-N 3.45Å; S475-G479 PolarHBondContact O-N 3.38Å; S475-G479 VanDerWaalsContact O-N 3.12Å
476	I	79.6	Confident	79.7	Confident	87 Å²	87	70.7 Å²	70.7	45%	0.446	40%	0.398	S	S	.	.	H	α-helix	trans	-71.9	-43.2	177.3	-66.9	162.7	0	0	0	111	L459 R472 L473 D474 G479 L480	L459-I476 HydrophobicContact CD1-CG2 3.93Å; L459-I476 HydrophobicContact CD2-CG2 4.48Å; R472-I476 WeakPolarHBondContact O-CD1 3.26Å; R472-I476 VanDerWaalsContact O-CG1 3.27Å; R472-I476 WeakPolarHBondContact O-CG1 3.25Å; R472-I476 PolarHBondContact O-N 3.1Å; L473-I476 PolarHBondContact O-N 3.13Å; D474-I476 VanDerWaalsContact C-N 3.33Å; D474-I476 PolarHBondContact O-N 3.11Å; I476-G479 PolarHBondContact O-N 2.75Å; I476-L480 HydrophobicContact CG2-CD1 4.34Å; I476-L480 WeakPolarHBondContact O-CG 3.16Å; I476-L480 PolarHBondContact O-N 2.95Å
477	S	82.7	Confident	80.5	Confident	13 Å²	13	67.8 Å²	67.8	9%	0.091	38%	0.383	C	S	.	.	H	α-helix	trans	-67.6	-39.7	-178.8	77	0	0	0	0	111.6	L473 D474 L480 N481	L473-S477 VanDerWaalsContact O-CB 3.29Å; L473-S477 WeakPolarHBondContact O-CB 3.41Å; L473-S477 PolarHBondContact O-N 3.06Å; L473-S477 PolarHBondContact O-OG 3.11Å; D474-S477 WeakPolarHBondContact CA-OG 3.19Å; D474-S477 PolarHBondContact O-N 2.93Å; D474-S477 PolarHBondContact O-OG 3.45Å; S477-L480 PolarHBondContact O-N 3.25Å; S477-N481 PolarHBondContact O-N 3.21Å; S477-N481 PolarHBondContact O-OD1 2.96Å
478	A	84.1	Confident	81.6	Confident	57 Å²	57	64.4 Å²	64.4	47%	0.471	36%	0.36	S	S	.	.	H	α-helix	trans	-63	-41.7	170.5	0	0	0	0	0	112.2	D474 L480 N481 L482	D474-A478 VanDerWaalsContact O-CB 3.23Å; D474-A478 WeakPolarHBondContact O-CB 3.39Å; D474-A478 PolarHBondContact O-N 2.92Å; A478-L480 PolarHBondContact O-N 3.35Å; A478-N481 PolarHBondContact O-N 2.92Å; A478-L482 PolarHBondContact O-N 3.29Å
479	G	84.6	Confident	82.6	Confident	41 Å²	41	63.8 Å²	63.8	42%	0.423	35%	0.347	S	S	.	.	H	α-helix	trans	-62	-39.6	174.8	0	0	0	0	0	113.4	S475 I476 C483	S475-G479 PolarHBondContact O-N 3.38Å; S475-G479 VanDerWaalsContact O-N 3.12Å; I476-G479 PolarHBondContact O-N 2.75Å; G479-C483 WeakPolarHBondContact O-CB 3.44Å; G479-C483 PolarHBondContact O-N 3.29Å
480	L	85.4	Confident	83.6	Confident	33 Å²	33	60.1 Å²	60.1	17%	0.173	34%	0.336	C	S	.	.	H	α-helix	trans	-66.8	-41.5	174	-75.3	173.4	0	0	0	112.3	I452 L455 L459 I476 S477 A478 C483 Q484	I452-L480 HydrophobicContact CG2-CB 4.16Å; L455-L480 HydrophobicContact CD2-CD1 4.02Å; L455-L480 HydrophobicContact CD2-CD2 4.12Å; L455-L480 HydrophobicContact CG-CD1 4.19Å; L459-L480 HydrophobicContact CD1-CD1 3.28Å; I476-L480 HydrophobicContact CG2-CD1 4.34Å; I476-L480 WeakPolarHBondContact O-CG 3.16Å; I476-L480 PolarHBondContact O-N 2.95Å; S477-L480 PolarHBondContact O-N 3.25Å; A478-L480 PolarHBondContact O-N 3.35Å; L480-C483 WeakPolarHBondContact O-CB 3.49Å; L480-C483 PolarHBondContact O-N 3.01Å; L480-Q484 PolarHBondContact O-N 3.04Å
481	N	86.2	Confident	84.3	Confident	65 Å²	65	57.3 Å²	57.3	35%	0.348	32%	0.323	S	S	.	.	H	α-helix	trans	-64.2	-43.3	177.2	-72.4	-0.1	0	0	0	111.5	H456 S477 A478 C483 Q484 E485	H456-N481 PolarHBondContact CE1-ND2 3.47Å; H456-N481 PolarHBondContact CE1-OD1 3.41Å; H456-N481 PolarHBondContact ND1-OD1 3.28Å; S477-N481 PolarHBondContact O-N 3.21Å; S477-N481 PolarHBondContact O-OD1 2.96Å; A478-N481 PolarHBondContact O-N 2.92Å; N481-C483 VanDerWaalsContact C-N 3.3Å; N481-C483 PolarHBondContact O-N 3.49Å; N481-Q484 PolarHBondContact O-N 3.33Å; N481-E485 PolarHBondContact O-N 3Å
482	L	88.7	Confident	85.1	Confident	111 Å²	111	54.9 Å²	54.9	58%	0.581	30%	0.303	S	S	*	.	H	α-helix	trans	-60.6	-40.1	172.5	-179.9	61.9	0	0	0	111.8	A478 V486	A478-L482 PolarHBondContact O-N 3.29Å; L482-V486 HydrophobicContact CD1-CG2 4.5Å; L482-V486 VanDerWaalsContact O-CG2 3.31Å; L482-V486 WeakPolarHBondContact O-CG2 3.46Å; L482-V486 PolarHBondContact O-N 3.31Å
483	C	87.6	Confident	86	Confident	55 Å²	55	56.8 Å²	56.8	37%	0.372	31%	0.314	S	S	.	.	H	α-helix	trans	-63	-45.6	175.2	-168.7	0	0	0	0	111.7	G479 L480 N481 V486 L487	G479-C483 WeakPolarHBondContact O-CB 3.44Å; G479-C483 PolarHBondContact O-N 3.29Å; L480-C483 WeakPolarHBondContact O-CB 3.49Å; L480-C483 PolarHBondContact O-N 3.01Å; N481-C483 VanDerWaalsContact C-N 3.3Å; N481-C483 PolarHBondContact O-N 3.49Å; C483-V486 PolarHBondContact O-N 3.06Å; C483-L487 WeakPolarHBondContact O-CB 3.49Å; C483-L487 WeakPolarHBondContact O-CD1 3.4Å; C483-L487 VanDerWaalsContact O-CG 3.26Å; C483-L487 WeakPolarHBondContact O-CG 3.45Å; C483-L487 PolarHBondContact O-N 3.49Å
484	Q	89.1	Confident	86.5	Confident	28 Å²	28	56.3 Å²	56.3	13%	0.131	31%	0.312	C	S	.	.	H	α-helix	trans	-62.4	-45.4	177.8	-158.8	-176.9	49.7	0	0	111.3	Y395 I449 I452 L480 N481 V486 L487 V488	Y395-Q484 PolarHBondContact OH-NE2 3.05Å; I449-Q484 HydrophobicContact CG2-CG 4.16Å; I449-Q484 PolarHBondContact O-NE2 3.3Å; I449-Q484 VanDerWaalsContact O-NE2 3.09Å; I452-Q484 HydrophobicContact CB-CG 4.44Å; I452-Q484 HydrophobicContact CD1-CB 4.21Å; I452-Q484 HydrophobicContact CD1-CG 4.48Å; I452-Q484 HydrophobicContact CG2-CB 4.05Å; I452-Q484 HydrophobicContact CG2-CG 4.28Å; L480-Q484 PolarHBondContact O-N 3.04Å; N481-Q484 PolarHBondContact O-N 3.33Å; Q484-V486 VanDerWaalsContact C-N 3.35Å; Q484-V486 PolarHBondContact O-N 3.41Å; Q484-L487 PolarHBondContact O-N 2.95Å; Q484-V488 HydrophobicContact CG-CG2 4.4Å; Q484-V488 WeakPolarHBondContact O-CB 3.44Å; Q484-V488 VanDerWaalsContact O-CG2 3.23Å; Q484-V488 WeakPolarHBondContact O-CG2 3.39Å; Q484-V488 PolarHBondContact O-N 3.25Å
485	E	89.3	Confident	86.8	Confident	98 Å²	98	55.1 Å²	55.1	46%	0.458	31%	0.307	S	S	.	.	H	α-helix	trans	-56.8	-45.1	174.6	-86.7	-161.3	-160.5	0	0	112.9	N481 R489	N481-E485 PolarHBondContact O-N 3Å; E485-R489 VanDerWaalsContact O-CG 3.32Å; E485-R489 WeakPolarHBondContact O-CG 3.41Å; E485-R489 PolarHBondContact O-N 3.47Å; E485-R489 VanDerWaalsContact O-N 3.15Å; E485-R489 IonicContact OE2-CZ 3.02Å; E485-R489 IonicContact OE2-NH1 2.72Å; E485-R489 PolarHBondContact OE2-NH1 2.87Å; E485-R489 IonicContact OE2-NH2 3.03Å; E485-R489 PolarHBondContact OE2-NH2 3.43Å
486	V	88.9	Confident	86.9	Confident	78 Å²	78	55.5 Å²	55.5	47%	0.473	30%	0.302	S	S	.	.	H	α-helix	trans	-64.5	-44.5	178.3	169.3	0	0	0	0	110.7	L482 C483 Q484 R489 L490	L482-V486 HydrophobicContact CD1-CG2 4.5Å; L482-V486 VanDerWaalsContact O-CG2 3.31Å; L482-V486 WeakPolarHBondContact O-CG2 3.46Å; L482-V486 PolarHBondContact O-N 3.31Å; C483-V486 PolarHBondContact O-N 3.06Å; Q484-V486 VanDerWaalsContact C-N 3.35Å; Q484-V486 PolarHBondContact O-N 3.41Å; V486-R489 PolarHBondContact O-N 3.06Å; V486-L490 VanDerWaalsContact O-CB 3.22Å; V486-L490 WeakPolarHBondContact O-CB 3.42Å; V486-L490 PolarHBondContact O-N 3.1Å
487	L	90	Very high	87.1	Confident	14 Å²	14	53 Å²	53	7%	0.073	29%	0.289	C	S	.	.	H	α-helix	trans	-64.7	-45.1	178.1	-70.6	164.1	0	0	0	112.5	F445 L448 I449 I452 C483 Q484 R489 L490 I491	F445-L487 HydrophobicContact CB-CD2 4.5Å; F445-L487 HydrophobicContact CD1-CD2 3.76Å; F445-L487 HydrophobicContact CE1-CD2 4.45Å; F445-L487 HydrophobicContact CG-CD2 4.43Å; L448-L487 HydrophobicContact CB-CD1 4.31Å; L448-L487 HydrophobicContact CD2-CD1 3.56Å; L448-L487 HydrophobicContact CD2-CD2 4.04Å; L448-L487 HydrophobicContact CD2-CG 4.46Å; L448-L487 HydrophobicContact CG-CD1 3.68Å; I449-L487 HydrophobicContact CD1-CB 3.97Å; I449-L487 HydrophobicContact CG1-CB 3.58Å; I449-L487 HydrophobicContact CG1-CD1 4.4Å; I452-L487 HydrophobicContact CD1-CD1 3.72Å; C483-L487 WeakPolarHBondContact O-CB 3.49Å; C483-L487 WeakPolarHBondContact O-CD1 3.4Å; C483-L487 VanDerWaalsContact O-CG 3.26Å; C483-L487 WeakPolarHBondContact O-CG 3.45Å; C483-L487 PolarHBondContact O-N 3.49Å; Q484-L487 PolarHBondContact O-N 2.95Å; L487-R489 VanDerWaalsContact C-N 3.29Å; L487-R489 PolarHBondContact O-N 3.01Å; L487-L490 PolarHBondContact O-N 3.41Å; L487-L490 VanDerWaalsContact O-N 3.1Å; L487-I491 PolarHBondContact O-N 3.47Å
488	V	90.4	Very high	86.9	Confident	21 Å²	21	53 Å²	53	13%	0.127	29%	0.287	C	S	.	.	H	α-helix	trans	-56.8	-43.9	177.8	163.6	0	0	0	0	110.6	Y395 Y396 I449 Q484	Y395-V488 HydrophobicContact CD1-CG2 4.45Å; Y395-V488 HydrophobicContact CG-CG2 4.34Å; Y396-V488 HydrophobicContact CD1-CG1 4.38Å; Y396-V488 HydrophobicContact CE1-CG1 3.61Å; Y396-V488 WeakPolarHBondContact CE1-O 3.24Å; Y396-V488 WeakPolarHBondContact OH-CA 3.5Å; Y396-V488 PolarHBondContact OH-O 2.97Å; I449-V488 HydrophobicContact CD1-CG2 3.9Å; I449-V488 HydrophobicContact CG1-CG2 4.14Å; I449-V488 HydrophobicContact CG2-CG2 3.87Å; Q484-V488 HydrophobicContact CG-CG2 4.4Å; Q484-V488 WeakPolarHBondContact O-CB 3.44Å; Q484-V488 VanDerWaalsContact O-CG2 3.23Å; Q484-V488 WeakPolarHBondContact O-CG2 3.39Å; Q484-V488 PolarHBondContact O-N 3.25Å
489	R	89.9	Confident	86.5	Confident	133 Å²	133	54 Å²	54	50%	0.502	29%	0.288	S	S	.	.	H	α-helix	trans	-69.7	-40.4	174.4	-67.3	171.6	-174.2	129.6	8.7	112.2	E485 V486 L487 I491 L492 F493	E485-R489 VanDerWaalsContact O-CG 3.32Å; E485-R489 WeakPolarHBondContact O-CG 3.41Å; E485-R489 PolarHBondContact O-N 3.47Å; E485-R489 VanDerWaalsContact O-N 3.15Å; E485-R489 IonicContact OE2-CZ 3.02Å; E485-R489 IonicContact OE2-NH1 2.72Å; E485-R489 PolarHBondContact OE2-NH1 2.87Å; E485-R489 IonicContact OE2-NH2 3.03Å; E485-R489 PolarHBondContact OE2-NH2 3.43Å; V486-R489 PolarHBondContact O-N 3.06Å; L487-R489 VanDerWaalsContact C-N 3.29Å; L487-R489 PolarHBondContact O-N 3.01Å; R489-I491 PolarHBondContact O-N 3.37Å; R489-L492 PolarHBondContact O-N 3.45Å; R489-F493 WeakPolarHBondContact O-CD2 3.3Å; R489-F493 PolarHBondContact O-N 3.27Å
490	L	88.5	Confident	85.9	Confident	45 Å²	45	56.3 Å²	56.3	24%	0.236	29%	0.29	C	S	.	.	H	α-helix	trans	-62.4	-38	-177.1	-170.7	153.1	0	0	0	112.7	F445 V486 L487 L492 F493 L494 L497	F445-L490 HydrophobicContact CD2-CD2 3.64Å; F445-L490 HydrophobicContact CE1-CD2 4.43Å; F445-L490 HydrophobicContact CE2-CD2 3.47Å; F445-L490 VanDerWaalsContact CE2-CD2 3.47Å; F445-L490 HydrophobicContact CG-CD2 4.21Å; F445-L490 HydrophobicContact CZ-CD2 3.9Å; V486-L490 VanDerWaalsContact O-CB 3.22Å; V486-L490 WeakPolarHBondContact O-CB 3.42Å; V486-L490 PolarHBondContact O-N 3.1Å; L487-L490 PolarHBondContact O-N 3.41Å; L487-L490 VanDerWaalsContact O-N 3.1Å; L490-L492 VanDerWaalsContact C-N 3.28Å; L490-L492 PolarHBondContact O-N 2.84Å; L490-F493 CarbonylContact O-C 3.53Å; L490-F493 PolarHBondContact O-N 2.7Å; L490-L494 HydrophobicContact CD2-CD1 4.43Å; L490-L494 PolarHBondContact O-N 2.71Å; L490-L497 HydrophobicContact CD2-CD1 4.08Å; L490-L497 HydrophobicContact CG-CD1 3.86Å
491	I	90	Very high	85.4	Confident	0 Å²	0	55 Å²	55	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-61.2	-35.3	176.3	-69.8	-174.8	0	0	0	112.5	L390 L404 S407 F442 F445 I449 L487 R489 L494	L390-I491 HydrophobicContact CD1-CD1 4.13Å; L404-I491 HydrophobicContact CD1-CG2 3.7Å; S407-I491 PolarHBondContact OG-O 3.15Å; F442-I491 HydrophobicContact CD2-CG2 4.12Å; F442-I491 HydrophobicContact CE2-CG2 3.81Å; F445-I491 HydrophobicContact CB-CD1 3.78Å; F445-I491 HydrophobicContact CB-CG1 3.73Å; I449-I491 HydrophobicContact CD1-CD1 3.42Å; I449-I491 VanDerWaalsContact CD1-CD1 3.42Å; I449-I491 HydrophobicContact CD1-CG1 4.22Å; L487-I491 PolarHBondContact O-N 3.47Å; R489-I491 PolarHBondContact O-N 3.37Å; I491-L494 WeakPolarHBondContact O-CB 3.35Å; I491-L494 PolarHBondContact O-N 2.62Å
492	L	89.3	Confident	85	Confident	34 Å²	34	53.5 Å²	53.5	18%	0.178	28%	0.277	C	S	.	.	H	α-helix	trans	-70	-38.7	178.5	-56.9	-177.4	0	0	0	111.7	Y396 G400 F403 L404 R489 L490 L494 P495	Y396-L492 HydrophobicContact CD1-CD1 4.08Å; Y396-L492 HydrophobicContact CD1-CD2 3.87Å; Y396-L492 HydrophobicContact CD1-CG 4.3Å; Y396-L492 HydrophobicContact CE1-CD1 3.84Å; Y396-L492 HydrophobicContact CE1-CD2 3.52Å; Y396-L492 HydrophobicContact CE1-CG 3.72Å; G400-L492 WeakPolarHBondContact O-CD2 3.49Å; F403-L492 HydrophobicContact CB-CB 4.33Å; F403-L492 HydrophobicContact CB-CD2 3.92Å; L404-L492 HydrophobicContact CB-CD2 4.2Å; R489-L492 PolarHBondContact O-N 3.45Å; L490-L492 VanDerWaalsContact C-N 3.28Å; L490-L492 PolarHBondContact O-N 2.84Å; L492-L494 VanDerWaalsContact C-N 3.32Å; L492-P495 WeakPolarHBondContact O-CD 3.47Å
493	F	87.8	Confident	84.6	Confident	125 Å²	125	49.2 Å²	49.2	55%	0.548	26%	0.255	S	S	.	.	H	α-helix	trans	-86.1	0.8	176.7	-65.6	-68.9	0	0	0	114	R489 L490 P495 L496 L497	R489-F493 WeakPolarHBondContact O-CD2 3.3Å; R489-F493 PolarHBondContact O-N 3.27Å; L490-F493 CarbonylContact O-C 3.53Å; L490-F493 PolarHBondContact O-N 2.7Å; F493-P495 VanDerWaalsContact C-CD 3.42Å; F493-P495 VanDerWaalsContact C-N 3.33Å; F493-L496 HydrophobicContact CD1-CD2 4.46Å; F493-L496 WeakPolarHBondContact O-CA 3.32Å; F493-L496 WeakPolarHBondContact O-CB 3.08Å; F493-L496 PolarHBondContact O-N 3.03Å; F493-L497 PolarHBondContact O-N 3.43Å
494	L	87.3	Confident	84.3	Confident	3 Å²	3	46.7 Å²	46.7	2%	0.016	24%	0.238	C	C	.	.	H	α-helix	trans	-51.8	-40.7	-179.6	-170.4	69.8	0	0	0	113.8	F442 F445 L490 I491 L492 L496 L497 F498 L503	F442-L494 HydrophobicContact CB-CD2 4.09Å; F442-L494 HydrophobicContact CD2-CD2 4.23Å; F445-L494 HydrophobicContact CD2-CD1 4.3Å; F445-L494 HydrophobicContact CE2-CD1 4.04Å; L490-L494 HydrophobicContact CD2-CD1 4.43Å; L490-L494 PolarHBondContact O-N 2.71Å; I491-L494 WeakPolarHBondContact O-CB 3.35Å; I491-L494 PolarHBondContact O-N 2.62Å; L492-L494 VanDerWaalsContact C-N 3.32Å; L494-L496 VanDerWaalsContact C-N 3.33Å; L494-L496 PolarHBondContact O-N 3.35Å; L494-L497 PolarHBondContact O-N 2.97Å; L494-F498 HydrophobicContact CD1-CD2 4.4Å; L494-F498 HydrophobicContact CD1-CE2 3.7Å; L494-F498 HydrophobicContact CD1-CZ 4.04Å; L494-F498 HydrophobicContact CD2-CE2 4.04Å; L494-F498 HydrophobicContact CG-CD2 4.08Å; L494-F498 HydrophobicContact CG-CE2 3.53Å; L494-F498 HydrophobicContact CG-CZ 4.34Å; L494-F498 WeakPolarHBondContact O-CD2 3.48Å; L494-F498 PolarHBondContact O-N 3.35Å; L494-F498 VanDerWaalsContact O-N 3.15Å; L494-L503 HydrophobicContact CD1-CD1 3.4Å
495	P	83.1	Confident	83.8	Confident	32 Å²	32	45.8 Å²	45.8	21%	0.208	23%	0.234	C	C	.	.	H	α-helix	trans	-61.2	-38.8	173.7	-22.5	34.4	0	0	0	113.2	F406 L492 F493 F498 T499	F406-P495 HydrophobicContact CD1-CB 4.44Å; F406-P495 HydrophobicContact CD1-CG 3.89Å; F406-P495 HydrophobicContact CE1-CB 4.05Å; F406-P495 HydrophobicContact CE1-CG 4.01Å; L492-P495 WeakPolarHBondContact O-CD 3.47Å; F493-P495 VanDerWaalsContact C-CD 3.42Å; F493-P495 VanDerWaalsContact C-N 3.33Å; P495-F498 PolarHBondContact O-N 2.81Å; P495-T499 PolarHBondContact O-N 3.44Å; P495-T499 VanDerWaalsContact O-N 3.14Å
496	L	82.9	Confident	83.5	Confident	93 Å²	93	42.3 Å²	42.3	49%	0.487	22%	0.218	S	C	.	.	H	α-helix	trans	-69.4	-42.9	178.8	-167.7	77.9	0	0	0	111.1	F493 L494 F498 T499 L500	F493-L496 HydrophobicContact CD1-CD2 4.46Å; F493-L496 WeakPolarHBondContact O-CA 3.32Å; F493-L496 WeakPolarHBondContact O-CB 3.08Å; F493-L496 PolarHBondContact O-N 3.03Å; L494-L496 VanDerWaalsContact C-N 3.33Å; L494-L496 PolarHBondContact O-N 3.35Å; L496-F498 VanDerWaalsContact C-N 3.26Å; L496-F498 PolarHBondContact O-N 3.27Å; L496-T499 WeakPolarHBondContact CA-OG1 3.29Å; L496-T499 PolarHBondContact O-N 3.39Å; L496-T499 PolarHBondContact O-OG1 2.69Å; L496-L500 HydrophobicContact CD2-CD1 4.41Å; L496-L500 HydrophobicContact CG-CD1 4.16Å; L496-L500 WeakPolarHBondContact O-CG 3.29Å; L496-L500 PolarHBondContact O-N 2.92Å
497	L	83.1	Confident	83.1	Confident	35 Å²	35	41.3 Å²	41.3	18%	0.183	21%	0.21	C	C	.	.	H	α-helix	trans	-60.4	-35.2	177.1	-67.1	172.6	0	0	0	112.2	L490 F493 L494 G501 V502 L503	L490-L497 HydrophobicContact CD2-CD1 4.08Å; L490-L497 HydrophobicContact CG-CD1 3.86Å; F493-L497 PolarHBondContact O-N 3.43Å; L494-L497 PolarHBondContact O-N 2.97Å; L497-G501 PolarHBondContact O-N 2.85Å; L497-G501 VanDerWaalsContact O-N 3.14Å; L497-V502 HydrophobicContact CB-CB 4.48Å; L497-V502 HydrophobicContact CD2-CB 4.04Å; L497-V502 HydrophobicContact CD2-CG1 4.13Å; L497-V502 HydrophobicContact CD2-CG2 4.2Å; L497-V502 PolarHBondContact O-N 3.07Å; L497-L503 HydrophobicContact CB-CD1 4.4Å; L497-L503 HydrophobicContact CB-CG 4.49Å
498	F	78.5	Confident	82.7	Confident	11 Å²	11	41.3 Å²	41.3	5%	0.048	21%	0.211	C	C	.	.	H	α-helix	trans	-72.2	-36.4	171	-71.5	-56	0	0	0	113.5	R438 Y441 L494 P495 L496 L500 G501 L503	R438-F498 HydrophobicContact CB-CD2 4.31Å; R438-F498 HydrophobicContact CB-CE2 3.66Å; R438-F498 HydrophobicContact CB-CZ 3.99Å; R438-F498 HydrophobicContact CG-CD1 4.34Å; R438-F498 HydrophobicContact CG-CD2 3.75Å; R438-F498 HydrophobicContact CG-CE1 4.16Å; R438-F498 HydrophobicContact CG-CE2 3.5Å; R438-F498 VanDerWaalsContact CG-CE2 3.5Å; R438-F498 HydrophobicContact CG-CG 4.18Å; R438-F498 HydrophobicContact CG-CZ 3.77Å; Y441-F498 AromaticContact CD2-CE1 3.86Å; Y441-F498 HydrophobicContact CD2-CE1 3.86Å; Y441-F498 AromaticContact CD2-CZ 3.64Å; Y441-F498 HydrophobicContact CD2-CZ 3.64Å; Y441-F498 HydrophobicContact CE2-CE1 4.21Å; Y441-F498 HydrophobicContact CE2-CZ 4.44Å; Y441-F498 HydrophobicContact CG-CZ 4.23Å; L494-F498 HydrophobicContact CD1-CD2 4.4Å; L494-F498 HydrophobicContact CD1-CE2 3.7Å; L494-F498 HydrophobicContact CD1-CZ 4.04Å; L494-F498 HydrophobicContact CD2-CE2 4.04Å; L494-F498 HydrophobicContact CG-CD2 4.08Å; L494-F498 HydrophobicContact CG-CE2 3.53Å; L494-F498 HydrophobicContact CG-CZ 4.34Å; L494-F498 WeakPolarHBondContact O-CD2 3.48Å; L494-F498 PolarHBondContact O-N 3.35Å; L494-F498 VanDerWaalsContact O-N 3.15Å; P495-F498 PolarHBondContact O-N 2.81Å; L496-F498 VanDerWaalsContact C-N 3.26Å; L496-F498 PolarHBondContact O-N 3.27Å; F498-L500 VanDerWaalsContact C-N 3.31Å; F498-L500 PolarHBondContact O-N 2.72Å; F498-G501 PolarHBondContact O-N 3.49Å; F498-L503 HydrophobicContact CD1-CB 4.15Å; F498-L503 HydrophobicContact CD1-CD1 4.43Å; F498-L503 HydrophobicContact CE1-CB 3.73Å; F498-L503 HydrophobicContact CE1-CD1 3.81Å; F498-L503 HydrophobicContact CE1-CG 4.41Å; F498-L503 HydrophobicContact CE2-CD1 4.41Å; F498-L503 HydrophobicContact CZ-CD1 3.78Å
499	T	75.2	Confident	82.5	Confident	78 Å²	78	43 Å²	43	48%	0.479	22%	0.216	S	C	.	.	H	α-helix	trans	-70	-26.6	175.1	53.5	0	0	0	0	113.7	P495 L496 F1305	P495-T499 PolarHBondContact O-N 3.44Å; P495-T499 VanDerWaalsContact O-N 3.14Å; L496-T499 WeakPolarHBondContact CA-OG1 3.29Å; L496-T499 PolarHBondContact O-N 3.39Å; L496-T499 PolarHBondContact O-OG1 2.69Å; T499-F1305 WeakPolarHBondContact O-CZ 3.39Å
500	L	72.8	Confident	82.4	Confident	91 Å²	91	39.2 Å²	39.2	48%	0.476	21%	0.21	S	C	.	.	H	α-helix	trans	-85.4	-14.6	174.6	-67.7	173.7	0	0	0	113.2	L496 F498 V502 Q1301	L496-L500 HydrophobicContact CD2-CD1 4.41Å; L496-L500 HydrophobicContact CG-CD1 4.16Å; L496-L500 WeakPolarHBondContact O-CG 3.29Å; L496-L500 PolarHBondContact O-N 2.92Å; F498-L500 VanDerWaalsContact C-N 3.31Å; F498-L500 PolarHBondContact O-N 2.72Å; L500-V502 HydrophobicContact CB-CG2 3.89Å; L500-Q1301 PolarHBondContact O-NE2 3.47Å
501	G	74.7	Confident	82.4	Confident	5 Å²	5	37.4 Å²	37.4	5%	0.052	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	72.5	35.3	-177.1	0	0	0	0	0	114	L497 F498 Y848	L497-G501 PolarHBondContact O-N 2.85Å; L497-G501 VanDerWaalsContact O-N 3.14Å; F498-G501 PolarHBondContact O-N 3.49Å; G501-Y848 WeakPolarHBondContact O-CB 3.29Å; G501-Y848 WeakPolarHBondContact O-CD1 3.5Å; G501-Y848 PolarHBondContact O-N 3.41Å
502	V	78.6	Confident	82.3	Confident	33 Å²	33	38.5 Å²	38.5	20%	0.2	21%	0.205	C	C	.	.			trans	-84	-25.2	-179.7	-179.1	0	0	0	0	112.1	L497 L500 M846 Y848	L497-V502 HydrophobicContact CB-CB 4.48Å; L497-V502 HydrophobicContact CD2-CB 4.04Å; L497-V502 HydrophobicContact CD2-CG1 4.13Å; L497-V502 HydrophobicContact CD2-CG2 4.2Å; L497-V502 PolarHBondContact O-N 3.07Å; L500-V502 HydrophobicContact CB-CG2 3.89Å; V502-M846 HydrophobicContact CG1-CE 3.95Å; V502-Y848 WeakPolarHBondContact O-CA 3.34Å; V502-Y848 WeakPolarHBondContact O-CB 3.05Å
503	L	80.7	Confident	82.3	Confident	22 Å²	22	40.7 Å²	40.7	12%	0.115	22%	0.217	C	C	.	.	S	Bend	trans	-102.1	128.3	177.6	-66.9	176.2	0	0	0	111.1	A424 Y441 F445 L494 L497 F498	A424-L503 WeakPolarHBondContact CB-O 3.35Å; Y441-L503 HydrophobicContact CD2-CD1 4.42Å; Y441-L503 HydrophobicContact CE1-CD2 4.37Å; Y441-L503 HydrophobicContact CE2-CB 4.15Å; Y441-L503 HydrophobicContact CG-CD1 4.31Å; F445-L503 HydrophobicContact CE2-CD1 4.33Å; F445-L503 HydrophobicContact CZ-CD2 4.48Å; L494-L503 HydrophobicContact CD1-CD1 3.4Å; L497-L503 HydrophobicContact CB-CD1 4.4Å; L497-L503 HydrophobicContact CB-CG 4.49Å; F498-L503 HydrophobicContact CD1-CB 4.15Å; F498-L503 HydrophobicContact CD1-CD1 4.43Å; F498-L503 HydrophobicContact CE1-CB 3.73Å; F498-L503 HydrophobicContact CE1-CD1 3.81Å; F498-L503 HydrophobicContact CE1-CG 4.41Å; F498-L503 HydrophobicContact CE2-CD1 4.41Å; F498-L503 HydrophobicContact CZ-CD1 3.78Å
504	P	79.3	Confident	82.5	Confident	2 Å²	2	36.6 Å²	36.6	1%	0.013	20%	0.201	C	C	.	.	P	Polyproline II helix	trans	-77.2	171.3	-178.6	28.8	-33.2	0	0	0	113.6	Y441 T508 F509 Y848 V849	Y441-P504 VanDerWaalsContact CE2-O 3.22Å; Y441-P504 WeakPolarHBondContact CE2-O 3.35Å; Y441-P504 WeakPolarHBondContact OH-CD 3.35Å; Y441-P504 WeakPolarHBondContact OH-CG 3.35Å; Y441-P504 PolarHBondContact OH-O 3.4Å; P504-T508 HydrophobicContact CB-CG2 4.45Å; P504-F509 HydrophobicContact CG-CB 3.94Å; P504-F509 HydrophobicContact CG-CD2 3.91Å; P504-F509 HydrophobicContact CG-CG 4.39Å; P504-Y848 HydrophobicContact CB-CD2 3.62Å; P504-Y848 HydrophobicContact CB-CE2 4.29Å; P504-Y848 HydrophobicContact CB-CG 4.11Å; P504-V849 HydrophobicContact CG-CG2 3.73Å
505	Q	79.4	Confident	82.6	Confident	9 Å²	9	36.5 Å²	36.5	4%	0.042	20%	0.2	C	C	.	.	P	Polyproline II helix	trans	-65.1	152.5	166.5	-61.8	-174.5	-3.5	0	0	111.2	D422 A424 S425 N431 V434 N507 T508 F509	D422-Q505 PolarHBondContact OD2-NE2 3.22Å; A424-Q505 HydrophobicContact CB-CG 3.92Å; S425-Q505 VanDerWaalsContact CA-NE2 3.27Å; S425-Q505 VanDerWaalsContact CB-NE2 3.28Å; N431-Q505 PolarHBondContact ND2-OE1 3.48Å; V434-Q505 HydrophobicContact CG2-CG 4.46Å; V434-Q505 VanDerWaalsContact CG2-NE2 3.27Å; Q505-N507 PolarHBondContact O-N 2.89Å; Q505-T508 WeakPolarHBondContact O-CB 3.35Å; Q505-T508 PolarHBondContact O-N 3.19Å; Q505-T508 VanDerWaalsContact O-N 3.13Å; Q505-F509 PolarHBondContact O-N 2.91Å
506	L	83	Confident	82.9	Confident	24 Å²	24	36.4 Å²	36.4	13%	0.126	20%	0.197	C	C	.	.	H	α-helix	trans	-60.3	-42.3	-170.3	-74.7	166.2	0	0	0	114	I433 V440 Y441 T508 F509 C510	I433-L506 HydrophobicContact CG2-CB 4.24Å; V440-L506 HydrophobicContact CB-CD1 3.89Å; V440-L506 HydrophobicContact CB-CD2 3.85Å; V440-L506 HydrophobicContact CG1-CD1 4.35Å; V440-L506 HydrophobicContact CG1-CD2 3.62Å; V440-L506 HydrophobicContact CG2-CD1 3.79Å; Y441-L506 HydrophobicContact CE2-CD2 4.48Å; L506-T508 VanDerWaalsContact C-N 3.33Å; L506-T508 PolarHBondContact O-N 3.49Å; L506-F509 PolarHBondContact O-N 3.44Å; L506-C510 WeakPolarHBondContact O-CB 3.46Å; L506-C510 PolarHBondContact O-N 3.16Å; L506-C510 PolarHBondContact O-SG 3.47Å; L506-C510 VanDerWaalsContact O-SG 3.33Å
507	N	81	Confident	83.2	Confident	57 Å²	57	33.9 Å²	33.9	31%	0.305	19%	0.185	S	C	.	.	H	α-helix	trans	-58	-47.7	175.4	-79.1	12.5	0	0	0	111.4	I433 Q505 F509 C510 C511	I433-N507 WeakPolarHBondContact CD1-ND2 3.31Å; Q505-N507 PolarHBondContact O-N 2.89Å; N507-F509 VanDerWaalsContact C-N 3.33Å; N507-F509 PolarHBondContact O-N 3.42Å; N507-C510 PolarHBondContact O-N 3.25Å; N507-C511 VanDerWaalsContact O-CB 3.22Å; N507-C511 WeakPolarHBondContact O-CB 3.49Å; N507-C511 PolarHBondContact O-N 2.89Å
508	T	82	Confident	83.5	Confident	14 Å²	14	32.2 Å²	32.2	9%	0.086	18%	0.177	C	C	.	.	H	α-helix	trans	-64.2	-39.2	179.5	-39.4	0	0	0	0	111	P504 Q505 L506 Y512 P851 E856	P504-T508 HydrophobicContact CB-CG2 4.45Å; Q505-T508 WeakPolarHBondContact O-CB 3.35Å; Q505-T508 PolarHBondContact O-N 3.19Å; Q505-T508 VanDerWaalsContact O-N 3.13Å; L506-T508 VanDerWaalsContact C-N 3.33Å; L506-T508 PolarHBondContact O-N 3.49Å; T508-Y512 VanDerWaalsContact O-CB 3.23Å; T508-Y512 WeakPolarHBondContact O-CB 3.26Å; T508-Y512 PolarHBondContact O-N 3.45Å; T508-P851 HydrophobicContact CG2-CG 4.38Å; T508-E856 WeakPolarHBondContact CA-OE1 3.25Å; T508-E856 WeakPolarHBondContact CB-OE1 3.46Å; T508-E856 PolarHBondContact N-OE1 3.39Å; T508-E856 PolarHBondContact OG1-OE1 2.76Å
509	F	86	Confident	83.8	Confident	56 Å²	56	33.2 Å²	33.2	25%	0.246	18%	0.182	C	C	.	.	H	α-helix	trans	-63.9	-51.7	174.3	-171.5	-110.1	0	0	0	112.5	Y441 P504 Q505 L506 N507 C511 Y512 L513 V849	Y441-F509 HydrophobicContact CE1-CD1 4.34Å; Y441-F509 HydrophobicContact CE1-CD2 4.33Å; Y441-F509 HydrophobicContact CE1-CG 4.23Å; Y441-F509 WeakPolarHBondContact OH-CB 3.34Å; P504-F509 HydrophobicContact CG-CB 3.94Å; P504-F509 HydrophobicContact CG-CD2 3.91Å; P504-F509 HydrophobicContact CG-CG 4.39Å; Q505-F509 PolarHBondContact O-N 2.91Å; L506-F509 PolarHBondContact O-N 3.44Å; N507-F509 VanDerWaalsContact C-N 3.33Å; N507-F509 PolarHBondContact O-N 3.42Å; F509-C511 VanDerWaalsContact C-N 3.31Å; F509-C511 PolarHBondContact O-N 2.91Å; F509-Y512 PolarHBondContact O-N 2.72Å; F509-L513 HydrophobicContact CE1-CD1 3.9Å; F509-L513 HydrophobicContact CZ-CD1 3.95Å; F509-L513 WeakPolarHBondContact O-CB 3.49Å; F509-L513 PolarHBondContact O-N 2.85Å; F509-V849 HydrophobicContact CD2-CG2 4.12Å; F509-V849 HydrophobicContact CE2-CG2 4.45Å
510	C	87.9	Confident	84.1	Confident	54 Å²	54	31.3 Å²	31.3	37%	0.365	17%	0.167	S	C	.	.	H	α-helix	trans	-64.8	-37.1	-179.8	-66.5	0	0	0	0	111.4	L506 N507 L514 L530	L506-C510 WeakPolarHBondContact O-CB 3.46Å; L506-C510 PolarHBondContact O-N 3.16Å; L506-C510 PolarHBondContact O-SG 3.47Å; L506-C510 VanDerWaalsContact O-SG 3.33Å; N507-C510 PolarHBondContact O-N 3.25Å; C510-L514 WeakPolarHBondContact O-CB 3.31Å; C510-L514 VanDerWaalsContact O-CG 3.25Å; C510-L514 WeakPolarHBondContact O-CG 3.33Å; C510-L514 PolarHBondContact O-N 3.36Å; C510-L530 HydrophobicContact CB-CD1 3.68Å
511	C	87.5	Confident	84.6	Confident	8 Å²	8	30.6 Å²	30.6	5%	0.054	16%	0.163	C	C	.	.	H	α-helix	trans	-66.8	-45.2	174.7	-164.9	0	0	0	0	111.4	N507 F509 E515 L530 P851	N507-C511 VanDerWaalsContact O-CB 3.22Å; N507-C511 WeakPolarHBondContact O-CB 3.49Å; N507-C511 PolarHBondContact O-N 2.89Å; F509-C511 VanDerWaalsContact C-N 3.31Å; F509-C511 PolarHBondContact O-N 2.91Å; C511-E515 WeakPolarHBondContact O-CB 3.47Å; C511-E515 PolarHBondContact O-N 3.41Å; C511-L530 HydrophobicContact CB-CD1 4.33Å; C511-P851 HydrophobicContact CB-CG 4.43Å
512	Y	88.9	Confident	85.1	Confident	22 Å²	22	33.3 Å²	33.3	9%	0.086	17%	0.174	C	C	.	.	H	α-helix	trans	-58.7	-49.4	173.2	163.3	-97.1	0	0	0	111.6	T508 F509 L514 E515 Q516 L831 V849	T508-Y512 VanDerWaalsContact O-CB 3.23Å; T508-Y512 WeakPolarHBondContact O-CB 3.26Å; T508-Y512 PolarHBondContact O-N 3.45Å; F509-Y512 PolarHBondContact O-N 2.72Å; Y512-L514 PolarHBondContact O-N 3.01Å; Y512-E515 PolarHBondContact O-N 3.45Å; Y512-Q516 HydrophobicContact CD1-CG 4.46Å; Y512-Q516 HydrophobicContact CD2-CG 3.9Å; Y512-Q516 HydrophobicContact CE1-CG 4.03Å; Y512-Q516 HydrophobicContact CE2-CG 3.42Å; Y512-Q516 VanDerWaalsContact CE2-CG 3.42Å; Y512-Q516 HydrophobicContact CG-CG 4.39Å; Y512-Q516 VanDerWaalsContact CZ-CG 3.46Å; Y512-Q516 WeakPolarHBondContact O-CB 3.45Å; Y512-Q516 VanDerWaalsContact O-CG 3.27Å; Y512-Q516 WeakPolarHBondContact O-CG 3.3Å; Y512-Q516 PolarHBondContact O-N 3.28Å; Y512-L831 VanDerWaalsContact OH-C 3.32Å; Y512-L831 PolarHBondContact OH-O 2.93Å; Y512-V849 HydrophobicContact CD1-CB 4.02Å; Y512-V849 HydrophobicContact CD1-CG2 3.61Å; Y512-V849 HydrophobicContact CD2-CB 4.19Å; Y512-V849 HydrophobicContact CE1-CB 3.94Å; Y512-V849 HydrophobicContact CE1-CG1 4.29Å; Y512-V849 HydrophobicContact CE1-CG2 3.81Å; Y512-V849 HydrophobicContact CE2-CB 4.09Å; Y512-V849 HydrophobicContact CG-CB 4.17Å; Y512-V849 HydrophobicContact CG-CG2 4.04Å
513	L	89.5	Confident	85	Confident	80 Å²	80	35 Å²	35	42%	0.419	20%	0.198	S	C	.	.	H	α-helix	trans	-64.9	-43.1	-176.3	-174.3	149.1	0	0	0	111.7	F509 Q516 V517	F509-L513 HydrophobicContact CE1-CD1 3.9Å; F509-L513 HydrophobicContact CZ-CD1 3.95Å; F509-L513 WeakPolarHBondContact O-CB 3.49Å; F509-L513 PolarHBondContact O-N 2.85Å; L513-Q516 PolarHBondContact O-N 3.44Å; L513-V517 HydrophobicContact CD2-CG2 4.42Å; L513-V517 VanDerWaalsContact O-CG2 3.31Å; L513-V517 WeakPolarHBondContact O-CG2 3.08Å; L513-V517 PolarHBondContact O-N 3.08Å
514	L	91	Very high	84.9	Confident	40 Å²	40	35.1 Å²	35.1	21%	0.209	20%	0.204	C	C	.	.	H	α-helix	trans	-67.3	-36.5	174.9	-69.4	169.9	0	0	0	112.3	C510 Y512 V517 D518 L530 A533 I534 C537	C510-L514 WeakPolarHBondContact O-CB 3.31Å; C510-L514 VanDerWaalsContact O-CG 3.25Å; C510-L514 WeakPolarHBondContact O-CG 3.33Å; C510-L514 PolarHBondContact O-N 3.36Å; Y512-L514 PolarHBondContact O-N 3.01Å; L514-V517 PolarHBondContact O-N 3.23Å; L514-D518 PolarHBondContact O-N 2.91Å; L514-L530 HydrophobicContact CD1-CD1 4.05Å; L514-A533 HydrophobicContact CB-CB 3.76Å; L514-A533 HydrophobicContact CD1-CB 4.22Å; L514-I534 HydrophobicContact CD1-CG1 3.63Å; L514-C537 HydrophobicContact CD2-CB 4.33Å; L514-C537 PolarHBondContact O-SG 3.21Å; L514-C537 VanDerWaalsContact O-SG 3.41Å
515	E	90.1	Very high	85.1	Confident	1 Å²	1	36.4 Å²	36.4	1%	0.005	21%	0.212	C	C	.	.	H	α-helix	trans	-67	-42.1	175.2	-177.5	175	-121	0	0	112	C511 Y512 V517 D518 M519 A526 C527 P851 V852	C511-E515 WeakPolarHBondContact O-CB 3.47Å; C511-E515 PolarHBondContact O-N 3.41Å; Y512-E515 PolarHBondContact O-N 3.45Å; E515-V517 VanDerWaalsContact C-N 3.3Å; E515-V517 PolarHBondContact O-N 3.16Å; E515-D518 PolarHBondContact O-N 3.33Å; E515-M519 HydrophobicContact CG-CE 3.49Å; E515-M519 VanDerWaalsContact CG-CE 3.49Å; E515-M519 HydrophobicContact CG-CG 4.48Å; E515-M519 HydrophobicContact CG-SD 4.09Å; E515-M519 WeakPolarHBondContact O-CB 3.08Å; E515-M519 VanDerWaalsContact O-CG 3.29Å; E515-M519 WeakPolarHBondContact O-CG 3.39Å; E515-M519 PolarHBondContact O-N 2.9Å; E515-A526 VanDerWaalsContact OE1-CA 3.22Å; E515-A526 WeakPolarHBondContact OE1-CA 3.46Å; E515-A526 WeakPolarHBondContact OE1-CB 3.41Å; E515-C527 PolarHBondContact OE1-N 2.9Å; E515-P851 WeakPolarHBondContact OE2-CA 3.23Å; E515-P851 WeakPolarHBondContact OE2-CB 3.33Å; E515-V852 PolarHBondContact OE2-N 3.3Å
516	Q	88.8	Confident	85.1	Confident	30 Å²	30	36 Å²	36	14%	0.14	21%	0.21	C	C	.	.	H	α-helix	trans	-63.1	-36	172.9	-68.3	-67.5	-78.4	0	0	112.2	Y512 L513 H520	Y512-Q516 HydrophobicContact CD1-CG 4.46Å; Y512-Q516 HydrophobicContact CD2-CG 3.9Å; Y512-Q516 HydrophobicContact CE1-CG 4.03Å; Y512-Q516 HydrophobicContact CE2-CG 3.42Å; Y512-Q516 VanDerWaalsContact CE2-CG 3.42Å; Y512-Q516 HydrophobicContact CG-CG 4.39Å; Y512-Q516 VanDerWaalsContact CZ-CG 3.46Å; Y512-Q516 WeakPolarHBondContact O-CB 3.45Å; Y512-Q516 VanDerWaalsContact O-CG 3.27Å; Y512-Q516 WeakPolarHBondContact O-CG 3.3Å; Y512-Q516 PolarHBondContact O-N 3.28Å; L513-Q516 PolarHBondContact O-N 3.44Å; Q516-H520 WeakPolarHBondContact O-CB 3.32Å; Q516-H520 PolarHBondContact O-CD2 3.31Å; Q516-H520 PolarHBondContact O-N 3.05Å; Q516-H520 PolarHBondContact OE1-CD2 3.2Å
517	V	89.3	Confident	84.9	Confident	40 Å²	40	34.9 Å²	34.9	24%	0.242	20%	0.204	C	C	.	.	H	α-helix	trans	-64.6	-52.5	173	164.3	0	0	0	0	110.9	L513 L514 E515 M519 I521 F522	L513-V517 HydrophobicContact CD2-CG2 4.42Å; L513-V517 VanDerWaalsContact O-CG2 3.31Å; L513-V517 WeakPolarHBondContact O-CG2 3.08Å; L513-V517 PolarHBondContact O-N 3.08Å; L514-V517 PolarHBondContact O-N 3.23Å; E515-V517 VanDerWaalsContact C-N 3.3Å; E515-V517 PolarHBondContact O-N 3.16Å; V517-M519 PolarHBondContact O-N 3.44Å; V517-I521 HydrophobicContact CG1-CD1 4.32Å; V517-I521 HydrophobicContact CG2-CD1 4.24Å; V517-I521 WeakPolarHBondContact O-CA 3.39Å; V517-I521 VanDerWaalsContact O-CB 3.26Å; V517-I521 WeakPolarHBondContact O-CB 3.35Å; V517-I521 PolarHBondContact O-N 3.14Å; V517-F522 HydrophobicContact CG1-CD2 4.36Å; V517-F522 HydrophobicContact CG1-CE2 3.92Å; V517-F522 PolarHBondContact O-N 3.01Å
518	D	88.6	Confident	84.7	Confident	0 Å²	0	32.9 Å²	32.9	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-62.1	-45.7	-180	-153.6	54	0	0	0	110.9	L514 E515 F522 G523 G524 C536 R539 S540	L514-D518 PolarHBondContact O-N 2.91Å; E515-D518 PolarHBondContact O-N 3.33Å; D518-F522 CarbonylContact O-C 3.5Å; D518-F522 WeakPolarHBondContact O-CA 3.43Å; D518-F522 WeakPolarHBondContact O-CB 3.45Å; D518-F522 PolarHBondContact O-N 3.39Å; D518-F522 VanDerWaalsContact O-N 3.16Å; D518-G523 PolarHBondContact O-N 3.36Å; D518-G523 VanDerWaalsContact O-N 3.13Å; D518-G524 WeakPolarHBondContact O-CA 3.18Å; D518-G524 PolarHBondContact O-N 3.31Å; D518-C536 HydrophobicContact CB-CB 4.49Å; D518-R539 IonicContact OD2-NH2 2.61Å; D518-R539 PolarHBondContact OD2-NH2 3.46Å; D518-S540 PolarHBondContact OD1-OG 2.98Å
519	M	85	Confident	84.6	Confident	31 Å²	31	34.3 Å²	34.3	15%	0.153	20%	0.203	C	C	.	.	H	α-helix	trans	-60.8	-55.6	177.9	-73.1	179.7	-176.5	0	0	113.7	E515 V517 G523 A526 V852	E515-M519 HydrophobicContact CG-CE 3.49Å; E515-M519 VanDerWaalsContact CG-CE 3.49Å; E515-M519 HydrophobicContact CG-CG 4.48Å; E515-M519 HydrophobicContact CG-SD 4.09Å; E515-M519 WeakPolarHBondContact O-CB 3.08Å; E515-M519 VanDerWaalsContact O-CG 3.29Å; E515-M519 WeakPolarHBondContact O-CG 3.39Å; E515-M519 PolarHBondContact O-N 2.9Å; V517-M519 PolarHBondContact O-N 3.44Å; M519-G523 VanDerWaalsContact O-CA 3.3Å; M519-G523 WeakPolarHBondContact O-CA 3.42Å; M519-G523 PolarHBondContact O-N 2.88Å; M519-A526 VanDerWaalsContact CE-CA 3.46Å; M519-A526 HydrophobicContact CE-CB 3.74Å; M519-V852 HydrophobicContact CE-CG2 3.84Å
520	H	82.6	Confident	84.5	Confident	38 Å²	38	34 Å²	34	18%	0.176	20%	0.204	C	C	.	.	H	α-helix	trans	-90.9	-25.4	-168.6	-63.2	-62	0	0	0	114	Q516 M776 P779	Q516-H520 WeakPolarHBondContact O-CB 3.32Å; Q516-H520 PolarHBondContact O-CD2 3.31Å; Q516-H520 PolarHBondContact O-N 3.05Å; Q516-H520 PolarHBondContact OE1-CD2 3.2Å; H520-M776 HydrophobicContact CB-CE 3.79Å; H520-M776 HydrophobicContact CB-CG 4.46Å; H520-M776 WeakPolarHBondContact O-CG 3.49Å; H520-P779 WeakPolarHBondContact NE2-CB 3.42Å
521	I	83.7	Confident	84.4	Confident	76 Å²	76	36.2 Å²	36.2	39%	0.39	22%	0.215	S	C	.	.	H	α-helix	trans	-96.5	-37.4	179.6	-57.7	-177.8	0	0	0	111.5	V517 Y772 M776	V517-I521 HydrophobicContact CG1-CD1 4.32Å; V517-I521 HydrophobicContact CG2-CD1 4.24Å; V517-I521 WeakPolarHBondContact O-CA 3.39Å; V517-I521 VanDerWaalsContact O-CB 3.26Å; V517-I521 WeakPolarHBondContact O-CB 3.35Å; V517-I521 PolarHBondContact O-N 3.14Å; I521-Y772 WeakPolarHBondContact CA-OH 3.11Å; I521-M776 HydrophobicContact CG1-CE 4.22Å
522	F	83.6	Confident	84.4	Confident	63 Å²	63	35.9 Å²	35.9	28%	0.276	21%	0.214	S	C	.	.	H	α-helix	trans	-107.8	-1.8	-177	-55.8	-51.6	0	0	0	114.6	V517 D518 G524 S540 I541 V544	V517-F522 HydrophobicContact CG1-CD2 4.36Å; V517-F522 HydrophobicContact CG1-CE2 3.92Å; V517-F522 PolarHBondContact O-N 3.01Å; D518-F522 CarbonylContact O-C 3.5Å; D518-F522 WeakPolarHBondContact O-CA 3.43Å; D518-F522 WeakPolarHBondContact O-CB 3.45Å; D518-F522 PolarHBondContact O-N 3.39Å; D518-F522 VanDerWaalsContact O-N 3.16Å; F522-G524 PolarHBondContact O-N 2.87Å; F522-S540 VanDerWaalsContact CG-CB 3.41Å; F522-I541 HydrophobicContact CE2-CG1 4.04Å; F522-I541 HydrophobicContact CZ-CG1 3.68Å; F522-V544 HydrophobicContact CD1-CG2 4.19Å; F522-V544 HydrophobicContact CE1-CG2 4.02Å
523	G	77.8	Confident	84.3	Confident	69 Å²	69	34.9 Å²	34.9	71%	0.711	21%	0.21	S	C	*	.			trans	68.9	22.8	-176.2	0	0	0	0	0	113.5	D518 M519	D518-G523 PolarHBondContact O-N 3.36Å; D518-G523 VanDerWaalsContact O-N 3.13Å; M519-G523 VanDerWaalsContact O-CA 3.3Å; M519-G523 WeakPolarHBondContact O-CA 3.42Å; M519-G523 PolarHBondContact O-N 2.88Å
524	G	79.1	Confident	84.4	Confident	23 Å²	23	35.5 Å²	35.5	24%	0.237	21%	0.213	C	C	.	.			trans	-80.6	-166.7	-174.1	0	0	0	0	0	114.8	D518 F522	D518-G524 WeakPolarHBondContact O-CA 3.18Å; D518-G524 PolarHBondContact O-N 3.31Å; F522-G524 PolarHBondContact O-N 2.87Å
525	T	82.5	Confident	84.3	Confident	29 Å²	29	36.4 Å²	36.4	18%	0.178	21%	0.213	C	C	.	.			trans	-125.8	165.7	-163.2	55	0	0	0	0	111.8	E936 I937	T525-E936 PolarHBondContact OG1-OE1 2.63Å; T525-I937 WeakPolarHBondContact CG2-O 3.45Å
526	A	79.6	Confident	84.3	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	21%	0.213	C	C	.	.			trans	-62.1	144.6	-179.9	0	0	0	0	0	113.1	E515 M519 V852 P917 I935 E936	E515-A526 VanDerWaalsContact OE1-CA 3.22Å; E515-A526 WeakPolarHBondContact OE1-CA 3.46Å; E515-A526 WeakPolarHBondContact OE1-CB 3.41Å; M519-A526 VanDerWaalsContact CE-CA 3.46Å; M519-A526 HydrophobicContact CE-CB 3.74Å; A526-V852 HydrophobicContact CB-CB 4.02Å; A526-V852 HydrophobicContact CB-CG1 4.11Å; A526-V852 HydrophobicContact CB-CG2 4.45Å; A526-P917 HydrophobicContact CB-CB 4.04Å; A526-I935 HydrophobicContact CB-CG2 3.96Å; A526-I935 WeakPolarHBondContact CB-O 3.35Å; A526-E936 WeakPolarHBondContact O-CG 3.45Å
527	C	79.6	Confident	84.4	Confident	1 Å²	1	35.3 Å²	35.3	1%	0.007	21%	0.209	C	C	.	.			trans	-113.4	131.1	-172.5	-75	0	0	0	0	111.8	E515 S529 A533 C536	E515-C527 PolarHBondContact OE1-N 2.9Å; C527-S529 VanDerWaalsContact C-N 3.33Å; C527-S529 PolarHBondContact O-N 3.34Å; C527-A533 HydrophobicContact CB-CB 3.88Å; C527-C536 VanDerWaalsContact SG-SG 3.68Å
528	F	76.7	Confident	84.4	Confident	15 Å²	15	36 Å²	36	7%	0.066	22%	0.219	C	C	.	.	S	Bend	trans	-77.6	-12.9	-174	-51.9	-51.3	0	0	0	116.1	S532 S585 N586 K853 I935 E936 T943 L1344	F528-S532 PolarHBondContact N-OG 3.43Å; F528-S585 WeakPolarHBondContact CD2-OG 3.5Å; F528-S585 WeakPolarHBondContact CE2-OG 3.36Å; F528-N586 HydrophobicContact CD2-CB 4.25Å; F528-N586 HydrophobicContact CE2-CB 4.23Å; F528-K853 WeakPolarHBondContact O-CD 3.46Å; F528-K853 PolarHBondContact O-NZ 2.8Å; F528-I935 HydrophobicContact CD1-CB 4.46Å; F528-I935 HydrophobicContact CD1-CG2 3.76Å; F528-I935 HydrophobicContact CE1-CB 4.09Å; F528-I935 HydrophobicContact CE1-CG2 3.71Å; F528-E936 HydrophobicContact CE1-CB 3.7Å; F528-E936 VanDerWaalsContact CE2-OE2 3.23Å; F528-E936 WeakPolarHBondContact CE2-OE2 3.35Å; F528-E936 HydrophobicContact CZ-CB 3.46Å; F528-E936 VanDerWaalsContact CZ-CB 3.46Å; F528-E936 HydrophobicContact CZ-CG 4.31Å; F528-E936 WeakPolarHBondContact CZ-OE2 3.39Å; F528-T943 HydrophobicContact CE1-CG2 3.6Å; F528-T943 HydrophobicContact CE2-CG2 4.17Å; F528-T943 VanDerWaalsContact CZ-CB 3.42Å; F528-T943 HydrophobicContact CZ-CG2 3.36Å; F528-T943 WeakPolarHBondContact CZ-OG1 3.31Å; F528-L1344 HydrophobicContact CB-CD1 3.67Å; F528-L1344 HydrophobicContact CD1-CD1 3.88Å; F528-L1344 HydrophobicContact CD1-CD2 4.37Å; F528-L1344 HydrophobicContact CG-CD1 3.81Å
529	S	79.4	Confident	84.5	Confident	44 Å²	44	37.3 Å²	37.3	31%	0.308	22%	0.224	S	C	.	.	S	Bend	trans	-169	160.5	-169.7	69.1	0	0	0	0	110.5	C527 V531 S532 A533	C527-S529 VanDerWaalsContact C-N 3.33Å; C527-S529 PolarHBondContact O-N 3.34Å; S529-V531 VanDerWaalsContact C-N 3.25Å; S529-V531 PolarHBondContact O-N 3.04Å; S529-S532 WeakPolarHBondContact CA-OG 3.45Å; S529-S532 PolarHBondContact N-OG 2.82Å; S529-S532 PolarHBondContact O-N 3.48Å; S529-S532 PolarHBondContact O-OG 3.3Å; S529-S532 PolarHBondContact OG-N 3.29Å; S529-S532 VanDerWaalsContact OG-N 3.11Å; S529-S532 PolarHBondContact OG-OG 3.05Å; S529-A533 PolarHBondContact O-N 3.27Å
530	L	84	Confident	84.8	Confident	50 Å²	50	36.1 Å²	36.1	26%	0.262	22%	0.219	S	C	.	.	H	α-helix	trans	-56	-39.1	173.4	-175.4	62.5	0	0	0	112.3	C510 C511 L514 A533 I534	C510-L530 HydrophobicContact CB-CD1 3.68Å; C511-L530 HydrophobicContact CB-CD1 4.33Å; L514-L530 HydrophobicContact CD1-CD1 4.05Å; L530-A533 PolarHBondContact O-N 3.46Å; L530-I534 HydrophobicContact CD1-CD1 4.44Å; L530-I534 HydrophobicContact CG-CD1 4.13Å; L530-I534 VanDerWaalsContact O-CG1 3.29Å; L530-I534 WeakPolarHBondContact O-CG1 3.48Å; L530-I534 PolarHBondContact O-N 2.97Å
531	V	85.9	Confident	85.2	Confident	100 Å²	100	39 Å²	39	61%	0.606	23%	0.234	S	C	*	.	H	α-helix	trans	-67.7	-41.7	179.3	-178.1	0	0	0	0	111.7	S529 Y535	S529-V531 VanDerWaalsContact C-N 3.25Å; S529-V531 PolarHBondContact O-N 3.04Å; V531-Y535 WeakPolarHBondContact O-CB 3.47Å; V531-Y535 PolarHBondContact O-N 2.85Å
532	S	85.8	Confident	85.6	Confident	2 Å²	2	40.7 Å²	40.7	1%	0.014	24%	0.244	C	C	.	.	H	α-helix	trans	-66.2	-36.7	172.5	43.4	0	0	0	0	112.2	F528 S529 Y535 C536 S585	F528-S532 PolarHBondContact N-OG 3.43Å; S529-S532 WeakPolarHBondContact CA-OG 3.45Å; S529-S532 PolarHBondContact N-OG 2.82Å; S529-S532 PolarHBondContact O-N 3.48Å; S529-S532 PolarHBondContact O-OG 3.3Å; S529-S532 PolarHBondContact OG-N 3.29Å; S529-S532 VanDerWaalsContact OG-N 3.11Å; S529-S532 PolarHBondContact OG-OG 3.05Å; S532-Y535 PolarHBondContact O-N 3.3Å; S532-C536 WeakPolarHBondContact O-CB 3.38Å; S532-C536 PolarHBondContact O-N 3.47Å; S532-C536 PolarHBondContact O-SG 2.82Å; S532-S585 WeakPolarHBondContact CB-O 3.3Å
533	A	88.3	Confident	85.9	Confident	1 Å²	1	38.5 Å²	38.5	1%	0.008	24%	0.236	C	C	.	.	H	α-helix	trans	-66.5	-42.7	178.2	0	0	0	0	0	111.9	L514 C527 S529 L530 Y535 C536 C537	L514-A533 HydrophobicContact CB-CB 3.76Å; L514-A533 HydrophobicContact CD1-CB 4.22Å; C527-A533 HydrophobicContact CB-CB 3.88Å; S529-A533 PolarHBondContact O-N 3.27Å; L530-A533 PolarHBondContact O-N 3.46Å; A533-Y535 VanDerWaalsContact C-N 3.35Å; A533-Y535 PolarHBondContact O-N 3.47Å; A533-C536 PolarHBondContact O-N 3.1Å; A533-C537 PolarHBondContact O-N 3.46Å
534	I	90.3	Very high	86.4	Confident	93 Å²	93	38.8 Å²	38.8	48%	0.477	22%	0.224	S	C	.	.	H	α-helix	trans	-60	-45.2	172.1	-67	164.9	0	0	0	110.6	L514 L530 A538	L514-I534 HydrophobicContact CD1-CG1 3.63Å; L530-I534 HydrophobicContact CD1-CD1 4.44Å; L530-I534 HydrophobicContact CG-CD1 4.13Å; L530-I534 VanDerWaalsContact O-CG1 3.29Å; L530-I534 WeakPolarHBondContact O-CG1 3.48Å; L530-I534 PolarHBondContact O-N 2.97Å; I534-A538 VanDerWaalsContact O-CB 3.24Å; I534-A538 WeakPolarHBondContact O-CB 3.37Å; I534-A538 PolarHBondContact O-N 2.86Å
535	Y	90.1	Very high	86.9	Confident	58 Å²	58	40.2 Å²	40.2	23%	0.227	23%	0.233	C	C	.	.	H	α-helix	trans	-62.1	-41.5	176.1	168.5	-104.2	0	0	0	112.6	V531 S532 A533 A538 R539 P587	V531-Y535 WeakPolarHBondContact O-CB 3.47Å; V531-Y535 PolarHBondContact O-N 2.85Å; S532-Y535 PolarHBondContact O-N 3.3Å; A533-Y535 VanDerWaalsContact C-N 3.35Å; A533-Y535 PolarHBondContact O-N 3.47Å; Y535-A538 PolarHBondContact O-N 3.38Å; Y535-R539 PolarHBondContact O-N 2.81Å; Y535-P587 HydrophobicContact CD1-CB 4.05Å; Y535-P587 HydrophobicContact CD2-CB 4.2Å; Y535-P587 HydrophobicContact CE1-CB 4.37Å; Y535-P587 HydrophobicContact CE2-CB 4.5Å; Y535-P587 HydrophobicContact CG-CB 3.97Å
536	C	89.2	Confident	87.2	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-64.5	-49.9	178.3	-69.9	0	0	0	0	111.8	D518 C527 S532 A533 A538 R539 S540 S585	D518-C536 HydrophobicContact CB-CB 4.49Å; C527-C536 VanDerWaalsContact SG-SG 3.68Å; S532-C536 WeakPolarHBondContact O-CB 3.38Å; S532-C536 PolarHBondContact O-N 3.47Å; S532-C536 PolarHBondContact O-SG 2.82Å; A533-C536 PolarHBondContact O-N 3.1Å; C536-A538 VanDerWaalsContact C-N 3.29Å; C536-A538 PolarHBondContact O-N 2.99Å; C536-R539 WeakPolarHBondContact O-CG 3.02Å; C536-R539 PolarHBondContact O-N 3.15Å; C536-R539 PolarHBondContact SG-NH2 2.77Å; C536-S540 WeakPolarHBondContact O-CB 3.35Å; C536-S540 PolarHBondContact O-N 3.03Å; C536-S540 VanDerWaalsContact O-N 3.12Å; C536-S540 PolarHBondContact O-OG 2.99Å; C536-S585 WeakPolarHBondContact SG-CB 3.46Å
537	C	90.5	Very high	87.5	Confident	9 Å²	9	42.2 Å²	42.2	6%	0.061	24%	0.244	C	C	.	.	H	α-helix	trans	-60	-39.7	173.6	-68.1	0	0	0	0	111.8	L514 A533 S540 I541	L514-C537 HydrophobicContact CD2-CB 4.33Å; L514-C537 PolarHBondContact O-SG 3.21Å; L514-C537 VanDerWaalsContact O-SG 3.41Å; A533-C537 PolarHBondContact O-N 3.46Å; C537-S540 PolarHBondContact O-N 2.83Å; C537-I541 WeakPolarHBondContact O-CB 3.28Å; C537-I541 WeakPolarHBondContact O-CD1 3.49Å; C537-I541 WeakPolarHBondContact O-CG1 3.45Å; C537-I541 PolarHBondContact O-N 3.4Å
538	A	91.1	Very high	87.6	Confident	54 Å²	54	49.3 Å²	49.3	45%	0.446	28%	0.275	S	S	.	.	H	α-helix	trans	-65.9	-43.1	179.6	0	0	0	0	0	113.5	I534 Y535 C536 S540 L542	I534-A538 VanDerWaalsContact O-CB 3.24Å; I534-A538 WeakPolarHBondContact O-CB 3.37Å; I534-A538 PolarHBondContact O-N 2.86Å; Y535-A538 PolarHBondContact O-N 3.38Å; C536-A538 VanDerWaalsContact C-N 3.29Å; C536-A538 PolarHBondContact O-N 2.99Å; A538-S540 VanDerWaalsContact C-N 3.3Å; A538-S540 PolarHBondContact O-N 3.34Å; A538-L542 WeakPolarHBondContact O-CB 3.37Å; A538-L542 PolarHBondContact O-N 3.06Å
539	R	89.9	Confident	88.1	Confident	28 Å²	28	53 Å²	53	11%	0.106	30%	0.295	C	S	.	.	H	α-helix	trans	-61.4	-40.7	173.4	62.9	170.2	-170.9	-170.2	-8.3	110.9	D518 Y535 C536 L542 C543 L580 S583	D518-R539 IonicContact OD2-NH2 2.61Å; D518-R539 PolarHBondContact OD2-NH2 3.46Å; Y535-R539 PolarHBondContact O-N 2.81Å; C536-R539 WeakPolarHBondContact O-CG 3.02Å; C536-R539 PolarHBondContact O-N 3.15Å; C536-R539 PolarHBondContact SG-NH2 2.77Å; R539-L542 PolarHBondContact O-N 3.02Å; R539-C543 PolarHBondContact O-N 2.74Å; R539-C543 PolarHBondContact O-SG 3.02Å; R539-L580 HydrophobicContact CG-CD2 4.14Å; R539-S583 PolarHBondContact NH1-O 3.48Å; R539-S583 PolarHBondContact NH1-OG 2.84Å
540	S	90.4	Very high	88.2	Confident	5 Å²	5	53.2 Å²	53.2	4%	0.035	29%	0.291	C	S	.	.	H	α-helix	trans	-72	-45.7	-174.1	-58.5	0	0	0	0	110.8	D518 F522 C536 C537 A538 L542 C543 V544	D518-S540 PolarHBondContact OD1-OG 2.98Å; F522-S540 VanDerWaalsContact CG-CB 3.41Å; C536-S540 WeakPolarHBondContact O-CB 3.35Å; C536-S540 PolarHBondContact O-N 3.03Å; C536-S540 VanDerWaalsContact O-N 3.12Å; C536-S540 PolarHBondContact O-OG 2.99Å; C537-S540 PolarHBondContact O-N 2.83Å; A538-S540 VanDerWaalsContact C-N 3.3Å; A538-S540 PolarHBondContact O-N 3.34Å; S540-L542 VanDerWaalsContact C-N 3.33Å; S540-L542 PolarHBondContact O-N 3.11Å; S540-C543 PolarHBondContact O-N 2.89Å; S540-V544 WeakPolarHBondContact O-CG2 3.41Å; S540-V544 PolarHBondContact O-N 3Å
541	I	91.6	Very high	87.8	Confident	98 Å²	98	51.4 Å²	51.4	50%	0.503	28%	0.284	S	S	.	.	H	α-helix	trans	-58.7	-42.9	172.3	-68.7	164.7	0	0	0	111.2	F522 C537 V544 A545	F522-I541 HydrophobicContact CE2-CG1 4.04Å; F522-I541 HydrophobicContact CZ-CG1 3.68Å; C537-I541 WeakPolarHBondContact O-CB 3.28Å; C537-I541 WeakPolarHBondContact O-CD1 3.49Å; C537-I541 WeakPolarHBondContact O-CG1 3.45Å; C537-I541 PolarHBondContact O-N 3.4Å; I541-V544 PolarHBondContact O-N 2.98Å; I541-A545 WeakPolarHBondContact O-CB 3.48Å; I541-A545 PolarHBondContact O-N 2.97Å
542	L	91.8	Very high	87.4	Confident	113 Å²	113	53.3 Å²	53.3	59%	0.592	28%	0.282	S	S	*	.	H	α-helix	trans	-63.3	-42.9	177.5	-179.9	62.6	0	0	0	112.1	A538 R539 S540 A545 V546	A538-L542 WeakPolarHBondContact O-CB 3.37Å; A538-L542 PolarHBondContact O-N 3.06Å; R539-L542 PolarHBondContact O-N 3.02Å; S540-L542 VanDerWaalsContact C-N 3.33Å; S540-L542 PolarHBondContact O-N 3.11Å; L542-A545 PolarHBondContact O-N 3.37Å; L542-V546 WeakPolarHBondContact O-CG2 3.49Å; L542-V546 PolarHBondContact O-N 3.09Å; L542-V546 VanDerWaalsContact O-N 3.09Å
543	C	90.3	Very high	87	Confident	16 Å²	16	56.4 Å²	56.4	11%	0.108	30%	0.298	C	S	.	.	H	α-helix	trans	-63.2	-44.3	176	-65.2	0	0	0	0	111.3	R539 S540 A545 V546 L547 F576 L580	R539-C543 PolarHBondContact O-N 2.74Å; R539-C543 PolarHBondContact O-SG 3.02Å; S540-C543 PolarHBondContact O-N 2.89Å; C543-A545 PolarHBondContact O-N 3.4Å; C543-V546 PolarHBondContact O-N 2.92Å; C543-L547 WeakPolarHBondContact O-CB 3.36Å; C543-L547 WeakPolarHBondContact O-CG 3.44Å; C543-L547 PolarHBondContact O-N 3.02Å; C543-F576 HydrophobicContact CB-CD1 4.35Å; C543-F576 HydrophobicContact CB-CG 4.34Å; C543-L580 HydrophobicContact CB-CD1 4.23Å
544	V	87.4	Confident	86.4	Confident	75 Å²	75	56.5 Å²	56.5	46%	0.455	30%	0.298	S	S	.	.	H	α-helix	trans	-63.1	-40	176.3	171.8	0	0	0	0	111.6	F522 S540 I541 L547 F548	F522-V544 HydrophobicContact CD1-CG2 4.19Å; F522-V544 HydrophobicContact CE1-CG2 4.02Å; S540-V544 WeakPolarHBondContact O-CG2 3.41Å; S540-V544 PolarHBondContact O-N 3Å; I541-V544 PolarHBondContact O-N 2.98Å; V544-L547 PolarHBondContact O-N 3.33Å; V544-F548 VanDerWaalsContact O-CB 3.25Å; V544-F548 WeakPolarHBondContact O-CB 3.26Å; V544-F548 PolarHBondContact O-N 3.4Å
545	A	89.5	Confident	85.6	Confident	54 Å²	54	58.1 Å²	58.1	45%	0.446	31%	0.307	S	S	.	.	H	α-helix	trans	-63.5	-41.2	176.9	0	0	0	0	0	112.7	I541 L542 C543 L549	I541-A545 WeakPolarHBondContact O-CB 3.48Å; I541-A545 PolarHBondContact O-N 2.97Å; L542-A545 PolarHBondContact O-N 3.37Å; C543-A545 PolarHBondContact O-N 3.4Å; A545-L549 WeakPolarHBondContact O-CB 3.35Å; A545-L549 PolarHBondContact O-N 3.39Å
546	V	88.9	Confident	85.1	Confident	42 Å²	42	58.8 Å²	58.8	26%	0.255	32%	0.32	S	S	.	.	H	α-helix	trans	-66.3	-44.1	175	174	0	0	0	0	111.1	L542 C543 L549 F550 F576	L542-V546 WeakPolarHBondContact O-CG2 3.49Å; L542-V546 PolarHBondContact O-N 3.09Å; L542-V546 VanDerWaalsContact O-N 3.09Å; C543-V546 PolarHBondContact O-N 2.92Å; V546-L549 PolarHBondContact O-N 2.91Å; V546-F550 HydrophobicContact CG1-CD2 4.04Å; V546-F550 HydrophobicContact CG1-CE2 3.98Å; V546-F550 WeakPolarHBondContact O-CD2 3.29Å; V546-F550 PolarHBondContact O-N 3.22Å; V546-F550 VanDerWaalsContact O-N 3.17Å; V546-F576 HydrophobicContact CB-CE2 4.3Å; V546-F576 HydrophobicContact CB-CZ 4.43Å; V546-F576 HydrophobicContact CG1-CE2 3.79Å; V546-F576 HydrophobicContact CG1-CZ 4.02Å
547	L	85.9	Confident	84.4	Confident	29 Å²	29	68.5 Å²	68.5	15%	0.152	36%	0.357	C	S	.	.	H	α-helix	trans	-64.2	-42.4	177.3	-71.6	174.2	0	0	0	112.1	C543 V544 L549 F550 G551 F569 F572 M573 F576	C543-L547 WeakPolarHBondContact O-CB 3.36Å; C543-L547 WeakPolarHBondContact O-CG 3.44Å; C543-L547 PolarHBondContact O-N 3.02Å; V544-L547 PolarHBondContact O-N 3.33Å; L547-L549 VanDerWaalsContact C-N 3.34Å; L547-L549 PolarHBondContact O-N 3.04Å; L547-F550 PolarHBondContact O-N 3.33Å; L547-G551 PolarHBondContact O-N 3.42Å; L547-F569 HydrophobicContact CB-CD2 4.47Å; L547-F569 HydrophobicContact CB-CE2 4.1Å; L547-F569 HydrophobicContact CD2-CD2 4.26Å; L547-F569 HydrophobicContact CD2-CE2 4.34Å; L547-F569 VanDerWaalsContact O-CD2 3.3Å; L547-F569 WeakPolarHBondContact O-CD2 3.26Å; L547-F569 WeakPolarHBondContact O-CE2 3.44Å; L547-F572 HydrophobicContact CD2-CB 3.81Å; L547-M573 HydrophobicContact CD1-CG 4.08Å; L547-M573 HydrophobicContact CD2-CB 4.42Å; L547-M573 HydrophobicContact CD2-CG 3.65Å; L547-M573 HydrophobicContact CG-CG 4.47Å; L547-F576 HydrophobicContact CD2-CD2 4.11Å; L547-F576 HydrophobicContact CG-CD2 4.2Å
548	F	83.6	Confident	83.1	Confident	149 Å²	149	70.8 Å²	70.8	65%	0.654	37%	0.37	S	S	*	.	H	α-helix	trans	-61.6	-40.9	175.3	-176.6	-94.7	0	0	0	111.8	V544 G551 Y552	V544-F548 VanDerWaalsContact O-CB 3.25Å; V544-F548 WeakPolarHBondContact O-CB 3.26Å; V544-F548 PolarHBondContact O-N 3.4Å; F548-G551 PolarHBondContact O-N 3.3Å; F548-Y552 VanDerWaalsContact O-CB 3.28Å; F548-Y552 WeakPolarHBondContact O-CB 3.22Å; F548-Y552 PolarHBondContact O-N 3.11Å
549	L	85.9	Confident	81.8	Confident	92 Å²	92	72.4 Å²	72.4	48%	0.482	39%	0.393	S	S	.	.	H	α-helix	trans	-59.4	-48.3	175.5	178.3	62.1	0	0	0	111.8	A545 V546 L547 L553	A545-L549 WeakPolarHBondContact O-CB 3.35Å; A545-L549 PolarHBondContact O-N 3.39Å; V546-L549 PolarHBondContact O-N 2.91Å; L547-L549 VanDerWaalsContact C-N 3.34Å; L547-L549 PolarHBondContact O-N 3.04Å; L549-L553 HydrophobicContact CD1-CD1 3.86Å; L549-L553 HydrophobicContact CD1-CG 4.15Å; L549-L553 HydrophobicContact CG-CD1 3.94Å; L549-L553 VanDerWaalsContact O-CB 3.31Å; L549-L553 WeakPolarHBondContact O-CB 3.43Å; L549-L553 WeakPolarHBondContact O-CG 3.3Å; L549-L553 PolarHBondContact O-N 2.7Å
550	F	81	Confident	80.6	Confident	49 Å²	49	74.5 Å²	74.5	22%	0.215	41%	0.411	C	S	.	.	H	α-helix	trans	-66.7	-38.6	177.2	-79.6	-73.8	0	0	0	112.8	V546 L547 S554 A568 F569 F572	V546-F550 HydrophobicContact CG1-CD2 4.04Å; V546-F550 HydrophobicContact CG1-CE2 3.98Å; V546-F550 WeakPolarHBondContact O-CD2 3.29Å; V546-F550 PolarHBondContact O-N 3.22Å; V546-F550 VanDerWaalsContact O-N 3.17Å; L547-F550 PolarHBondContact O-N 3.33Å; F550-S554 PolarHBondContact O-N 3.08Å; F550-A568 HydrophobicContact CD1-CB 4.49Å; F550-F569 HydrophobicContact CB-CB 4.1Å; F550-F569 HydrophobicContact CB-CD2 4.46Å; F550-F572 AromaticContact CD2-CD2 3.79Å; F550-F572 HydrophobicContact CD2-CD2 3.79Å; F550-F572 HydrophobicContact CD2-CE2 4.06Å; F550-F572 HydrophobicContact CE1-CD2 4.45Å; F550-F572 AromaticContact CE1-CE2 4Å; F550-F572 HydrophobicContact CE1-CE2 4Å; F550-F572 AromaticContact CE2-CD2 3.67Å; F550-F572 HydrophobicContact CE2-CD2 3.67Å; F550-F572 AromaticContact CE2-CE2 3.46Å; F550-F572 HydrophobicContact CE2-CE2 3.46Å; F550-F572 VanDerWaalsContact CE2-CE2 3.46Å; F550-F572 HydrophobicContact CE2-CZ 4.14Å; F550-F572 HydrophobicContact CG-CD2 4.26Å; F550-F572 HydrophobicContact CZ-CD2 4.03Å; F550-F572 AromaticContact CZ-CE2 3.43Å; F550-F572 HydrophobicContact CZ-CE2 3.43Å; F550-F572 VanDerWaalsContact CZ-CE2 3.43Å; F550-F572 HydrophobicContact CZ-CZ 4.15Å
551	G	76.2	Confident	79.4	Confident	13 Å²	13	76.6 Å²	76.6	13%	0.134	43%	0.426	C	S	.	.	H	α-helix	trans	-62	-48.8	174.5	0	0	0	0	0	112.6	L547 F548 S554 I555	L547-G551 PolarHBondContact O-N 3.42Å; F548-G551 PolarHBondContact O-N 3.3Å; G551-S554 WeakPolarHBondContact O-CB 3.27Å; G551-S554 PolarHBondContact O-N 2.91Å; G551-I555 WeakPolarHBondContact O-CG1 3.34Å; G551-I555 PolarHBondContact O-N 2.97Å
552	Y	78	Confident	78.3	Confident	139 Å²	139	77.1 Å²	77.1	55%	0.545	43%	0.426	S	S	.	.	H	α-helix	trans	-62.3	-43.9	177	179.4	-95.6	0	0	0	112.1	F548 S554 I555 S556	F548-Y552 VanDerWaalsContact O-CB 3.28Å; F548-Y552 WeakPolarHBondContact O-CB 3.22Å; F548-Y552 PolarHBondContact O-N 3.11Å; Y552-S554 VanDerWaalsContact C-N 3.3Å; Y552-S554 PolarHBondContact O-N 2.93Å; Y552-I555 PolarHBondContact O-N 3.26Å; Y552-S556 WeakPolarHBondContact O-CB 3.35Å; Y552-S556 PolarHBondContact O-N 3.21Å; Y552-S556 PolarHBondContact O-OG 2.83Å
553	L	78.1	Confident	77.6	Confident	68 Å²	68	72.3 Å²	72.3	36%	0.356	40%	0.402	S	S	.	.	H	α-helix	trans	-64	-33.1	176	-74.8	171.2	0	0	0	112.6	L549 R557 L565	L549-L553 HydrophobicContact CD1-CD1 3.86Å; L549-L553 HydrophobicContact CD1-CG 4.15Å; L549-L553 HydrophobicContact CG-CD1 3.94Å; L549-L553 VanDerWaalsContact O-CB 3.31Å; L549-L553 WeakPolarHBondContact O-CB 3.43Å; L549-L553 WeakPolarHBondContact O-CG 3.3Å; L549-L553 PolarHBondContact O-N 2.7Å; L553-R557 VanDerWaalsContact O-CB 3.28Å; L553-R557 WeakPolarHBondContact O-CB 3.44Å; L553-R557 PolarHBondContact O-N 3.48Å; L553-L565 HydrophobicContact CB-CD1 4.5Å; L553-L565 WeakPolarHBondContact O-CD1 3.22Å
554	S	75.3	Confident	77.4	Confident	3 Å²	3	76.1 Å²	76.1	2%	0.021	43%	0.425	C	S	.	.	H	α-helix	trans	-66.1	-53.8	172.2	-175	0	0	0	0	111.3	F550 G551 Y552 R557 T558 S563 F566	F550-S554 PolarHBondContact O-N 3.08Å; G551-S554 WeakPolarHBondContact O-CB 3.27Å; G551-S554 PolarHBondContact O-N 2.91Å; Y552-S554 VanDerWaalsContact C-N 3.3Å; Y552-S554 PolarHBondContact O-N 2.93Å; S554-R557 PolarHBondContact O-N 2.76Å; S554-T558 CarbonylContact O-C 3.5Å; S554-T558 WeakPolarHBondContact O-CA 3.44Å; S554-T558 PolarHBondContact O-N 3.31Å; S554-T558 PolarHBondContact O-OG1 3.37Å; S554-S563 PolarHBondContact OG-OG 3.3Å; S554-F566 WeakPolarHBondContact OG-CB 3.23Å; S554-F566 PolarHBondContact OG-N 3.36Å
555	I	73.6	Confident	77.2	Confident	126 Å²	126	75 Å²	75	65%	0.646	42%	0.416	S	S	*	.	H	α-helix	trans	-61.3	-48.2	-176.1	-66.4	163.8	0	0	0	111.3	G551 Y552 R557	G551-I555 WeakPolarHBondContact O-CG1 3.34Å; G551-I555 PolarHBondContact O-N 2.97Å; Y552-I555 PolarHBondContact O-N 3.26Å; I555-R557 VanDerWaalsContact C-N 3.27Å; I555-R557 PolarHBondContact O-N 2.93Å
556	S	78.2	Confident	76.8	Confident	73 Å²	73	74.3 Å²	74.3	51%	0.51	40%	0.403	S	S	.	.	H	α-helix	trans	-68	-22.2	-176.4	55.2	0	0	0	0	114.3	Y552	Y552-S556 WeakPolarHBondContact O-CB 3.35Å; Y552-S556 PolarHBondContact O-N 3.21Å; Y552-S556 PolarHBondContact O-OG 2.83Å
557	R	75.3	Confident	76.6	Confident	204 Å²	204	72.3 Å²	72.3	77%	0.77	39%	0.391	S	S	*	.	H	α-helix	trans	-106.1	-27	-178.3	-156.4	171.3	-166.7	139.1	2.8	113.9	L553 S554 I555 L565	L553-R557 VanDerWaalsContact O-CB 3.28Å; L553-R557 WeakPolarHBondContact O-CB 3.44Å; L553-R557 PolarHBondContact O-N 3.48Å; S554-R557 PolarHBondContact O-N 2.76Å; I555-R557 VanDerWaalsContact C-N 3.27Å; I555-R557 PolarHBondContact O-N 2.93Å; R557-L565 HydrophobicContact CB-CD1 4.34Å
558	T	63.8	Low	76.7	Confident	56 Å²	56	71.8 Å²	71.8	34%	0.344	39%	0.391	S	S	.	.			trans	-156.5	99.7	-171.5	41.5	0	0	0	0	110.8	S554 S560 S563	S554-T558 CarbonylContact O-C 3.5Å; S554-T558 WeakPolarHBondContact O-CA 3.44Å; S554-T558 PolarHBondContact O-N 3.31Å; S554-T558 PolarHBondContact O-OG1 3.37Å; T558-S560 PolarHBondContact O-N 2.93Å; T558-S563 WeakPolarHBondContact OG1-CB 3.48Å; T558-S563 PolarHBondContact OG1-OG 2.91Å
559	G	62.5	Low	76.8	Confident	89 Å²	89	66.4 Å²	66.4	92%	0.918	37%	0.367	S	S	*	.			trans	-70.1	28.6	174.7	0	0	0	0	0	115.5
560	S	64.8	Low	76.7	Confident	71 Å²	71	62 Å²	62	50%	0.497	34%	0.344	S	S	.	.	S	Bend	trans	-125.1	135.9	-178.7	174.7	0	0	0	0	110.4	T558 Q562 S563	T558-S560 PolarHBondContact O-N 2.93Å; S560-Q562 PolarHBondContact O-N 2.85Å; S560-S563 PolarHBondContact O-N 3.41Å
561	S	65.8	Low	77.1	Confident	49 Å²	49	60 Å²	60	34%	0.343	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-23.4	-179.9	52.7	0	0	0	0	113.4	S563 F566 H647	S561-S563 PolarHBondContact O-N 2.81Å; S561-F566 WeakPolarHBondContact O-CD1 3.39Å; S561-H647 PolarHBondContact O-CE1 2.78Å
562	Q	68.2	Low	77.8	Confident	109 Å²	109	62.8 Å²	62.8	51%	0.509	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.5	14.5	177.3	-70.8	-169.7	-12	0	0	114.2	S560 T653	S560-Q562 PolarHBondContact O-N 2.85Å; Q562-T653 PolarHBondContact NE2-OG1 2.85Å; Q562-T653 VanDerWaalsContact NE2-OG1 3.09Å
563	S	77	Confident	78.2	Confident	13 Å²	13	58.5 Å²	58.5	9%	0.091	33%	0.331	C	S	.	.			trans	-68	147.7	175.2	95.8	0	0	0	0	111.9	S554 T558 S560 S561 L565 F566 S567	S554-S563 PolarHBondContact OG-OG 3.3Å; T558-S563 WeakPolarHBondContact OG1-CB 3.48Å; T558-S563 PolarHBondContact OG1-OG 2.91Å; S560-S563 PolarHBondContact O-N 3.41Å; S561-S563 PolarHBondContact O-N 2.81Å; S563-L565 PolarHBondContact O-N 2.87Å; S563-L565 PolarHBondContact OG-N 2.81Å; S563-F566 PolarHBondContact O-N 2.9Å; S563-F566 WeakPolarHBondContact OG-CB 3.39Å; S563-F566 PolarHBondContact OG-N 3.44Å; S563-S567 PolarHBondContact O-N 3.44Å; S563-S567 PolarHBondContact O-OG 3.48Å
564	V	86.1	Confident	78.7	Confident	95 Å²	95	55.8 Å²	55.8	58%	0.576	32%	0.318	S	S	*	.	H	α-helix	trans	-64.1	-28.2	174.2	-177.1	0	0	0	0	110.9	A568 F644	V564-A568 WeakPolarHBondContact O-CB 3.21Å; V564-A568 PolarHBondContact O-N 3.08Å; V564-F644 HydrophobicContact CG1-CE2 4.11Å; V564-F644 HydrophobicContact CG1-CZ 4.06Å
565	L	83	Confident	79.5	Confident	52 Å²	52	56.9 Å²	56.9	27%	0.272	32%	0.323	S	S	.	.	H	α-helix	trans	-72	-38.9	176.1	-64.3	174.8	0	0	0	112.2	L553 R557 S563 A568 F569	L553-L565 HydrophobicContact CB-CD1 4.5Å; L553-L565 WeakPolarHBondContact O-CD1 3.22Å; R557-L565 HydrophobicContact CB-CD1 4.34Å; S563-L565 PolarHBondContact O-N 2.87Å; S563-L565 PolarHBondContact OG-N 2.81Å; L565-A568 PolarHBondContact O-N 3.37Å; L565-F569 PolarHBondContact O-N 3.49Å
566	F	81.3	Confident	80.3	Confident	39 Å²	39	52.4 Å²	52.4	17%	0.171	30%	0.299	C	S	.	.	H	α-helix	trans	-67.7	-41	173	-158.8	-111.1	0	0	0	110.9	S554 S561 S563 A568 F569 C570 H647 V738	S554-F566 WeakPolarHBondContact OG-CB 3.23Å; S554-F566 PolarHBondContact OG-N 3.36Å; S561-F566 WeakPolarHBondContact O-CD1 3.39Å; S563-F566 PolarHBondContact O-N 2.9Å; S563-F566 WeakPolarHBondContact OG-CB 3.39Å; S563-F566 PolarHBondContact OG-N 3.44Å; F566-A568 VanDerWaalsContact C-N 3.3Å; F566-A568 PolarHBondContact O-N 3.26Å; F566-F569 HydrophobicContact CD2-CD1 4.48Å; F566-F569 HydrophobicContact CE2-CD1 4.37Å; F566-F569 WeakPolarHBondContact O-CB 3.3Å; F566-F569 PolarHBondContact O-N 3.27Å; F566-C570 PolarHBondContact O-N 2.88Å; F566-C570 PolarHBondContact O-SG 3.07Å; F566-H647 AromaticContact CD1-CE1 3.59Å; F566-H647 AromaticContact CD1-NE2 3.42Å; F566-H647 WeakPolarHBondContact CD1-NE2 3.44Å; F566-H647 AromaticContact CE1-NE2 3.76Å; F566-V738 HydrophobicContact CE1-CG1 3.8Å; F566-V738 HydrophobicContact CZ-CG1 3.52Å
567	S	85.6	Confident	80.7	Confident	1 Å²	1	52.4 Å²	52.4	1%	0.007	30%	0.298	C	S	.	.	H	α-helix	trans	-58.7	-41.8	172.4	-53.3	0	0	0	0	111.7	S563 C570 G571 H647	S563-S567 PolarHBondContact O-N 3.44Å; S563-S567 PolarHBondContact O-OG 3.48Å; S567-C570 PolarHBondContact O-N 3.13Å; S567-G571 PolarHBondContact O-N 3.37Å; S567-H647 WeakPolarHBondContact CA-ND1 3.48Å; S567-H647 WeakPolarHBondContact CB-ND1 3.37Å; S567-H647 PolarHBondContact OG-ND1 2.68Å
568	A	87.5	Confident	81.3	Confident	18 Å²	18	43.4 Å²	43.4	15%	0.149	27%	0.265	C	S	.	.	H	α-helix	trans	-65.7	-41.5	175.1	0	0	0	0	0	112.2	F550 V564 L565 F566 C570 G571 F572 F644	F550-A568 HydrophobicContact CD1-CB 4.49Å; V564-A568 WeakPolarHBondContact O-CB 3.21Å; V564-A568 PolarHBondContact O-N 3.08Å; L565-A568 PolarHBondContact O-N 3.37Å; F566-A568 VanDerWaalsContact C-N 3.3Å; F566-A568 PolarHBondContact O-N 3.26Å; A568-C570 PolarHBondContact O-N 3.04Å; A568-G571 PolarHBondContact O-N 2.93Å; A568-F572 WeakPolarHBondContact O-CD2 3.08Å; A568-F572 PolarHBondContact O-N 3.47Å; A568-F644 HydrophobicContact CB-CD2 4.39Å; A568-F644 HydrophobicContact CB-CE2 4.32Å
569	F	86.1	Confident	82.5	Confident	35 Å²	35	43.4 Å²	43.4	15%	0.154	26%	0.262	C	S	.	.	H	α-helix	trans	-56.5	-47.9	172.3	167	-99.3	0	0	0	111.9	L547 F550 L565 F566 G571 F572 M573	L547-F569 HydrophobicContact CB-CD2 4.47Å; L547-F569 HydrophobicContact CB-CE2 4.1Å; L547-F569 HydrophobicContact CD2-CD2 4.26Å; L547-F569 HydrophobicContact CD2-CE2 4.34Å; L547-F569 VanDerWaalsContact O-CD2 3.3Å; L547-F569 WeakPolarHBondContact O-CD2 3.26Å; L547-F569 WeakPolarHBondContact O-CE2 3.44Å; F550-F569 HydrophobicContact CB-CB 4.1Å; F550-F569 HydrophobicContact CB-CD2 4.46Å; L565-F569 PolarHBondContact O-N 3.49Å; F566-F569 HydrophobicContact CD2-CD1 4.48Å; F566-F569 HydrophobicContact CE2-CD1 4.37Å; F566-F569 WeakPolarHBondContact O-CB 3.3Å; F566-F569 PolarHBondContact O-N 3.27Å; F569-G571 PolarHBondContact O-N 2.68Å; F569-F572 PolarHBondContact O-N 3.18Å; F569-M573 HydrophobicContact CD1-CE 4.39Å; F569-M573 HydrophobicContact CE1-CE 3.65Å; F569-M573 HydrophobicContact CE1-CG 4.36Å; F569-M573 HydrophobicContact CE1-SD 3.98Å; F569-M573 HydrophobicContact CE2-CG 4.23Å; F569-M573 HydrophobicContact CE2-SD 4.32Å; F569-M573 HydrophobicContact CZ-CE 3.98Å; F569-M573 HydrophobicContact CZ-CG 4.08Å; F569-M573 HydrophobicContact CZ-SD 3.66Å; F569-M573 PolarHBondContact O-N 2.88Å
570	C	83.5	Confident	83.7	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-61.8	-41.9	175.5	-69.6	0	0	0	0	112.6	F566 S567 A568 M573 A574 H647	F566-C570 PolarHBondContact O-N 2.88Å; F566-C570 PolarHBondContact O-SG 3.07Å; S567-C570 PolarHBondContact O-N 3.13Å; A568-C570 PolarHBondContact O-N 3.04Å; C570-M573 PolarHBondContact O-N 3.19Å; C570-A574 PolarHBondContact O-N 3.26Å; C570-A574 VanDerWaalsContact O-N 3.16Å; C570-H647 HydrophobicContact CB-CB 4.42Å; C570-H647 PolarHBondContact SG-CD2 2.89Å
571	G	88.9	Confident	84.7	Confident	6 Å²	6	40.7 Å²	40.7	6%	0.062	23%	0.226	C	C	.	.	H	α-helix	trans	-62.1	-42.3	173.9	0	0	0	0	0	113.2	S567 A568 F569 A574 F575 G640	S567-G571 PolarHBondContact O-N 3.37Å; A568-G571 PolarHBondContact O-N 2.93Å; F569-G571 PolarHBondContact O-N 2.68Å; G571-A574 PolarHBondContact O-N 3.37Å; G571-F575 PolarHBondContact O-N 3.19Å; G571-G640 WeakPolarHBondContact CA-O 3.19Å; G571-G640 WeakPolarHBondContact O-CA 3.33Å
572	F	90.5	Very high	85.6	Confident	72 Å²	72	40.3 Å²	40.3	32%	0.316	22%	0.216	S	C	.	.	H	α-helix	trans	-69.3	-34.2	175.6	-80	-61.7	0	0	0	112.8	L547 F550 A568 F569 F575 F576	L547-F572 HydrophobicContact CD2-CB 3.81Å; F550-F572 AromaticContact CD2-CD2 3.79Å; F550-F572 HydrophobicContact CD2-CD2 3.79Å; F550-F572 HydrophobicContact CD2-CE2 4.06Å; F550-F572 HydrophobicContact CE1-CD2 4.45Å; F550-F572 AromaticContact CE1-CE2 4Å; F550-F572 HydrophobicContact CE1-CE2 4Å; F550-F572 AromaticContact CE2-CD2 3.67Å; F550-F572 HydrophobicContact CE2-CD2 3.67Å; F550-F572 AromaticContact CE2-CE2 3.46Å; F550-F572 HydrophobicContact CE2-CE2 3.46Å; F550-F572 VanDerWaalsContact CE2-CE2 3.46Å; F550-F572 HydrophobicContact CE2-CZ 4.14Å; F550-F572 HydrophobicContact CG-CD2 4.26Å; F550-F572 HydrophobicContact CZ-CD2 4.03Å; F550-F572 AromaticContact CZ-CE2 3.43Å; F550-F572 HydrophobicContact CZ-CE2 3.43Å; F550-F572 VanDerWaalsContact CZ-CE2 3.43Å; F550-F572 HydrophobicContact CZ-CZ 4.15Å; A568-F572 WeakPolarHBondContact O-CD2 3.08Å; A568-F572 PolarHBondContact O-N 3.47Å; F569-F572 PolarHBondContact O-N 3.18Å; F572-F575 PolarHBondContact O-N 3.15Å; F572-F576 HydrophobicContact CB-CD2 4.13Å; F572-F576 HydrophobicContact CB-CE2 4.08Å; F572-F576 HydrophobicContact CD1-CD2 4.48Å; F572-F576 AromaticContact CD1-CE2 3.85Å; F572-F576 HydrophobicContact CD1-CE2 3.85Å; F572-F576 HydrophobicContact CD1-CZ 4.44Å; F572-F576 HydrophobicContact CG-CE2 4.27Å; F572-F576 WeakPolarHBondContact O-CB 3.21Å; F572-F576 WeakPolarHBondContact O-CD2 3.46Å; F572-F576 PolarHBondContact O-N 2.65Å
573	M	87.4	Confident	86.2	Confident	50 Å²	50	36.5 Å²	36.5	25%	0.246	20%	0.202	C	C	.	.	H	α-helix	trans	-61.1	-45.2	172.4	-76.6	-149.6	-62.1	0	0	111.5	L547 F569 C570 S577 V738	L547-M573 HydrophobicContact CD1-CG 4.08Å; L547-M573 HydrophobicContact CD2-CB 4.42Å; L547-M573 HydrophobicContact CD2-CG 3.65Å; L547-M573 HydrophobicContact CG-CG 4.47Å; F569-M573 HydrophobicContact CD1-CE 4.39Å; F569-M573 HydrophobicContact CE1-CE 3.65Å; F569-M573 HydrophobicContact CE1-CG 4.36Å; F569-M573 HydrophobicContact CE1-SD 3.98Å; F569-M573 HydrophobicContact CE2-CG 4.23Å; F569-M573 HydrophobicContact CE2-SD 4.32Å; F569-M573 HydrophobicContact CZ-CE 3.98Å; F569-M573 HydrophobicContact CZ-CG 4.08Å; F569-M573 HydrophobicContact CZ-SD 3.66Å; F569-M573 PolarHBondContact O-N 2.88Å; C570-M573 PolarHBondContact O-N 3.19Å; M573-S577 VanDerWaalsContact O-CB 3.29Å; M573-S577 WeakPolarHBondContact O-CB 3.28Å; M573-S577 PolarHBondContact O-N 3.4Å; M573-S577 PolarHBondContact O-OG 2.96Å; M573-V738 HydrophobicContact CE-CG2 4.26Å
574	A	87.9	Confident	86.4	Confident	10 Å²	10	36.7 Å²	36.7	8%	0.083	20%	0.203	C	C	.	.	H	α-helix	trans	-64.2	-38.7	175.4	0	0	0	0	0	112.6	C570 G571 S577 Y578 I639 A643	C570-A574 PolarHBondContact O-N 3.26Å; C570-A574 VanDerWaalsContact O-N 3.16Å; G571-A574 PolarHBondContact O-N 3.37Å; A574-S577 PolarHBondContact O-OG 3.35Å; A574-Y578 WeakPolarHBondContact O-CB 3.13Å; A574-Y578 PolarHBondContact O-N 2.59Å; A574-I639 HydrophobicContact CB-CG2 4.19Å; A574-A643 HydrophobicContact CB-CB 3.62Å
575	F	92.4	Very high	86.1	Confident	26 Å²	26	32.1 Å²	32.1	11%	0.114	18%	0.175	C	C	.	.	H	α-helix	trans	-62.8	-54.9	174.4	178.6	-88.2	0	0	0	112.6	G571 F572 L579 F633 A636	G571-F575 PolarHBondContact O-N 3.19Å; F572-F575 PolarHBondContact O-N 3.15Å; F575-L579 HydrophobicContact CE1-CD2 4.28Å; F575-L579 WeakPolarHBondContact O-CB 3.38Å; F575-L579 PolarHBondContact O-N 3.41Å; F575-F633 HydrophobicContact CE2-CE2 4.44Å; F575-F633 HydrophobicContact CZ-CD2 4.07Å; F575-F633 AromaticContact CZ-CE2 3.82Å; F575-F633 HydrophobicContact CZ-CE2 3.82Å; F575-A636 VanDerWaalsContact CD2-C 3.41Å; F575-A636 HydrophobicContact CD2-CB 3.62Å; F575-A636 WeakPolarHBondContact CD2-O 3.18Å; F575-A636 HydrophobicContact CE2-CB 3.55Å; F575-A636 HydrophobicContact CG-CB 4.32Å; F575-A636 HydrophobicContact CZ-CB 4.22Å
576	F	90.5	Very high	85.9	Confident	33 Å²	33	31.9 Å²	31.9	15%	0.145	17%	0.174	C	C	.	.	H	α-helix	trans	-70.8	-38.4	-173.8	-73.8	-60.6	0	0	0	112.7	C543 V546 L547 F572 Y578 L579 L580	C543-F576 HydrophobicContact CB-CD1 4.35Å; C543-F576 HydrophobicContact CB-CG 4.34Å; V546-F576 HydrophobicContact CB-CE2 4.3Å; V546-F576 HydrophobicContact CB-CZ 4.43Å; V546-F576 HydrophobicContact CG1-CE2 3.79Å; V546-F576 HydrophobicContact CG1-CZ 4.02Å; L547-F576 HydrophobicContact CD2-CD2 4.11Å; L547-F576 HydrophobicContact CG-CD2 4.2Å; F572-F576 HydrophobicContact CB-CD2 4.13Å; F572-F576 HydrophobicContact CB-CE2 4.08Å; F572-F576 HydrophobicContact CD1-CD2 4.48Å; F572-F576 AromaticContact CD1-CE2 3.85Å; F572-F576 HydrophobicContact CD1-CE2 3.85Å; F572-F576 HydrophobicContact CD1-CZ 4.44Å; F572-F576 HydrophobicContact CG-CE2 4.27Å; F572-F576 WeakPolarHBondContact O-CB 3.21Å; F572-F576 WeakPolarHBondContact O-CD2 3.46Å; F572-F576 PolarHBondContact O-N 2.65Å; F576-Y578 PolarHBondContact O-N 2.77Å; F576-L579 PolarHBondContact O-N 3.14Å; F576-L580 VanDerWaalsContact O-CB 3.3Å; F576-L580 WeakPolarHBondContact O-CB 3.34Å; F576-L580 VanDerWaalsContact O-CG 3.29Å; F576-L580 WeakPolarHBondContact O-CG 3.31Å; F576-L580 PolarHBondContact O-N 3.11Å
577	S	87	Confident	85.7	Confident	72 Å²	72	30.6 Å²	30.6	50%	0.503	17%	0.169	S	C	.	.	H	α-helix	trans	-61.6	-44	176.2	55	0	0	0	0	112.1	M573 A574 S581	M573-S577 VanDerWaalsContact O-CB 3.29Å; M573-S577 WeakPolarHBondContact O-CB 3.28Å; M573-S577 PolarHBondContact O-N 3.4Å; M573-S577 PolarHBondContact O-OG 2.96Å; A574-S577 PolarHBondContact O-OG 3.35Å; S577-S581 WeakPolarHBondContact O-CB 3.28Å; S577-S581 PolarHBondContact O-N 3.05Å
578	Y	88.4	Confident	85.2	Confident	15 Å²	15	37.6 Å²	37.6	6%	0.059	20%	0.2	C	C	.	.	H	α-helix	trans	-62.5	-44.8	174.5	-176.7	-88.1	0	0	0	112.1	A574 F576 R582 L635 A636 I639 H727	A574-Y578 WeakPolarHBondContact O-CB 3.13Å; A574-Y578 PolarHBondContact O-N 2.59Å; F576-Y578 PolarHBondContact O-N 2.77Å; Y578-R582 PolarHBondContact O-N 3.14Å; Y578-R582 WeakPolarHBondContact OH-CD 3.43Å; Y578-R582 VanDerWaalsContact OH-CZ 3.32Å; Y578-R582 PolarHBondContact OH-NE 3.25Å; Y578-R582 PolarHBondContact OH-NH1 2.73Å; Y578-L635 HydrophobicContact CE1-CB 4.28Å; Y578-L635 HydrophobicContact CE1-CG 4.38Å; Y578-L635 VanDerWaalsContact OH-CD2 3.27Å; Y578-L635 WeakPolarHBondContact OH-CD2 3.44Å; Y578-A636 HydrophobicContact CD1-CB 3.78Å; Y578-A636 HydrophobicContact CE1-CB 4.44Å; Y578-I639 HydrophobicContact CD1-CD1 4.5Å; Y578-I639 HydrophobicContact CD2-CD1 3.51Å; Y578-I639 HydrophobicContact CE2-CD1 3.66Å; Y578-I639 HydrophobicContact CG-CD1 3.97Å; Y578-H727 AromaticContact CE2-CD2 3.72Å; Y578-H727 AromaticContact CE2-NE2 3.68Å
579	L	88.5	Confident	84.3	Confident	56 Å²	56	37.8 Å²	37.8	29%	0.293	20%	0.2	S	C	.	.	H	α-helix	trans	-65.3	-46.4	-179	-158	85.1	0	0	0	111.8	F575 F576 R582 S583 A636	F575-L579 HydrophobicContact CE1-CD2 4.28Å; F575-L579 WeakPolarHBondContact O-CB 3.38Å; F575-L579 PolarHBondContact O-N 3.41Å; F576-L579 PolarHBondContact O-N 3.14Å; L579-R582 PolarHBondContact O-N 3.27Å; L579-S583 WeakPolarHBondContact O-CB 3.4Å; L579-S583 PolarHBondContact O-N 3.31Å; L579-A636 HydrophobicContact CD1-CB 4.04Å
580	L	87.2	Confident	83.5	Confident	47 Å²	47	39.2 Å²	39.2	25%	0.246	21%	0.209	C	C	.	.	H	α-helix	trans	-60.9	-50	177.9	-75.5	167.1	0	0	0	110.9	R539 C543 F576 R582 S583	R539-L580 HydrophobicContact CG-CD2 4.14Å; C543-L580 HydrophobicContact CB-CD1 4.23Å; F576-L580 VanDerWaalsContact O-CB 3.3Å; F576-L580 WeakPolarHBondContact O-CB 3.34Å; F576-L580 VanDerWaalsContact O-CG 3.29Å; F576-L580 WeakPolarHBondContact O-CG 3.31Å; F576-L580 PolarHBondContact O-N 3.11Å; L580-R582 PolarHBondContact O-N 2.94Å; L580-S583 WeakPolarHBondContact CA-OG 3.1Å; L580-S583 PolarHBondContact O-N 3.33Å; L580-S583 PolarHBondContact O-OG 2.9Å
581	S	85.2	Confident	83	Confident	57 Å²	57	45.3 Å²	45.3	40%	0.399	24%	0.235	S	C	.	.	H	α-helix	trans	-54.8	-27.4	-179.7	-176.8	0	0	0	0	113.9	S577 N939	S577-S581 WeakPolarHBondContact O-CB 3.28Å; S577-S581 PolarHBondContact O-N 3.05Å; S581-N939 PolarHBondContact O-N 3.35Å; S581-N939 VanDerWaalsContact OG-CB 3.28Å; S581-N939 WeakPolarHBondContact OG-CB 3.34Å
582	R	84.5	Confident	81.9	Confident	40 Å²	40	46.8 Å²	46.8	15%	0.151	25%	0.25	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.4	-2.1	178.2	-69.2	-163.8	155.1	-144.6	-11.1	115.1	Y578 L579 L580 R628 N632 N939	Y578-R582 PolarHBondContact O-N 3.14Å; Y578-R582 WeakPolarHBondContact OH-CD 3.43Å; Y578-R582 VanDerWaalsContact OH-CZ 3.32Å; Y578-R582 PolarHBondContact OH-NE 3.25Å; Y578-R582 PolarHBondContact OH-NH1 2.73Å; L579-R582 PolarHBondContact O-N 3.27Å; L580-R582 PolarHBondContact O-N 2.94Å; R582-R628 PolarHBondContact O-NH2 3.45Å; R582-N632 WeakPolarHBondContact CD-OD1 3.4Å; R582-N632 PolarHBondContact NH1-OD1 2.96Å; R582-N939 HydrophobicContact CG-CB 3.77Å; R582-N939 PolarHBondContact NE-OD1 2.67Å; R582-N939 PolarHBondContact NH2-OD1 2.94Å
583	S	82.6	Confident	80.7	Confident	30 Å²	30	45 Å²	45	21%	0.21	25%	0.246	C	C	.	.			trans	-94.2	121.4	-173.9	71.1	0	0	0	0	112.6	R539 L579 L580	R539-S583 PolarHBondContact NH1-O 3.48Å; R539-S583 PolarHBondContact NH1-OG 2.84Å; L579-S583 WeakPolarHBondContact O-CB 3.4Å; L579-S583 PolarHBondContact O-N 3.31Å; L580-S583 WeakPolarHBondContact CA-OG 3.1Å; L580-S583 PolarHBondContact O-N 3.33Å; L580-S583 PolarHBondContact O-OG 2.9Å
584	T	81	Confident	79.9	Confident	16 Å²	16	46.6 Å²	46.6	10%	0.098	26%	0.255	C	S	.	.			trans	-70.5	141.9	179.6	56.9	0	0	0	0	112	N586 F941 Y1348	T584-N586 PolarHBondContact O-N 3.15Å; T584-F941 HydrophobicContact CG2-CD2 3.77Å; T584-F941 HydrophobicContact CG2-CE2 3.72Å; T584-F941 HydrophobicContact CG2-CG 4.22Å; T584-F941 HydrophobicContact CG2-CZ 4.12Å; T584-Y1348 HydrophobicContact CG2-CE1 4.21Å
585	S	79.7	Confident	79	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	28%	0.281	C	S	.	.	S	Bend	trans	-62.4	-21.4	175.4	67.9	0	0	0	0	114.7	F528 S532 C536 P587 E936	F528-S585 WeakPolarHBondContact CD2-OG 3.5Å; F528-S585 WeakPolarHBondContact CE2-OG 3.36Å; S532-S585 WeakPolarHBondContact CB-O 3.3Å; C536-S585 WeakPolarHBondContact SG-CB 3.46Å; S585-P587 VanDerWaalsContact O-CD 3.29Å; S585-P587 WeakPolarHBondContact O-CD 3.41Å; S585-E936 WeakPolarHBondContact CB-OE1 3.34Å; S585-E936 WeakPolarHBondContact CB-OE2 3.48Å; S585-E936 PolarHBondContact N-OE1 3.49Å; S585-E936 PolarHBondContact N-OE2 2.84Å; S585-E936 VanDerWaalsContact N-OE2 3.08Å; S585-E936 VanDerWaalsContact OG-CD 3.32Å; S585-E936 PolarHBondContact OG-OE2 3.09Å
586	N	78.2	Confident	77.7	Confident	47 Å²	47	55.5 Å²	55.5	25%	0.251	30%	0.295	S	S	.	.			trans	-75.5	115.3	179.5	-179.8	5.8	0	0	0	112	F528 T584 K588	F528-N586 HydrophobicContact CD2-CB 4.25Å; F528-N586 HydrophobicContact CE2-CB 4.23Å; T584-N586 PolarHBondContact O-N 3.15Å; N586-K588 VanDerWaalsContact OD1-CB 3.32Å; N586-K588 WeakPolarHBondContact OD1-CB 3.46Å; N586-K588 WeakPolarHBondContact OD1-CG 3.49Å; N586-K588 PolarHBondContact OD1-N 3Å
587	P	77	Confident	76.6	Confident	11 Å²	11	58.7 Å²	58.7	7%	0.071	31%	0.313	C	S	.	.			trans	-83.3	-15.2	-177.9	34.7	-36.7	0	0	0	113.9	Y535 S585 L590 F591	Y535-P587 HydrophobicContact CD1-CB 4.05Å; Y535-P587 HydrophobicContact CD2-CB 4.2Å; Y535-P587 HydrophobicContact CE1-CB 4.37Å; Y535-P587 HydrophobicContact CE2-CB 4.5Å; Y535-P587 HydrophobicContact CG-CB 3.97Å; S585-P587 VanDerWaalsContact O-CD 3.29Å; S585-P587 WeakPolarHBondContact O-CD 3.41Å; P587-L590 PolarHBondContact O-N 2.95Å; P587-F591 HydrophobicContact CB-CD2 3.94Å; P587-F591 HydrophobicContact CB-CE2 3.91Å; P587-F591 WeakPolarHBondContact O-CD2 3.07Å; P587-F591 PolarHBondContact O-N 2.91Å
588	K	75	Confident	75.6	Confident	148 Å²	148	63.1 Å²	63.1	64%	0.643	32%	0.323	S	S	*	.	H	α-helix	trans	-51	-49.2	-173.6	-67.4	172.7	-178.3	170.3	0	114	N586 G592	N586-K588 VanDerWaalsContact OD1-CB 3.32Å; N586-K588 WeakPolarHBondContact OD1-CB 3.46Å; N586-K588 WeakPolarHBondContact OD1-CG 3.49Å; N586-K588 PolarHBondContact OD1-N 3Å; K588-G592 PolarHBondContact O-N 2.92Å
589	P	67.9	Low	74.4	Confident	23 Å²	23	66.5 Å²	66.5	15%	0.149	34%	0.34	C	S	.	.	H	α-helix	trans	-79.2	-23.1	-176.4	33.8	-37.7	0	0	0	113.1	G592 C593 L625	P589-G592 WeakPolarHBondContact O-CA 3.23Å; P589-G592 PolarHBondContact O-N 2.93Å; P589-C593 PolarHBondContact O-N 2.93Å; P589-L625 HydrophobicContact CB-CD2 3.47Å; P589-L625 VanDerWaalsContact CB-CD2 3.47Å; P589-L625 HydrophobicContact CG-CD2 3.34Å
590	L	70.5	Confident	72.7	Confident	65 Å²	65	69.4 Å²	69.4	34%	0.34	36%	0.36	S	S	.	.	H	α-helix	trans	-69.4	-43.9	170.6	-169.9	149.6	0	0	0	110.4	P587 G592 C593 L594	P587-L590 PolarHBondContact O-N 2.95Å; L590-G592 VanDerWaalsContact C-N 3.26Å; L590-G592 PolarHBondContact O-N 2.95Å; L590-C593 PolarHBondContact O-N 3.03Å; L590-L594 PolarHBondContact O-N 2.8Å
591	F	72.5	Confident	70.9	Confident	128 Å²	128	78.3 Å²	78.3	56%	0.561	39%	0.39	S	S	*	.	H	α-helix	trans	-61.2	-34.2	167.7	-79	-62.6	0	0	0	112.5	P587 R595	P587-F591 HydrophobicContact CB-CD2 3.94Å; P587-F591 HydrophobicContact CB-CE2 3.91Å; P587-F591 WeakPolarHBondContact O-CD2 3.07Å; P587-F591 PolarHBondContact O-N 2.91Å; F591-R595 WeakPolarHBondContact O-CB 3.36Å; F591-R595 PolarHBondContact O-N 3.29Å
592	G	66.8	Low	68.9	Low	36 Å²	36	81.1 Å²	81.1	37%	0.371	40%	0.4	S	S	.	.	H	α-helix	trans	-61.3	-43.2	172.6	0	0	0	0	0	113.2	K588 P589 L590 R595 S596	K588-G592 PolarHBondContact O-N 2.92Å; P589-G592 WeakPolarHBondContact O-CA 3.23Å; P589-G592 PolarHBondContact O-N 2.93Å; L590-G592 VanDerWaalsContact C-N 3.26Å; L590-G592 PolarHBondContact O-N 2.95Å; G592-R595 PolarHBondContact O-N 2.93Å; G592-S596 PolarHBondContact O-N 3.08Å
593	C	64.8	Low	66.6	Low	35 Å²	35	84.5 Å²	84.5	24%	0.236	43%	0.426	C	S	.	.	H	α-helix	trans	-69.1	-45.3	175	-172.6	0	0	0	0	111.9	P589 L590 R595 S596 I597	P589-C593 PolarHBondContact O-N 2.93Å; L590-C593 PolarHBondContact O-N 3.03Å; C593-R595 PolarHBondContact O-N 3.32Å; C593-S596 PolarHBondContact O-N 2.89Å; C593-S596 VanDerWaalsContact O-N 3.14Å; C593-S596 PolarHBondContact O-OG 2.93Å; C593-I597 WeakPolarHBondContact O-CG1 3.44Å; C593-I597 PolarHBondContact O-N 3.37Å
594	L	69.9	Low	64.5	Low	84 Å²	84	89.6 Å²	89.6	44%	0.44	45%	0.451	S	S	.	.	H	α-helix	trans	-56.8	-44.2	174.1	-143.8	84.1	0	0	0	110.7	L590 I597 F598	L590-L594 PolarHBondContact O-N 2.8Å; L594-I597 PolarHBondContact O-N 3.44Å; L594-F598 HydrophobicContact CD2-CE2 4.2Å; L594-F598 HydrophobicContact CG-CD2 4.36Å; L594-F598 HydrophobicContact CG-CE2 4.11Å; L594-F598 WeakPolarHBondContact O-CD2 3.49Å; L594-F598 PolarHBondContact O-N 2.75Å
595	R	70.2	Confident	62.6	Low	162 Å²	162	93.9 Å²	93.9	61%	0.611	48%	0.482	S	S	*	.	H	α-helix	trans	-66.2	-38.1	176.9	-177	174.9	-176.2	149.2	10.1	112.5	F591 G592 C593 F598 Q599	F591-R595 WeakPolarHBondContact O-CB 3.36Å; F591-R595 PolarHBondContact O-N 3.29Å; G592-R595 PolarHBondContact O-N 2.93Å; C593-R595 PolarHBondContact O-N 3.32Å; R595-F598 PolarHBondContact O-N 3Å; R595-Q599 HydrophobicContact CG-CG 4.08Å; R595-Q599 VanDerWaalsContact CG-OE1 3.25Å; R595-Q599 VanDerWaalsContact O-CB 3.23Å; R595-Q599 WeakPolarHBondContact O-CB 3.01Å; R595-Q599 VanDerWaalsContact O-CG 3.27Å; R595-Q599 WeakPolarHBondContact O-CG 2.99Å; R595-Q599 PolarHBondContact O-N 3.05Å
596	S	64.6	Low	60.6	Low	60 Å²	60	102.5 Å²	102.5	42%	0.42	52%	0.519	S	S	.	.	H	α-helix	trans	-66.4	-40.3	176.9	70.7	0	0	0	0	111.4	G592 C593 Q599 T600	G592-S596 PolarHBondContact O-N 3.08Å; C593-S596 PolarHBondContact O-N 2.89Å; C593-S596 VanDerWaalsContact O-N 3.14Å; C593-S596 PolarHBondContact O-OG 2.93Å; S596-Q599 PolarHBondContact O-N 3.45Å; S596-T600 PolarHBondContact O-N 3.46Å
597	I	67.1	Low	58.9	Low	101 Å²	101	107.5 Å²	107.5	52%	0.518	54%	0.538	S	S	.	.	H	α-helix	trans	-57.9	-51.5	173	-65.8	164.1	0	0	0	110.3	C593 L594 Q599 T600	C593-I597 WeakPolarHBondContact O-CG1 3.44Å; C593-I597 PolarHBondContact O-N 3.37Å; L594-I597 PolarHBondContact O-N 3.44Å; I597-Q599 PolarHBondContact O-N 3Å; I597-T600 WeakPolarHBondContact O-CG2 3.15Å; I597-T600 PolarHBondContact O-N 2.97Å; I597-T600 PolarHBondContact O-OG1 2.88Å
598	F	66.8	Low	57	Low	165 Å²	165	118.5 Å²	118.5	72%	0.724	58%	0.578	S	S	*	*	H	α-helix	trans	-68.8	-27.2	178	-77.7	-66.1	0	0	0	114.2	L594 R595	L594-F598 HydrophobicContact CD2-CE2 4.2Å; L594-F598 HydrophobicContact CG-CD2 4.36Å; L594-F598 HydrophobicContact CG-CE2 4.11Å; L594-F598 WeakPolarHBondContact O-CD2 3.49Å; L594-F598 PolarHBondContact O-N 2.75Å; R595-F598 PolarHBondContact O-N 3Å
599	Q	63.5	Low	55	Low	85 Å²	85	119.4 Å²	119.4	40%	0.397	59%	0.585	S	S	.	*	T	Hydrogen-bonded Turn	trans	-90.8	11	179.2	-67.4	-161.7	-82.5	0	0	114.5	R595 S596 I597 R601 I602	R595-Q599 HydrophobicContact CG-CG 4.08Å; R595-Q599 VanDerWaalsContact CG-OE1 3.25Å; R595-Q599 VanDerWaalsContact O-CB 3.23Å; R595-Q599 WeakPolarHBondContact O-CB 3.01Å; R595-Q599 VanDerWaalsContact O-CG 3.27Å; R595-Q599 WeakPolarHBondContact O-CG 2.99Å; R595-Q599 PolarHBondContact O-N 3.05Å; S596-Q599 PolarHBondContact O-N 3.45Å; I597-Q599 PolarHBondContact O-N 3Å; Q599-R601 PolarHBondContact O-N 2.91Å; Q599-I602 PolarHBondContact O-N 3.36Å
600	T	52	Low	53.3	Low	117 Å²	117	120.4 Å²	120.4	72%	0.718	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.4	-6.4	174.9	45.7	0	0	0	0	115.5	S596 I597	S596-T600 PolarHBondContact O-N 3.46Å; I597-T600 WeakPolarHBondContact O-CG2 3.15Å; I597-T600 PolarHBondContact O-N 2.97Å; I597-T600 PolarHBondContact O-OG1 2.88Å
601	R	49.6	Very low	51.6	Low	235 Å²	235	128.5 Å²	128.5	89%	0.887	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.9	2	176.1	-68.2	-170	176.3	-164.2	-0.3	116	Q599	Q599-R601 PolarHBondContact O-N 2.91Å
602	I	41.8	Very low	49.9	Very low	116 Å²	116	129.8 Å²	129.8	60%	0.595	62%	0.622	S	S	*	*	S	Bend	trans	-109.3	125.2	-177.6	-55.2	-179	0	0	0	111.3	Q599	Q599-I602 PolarHBondContact O-N 3.36Å
603	P	37.4	Very low	48.7	Very low	110 Å²	110	130.4 Å²	130.4	71%	0.714	62%	0.62	S	S	*	*			trans	-74.6	161.8	-171.3	28.8	-35.4	0	0	0	115.1	S605	P603-S605 PolarHBondContact O-N 2.99Å
604	L	38.4	Very low	47.4	Very low	138 Å²	138	131.9 Å²	131.9	72%	0.723	63%	0.63	S	S	*	*	S	Bend	trans	-61.8	0.2	-161	-86.6	86.9	0	0	0	118.8	K606 K607	L604-K606 VanDerWaalsContact C-N 3.33Å; L604-K606 PolarHBondContact O-N 2.64Å; L604-K607 HydrophobicContact CD2-CD 4.35Å; L604-K607 PolarHBondContact O-N 2.93Å
605	S	41.3	Very low	45.8	Very low	106 Å²	106	131.6 Å²	131.6	74%	0.741	63%	0.629	S	S	*	*	G	3₁₀ helix	trans	-49.5	-43.5	-163	-173.1	0	0	0	0	115	P603 K607	P603-S605 PolarHBondContact O-N 2.99Å; S605-K607 VanDerWaalsContact C-N 3.25Å; S605-K607 PolarHBondContact O-N 2.94Å; S605-K607 VanDerWaalsContact O-N 3.13Å
606	K	38	Very low	44.4	Very low	181 Å²	181	131.9 Å²	131.9	79%	0.787	63%	0.63	S	S	*	*	G	3₁₀ helix	trans	-69	-8.1	-177.2	-75	-169.1	172.5	-175.5	0	115.8	L604 R608	L604-K606 VanDerWaalsContact C-N 3.33Å; L604-K606 PolarHBondContact O-N 2.64Å; K606-R608 VanDerWaalsContact C-N 3.32Å; K606-R608 PolarHBondContact O-N 3.16Å
607	K	41.1	Very low	43.6	Very low	151 Å²	151	133.1 Å²	133.1	66%	0.657	63%	0.628	S	S	*	*	G	3₁₀ helix	trans	-70.7	-18	179.4	-89.2	-175.6	174.4	176.7	0	115.1	L604 S605	L604-K607 HydrophobicContact CD2-CD 4.35Å; L604-K607 PolarHBondContact O-N 2.93Å; S605-K607 VanDerWaalsContact C-N 3.25Å; S605-K607 PolarHBondContact O-N 2.94Å; S605-K607 VanDerWaalsContact O-N 3.13Å
608	R	37.1	Very low	42.6	Very low	242 Å²	242	135.3 Å²	135.3	91%	0.913	64%	0.636	S	S	*	*	G	3₁₀ helix	trans	-82.4	-16.9	-176.4	-91.8	-178	168.5	169.8	-4.3	115.6	K606	K606-R608 VanDerWaalsContact C-N 3.32Å; K606-R608 PolarHBondContact O-N 3.16Å
609	Q	33.8	Very low	41.7	Very low	168 Å²	168	132.6 Å²	132.6	79%	0.785	63%	0.629	S	S	*	*			trans	-91.6	-2.6	-175.5	-79.7	178.2	-30.4	0	0	115	R611	Q609-R611 PolarHBondContact O-N 3.11Å
610	A	31.3	Very low	41.2	Very low	43 Å²	43	133 Å²	133	36%	0.355	63%	0.633	S	S	.	*			trans	-74.6	64.4	177.9	0	0	0	0	0	112.9	D615	A610-D615 HydrophobicContact CB-CB 4.46Å
611	R	36.4	Very low	41.4	Very low	236 Å²	236	129.2 Å²	129.2	89%	0.891	62%	0.617	S	S	*	*			trans	-78.5	-19.3	174.4	-80.1	-170.8	173.8	-173.5	-1.8	113.5	Q609	Q609-R611 PolarHBondContact O-N 3.11Å
612	R	36.4	Very low	42.1	Very low	154 Å²	154	121.9 Å²	121.9	58%	0.581	60%	0.595	S	S	*	*	S	Bend	trans	-83.2	136.6	179	-67.4	-171.6	177.5	-149.5	-2.4	111.6	S614 D615	R612-S614 PolarHBondContact O-N 2.91Å; R612-D615 PolarHBondContact O-N 3.42Å
613	P	40.4	Very low	43.3	Very low	50 Å²	50	122.6 Å²	122.6	33%	0.325	59%	0.59	S	S	.	*	H	α-helix	trans	-73.6	-9.5	-177.2	25.1	-29.5	0	0	0	114.4	K617 D1247	P613-K617 VanDerWaalsContact O-CD 3.29Å; P613-K617 WeakPolarHBondContact O-CD 3.13Å; P613-K617 WeakPolarHBondContact O-CG 2.99Å; P613-D1247 WeakPolarHBondContact CG-OD1 3.22Å; P613-D1247 WeakPolarHBondContact CG-OD2 3.22Å
614	S	38.8	Very low	44.8	Very low	65 Å²	65	119.9 Å²	119.9	46%	0.455	57%	0.569	S	S	.	*	H	α-helix	trans	-59.4	-53.7	166.9	43	0	0	0	0	111.8	R612 R616 K617 E618	R612-S614 PolarHBondContact O-N 2.91Å; S614-R616 VanDerWaalsContact C-N 3.29Å; S614-R616 PolarHBondContact O-N 3.36Å; S614-K617 WeakPolarHBondContact O-CB 3.49Å; S614-K617 PolarHBondContact O-N 3.02Å; S614-E618 PolarHBondContact O-N 3.03Å
615	D	36	Very low	46.3	Very low	78 Å²	78	114 Å²	114	42%	0.417	54%	0.538	S	S	.	.	H	α-helix	trans	-72.4	-30.8	-165.1	-47.9	-1.1	0	0	0	110.5	A610 R612 K617 L619	A610-D615 HydrophobicContact CB-CB 4.46Å; R612-D615 PolarHBondContact O-N 3.42Å; D615-K617 PolarHBondContact O-N 3.41Å; D615-L619 PolarHBondContact O-N 3.4Å
616	R	41.7	Very low	47.7	Very low	168 Å²	168	114.2 Å²	114.2	63%	0.634	53%	0.528	S	S	*	.	H	α-helix	trans	-64.7	-27.9	172.9	-162.4	-179.5	-65.6	-161.2	3.3	112.2	S614 I620	S614-R616 VanDerWaalsContact C-N 3.29Å; S614-R616 PolarHBondContact O-N 3.36Å; R616-I620 WeakPolarHBondContact O-CD1 3.27Å; R616-I620 WeakPolarHBondContact O-CG1 3.18Å; R616-I620 PolarHBondContact O-N 2.78Å
617	K	45.9	Very low	49.3	Very low	87 Å²	87	108.3 Å²	108.3	38%	0.378	50%	0.504	S	S	.	.	H	α-helix	trans	-82.9	-37.8	-178	-69	166.6	-174.6	167.5	0	112.2	P613 S614 D615 L619 I620 G621	P613-K617 VanDerWaalsContact O-CD 3.29Å; P613-K617 WeakPolarHBondContact O-CD 3.13Å; P613-K617 WeakPolarHBondContact O-CG 2.99Å; S614-K617 WeakPolarHBondContact O-CB 3.49Å; S614-K617 PolarHBondContact O-N 3.02Å; D615-K617 PolarHBondContact O-N 3.41Å; K617-L619 VanDerWaalsContact C-N 3.28Å; K617-L619 PolarHBondContact O-N 2.86Å; K617-I620 PolarHBondContact O-N 3.23Å; K617-G621 PolarHBondContact O-N 2.96Å
618	E	48	Very low	51.1	Low	146 Å²	146	101.4 Å²	101.4	68%	0.682	47%	0.474	S	S	*	.	H	α-helix	trans	-59.6	-40.4	168.6	-68.5	-165.3	155.7	0	0	111.7	S614 I620 G621 N622	S614-E618 PolarHBondContact O-N 3.03Å; E618-I620 VanDerWaalsContact C-N 3.31Å; E618-I620 PolarHBondContact O-N 3.5Å; E618-G621 PolarHBondContact O-N 2.94Å; E618-N622 PolarHBondContact O-N 3.22Å; E618-N622 PolarHBondContact O-ND2 3.02Å; E618-N622 VanDerWaalsContact O-ND2 3.11Å
619	L	46.6	Very low	53.2	Low	109 Å²	109	93.1 Å²	93.1	57%	0.571	45%	0.448	S	S	*	.	H	α-helix	trans	-61.4	-37.2	176.9	-166.9	71.9	0	0	0	112.7	D615 K617 R623	D615-L619 PolarHBondContact O-N 3.4Å; K617-L619 VanDerWaalsContact C-N 3.28Å; K617-L619 PolarHBondContact O-N 2.86Å; L619-R623 WeakPolarHBondContact O-CB 3.5Å; L619-R623 PolarHBondContact O-N 3.3Å
620	I	52.6	Low	55.4	Low	93 Å²	93	89.8 Å²	89.8	48%	0.477	43%	0.428	S	S	.	.	H	α-helix	trans	-69.4	-47.7	175.8	-68.5	162.5	0	0	0	110.7	R616 K617 E618 N622 R623 I624	R616-I620 WeakPolarHBondContact O-CD1 3.27Å; R616-I620 WeakPolarHBondContact O-CG1 3.18Å; R616-I620 PolarHBondContact O-N 2.78Å; K617-I620 PolarHBondContact O-N 3.23Å; E618-I620 VanDerWaalsContact C-N 3.31Å; E618-I620 PolarHBondContact O-N 3.5Å; I620-N622 VanDerWaalsContact C-N 3.35Å; I620-N622 PolarHBondContact O-N 3.43Å; I620-R623 PolarHBondContact O-N 2.87Å; I620-R623 VanDerWaalsContact O-N 3.13Å; I620-I624 HydrophobicContact CG2-CD1 3.82Å; I620-I624 HydrophobicContact CG2-CG1 4.45Å; I620-I624 WeakPolarHBondContact O-CG1 3.03Å; I620-I624 PolarHBondContact O-N 3.16Å
621	G	57.9	Low	57.9	Low	37 Å²	37	88.5 Å²	88.5	38%	0.381	42%	0.415	S	S	.	.	H	α-helix	trans	-58.5	-43.7	179.5	0	0	0	0	0	113	K617 E618 R623 I624 L625	K617-G621 PolarHBondContact O-N 2.96Å; E618-G621 PolarHBondContact O-N 2.94Å; G621-R623 PolarHBondContact O-N 3.18Å; G621-I624 PolarHBondContact O-N 3.39Å; G621-L625 PolarHBondContact O-N 3.26Å; G621-L625 VanDerWaalsContact O-N 3.11Å
622	N	63.7	Low	60.2	Low	82 Å²	82	77.8 Å²	77.8	44%	0.439	38%	0.376	S	S	.	.	H	α-helix	trans	-61.7	-41.4	175.2	-71.6	-37.8	0	0	0	112.4	E618 I620 L625 E626	E618-N622 PolarHBondContact O-N 3.22Å; E618-N622 PolarHBondContact O-ND2 3.02Å; E618-N622 VanDerWaalsContact O-ND2 3.11Å; I620-N622 VanDerWaalsContact C-N 3.35Å; I620-N622 PolarHBondContact O-N 3.43Å; N622-L625 PolarHBondContact O-N 2.87Å; N622-E626 PolarHBondContact O-N 3.42Å
623	R	65.9	Low	62.6	Low	131 Å²	131	76.2 Å²	76.2	49%	0.494	37%	0.373	S	S	.	.	H	α-helix	trans	-69.3	-33.2	179.6	-160.6	176.3	-170.4	-174.9	0.8	112.6	L619 I620 G621 L627 V1408	L619-R623 WeakPolarHBondContact O-CB 3.5Å; L619-R623 PolarHBondContact O-N 3.3Å; I620-R623 PolarHBondContact O-N 2.87Å; I620-R623 VanDerWaalsContact O-N 3.13Å; G621-R623 PolarHBondContact O-N 3.18Å; R623-L627 WeakPolarHBondContact O-CG 3.2Å; R623-L627 PolarHBondContact O-N 3.27Å; R623-V1408 PolarHBondContact NH1-O 2.73Å; R623-V1408 PolarHBondContact NH2-O 3.34Å
624	I	69	Low	64.9	Low	52 Å²	52	76.4 Å²	76.4	27%	0.267	37%	0.369	S	S	.	.	H	α-helix	trans	-65	-44.9	171.9	-68.1	166.7	0	0	0	110.2	I620 G621 L627 R628 T1351	I620-I624 HydrophobicContact CG2-CD1 3.82Å; I620-I624 HydrophobicContact CG2-CG1 4.45Å; I620-I624 WeakPolarHBondContact O-CG1 3.03Å; I620-I624 PolarHBondContact O-N 3.16Å; G621-I624 PolarHBondContact O-N 3.39Å; I624-L627 PolarHBondContact O-N 2.8Å; I624-R628 WeakPolarHBondContact O-CB 3.22Å; I624-R628 PolarHBondContact O-N 2.97Å; I624-T1351 HydrophobicContact CD1-CG2 4.18Å
625	L	70.1	Confident	67.1	Low	14 Å²	14	75.9 Å²	75.9	7%	0.073	36%	0.361	C	S	.	.	H	α-helix	trans	-68.6	-35.7	179.2	-161.1	79.3	0	0	0	112.6	P589 G621 N622 R628 L629 Y1348	P589-L625 HydrophobicContact CB-CD2 3.47Å; P589-L625 VanDerWaalsContact CB-CD2 3.47Å; P589-L625 HydrophobicContact CG-CD2 3.34Å; G621-L625 PolarHBondContact O-N 3.26Å; G621-L625 VanDerWaalsContact O-N 3.11Å; N622-L625 PolarHBondContact O-N 2.87Å; L625-R628 PolarHBondContact O-N 3.39Å; L625-L629 HydrophobicContact CD2-CD1 4.33Å; L625-L629 HydrophobicContact CG-CD1 4.33Å; L625-L629 WeakPolarHBondContact O-CB 3.47Å; L625-L629 PolarHBondContact O-N 2.88Å; L625-Y1348 HydrophobicContact CD1-CE1 4.03Å
626	E	71.1	Confident	69.7	Low	112 Å²	112	72.1 Å²	72.1	52%	0.523	34%	0.341	S	S	.	.	H	α-helix	trans	-58	-47.9	173.9	-171.4	-171.1	156.6	0	0	111.5	N622 L629 R630	N622-E626 PolarHBondContact O-N 3.42Å; E626-L629 PolarHBondContact O-N 2.98Å; E626-R630 PolarHBondContact O-N 2.86Å; E626-R630 VanDerWaalsContact O-N 3.09Å
627	L	72	Confident	72	Confident	56 Å²	56	65.8 Å²	65.8	29%	0.293	32%	0.322	S	S	.	.	H	α-helix	trans	-61.4	-45.5	174.3	-69.3	168.1	0	0	0	111.7	R623 I624 R630 N631	R623-L627 WeakPolarHBondContact O-CG 3.2Å; R623-L627 PolarHBondContact O-N 3.27Å; I624-L627 PolarHBondContact O-N 2.8Å; L627-R630 PolarHBondContact O-N 3.06Å; L627-N631 WeakPolarHBondContact O-CB 3.23Å; L627-N631 PolarHBondContact O-N 3.3Å; L627-N631 PolarHBondContact O-ND2 2.82Å
628	R	78.8	Confident	74.1	Confident	7 Å²	7	64.1 Å²	64.1	3%	0.026	32%	0.321	C	S	.	.	H	α-helix	trans	-63.2	-41.2	178.6	-179.2	172.8	164.9	111.5	0.5	112.2	R582 I624 L625 N631 N632 N939 G940 E1350	R582-R628 PolarHBondContact O-NH2 3.45Å; I624-R628 WeakPolarHBondContact O-CB 3.22Å; I624-R628 PolarHBondContact O-N 2.97Å; L625-R628 PolarHBondContact O-N 3.39Å; R628-N631 PolarHBondContact O-N 2.98Å; R628-N632 WeakPolarHBondContact CG-ND2 3.43Å; R628-N632 WeakPolarHBondContact O-CB 3.45Å; R628-N632 PolarHBondContact O-N 3.2Å; R628-N632 PolarHBondContact O-ND2 3.37Å; R628-N939 PolarHBondContact NH2-O 3.42Å; R628-G940 PolarHBondContact NH1-O 2.97Å; R628-E1350 IonicContact CZ-OE1 2.78Å; R628-E1350 IonicContact CZ-OE2 3.67Å; R628-E1350 VanDerWaalsContact NH1-CD 3.31Å; R628-E1350 IonicContact NH1-OE1 3.64Å; R628-E1350 PolarHBondContact NH1-OE1 2.74Å; R628-E1350 IonicContact NH1-OE2 2.67Å; R628-E1350 PolarHBondContact NH1-OE2 3.09Å
629	L	80	Confident	76.1	Confident	67 Å²	67	59 Å²	59	35%	0.351	30%	0.298	S	S	.	.	H	α-helix	trans	-61	-48	174.6	-92.9	161.5	0	0	0	111.4	L625 E626 N632 F633	L625-L629 HydrophobicContact CD2-CD1 4.33Å; L625-L629 HydrophobicContact CG-CD1 4.33Å; L625-L629 WeakPolarHBondContact O-CB 3.47Å; L625-L629 PolarHBondContact O-N 2.88Å; E626-L629 PolarHBondContact O-N 2.98Å; L629-N632 PolarHBondContact O-N 3.45Å; L629-F633 WeakPolarHBondContact O-CB 3.34Å; L629-F633 PolarHBondContact O-N 3.34Å
630	R	81.4	Confident	78.1	Confident	98 Å²	98	54.1 Å²	54.1	37%	0.37	27%	0.274	S	S	.	.	H	α-helix	trans	-60.4	-46.7	177.2	-173.2	-177.4	69.5	-166.6	3.6	112	E626 L627 F633 F634 D1363	E626-R630 PolarHBondContact O-N 2.86Å; E626-R630 VanDerWaalsContact O-N 3.09Å; L627-R630 PolarHBondContact O-N 3.06Å; R630-F633 PolarHBondContact O-N 2.96Å; R630-F634 WeakPolarHBondContact O-CB 3.49Å; R630-F634 PolarHBondContact O-N 2.81Å; R630-D1363 IonicContact CZ-OD1 4Å; R630-D1363 IonicContact NH2-OD1 3.3Å; R630-D1363 PolarHBondContact NH2-OD1 3.32Å; R630-D1363 IonicContact NH2-OD2 3.99Å; R630-D1363 PolarHBondContact NH2-OD2 2.95Å
631	N	83	Confident	80	Confident	16 Å²	16	55.3 Å²	55.3	9%	0.086	28%	0.28	C	S	.	.	H	α-helix	trans	-69.9	-38.1	-178.3	-71	-29.8	0	0	0	112.4	L627 R628 L635 V1362 D1363 F1365	L627-N631 WeakPolarHBondContact O-CB 3.23Å; L627-N631 PolarHBondContact O-N 3.3Å; L627-N631 PolarHBondContact O-ND2 2.82Å; R628-N631 PolarHBondContact O-N 2.98Å; N631-L635 WeakPolarHBondContact O-CB 3.22Å; N631-L635 PolarHBondContact O-N 3.36Å; N631-V1362 PolarHBondContact ND2-O 2.62Å; N631-D1363 PolarHBondContact ND2-OD1 2.83Å; N631-D1363 PolarHBondContact OD1-OD1 2.91Å; N631-F1365 WeakPolarHBondContact OD1-CB 3.3Å; N631-F1365 PolarHBondContact OD1-N 3.13Å; N631-F1365 VanDerWaalsContact OD1-N 3.11Å
632	N	85.1	Confident	81.6	Confident	12 Å²	12	59 Å²	59	6%	0.064	29%	0.291	C	S	.	.	H	α-helix	trans	-66.9	-41.4	174.4	-71.6	-17.2	0	0	0	111.8	R582 R628 L629 A636	R582-N632 WeakPolarHBondContact CD-OD1 3.4Å; R582-N632 PolarHBondContact NH1-OD1 2.96Å; R628-N632 WeakPolarHBondContact CG-ND2 3.43Å; R628-N632 WeakPolarHBondContact O-CB 3.45Å; R628-N632 PolarHBondContact O-N 3.2Å; R628-N632 PolarHBondContact O-ND2 3.37Å; L629-N632 PolarHBondContact O-N 3.45Å; N632-A636 WeakPolarHBondContact O-CB 3.41Å; N632-A636 PolarHBondContact O-N 3.33Å
633	F	87.1	Confident	82.6	Confident	120 Å²	120	55.4 Å²	55.4	53%	0.526	27%	0.273	S	S	.	.	H	α-helix	trans	-63.8	-46.6	175.9	-174.2	-90.5	0	0	0	111.4	F575 L629 R630 L635 A636 S637	F575-F633 HydrophobicContact CE2-CE2 4.44Å; F575-F633 HydrophobicContact CZ-CD2 4.07Å; F575-F633 AromaticContact CZ-CE2 3.82Å; F575-F633 HydrophobicContact CZ-CE2 3.82Å; L629-F633 WeakPolarHBondContact O-CB 3.34Å; L629-F633 PolarHBondContact O-N 3.34Å; R630-F633 PolarHBondContact O-N 2.96Å; F633-L635 PolarHBondContact O-N 3.28Å; F633-A636 PolarHBondContact O-N 3.16Å; F633-S637 PolarHBondContact O-N 3.08Å; F633-S637 PolarHBondContact O-OG 2.58Å
634	F	88.1	Confident	83.7	Confident	55 Å²	55	52.3 Å²	52.3	24%	0.241	26%	0.263	C	S	.	.	H	α-helix	trans	-58.5	-47.7	176.3	174.8	-105.9	0	0	0	112.5	R630 S637 C638 F1365 V1368	R630-F634 WeakPolarHBondContact O-CB 3.49Å; R630-F634 PolarHBondContact O-N 2.81Å; F634-S637 PolarHBondContact O-N 3Å; F634-C638 PolarHBondContact O-N 2.92Å; F634-C638 PolarHBondContact O-SG 3.25Å; F634-F1365 HydrophobicContact CB-CD2 4.16Å; F634-F1365 HydrophobicContact CD1-CB 4.41Å; F634-F1365 HydrophobicContact CD1-CD2 4.37Å; F634-F1365 AromaticContact CD2-CD2 3.73Å; F634-F1365 HydrophobicContact CD2-CD2 3.73Å; F634-F1365 HydrophobicContact CD2-CE2 4.22Å; F634-F1365 HydrophobicContact CE2-CD2 4.2Å; F634-F1365 HydrophobicContact CG-CB 4.49Å; F634-F1365 AromaticContact CG-CD2 3.82Å; F634-F1365 HydrophobicContact CG-CD2 3.82Å; F634-V1368 HydrophobicContact CE1-CG2 4.5Å; F634-V1368 HydrophobicContact CZ-CG1 4.14Å
635	L	86.3	Confident	84.7	Confident	53 Å²	53	52.5 Å²	52.5	28%	0.277	27%	0.273	S	S	.	.	H	α-helix	trans	-72.1	-34.3	-179	-172.1	48.6	0	0	0	112	Y578 N631 F633 C638 I639 L1364	Y578-L635 HydrophobicContact CE1-CB 4.28Å; Y578-L635 HydrophobicContact CE1-CG 4.38Å; Y578-L635 VanDerWaalsContact OH-CD2 3.27Å; Y578-L635 WeakPolarHBondContact OH-CD2 3.44Å; N631-L635 WeakPolarHBondContact O-CB 3.22Å; N631-L635 PolarHBondContact O-N 3.36Å; F633-L635 PolarHBondContact O-N 3.28Å; L635-C638 HydrophobicContact CD1-CB 4.43Å; L635-C638 PolarHBondContact O-N 3.33Å; L635-I639 HydrophobicContact CD1-CD1 4.17Å; L635-I639 HydrophobicContact CD1-CG1 4.27Å; L635-I639 HydrophobicContact CG-CD1 4.02Å; L635-I639 WeakPolarHBondContact O-CB 3.11Å; L635-I639 VanDerWaalsContact O-CG1 3.29Å; L635-I639 WeakPolarHBondContact O-CG1 3.22Å; L635-I639 PolarHBondContact O-N 2.77Å; L635-L1364 HydrophobicContact CD2-CD2 4.11Å
636	A	89.1	Confident	85.4	Confident	0 Å²	0	55 Å²	55	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-58.6	-47.4	168.8	0	0	0	0	0	111.2	F575 Y578 L579 N632 F633 C638 I639 G640	F575-A636 VanDerWaalsContact CD2-C 3.41Å; F575-A636 HydrophobicContact CD2-CB 3.62Å; F575-A636 WeakPolarHBondContact CD2-O 3.18Å; F575-A636 HydrophobicContact CE2-CB 3.55Å; F575-A636 HydrophobicContact CG-CB 4.32Å; F575-A636 HydrophobicContact CZ-CB 4.22Å; Y578-A636 HydrophobicContact CD1-CB 3.78Å; Y578-A636 HydrophobicContact CE1-CB 4.44Å; L579-A636 HydrophobicContact CD1-CB 4.04Å; N632-A636 WeakPolarHBondContact O-CB 3.41Å; N632-A636 PolarHBondContact O-N 3.33Å; F633-A636 PolarHBondContact O-N 3.16Å; A636-C638 VanDerWaalsContact C-N 3.33Å; A636-C638 PolarHBondContact O-N 3.34Å; A636-I639 PolarHBondContact O-N 3.34Å; A636-G640 PolarHBondContact O-N 2.85Å
637	S	90.9	Very high	86	Confident	35 Å²	35	50.2 Å²	50.2	25%	0.245	26%	0.263	C	S	.	.	H	α-helix	trans	-59.9	-42	176.4	-65	0	0	0	0	112.1	F633 F634 L641	F633-S637 PolarHBondContact O-N 3.08Å; F633-S637 PolarHBondContact O-OG 2.58Å; F634-S637 PolarHBondContact O-N 3Å; S637-L641 VanDerWaalsContact O-CB 3.31Å; S637-L641 WeakPolarHBondContact O-CB 3.36Å; S637-L641 WeakPolarHBondContact O-CG 3.1Å; S637-L641 PolarHBondContact O-N 3.27Å
638	C	90.5	Very high	86.6	Confident	52 Å²	52	50.7 Å²	50.7	35%	0.351	27%	0.271	S	S	.	.	H	α-helix	trans	-63.8	-45.1	176.3	-65.1	0	0	0	0	112	F634 L635 A636 L642	F634-C638 PolarHBondContact O-N 2.92Å; F634-C638 PolarHBondContact O-SG 3.25Å; L635-C638 HydrophobicContact CD1-CB 4.43Å; L635-C638 PolarHBondContact O-N 3.33Å; A636-C638 VanDerWaalsContact C-N 3.33Å; A636-C638 PolarHBondContact O-N 3.34Å; C638-L642 VanDerWaalsContact O-CB 3.25Å; C638-L642 WeakPolarHBondContact O-CB 3.44Å; C638-L642 PolarHBondContact O-N 2.92Å
639	I	88.3	Confident	86.8	Confident	38 Å²	38	52.4 Å²	52.4	20%	0.195	28%	0.283	C	S	.	.	H	α-helix	trans	-65.5	-44	178.5	-69.9	166	0	0	0	110.8	A574 Y578 L635 A636 L642 A643	A574-I639 HydrophobicContact CB-CG2 4.19Å; Y578-I639 HydrophobicContact CD1-CD1 4.5Å; Y578-I639 HydrophobicContact CD2-CD1 3.51Å; Y578-I639 HydrophobicContact CE2-CD1 3.66Å; Y578-I639 HydrophobicContact CG-CD1 3.97Å; L635-I639 HydrophobicContact CD1-CD1 4.17Å; L635-I639 HydrophobicContact CD1-CG1 4.27Å; L635-I639 HydrophobicContact CG-CD1 4.02Å; L635-I639 WeakPolarHBondContact O-CB 3.11Å; L635-I639 VanDerWaalsContact O-CG1 3.29Å; L635-I639 WeakPolarHBondContact O-CG1 3.22Å; L635-I639 PolarHBondContact O-N 2.77Å; A636-I639 PolarHBondContact O-N 3.34Å; I639-L642 PolarHBondContact O-N 3.01Å; I639-A643 WeakPolarHBondContact O-CB 3.45Å; I639-A643 PolarHBondContact O-N 3.26Å
640	G	90.1	Very high	86.8	Confident	7 Å²	7	52.8 Å²	52.8	7%	0.072	29%	0.289	C	S	.	.	H	α-helix	trans	-64.4	-41.8	177.5	0	0	0	0	0	113.2	G571 A636 F644	G571-G640 WeakPolarHBondContact CA-O 3.19Å; G571-G640 WeakPolarHBondContact O-CA 3.33Å; A636-G640 PolarHBondContact O-N 2.85Å; G640-F644 VanDerWaalsContact O-CB 3.28Å; G640-F644 WeakPolarHBondContact O-CB 3.46Å; G640-F644 PolarHBondContact O-N 2.92Å
641	L	92.2	Very high	86.8	Confident	117 Å²	117	50.5 Å²	50.5	61%	0.613	29%	0.286	S	S	*	.	H	α-helix	trans	-64.6	-40.1	173.1	-82.5	165.2	0	0	0	112.2	S637 F644 A645	S637-L641 VanDerWaalsContact O-CB 3.31Å; S637-L641 WeakPolarHBondContact O-CB 3.36Å; S637-L641 WeakPolarHBondContact O-CG 3.1Å; S637-L641 PolarHBondContact O-N 3.27Å; L641-F644 PolarHBondContact O-N 3.05Å; L641-A645 VanDerWaalsContact O-CB 3.31Å; L641-A645 WeakPolarHBondContact O-CB 3.46Å; L641-A645 PolarHBondContact O-N 2.97Å
642	L	90.1	Very high	86.3	Confident	115 Å²	115	50 Å²	50	60%	0.602	28%	0.283	S	S	*	.	H	α-helix	trans	-70.7	-38.2	179.4	-171.9	133.3	0	0	0	111.8	C638 I639 A645 L646	C638-L642 VanDerWaalsContact O-CB 3.25Å; C638-L642 WeakPolarHBondContact O-CB 3.44Å; C638-L642 PolarHBondContact O-N 2.92Å; I639-L642 PolarHBondContact O-N 3.01Å; L642-A645 PolarHBondContact O-N 3.42Å; L642-L646 HydrophobicContact CD2-CD1 3.7Å; L642-L646 HydrophobicContact CG-CD1 4.38Å; L642-L646 WeakPolarHBondContact O-CB 3.29Å; L642-L646 WeakPolarHBondContact O-CG 3.42Å; L642-L646 PolarHBondContact O-N 3.02Å
643	A	86.4	Confident	85.8	Confident	7 Å²	7	52 Å²	52	6%	0.058	30%	0.296	C	S	.	.	H	α-helix	trans	-65.6	-43.2	171.2	0	0	0	0	0	112.3	A574 I639 L646 H647 I735	A574-A643 HydrophobicContact CB-CB 3.62Å; I639-A643 WeakPolarHBondContact O-CB 3.45Å; I639-A643 PolarHBondContact O-N 3.26Å; A643-L646 PolarHBondContact O-N 3.1Å; A643-H647 VanDerWaalsContact O-CB 3.32Å; A643-H647 WeakPolarHBondContact O-CB 3.43Å; A643-H647 PolarHBondContact O-N 3.41Å; A643-I735 HydrophobicContact CB-CD1 3.94Å
644	F	89	Confident	85.5	Confident	65 Å²	65	52.4 Å²	52.4	29%	0.285	30%	0.3	S	S	.	.	H	α-helix	trans	-58.2	-48.7	172.7	170.7	-98.1	0	0	0	111.6	V564 A568 G640 L641 H647 C648	V564-F644 HydrophobicContact CG1-CE2 4.11Å; V564-F644 HydrophobicContact CG1-CZ 4.06Å; A568-F644 HydrophobicContact CB-CD2 4.39Å; A568-F644 HydrophobicContact CB-CE2 4.32Å; G640-F644 VanDerWaalsContact O-CB 3.28Å; G640-F644 WeakPolarHBondContact O-CB 3.46Å; G640-F644 PolarHBondContact O-N 2.92Å; L641-F644 PolarHBondContact O-N 3.05Å; F644-H647 PolarHBondContact O-N 2.7Å; F644-C648 WeakPolarHBondContact O-CB 3.18Å; F644-C648 PolarHBondContact O-N 2.7Å
645	A	89.1	Confident	85.1	Confident	57 Å²	57	54.8 Å²	54.8	47%	0.471	31%	0.311	S	S	.	.	H	α-helix	trans	-65.3	-42.6	180	0	0	0	0	0	112.3	L641 L642 C648 S649	L641-A645 VanDerWaalsContact O-CB 3.31Å; L641-A645 WeakPolarHBondContact O-CB 3.46Å; L641-A645 PolarHBondContact O-N 2.97Å; L642-A645 PolarHBondContact O-N 3.42Å; A645-C648 PolarHBondContact O-N 3.4Å; A645-S649 WeakPolarHBondContact O-CB 3.45Å; A645-S649 PolarHBondContact O-N 3.21Å
646	L	85.4	Confident	84.4	Confident	65 Å²	65	54.6 Å²	54.6	34%	0.34	31%	0.313	S	S	.	.	H	α-helix	trans	-64.4	-38.7	175.8	-85.4	166.9	0	0	0	112.6	L642 A643 S649 F652	L642-L646 HydrophobicContact CD2-CD1 3.7Å; L642-L646 HydrophobicContact CG-CD1 4.38Å; L642-L646 WeakPolarHBondContact O-CB 3.29Å; L642-L646 WeakPolarHBondContact O-CG 3.42Å; L642-L646 PolarHBondContact O-N 3.02Å; A643-L646 PolarHBondContact O-N 3.1Å; L646-S649 PolarHBondContact O-OG 3.21Å; L646-F652 HydrophobicContact CB-CE2 4.02Å
647	H	82.6	Confident	83.7	Confident	12 Å²	12	59.8 Å²	59.8	6%	0.056	34%	0.344	C	S	.	.	H	α-helix	trans	-73.2	-38.9	176.1	-175.5	-67.1	0	0	0	112.6	S561 F566 S567 C570 A643 F644 S649 T739	S561-H647 PolarHBondContact O-CE1 2.78Å; F566-H647 AromaticContact CD1-CE1 3.59Å; F566-H647 AromaticContact CD1-NE2 3.42Å; F566-H647 WeakPolarHBondContact CD1-NE2 3.44Å; F566-H647 AromaticContact CE1-NE2 3.76Å; S567-H647 WeakPolarHBondContact CA-ND1 3.48Å; S567-H647 WeakPolarHBondContact CB-ND1 3.37Å; S567-H647 PolarHBondContact OG-ND1 2.68Å; C570-H647 HydrophobicContact CB-CB 4.42Å; C570-H647 PolarHBondContact SG-CD2 2.89Å; A643-H647 VanDerWaalsContact O-CB 3.32Å; A643-H647 WeakPolarHBondContact O-CB 3.43Å; A643-H647 PolarHBondContact O-N 3.41Å; F644-H647 PolarHBondContact O-N 2.7Å; H647-S649 PolarHBondContact O-N 3.47Å; H647-T739 VanDerWaalsContact CD2-CG2 3.47Å; H647-T739 WeakPolarHBondContact CD2-CG2 3.49Å; H647-T739 WeakPolarHBondContact NE2-CG2 3.21Å
648	C	84.8	Confident	83.2	Confident	67 Å²	67	62.7 Å²	62.7	45%	0.453	36%	0.356	S	S	.	.	H	α-helix	trans	-69.2	-25.7	176.3	-170.8	0	0	0	0	111.6	F644 A645	F644-C648 WeakPolarHBondContact O-CB 3.18Å; F644-C648 PolarHBondContact O-N 2.7Å; A645-C648 PolarHBondContact O-N 3.4Å
649	S	84.4	Confident	82.4	Confident	42 Å²	42	61.2 Å²	61.2	29%	0.294	35%	0.345	S	S	.	.	S	Bend	trans	-73.2	142.4	165.2	85.4	0	0	0	0	111.3	A645 L646 H647 V651	A645-S649 WeakPolarHBondContact O-CB 3.45Å; A645-S649 PolarHBondContact O-N 3.21Å; L646-S649 PolarHBondContact O-OG 3.21Å; H647-S649 PolarHBondContact O-N 3.47Å; S649-V651 PolarHBondContact O-N 3.16Å; S649-V651 WeakPolarHBondContact OG-CB 3.3Å; S649-V651 VanDerWaalsContact OG-CG2 3.27Å; S649-V651 WeakPolarHBondContact OG-CG2 3.42Å
650	T	78.4	Confident	81.5	Confident	76 Å²	76	59.8 Å²	59.8	47%	0.466	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.1	8.6	-178.4	54.1	0	0	0	0	114.5	F652 T653 M654	T650-F652 PolarHBondContact O-N 2.63Å; T650-T653 CarbonylContact O-C 3.6Å; T650-T653 PolarHBondContact O-N 2.95Å; T650-T653 VanDerWaalsContact O-N 3.08Å; T650-T653 PolarHBondContact O-OG1 2.93Å; T650-M654 WeakPolarHBondContact O-CB 3.44Å; T650-M654 VanDerWaalsContact O-CG 3.23Å; T650-M654 WeakPolarHBondContact O-CG 3.16Å; T650-M654 PolarHBondContact O-N 3.44Å
651	V	81.8	Confident	80.7	Confident	50 Å²	50	64.9 Å²	64.9	30%	0.303	36%	0.36	S	S	.	.	H	α-helix	trans	-56.4	-44.5	-174.9	167.2	0	0	0	0	112.9	S649 T653 M654 F655 L659	S649-V651 PolarHBondContact O-N 3.16Å; S649-V651 WeakPolarHBondContact OG-CB 3.3Å; S649-V651 VanDerWaalsContact OG-CG2 3.27Å; S649-V651 WeakPolarHBondContact OG-CG2 3.42Å; V651-T653 VanDerWaalsContact C-N 3.31Å; V651-T653 PolarHBondContact O-N 2.88Å; V651-M654 PolarHBondContact O-N 2.97Å; V651-F655 PolarHBondContact O-N 3.14Å; V651-L659 HydrophobicContact CG1-CD1 3.6Å; V651-L659 WeakPolarHBondContact O-CD1 3.42Å
652	F	73.7	Confident	80.1	Confident	6 Å²	6	61.2 Å²	61.2	3%	0.026	35%	0.35	C	S	.	.	H	α-helix	trans	-68	-27.2	177.9	-72.2	-76.4	0	0	0	114	L646 T650 L659 T732 I735 T739 N740	L646-F652 HydrophobicContact CB-CE2 4.02Å; T650-F652 PolarHBondContact O-N 2.63Å; F652-L659 HydrophobicContact CD1-CB 4.16Å; F652-L659 HydrophobicContact CD1-CD1 3.91Å; F652-L659 HydrophobicContact CE1-CB 4.39Å; F652-L659 HydrophobicContact CE1-CD1 4.35Å; F652-L659 HydrophobicContact CG-CD1 4.37Å; F652-T732 HydrophobicContact CE1-CG2 3.93Å; F652-T732 HydrophobicContact CZ-CG2 4.27Å; F652-I735 HydrophobicContact CD1-CG2 4.49Å; F652-I735 HydrophobicContact CD2-CG2 4.08Å; F652-I735 HydrophobicContact CE1-CB 4.34Å; F652-I735 HydrophobicContact CE1-CG2 4.03Å; F652-I735 HydrophobicContact CE2-CG2 3.56Å; F652-I735 HydrophobicContact CZ-CB 4.01Å; F652-I735 HydrophobicContact CZ-CG2 3.54Å; F652-T739 HydrophobicContact CB-CG2 4.17Å; F652-N740 PolarHBondContact O-ND2 3.33Å
653	T	72.9	Confident	79.7	Confident	54 Å²	54	58.4 Å²	58.4	33%	0.331	33%	0.333	S	S	.	.	H	α-helix	trans	-87.2	-24.3	175.1	44.7	0	0	0	0	113.4	Q562 T650 V651	Q562-T653 PolarHBondContact NE2-OG1 2.85Å; Q562-T653 VanDerWaalsContact NE2-OG1 3.09Å; T650-T653 CarbonylContact O-C 3.6Å; T650-T653 PolarHBondContact O-N 2.95Å; T650-T653 VanDerWaalsContact O-N 3.08Å; T650-T653 PolarHBondContact O-OG1 2.93Å; V651-T653 VanDerWaalsContact C-N 3.31Å; V651-T653 PolarHBondContact O-N 2.88Å
654	M	81.2	Confident	79.1	Confident	128 Å²	128	58.4 Å²	58.4	63%	0.631	33%	0.333	S	S	*	.	H	α-helix	trans	-86.1	-29.8	178.4	-67.9	-71.1	-75.3	0	0	112.7	T650 V651	T650-M654 WeakPolarHBondContact O-CB 3.44Å; T650-M654 VanDerWaalsContact O-CG 3.23Å; T650-M654 WeakPolarHBondContact O-CG 3.16Å; T650-M654 PolarHBondContact O-N 3.44Å; V651-M654 PolarHBondContact O-N 2.97Å
655	F	80.2	Confident	78.7	Confident	105 Å²	105	58.9 Å²	58.9	46%	0.461	34%	0.338	S	S	.	.			trans	-125.8	46	-177.7	-56.1	-73.6	0	0	0	114.3	V651 T657 I658 L659	V651-F655 PolarHBondContact O-N 3.14Å; F655-T657 VanDerWaalsContact C-N 3.3Å; F655-T657 PolarHBondContact O-N 3.15Å; F655-I658 HydrophobicContact CB-CB 4.4Å; F655-I658 HydrophobicContact CD1-CD1 4.24Å; F655-I658 PolarHBondContact O-N 3.22Å; F655-I658 VanDerWaalsContact O-N 3.08Å; F655-L659 HydrophobicContact CB-CD1 4.02Å; F655-L659 HydrophobicContact CB-CG 4.46Å; F655-L659 PolarHBondContact O-N 3.12Å
656	P	71.9	Confident	78.5	Confident	48 Å²	48	57.4 Å²	57.4	31%	0.312	33%	0.326	S	S	.	.	H	α-helix	trans	-61.8	-35.3	-173.5	27.2	-36.2	0	0	0	112.9	G660	P656-G660 WeakPolarHBondContact O-CA 3.45Å; P656-G660 PolarHBondContact O-N 3.2Å
657	T	74.8	Confident	78.4	Confident	109 Å²	109	55.3 Å²	55.3	67%	0.669	32%	0.315	S	S	*	.	I	π-helix	trans	-67.8	-33.6	175.5	33.9	0	0	0	0	113.1	F655 F661 G662	F655-T657 VanDerWaalsContact C-N 3.3Å; F655-T657 PolarHBondContact O-N 3.15Å; T657-F661 WeakPolarHBondContact O-CA 3.2Å; T657-F661 WeakPolarHBondContact O-CB 3.31Å; T657-F661 PolarHBondContact O-N 3.05Å; T657-G662 PolarHBondContact O-N 3.49Å
658	I	78.6	Confident	78.4	Confident	97 Å²	97	56.7 Å²	56.7	50%	0.497	33%	0.325	S	S	.	.	I	π-helix	trans	-80.9	-48.4	179.9	-60.1	176.4	0	0	0	110.3	F655 G662 F663	F655-I658 HydrophobicContact CB-CB 4.4Å; F655-I658 HydrophobicContact CD1-CD1 4.24Å; F655-I658 PolarHBondContact O-N 3.22Å; F655-I658 VanDerWaalsContact O-N 3.08Å; I658-G662 VanDerWaalsContact O-CA 3.31Å; I658-G662 WeakPolarHBondContact O-CA 3.27Å; I658-G662 PolarHBondContact O-N 3.15Å; I658-G662 VanDerWaalsContact O-N 3.09Å; I658-F663 WeakPolarHBondContact O-CD2 3.37Å; I658-F663 PolarHBondContact O-N 3.34Å
659	L	74.5	Confident	78.5	Confident	20 Å²	20	58.4 Å²	58.4	11%	0.105	33%	0.328	C	S	.	.	I	π-helix	trans	-76	-25.4	-176.3	-67.4	161.1	0	0	0	113.1	V651 F652 F655 F663 T732	V651-L659 HydrophobicContact CG1-CD1 3.6Å; V651-L659 WeakPolarHBondContact O-CD1 3.42Å; F652-L659 HydrophobicContact CD1-CB 4.16Å; F652-L659 HydrophobicContact CD1-CD1 3.91Å; F652-L659 HydrophobicContact CE1-CB 4.39Å; F652-L659 HydrophobicContact CE1-CD1 4.35Å; F652-L659 HydrophobicContact CG-CD1 4.37Å; F655-L659 HydrophobicContact CB-CD1 4.02Å; F655-L659 HydrophobicContact CB-CG 4.46Å; F655-L659 PolarHBondContact O-N 3.12Å; L659-F663 HydrophobicContact CD2-CD2 4.41Å; L659-F663 HydrophobicContact CD2-CE2 4.14Å; L659-F663 HydrophobicContact CD2-CZ 4.29Å; L659-F663 WeakPolarHBondContact O-CB 3.36Å; L659-T732 HydrophobicContact CD2-CG2 3.82Å
660	G	70.1	Confident	78.7	Confident	9 Å²	9	57.8 Å²	57.8	9%	0.093	32%	0.321	C	S	.	.	I	π-helix	trans	-79	-79.2	161.3	0	0	0	0	0	111.1	P656 S664 S736	P656-G660 WeakPolarHBondContact O-CA 3.45Å; P656-G660 PolarHBondContact O-N 3.2Å; G660-S664 WeakPolarHBondContact O-CB 3.44Å; G660-S664 PolarHBondContact O-N 3.39Å; G660-S664 PolarHBondContact O-OG 2.97Å; G660-S736 PolarHBondContact N-OG 2.66Å
661	F	72.8	Confident	78.9	Confident	114 Å²	114	54.8 Å²	54.8	50%	0.5	31%	0.306	S	S	.	.	I	π-helix	trans	-71.7	-45.7	-160.4	-157.6	-87.7	0	0	0	112.6	T657 S664 I665 L745	T657-F661 WeakPolarHBondContact O-CA 3.2Å; T657-F661 WeakPolarHBondContact O-CB 3.31Å; T657-F661 PolarHBondContact O-N 3.05Å; F661-S664 PolarHBondContact O-OG 3.42Å; F661-I665 HydrophobicContact CD1-CD1 3.64Å; F661-I665 HydrophobicContact CD1-CG1 4.42Å; F661-I665 HydrophobicContact CE1-CD1 3.32Å; F661-I665 HydrophobicContact CE1-CG1 4.39Å; F661-I665 HydrophobicContact CZ-CD1 4.13Å; F661-I665 WeakPolarHBondContact O-CB 3.47Å; F661-I665 WeakPolarHBondContact O-CG1 3.44Å; F661-I665 PolarHBondContact O-N 2.91Å; F661-L745 HydrophobicContact CB-CD1 3.86Å; F661-L745 HydrophobicContact CB-CD2 4.35Å; F661-L745 HydrophobicContact CD2-CD1 4.06Å; F661-L745 HydrophobicContact CD2-CD2 3.41Å; F661-L745 VanDerWaalsContact CD2-CD2 3.41Å; F661-L745 HydrophobicContact CD2-CG 3.96Å; F661-L745 HydrophobicContact CE2-CD2 3.9Å; F661-L745 HydrophobicContact CG-CD1 4.36Å; F661-L745 HydrophobicContact CG-CD2 4Å
662	G	79.4	Confident	79.1	Confident	39 Å²	39	54.9 Å²	54.9	40%	0.402	31%	0.312	S	S	.	.	I	π-helix	trans	-62	-49	177	0	0	0	0	0	112.7	T657 I658 I665 A666	T657-G662 PolarHBondContact O-N 3.49Å; I658-G662 VanDerWaalsContact O-CA 3.31Å; I658-G662 WeakPolarHBondContact O-CA 3.27Å; I658-G662 PolarHBondContact O-N 3.15Å; I658-G662 VanDerWaalsContact O-N 3.09Å; G662-I665 PolarHBondContact O-N 3.14Å; G662-A666 WeakPolarHBondContact O-CB 3.26Å; G662-A666 PolarHBondContact O-N 2.98Å
663	F	81.7	Confident	79.9	Confident	56 Å²	56	56.9 Å²	56.9	25%	0.246	32%	0.324	C	S	.	.	H	α-helix	trans	-69.9	-36.5	-178.7	-87.1	-121.2	0	0	0	113	I658 L659 A666 V667 F729 T732 V733	I658-F663 WeakPolarHBondContact O-CD2 3.37Å; I658-F663 PolarHBondContact O-N 3.34Å; L659-F663 HydrophobicContact CD2-CD2 4.41Å; L659-F663 HydrophobicContact CD2-CE2 4.14Å; L659-F663 HydrophobicContact CD2-CZ 4.29Å; L659-F663 WeakPolarHBondContact O-CB 3.36Å; F663-A666 WeakPolarHBondContact O-CB 3.31Å; F663-A666 PolarHBondContact O-N 2.74Å; F663-V667 WeakPolarHBondContact O-CG2 3.44Å; F663-V667 PolarHBondContact O-N 3.5Å; F663-F729 HydrophobicContact CB-CD1 4.28Å; F663-F729 AromaticContact CD1-CD1 3.51Å; F663-F729 HydrophobicContact CD1-CD1 3.51Å; F663-F729 AromaticContact CD1-CE1 3.68Å; F663-F729 HydrophobicContact CD1-CE1 3.68Å; F663-F729 HydrophobicContact CE1-CD1 4.1Å; F663-F729 AromaticContact CE1-CE1 3.99Å; F663-F729 HydrophobicContact CE1-CE1 3.99Å; F663-F729 HydrophobicContact CG-CD1 4.11Å; F663-F729 HydrophobicContact CG-CE1 4.09Å; F663-T732 HydrophobicContact CD1-CG2 3.64Å; F663-T732 HydrophobicContact CE1-CG2 3.81Å; F663-T732 HydrophobicContact CG-CG2 4.35Å; F663-V733 HydrophobicContact CB-CG2 3.84Å
664	S	74.1	Confident	80.5	Confident	8 Å²	8	54.3 Å²	54.3	6%	0.056	31%	0.308	C	S	.	.	H	α-helix	trans	-70.2	-37.4	174.9	53.8	0	0	0	0	112.6	G660 F661 A666 V667 V668 L745	G660-S664 WeakPolarHBondContact O-CB 3.44Å; G660-S664 PolarHBondContact O-N 3.39Å; G660-S664 PolarHBondContact O-OG 2.97Å; F661-S664 PolarHBondContact O-OG 3.42Å; S664-A666 VanDerWaalsContact C-N 3.32Å; S664-A666 PolarHBondContact O-N 2.73Å; S664-V667 WeakPolarHBondContact O-CB 3.14Å; S664-V667 PolarHBondContact O-N 3.31Å; S664-V668 WeakPolarHBondContact O-CG2 3.47Å; S664-V668 PolarHBondContact O-N 3.35Å; S664-L745 VanDerWaalsContact OG-CD2 3.26Å; S664-L745 WeakPolarHBondContact OG-CD2 3.48Å
665	I	80.3	Confident	80.6	Confident	75 Å²	75	52 Å²	52	39%	0.385	30%	0.296	S	S	.	.	H	α-helix	trans	-61.9	-39.9	168.2	-74	-179.2	0	0	0	111.3	F661 G662 V667 V668 I669	F661-I665 HydrophobicContact CD1-CD1 3.64Å; F661-I665 HydrophobicContact CD1-CG1 4.42Å; F661-I665 HydrophobicContact CE1-CD1 3.32Å; F661-I665 HydrophobicContact CE1-CG1 4.39Å; F661-I665 HydrophobicContact CZ-CD1 4.13Å; F661-I665 WeakPolarHBondContact O-CB 3.47Å; F661-I665 WeakPolarHBondContact O-CG1 3.44Å; F661-I665 PolarHBondContact O-N 2.91Å; G662-I665 PolarHBondContact O-N 3.14Å; I665-V667 VanDerWaalsContact C-N 3.34Å; I665-V667 PolarHBondContact O-N 3.39Å; I665-V668 WeakPolarHBondContact O-CB 3.2Å; I665-V668 PolarHBondContact O-N 3.45Å; I665-V668 VanDerWaalsContact O-N 3.1Å; I665-I669 HydrophobicContact CG2-CD1 3.79Å; I665-I669 HydrophobicContact CG2-CG1 4.43Å; I665-I669 WeakPolarHBondContact O-CG1 3.49Å; I665-I669 PolarHBondContact O-N 3.37Å
666	A	85.4	Confident	80.9	Confident	26 Å²	26	54 Å²	54	22%	0.215	30%	0.301	C	S	.	.	H	α-helix	trans	-61.5	-40.2	173.8	0	0	0	0	0	112.1	G662 F663 S664 V668 I669 I670 F729	G662-A666 WeakPolarHBondContact O-CB 3.26Å; G662-A666 PolarHBondContact O-N 2.98Å; F663-A666 WeakPolarHBondContact O-CB 3.31Å; F663-A666 PolarHBondContact O-N 2.74Å; S664-A666 VanDerWaalsContact C-N 3.32Å; S664-A666 PolarHBondContact O-N 2.73Å; A666-V668 VanDerWaalsContact C-N 3.34Å; A666-V668 PolarHBondContact O-N 2.95Å; A666-I669 PolarHBondContact O-N 2.71Å; A666-I670 VanDerWaalsContact O-CB 3.26Å; A666-I670 WeakPolarHBondContact O-CB 3.26Å; A666-I670 VanDerWaalsContact O-CG1 3.3Å; A666-I670 WeakPolarHBondContact O-CG1 3.37Å; A666-I670 PolarHBondContact O-N 3.21Å; A666-F729 HydrophobicContact CB-CD1 4.16Å; A666-F729 HydrophobicContact CB-CE1 3.52Å; A666-F729 HydrophobicContact CB-CZ 3.87Å
667	V	82.7	Confident	81.7	Confident	20 Å²	20	55.8 Å²	55.8	12%	0.121	31%	0.308	C	S	.	.	H	α-helix	trans	-58.1	-43.1	170	169.6	0	0	0	0	111.5	F663 S664 I665 G671 F729 Y730 V733	F663-V667 WeakPolarHBondContact O-CG2 3.44Å; F663-V667 PolarHBondContact O-N 3.5Å; S664-V667 WeakPolarHBondContact O-CB 3.14Å; S664-V667 PolarHBondContact O-N 3.31Å; I665-V667 VanDerWaalsContact C-N 3.34Å; I665-V667 PolarHBondContact O-N 3.39Å; V667-G671 WeakPolarHBondContact O-CA 3.39Å; V667-G671 PolarHBondContact O-N 3.01Å; V667-F729 HydrophobicContact CG2-CB 3.59Å; V667-F729 HydrophobicContact CG2-CD1 4.4Å; V667-F729 HydrophobicContact CG2-CG 4.21Å; V667-Y730 HydrophobicContact CG1-CD1 4.37Å; V667-Y730 HydrophobicContact CG1-CE1 3.7Å; V667-Y730 HydrophobicContact CG2-CD1 4.49Å; V667-V733 HydrophobicContact CG2-CG2 4.25Å
668	V	81.8	Confident	82.3	Confident	42 Å²	42	51.4 Å²	51.4	26%	0.255	28%	0.281	S	S	.	.	H	α-helix	trans	-61	-49.3	178.1	-175.8	0	0	0	0	111.4	S664 I665 A666 A672 L747	S664-V668 WeakPolarHBondContact O-CG2 3.47Å; S664-V668 PolarHBondContact O-N 3.35Å; I665-V668 WeakPolarHBondContact O-CB 3.2Å; I665-V668 PolarHBondContact O-N 3.45Å; I665-V668 VanDerWaalsContact O-N 3.1Å; A666-V668 VanDerWaalsContact C-N 3.34Å; A666-V668 PolarHBondContact O-N 2.95Å; V668-A672 VanDerWaalsContact O-CB 3.26Å; V668-A672 WeakPolarHBondContact O-CB 3.15Å; V668-A672 PolarHBondContact O-N 3.08Å; V668-L747 HydrophobicContact CB-CD2 4.09Å; V668-L747 HydrophobicContact CG1-CD1 3.85Å; V668-L747 HydrophobicContact CG1-CD2 3.92Å; V668-L747 HydrophobicContact CG1-CG 4.45Å; V668-L747 HydrophobicContact CG2-CB 3.78Å; V668-L747 HydrophobicContact CG2-CD1 3.99Å; V668-L747 HydrophobicContact CG2-CD2 3.85Å; V668-L747 HydrophobicContact CG2-CG 4.07Å
669	I	87.8	Confident	82.6	Confident	102 Å²	102	47 Å²	47	52%	0.523	26%	0.258	S	S	.	.	H	α-helix	trans	-67.7	-46.5	-176.9	-64.4	168.7	0	0	0	110.4	I665 A666 A672 V673	I665-I669 HydrophobicContact CG2-CD1 3.79Å; I665-I669 HydrophobicContact CG2-CG1 4.43Å; I665-I669 WeakPolarHBondContact O-CG1 3.49Å; I665-I669 PolarHBondContact O-N 3.37Å; A666-I669 PolarHBondContact O-N 2.71Å; I669-A672 PolarHBondContact O-N 3.21Å; I669-V673 VanDerWaalsContact O-CG2 3.31Å; I669-V673 WeakPolarHBondContact O-CG2 3.38Å; I669-V673 PolarHBondContact O-N 3.39Å
670	I	88.3	Confident	83.1	Confident	29 Å²	29	47.8 Å²	47.8	15%	0.149	26%	0.261	C	S	.	.	H	α-helix	trans	-65.6	-44	179.2	-70.9	168.7	0	0	0	110.8	A666 A672 V673 A674 L721 E725 F729	A666-I670 VanDerWaalsContact O-CB 3.26Å; A666-I670 WeakPolarHBondContact O-CB 3.26Å; A666-I670 VanDerWaalsContact O-CG1 3.3Å; A666-I670 WeakPolarHBondContact O-CG1 3.37Å; A666-I670 PolarHBondContact O-N 3.21Å; I670-A672 PolarHBondContact O-N 2.99Å; I670-V673 PolarHBondContact O-N 2.93Å; I670-A674 WeakPolarHBondContact O-CB 3.42Å; I670-A674 PolarHBondContact O-N 3.27Å; I670-L721 HydrophobicContact CG1-CD2 4.31Å; I670-L721 HydrophobicContact CG2-CB 4.45Å; I670-L721 HydrophobicContact CG2-CD2 4.14Å; I670-E725 HydrophobicContact CG2-CB 4.24Å; I670-F729 HydrophobicContact CD1-CD2 3.79Å; I670-F729 HydrophobicContact CD1-CE2 3.23Å; I670-F729 HydrophobicContact CD1-CZ 3.82Å
671	G	83.2	Confident	83.9	Confident	14 Å²	14	49.9 Å²	49.9	14%	0.144	27%	0.27	C	S	.	.	H	α-helix	trans	-63.3	-41.1	176.9	0	0	0	0	0	112.6	V667 H675	V667-G671 WeakPolarHBondContact O-CA 3.39Å; V667-G671 PolarHBondContact O-N 3.01Å; G671-H675 WeakPolarHBondContact O-CB 3.44Å; G671-H675 PolarHBondContact O-N 3.45Å
672	A	85.7	Confident	84.4	Confident	52 Å²	52	45.6 Å²	45.6	43%	0.43	25%	0.251	S	S	.	.	I	π-helix	trans	-64.4	-38.9	173.7	0	0	0	0	0	112.3	V668 I669 I670 Y676 L677	V668-A672 VanDerWaalsContact O-CB 3.26Å; V668-A672 WeakPolarHBondContact O-CB 3.15Å; V668-A672 PolarHBondContact O-N 3.08Å; I669-A672 PolarHBondContact O-N 3.21Å; I670-A672 PolarHBondContact O-N 2.99Å; A672-Y676 WeakPolarHBondContact O-CB 3.17Å; A672-Y676 PolarHBondContact O-N 3.44Å; A672-L677 PolarHBondContact O-N 3.26Å
673	V	89.7	Confident	84.5	Confident	47 Å²	47	45.5 Å²	45.5	29%	0.285	24%	0.239	S	C	.	.	I	π-helix	trans	-70.8	-44.3	176.5	171.7	0	0	0	0	111.7	I669 I670 L678 L721	I669-V673 VanDerWaalsContact O-CG2 3.31Å; I669-V673 WeakPolarHBondContact O-CG2 3.38Å; I669-V673 PolarHBondContact O-N 3.39Å; I670-V673 PolarHBondContact O-N 2.93Å; V673-L678 HydrophobicContact CG1-CD1 4.07Å; V673-L678 HydrophobicContact CG1-CG 4.33Å; V673-L678 WeakPolarHBondContact O-CB 3.46Å; V673-L678 WeakPolarHBondContact O-CG 3.21Å; V673-L678 PolarHBondContact O-N 2.92Å; V673-L721 HydrophobicContact CG1-CD1 3.86Å
674	A	86.2	Confident	84.3	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	23%	0.231	C	C	.	.	I	π-helix	trans	-79	-43.2	-173.2	0	0	0	0	0	113.7	I670 P679 F718 L721	I670-A674 WeakPolarHBondContact O-CB 3.42Å; I670-A674 PolarHBondContact O-N 3.27Å; A674-P679 WeakPolarHBondContact O-CD 3.47Å; A674-P679 VanDerWaalsContact O-CG 3.24Å; A674-P679 WeakPolarHBondContact O-CG 3.15Å; A674-F718 WeakPolarHBondContact O-CE2 3.44Å; A674-L721 HydrophobicContact CB-CB 4.42Å
675	H	84.2	Confident	84.5	Confident	81 Å²	81	44.6 Å²	44.6	38%	0.375	24%	0.237	S	C	.	.	I	π-helix	trans	-98.6	-19.2	-174.4	-58.1	-61.3	0	0	0	114.2	G671 E725	G671-H675 WeakPolarHBondContact O-CB 3.44Å; G671-H675 PolarHBondContact O-N 3.45Å; H675-E725 IonicContact CD2-OE1 3.37Å; H675-E725 PolarHBondContact CD2-OE1 2.99Å; H675-E725 IonicContact CE1-OE1 2.78Å; H675-E725 IonicContact CE1-OE2 2.63Å; H675-E725 VanDerWaalsContact NE2-CD 3.33Å; H675-E725 IonicContact NE2-OE1 3.84Å; H675-E725 PolarHBondContact NE2-OE1 3.35Å; H675-E725 IonicContact NE2-OE2 2.7Å; H675-E725 PolarHBondContact NE2-OE2 3.01Å; H675-E725 VanDerWaalsContact NE2-OE2 3.15Å
676	Y	84.8	Confident	84.6	Confident	145 Å²	145	41.1 Å²	41.1	57%	0.569	22%	0.219	S	C	*	.	I	π-helix	trans	-113.2	-61	177.8	-170.4	-95	0	0	0	112.8	A672 Q680	A672-Y676 WeakPolarHBondContact O-CB 3.17Å; A672-Y676 PolarHBondContact O-N 3.44Å; Y676-Q680 HydrophobicContact CD2-CG 4.48Å; Y676-Q680 HydrophobicContact CE2-CG 4.46Å; Y676-Q680 VanDerWaalsContact O-CB 3.31Å; Y676-Q680 WeakPolarHBondContact O-CB 3.23Å; Y676-Q680 WeakPolarHBondContact O-CG 3.47Å; Y676-Q680 PolarHBondContact O-N 3.05Å; Y676-Q680 VanDerWaalsContact O-N 3.08Å
677	L	88.9	Confident	84.3	Confident	87 Å²	87	42.7 Å²	42.7	46%	0.455	23%	0.228	S	C	.	.	I	π-helix	trans	-67.7	-56.7	-169.8	-170.5	66	0	0	0	113.1	A672 Q680 L681	A672-L677 PolarHBondContact O-N 3.26Å; L677-Q680 PolarHBondContact O-N 3.32Å; L677-L681 HydrophobicContact CD1-CD1 4.07Å; L677-L681 HydrophobicContact CD1-CG 4.41Å; L677-L681 HydrophobicContact CG-CD1 3.92Å; L677-L681 VanDerWaalsContact O-CG 3.3Å; L677-L681 WeakPolarHBondContact O-CG 3.36Å; L677-L681 PolarHBondContact O-N 3.01Å
678	L	88	Confident	84.1	Confident	17 Å²	17	44 Å²	44	9%	0.089	23%	0.234	C	C	.	.	H	α-helix	trans	-59	-44.3	-179.9	-79.3	167.8	0	0	0	112.6	V673 R682 L695 F714 F718 L721	V673-L678 HydrophobicContact CG1-CD1 4.07Å; V673-L678 HydrophobicContact CG1-CG 4.33Å; V673-L678 WeakPolarHBondContact O-CB 3.46Å; V673-L678 WeakPolarHBondContact O-CG 3.21Å; V673-L678 PolarHBondContact O-N 2.92Å; L678-R682 WeakPolarHBondContact O-CB 3.5Å; L678-R682 PolarHBondContact O-N 3.47Å; L678-L695 HydrophobicContact CD2-CD1 3.81Å; L678-F714 HydrophobicContact CD2-CB 4.47Å; L678-F718 HydrophobicContact CD1-CB 4.43Å; L678-F718 HydrophobicContact CD1-CD2 4.48Å; L678-L721 HydrophobicContact CD1-CD1 3.8Å
679	P	84.2	Confident	84	Confident	5 Å²	5	46.2 Å²	46.2	3%	0.032	24%	0.24	C	C	.	.	H	α-helix	trans	-62.2	-45.8	175.3	-29.7	40.1	0	0	0	113.4	A674 L681 R682 K683	A674-P679 WeakPolarHBondContact O-CD 3.47Å; A674-P679 VanDerWaalsContact O-CG 3.24Å; A674-P679 WeakPolarHBondContact O-CG 3.15Å; P679-L681 PolarHBondContact O-N 2.85Å; P679-R682 PolarHBondContact O-N 3.26Å; P679-K683 WeakPolarHBondContact O-CG 3.46Å; P679-K683 PolarHBondContact O-N 2.95Å
680	Q	85.1	Confident	83.7	Confident	35 Å²	35	44.1 Å²	44.1	16%	0.164	23%	0.23	C	C	.	.	H	α-helix	trans	-65.4	-38.4	-178.3	-65.9	-83.9	56.6	0	0	112	Y676 L677 R682 P686	Y676-Q680 HydrophobicContact CD2-CG 4.48Å; Y676-Q680 HydrophobicContact CE2-CG 4.46Å; Y676-Q680 VanDerWaalsContact O-CB 3.31Å; Y676-Q680 WeakPolarHBondContact O-CB 3.23Å; Y676-Q680 WeakPolarHBondContact O-CG 3.47Å; Y676-Q680 PolarHBondContact O-N 3.05Å; Y676-Q680 VanDerWaalsContact O-N 3.08Å; L677-Q680 PolarHBondContact O-N 3.32Å; Q680-R682 PolarHBondContact O-N 3.4Å; Q680-P686 WeakPolarHBondContact O-CA 3.25Å; Q680-P686 VanDerWaalsContact O-CB 3.29Å; Q680-P686 WeakPolarHBondContact O-CB 3.26Å
681	L	87.1	Confident	83.1	Confident	53 Å²	53	44.2 Å²	44.2	28%	0.277	23%	0.233	S	C	.	.	H	α-helix	trans	-69.5	-17.7	176.5	-68.2	172.7	0	0	0	114	L677 P679 V694 L695	L677-L681 HydrophobicContact CD1-CD1 4.07Å; L677-L681 HydrophobicContact CD1-CG 4.41Å; L677-L681 HydrophobicContact CG-CD1 3.92Å; L677-L681 VanDerWaalsContact O-CG 3.3Å; L677-L681 WeakPolarHBondContact O-CG 3.36Å; L677-L681 PolarHBondContact O-N 3.01Å; P679-L681 PolarHBondContact O-N 2.85Å; L681-V694 HydrophobicContact CB-CB 4.39Å; L681-V694 HydrophobicContact CD2-CB 3.99Å; L681-V694 HydrophobicContact CD2-CG1 4.25Å; L681-V694 HydrophobicContact CD2-CG2 3.9Å; L681-V694 PolarHBondContact O-N 3.4Å; L681-V694 VanDerWaalsContact O-N 3.1Å; L681-L695 HydrophobicContact CB-CD1 3.84Å; L681-L695 HydrophobicContact CB-CG 4.01Å; L681-L695 PolarHBondContact O-N 2.66Å
682	R	84.4	Confident	82.9	Confident	24 Å²	24	51.2 Å²	51.2	9%	0.091	26%	0.255	C	S	.	.	H	α-helix	trans	-98.9	-24.4	-177.9	-166.7	-179.2	-167	164.2	0	113.9	L678 P679 Q680 E715 L908 G909	L678-R682 WeakPolarHBondContact O-CB 3.5Å; L678-R682 PolarHBondContact O-N 3.47Å; P679-R682 PolarHBondContact O-N 3.26Å; Q680-R682 PolarHBondContact O-N 3.4Å; R682-E715 IonicContact NH2-OE1 2.61Å; R682-E715 PolarHBondContact NH2-OE1 2.92Å; R682-L908 PolarHBondContact NH1-O 2.92Å; R682-L908 PolarHBondContact NH2-O 3.38Å; R682-L908 VanDerWaalsContact NH2-O 3.14Å; R682-G909 VanDerWaalsContact CZ-C 3.48Å; R682-G909 PolarHBondContact NE-O 3.22Å; R682-G909 PolarHBondContact NH1-O 3.36Å; R682-G909 VanDerWaalsContact NH1-O 3.07Å
683	K	80.7	Confident	82.8	Confident	37 Å²	37	49.2 Å²	49.2	16%	0.161	24%	0.238	C	C	.	.	S	Bend	trans	-55	151.9	173.4	-77	178.1	-169.8	177.1	0	111.3	P679 T685 P686 P693 E1001	P679-K683 WeakPolarHBondContact O-CG 3.46Å; P679-K683 PolarHBondContact O-N 2.95Å; K683-T685 VanDerWaalsContact C-N 3.29Å; K683-T685 PolarHBondContact O-N 2.85Å; K683-P686 WeakPolarHBondContact O-CD 3.49Å; K683-P693 WeakPolarHBondContact O-CB 3.15Å; K683-E1001 IonicContact NZ-OE2 2.73Å
684	H	77.6	Confident	82.6	Confident	16 Å²	16	50.9 Å²	50.9	7%	0.074	25%	0.248	C	C	.	.	S	Bend	trans	-58	-41.3	-179.3	-168	-123.1	0	0	0	113	P686 R692 P693 Y700 I1002	H684-P686 WeakPolarHBondContact O-CD 3.41Å; H684-R692 CarbonylContact O-C 3.54Å; H684-P693 WeakPolarHBondContact O-CD 3.5Å; H684-Y700 AromaticContact CD2-CE2 3.91Å; H684-Y700 AromaticContact NE2-CE2 3.93Å; H684-Y700 AromaticContact NE2-CZ 3.93Å; H684-Y700 PolarHBondContact NE2-OH 2.91Å; H684-I1002 HydrophobicContact CB-CG2 4.23Å
685	T	79.1	Confident	82.6	Confident	29 Å²	29	52 Å²	52	18%	0.178	25%	0.254	C	S	.	.	S	Bend	trans	-118.3	87.1	174.2	46.6	0	0	0	0	111.1	K683 C687 I688 L690 V987 M995	K683-T685 VanDerWaalsContact C-N 3.29Å; K683-T685 PolarHBondContact O-N 2.85Å; T685-C687 PolarHBondContact O-N 3.31Å; T685-I688 PolarHBondContact O-N 3.2Å; T685-L690 CarbonylContact C-O 3.46Å; T685-L690 WeakPolarHBondContact CA-O 3.43Å; T685-L690 WeakPolarHBondContact CB-O 3.32Å; T685-V987 HydrophobicContact CG2-CG2 4.31Å; T685-M995 HydrophobicContact CG2-CE 4.2Å; T685-M995 HydrophobicContact CG2-SD 4.48Å
686	P	81.5	Confident	82.6	Confident	3 Å²	3	53.3 Å²	53.3	2%	0.019	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.5	123.8	-178.1	-26.3	34.4	0	0	0	112.2	Q680 K683 H684 I688 F689 L690 R692 V694	Q680-P686 WeakPolarHBondContact O-CA 3.25Å; Q680-P686 VanDerWaalsContact O-CB 3.29Å; Q680-P686 WeakPolarHBondContact O-CB 3.26Å; K683-P686 WeakPolarHBondContact O-CD 3.49Å; H684-P686 WeakPolarHBondContact O-CD 3.41Å; P686-I688 PolarHBondContact O-N 3.33Å; P686-F689 PolarHBondContact O-N 2.99Å; P686-L690 HydrophobicContact CB-CB 4.04Å; P686-L690 HydrophobicContact CB-CD1 3.93Å; P686-L690 HydrophobicContact CG-CB 4.16Å; P686-L690 HydrophobicContact CG-CD1 4.46Å; P686-L690 PolarHBondContact O-N 3.29Å; P686-R692 WeakPolarHBondContact CD-O 3.2Å; P686-V694 HydrophobicContact CG-CG2 4.28Å
687	C	78.6	Confident	82.5	Confident	59 Å²	59	48.2 Å²	48.2	40%	0.399	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.5	22.3	-175.5	-61.1	0	0	0	0	115	T685 F689	T685-C687 PolarHBondContact O-N 3.31Å; C687-F689 HydrophobicContact CB-CD2 4.15Å; C687-F689 WeakPolarHBondContact O-CD2 3.3Å; C687-F689 PolarHBondContact O-N 3.4Å
688	I	79.7	Confident	82.2	Confident	48 Å²	48	50.5 Å²	50.5	25%	0.246	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	67.4	-28.6	-172.9	-50.6	176	0	0	0	113.8	T685 P686 V987 A992 M995 R996	T685-I688 PolarHBondContact O-N 3.2Å; P686-I688 PolarHBondContact O-N 3.33Å; I688-V987 WeakPolarHBondContact O-CG2 3.48Å; I688-A992 HydrophobicContact CG2-CB 3.83Å; I688-M995 HydrophobicContact CG2-CB 4.18Å; I688-M995 HydrophobicContact CG2-SD 3.85Å; I688-R996 HydrophobicContact CD1-CG 3.88Å
689	F	79.8	Confident	81.9	Confident	87 Å²	87	50.3 Å²	50.3	38%	0.382	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-34.2	-177.4	-59.6	-66.6	0	0	0	114.7	P686 C687 F986 V987 W989	P686-F689 PolarHBondContact O-N 2.99Å; C687-F689 HydrophobicContact CB-CD2 4.15Å; C687-F689 WeakPolarHBondContact O-CD2 3.3Å; C687-F689 PolarHBondContact O-N 3.4Å; F689-F986 HydrophobicContact CB-CD1 4.32Å; F689-F986 CarbonylContact O-C 3.6Å; F689-F986 VanDerWaalsContact O-CA 3.29Å; F689-F986 WeakPolarHBondContact O-CA 3.45Å; F689-F986 WeakPolarHBondContact O-CD1 3.42Å; F689-V987 PolarHBondContact O-N 3.4Å; F689-W989 AromaticContact CE1-CH2 3.73Å; F689-W989 HydrophobicContact CE1-CH2 3.73Å; F689-W989 HydrophobicContact CE1-CZ2 4.34Å; F689-W989 AromaticContact CE1-CZ3 3.93Å; F689-W989 HydrophobicContact CE1-CZ3 3.93Å; F689-W989 HydrophobicContact CZ-CH2 4.46Å
690	L	80.9	Confident	81.5	Confident	58 Å²	58	52.7 Å²	52.7	30%	0.304	26%	0.256	S	S	.	.	B	Isolated β-bridge	trans	-89.3	134.5	-179.1	-76.1	160.9	0	0	0	110.5	T685 P686 V694 G985 F986	T685-L690 CarbonylContact C-O 3.46Å; T685-L690 WeakPolarHBondContact CA-O 3.43Å; T685-L690 WeakPolarHBondContact CB-O 3.32Å; P686-L690 HydrophobicContact CB-CB 4.04Å; P686-L690 HydrophobicContact CB-CD1 3.93Å; P686-L690 HydrophobicContact CG-CB 4.16Å; P686-L690 HydrophobicContact CG-CD1 4.46Å; P686-L690 PolarHBondContact O-N 3.29Å; L690-V694 HydrophobicContact CD1-CG2 4.25Å; L690-G985 WeakPolarHBondContact CA-O 3.29Å; L690-F986 HydrophobicContact CD2-CE1 4.49Å; L690-F986 HydrophobicContact CD2-CZ 4.37Å
691	S	76.6	Confident	81	Confident	32 Å²	32	54.5 Å²	54.5	22%	0.224	29%	0.285	C	S	.	.	S	Bend	trans	-87.4	-5	-174.7	62.5	0	0	0	0	114.7	G985	S691-G985 PolarHBondContact N-O 2.89Å; S691-G985 WeakPolarHBondContact OG-CA 3.39Å; S691-G985 PolarHBondContact OG-O 3.28Å
692	R	78.1	Confident	80.5	Confident	161 Å²	161	56.2 Å²	56.2	61%	0.608	29%	0.293	S	S	*	.	S	Bend	trans	-141.8	148.8	177.7	-67.9	-179.1	171.9	168.5	-4.3	110.1	H684 P686	H684-R692 CarbonylContact O-C 3.54Å; P686-R692 WeakPolarHBondContact CD-O 3.2Å
693	P	83	Confident	79.9	Confident	9 Å²	9	64 Å²	64	6%	0.058	33%	0.328	C	S	.	.			trans	-64.1	145.2	175.8	26	-32.3	0	0	0	111.1	K683 H684 K696 Y700	K683-P693 WeakPolarHBondContact O-CB 3.15Å; H684-P693 WeakPolarHBondContact O-CD 3.5Å; P693-K696 HydrophobicContact CG-CG 4.16Å; P693-K696 VanDerWaalsContact O-CE 3.31Å; P693-K696 WeakPolarHBondContact O-CE 3.47Å; P693-K696 WeakPolarHBondContact O-CG 3.45Å; P693-Y700 VanDerWaalsContact CD-CZ 3.44Å; P693-Y700 VanDerWaalsContact CD-OH 3.28Å; P693-Y700 WeakPolarHBondContact CD-OH 3.33Å; P693-Y700 HydrophobicContact CG-CD2 4.06Å; P693-Y700 HydrophobicContact CG-CE1 4.15Å; P693-Y700 HydrophobicContact CG-CE2 3.64Å
694	V	85.4	Confident	79.4	Confident	82 Å²	82	65.9 Å²	65.9	50%	0.497	34%	0.34	S	S	.	.	S	Bend	trans	-78.9	-47.9	174.3	-177.9	0	0	0	0	109.5	L681 P686 L690 K696	L681-V694 HydrophobicContact CB-CB 4.39Å; L681-V694 HydrophobicContact CD2-CB 3.99Å; L681-V694 HydrophobicContact CD2-CG1 4.25Å; L681-V694 HydrophobicContact CD2-CG2 3.9Å; L681-V694 PolarHBondContact O-N 3.4Å; L681-V694 VanDerWaalsContact O-N 3.1Å; P686-V694 HydrophobicContact CG-CG2 4.28Å; L690-V694 HydrophobicContact CD1-CG2 4.25Å; V694-K696 PolarHBondContact O-N 3.34Å; V694-K696 VanDerWaalsContact O-N 3.14Å
695	L	87	Confident	79.3	Confident	25 Å²	25	66 Å²	66	13%	0.131	34%	0.342	C	S	.	.	S	Bend	trans	-87.4	75.2	175.8	-64.7	175.3	0	0	0	110.5	L678 L681 W713 F714	L678-L695 HydrophobicContact CD2-CD1 3.81Å; L681-L695 HydrophobicContact CB-CD1 3.84Å; L681-L695 HydrophobicContact CB-CG 4.01Å; L681-L695 PolarHBondContact O-N 2.66Å; L695-W713 HydrophobicContact CD2-CZ2 4.24Å; L695-F714 HydrophobicContact CB-CD1 4.31Å; L695-F714 HydrophobicContact CB-CD2 4.48Å; L695-F714 HydrophobicContact CB-CE1 4.18Å; L695-F714 HydrophobicContact CB-CE2 4.36Å; L695-F714 HydrophobicContact CB-CG 4.45Å; L695-F714 HydrophobicContact CB-CZ 4.21Å; L695-F714 HydrophobicContact CD1-CB 4.29Å; L695-F714 HydrophobicContact CD1-CD2 4.41Å; L695-F714 HydrophobicContact CD1-CG 4.25Å; L695-F714 HydrophobicContact CD2-CB 4.4Å; L695-F714 HydrophobicContact CD2-CD1 3.97Å; L695-F714 HydrophobicContact CD2-CG 4.24Å
696	K	83.5	Confident	79.1	Confident	107 Å²	107	71.2 Å²	71.2	47%	0.465	37%	0.368	S	S	.	.			trans	-65.5	136.2	176.8	-67.2	169.7	-175.4	169.3	0	111.1	P693 V694 Y700	P693-K696 HydrophobicContact CG-CG 4.16Å; P693-K696 VanDerWaalsContact O-CE 3.31Å; P693-K696 WeakPolarHBondContact O-CE 3.47Å; P693-K696 WeakPolarHBondContact O-CG 3.45Å; V694-K696 PolarHBondContact O-N 3.34Å; V694-K696 VanDerWaalsContact O-N 3.14Å; K696-Y700 HydrophobicContact CB-CD1 4.48Å; K696-Y700 HydrophobicContact CB-CG 4.47Å; K696-Y700 HydrophobicContact CD-CD1 4.02Å; K696-Y700 HydrophobicContact CG-CD1 3.92Å; K696-Y700 HydrophobicContact CG-CE1 4.46Å; K696-Y700 HydrophobicContact CG-CG 4.29Å
697	T	83.6	Confident	78.9	Confident	39 Å²	39	75.2 Å²	75.2	24%	0.239	39%	0.39	C	S	.	.			trans	-68.7	157.6	161.7	52.9	0	0	0	0	109.8	E699 Y700	T697-E699 WeakPolarHBondContact CB-OE2 3.43Å; T697-E699 PolarHBondContact O-N 2.93Å; T697-Y700 WeakPolarHBondContact O-CB 3.45Å; T697-Y700 PolarHBondContact O-N 2.91Å
698	K	83.4	Confident	78.9	Confident	135 Å²	135	76.1 Å²	76.1	59%	0.587	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-25.7	179.1	-179.9	167.8	-180	166.7	0	111.7	M712	K698-M712 HydrophobicContact CB-SD 4.34Å
699	E	81.5	Confident	79	Confident	13 Å²	13	74.7 Å²	74.7	6%	0.061	39%	0.385	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.7	2	-175.4	-53.4	78.4	-172.4	0	0	112.6	T697 G701 V705 K710 R1006 I1008	T697-E699 WeakPolarHBondContact CB-OE2 3.43Å; T697-E699 PolarHBondContact O-N 2.93Å; E699-G701 PolarHBondContact O-N 3.31Å; E699-G701 VanDerWaalsContact O-N 3.11Å; E699-V705 HydrophobicContact CB-CG2 4.45Å; E699-K710 PolarHBondContact OE1-N 2.89Å; E699-R1006 PolarHBondContact O-NH1 3.38Å; E699-I1008 HydrophobicContact CB-CD1 3.72Å; E699-I1008 HydrophobicContact CG-CD1 3.72Å
700	Y	75.6	Confident	79.2	Confident	54 Å²	54	75 Å²	75	21%	0.212	39%	0.386	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-14.9	-177.3	-172.3	-105.4	0	0	0	114.5	H684 P693 K696 T697 R1006	H684-Y700 AromaticContact CD2-CE2 3.91Å; H684-Y700 AromaticContact NE2-CE2 3.93Å; H684-Y700 AromaticContact NE2-CZ 3.93Å; H684-Y700 PolarHBondContact NE2-OH 2.91Å; P693-Y700 VanDerWaalsContact CD-CZ 3.44Å; P693-Y700 VanDerWaalsContact CD-OH 3.28Å; P693-Y700 WeakPolarHBondContact CD-OH 3.33Å; P693-Y700 HydrophobicContact CG-CD2 4.06Å; P693-Y700 HydrophobicContact CG-CE1 4.15Å; P693-Y700 HydrophobicContact CG-CE2 3.64Å; K696-Y700 HydrophobicContact CB-CD1 4.48Å; K696-Y700 HydrophobicContact CB-CG 4.47Å; K696-Y700 HydrophobicContact CD-CD1 4.02Å; K696-Y700 HydrophobicContact CG-CD1 3.92Å; K696-Y700 HydrophobicContact CG-CE1 4.46Å; K696-Y700 HydrophobicContact CG-CG 4.29Å; T697-Y700 WeakPolarHBondContact O-CB 3.45Å; T697-Y700 PolarHBondContact O-N 2.91Å; Y700-R1006 PolarHBondContact O-NH1 3.05Å
701	G	73.4	Confident	79.4	Confident	74 Å²	74	73.5 Å²	73.5	76%	0.763	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-127.4	7	-179.9	0	0	0	0	0	116.3	E699	E699-G701 PolarHBondContact O-N 3.31Å; E699-G701 VanDerWaalsContact O-N 3.11Å
702	L	77.5	Confident	80	Confident	89 Å²	89	74.6 Å²	74.6	47%	0.466	38%	0.382	S	S	.	.			trans	-88.2	141	177.9	-64.6	174	0	0	0	110.7	R1006	L702-R1006 PolarHBondContact O-NH1 3.47Å; L702-R1006 PolarHBondContact O-NH2 2.92Å
703	F	70.9	Confident	80.6	Confident	188 Å²	188	74.9 Å²	74.9	83%	0.825	38%	0.383	S	S	*	.	S	Bend	trans	-75	-63.3	176.6	-174.2	-93.7	0	0	0	111
704	D	71.6	Confident	80.8	Confident	76 Å²	76	74.8 Å²	74.8	41%	0.406	38%	0.382	S	S	.	.	S	Bend	trans	-90.8	154.4	168.7	-94.9	-58.2	0	0	0	111.3	R1278	D704-R1278 VanDerWaalsContact CG-NH1 3.27Å; D704-R1278 IonicContact OD1-NH1 3.92Å; D704-R1278 PolarHBondContact OD1-NH1 3.24Å; D704-R1278 IonicContact OD2-NH1 3.83Å; D704-R1278 PolarHBondContact OD2-NH1 3.09Å; D704-R1278 VanDerWaalsContact OD2-NH1 3.07Å
705	V	75.1	Confident	81.1	Confident	18 Å²	18	71 Å²	71	11%	0.109	36%	0.359	C	S	.	.			trans	-123.9	121.9	175.1	178.7	0	0	0	0	109.7	E699 D707 I1008 F1279	E699-V705 HydrophobicContact CB-CG2 4.45Å; V705-D707 VanDerWaalsContact CG1-O 3.26Å; V705-D707 WeakPolarHBondContact CG1-O 3.45Å; V705-I1008 HydrophobicContact CG1-CD1 4.27Å; V705-I1008 HydrophobicContact CG1-CG2 4.21Å; V705-I1008 HydrophobicContact CG2-CD1 4.38Å; V705-F1279 HydrophobicContact CB-CB 4.31Å; V705-F1279 HydrophobicContact CG1-CB 4.16Å
706	N	74.1	Confident	81.2	Confident	138 Å²	138	76.2 Å²	76.2	74%	0.738	38%	0.377	S	S	*	.			trans	-103.8	-8.4	-174.1	-62.6	-5.9	0	0	0	113.9	F1279	N706-F1279 WeakPolarHBondContact O-CE2 3.46Å
707	D	78.2	Confident	81.5	Confident	88 Å²	88	74.5 Å²	74.5	47%	0.471	37%	0.372	S	S	.	.	S	Bend	trans	-131.3	156.3	-174.8	-80.8	-45.4	0	0	0	111.3	V705 A709 K710	V705-D707 VanDerWaalsContact CG1-O 3.26Å; V705-D707 WeakPolarHBondContact CG1-O 3.45Å; D707-A709 PolarHBondContact O-N 3.35Å; D707-K710 WeakPolarHBondContact OD2-CE 3.46Å; D707-K710 IonicContact OD2-NZ 2.79Å; D707-K710 PolarHBondContact OD2-NZ 3.31Å
708	I	77.4	Confident	81.8	Confident	77 Å²	77	73.3 Å²	73.3	40%	0.395	36%	0.364	S	S	.	.	P	Polyproline II helix	trans	-57.9	134.4	165.4	-51.2	173.6	0	0	0	109.6	K710 F1279	I708-K710 PolarHBondContact O-N 3.04Å; I708-F1279 HydrophobicContact CB-CE1 4.48Å; I708-F1279 HydrophobicContact CG1-CE1 3.7Å; I708-F1279 HydrophobicContact CG1-CZ 3.63Å
709	A	81.7	Confident	82	Confident	18 Å²	18	67.3 Å²	67.3	15%	0.149	34%	0.339	C	S	.	.	P	Polyproline II helix	trans	-47.8	130.3	-177.9	0	0	0	0	0	113.2	D707 R910 I1008 Q1354	D707-A709 PolarHBondContact O-N 3.35Å; A709-R910 PolarHBondContact O-NH2 3.26Å; A709-I1008 HydrophobicContact CB-CB 4.48Å; A709-I1008 HydrophobicContact CB-CD1 4.01Å; A709-Q1354 PolarHBondContact O-NE2 3.44Å; A709-Q1354 PolarHBondContact O-OE1 3.22Å
710	K	84.7	Confident	82.4	Confident	94 Å²	94	73 Å²	73	41%	0.409	36%	0.36	S	S	.	.	P	Polyproline II helix	trans	-90.4	125.5	-166	-72.6	172.5	-178.7	168.4	0	112	E699 D707 I708 M712	E699-K710 PolarHBondContact OE1-N 2.89Å; D707-K710 WeakPolarHBondContact OD2-CE 3.46Å; D707-K710 IonicContact OD2-NZ 2.79Å; D707-K710 PolarHBondContact OD2-NZ 3.31Å; I708-K710 PolarHBondContact O-N 3.04Å; K710-M712 PolarHBondContact O-N 3.14Å; K710-M712 VanDerWaalsContact O-N 3.09Å
711	V	85.1	Confident	83.1	Confident	27 Å²	27	71.8 Å²	71.8	16%	0.164	36%	0.357	C	S	.	.			trans	-58	112.6	-174	-174.9	0	0	0	0	112.3	E715 R716 Q1354 I1358	V711-E715 VanDerWaalsContact CA-OE2 3.26Å; V711-E715 WeakPolarHBondContact CA-OE2 3.49Å; V711-E715 HydrophobicContact CG1-CB 4.46Å; V711-R716 HydrophobicContact CG1-CG 3.74Å; V711-Q1354 HydrophobicContact CG2-CB 4.09Å; V711-Q1354 HydrophobicContact CG2-CG 4.44Å; V711-I1358 HydrophobicContact CG1-CD1 3.81Å; V711-I1358 HydrophobicContact CG2-CD1 4.29Å
712	M	89	Confident	83.6	Confident	54 Å²	54	71.9 Å²	71.9	27%	0.266	34%	0.338	S	S	.	.			trans	-86.1	158.9	179.2	-65	-91	67.5	0	0	112.3	K698 K710 F714 E715 R716	K698-M712 HydrophobicContact CB-SD 4.34Å; K710-M712 PolarHBondContact O-N 3.14Å; K710-M712 VanDerWaalsContact O-N 3.09Å; M712-F714 VanDerWaalsContact C-N 3.32Å; M712-F714 HydrophobicContact CB-CD1 3.93Å; M712-F714 HydrophobicContact CB-CE1 3.52Å; M712-F714 HydrophobicContact CB-CE2 4.33Å; M712-F714 HydrophobicContact CB-CZ 3.75Å; M712-F714 HydrophobicContact CG-CE1 3.98Å; M712-F714 HydrophobicContact CG-CZ 4.07Å; M712-F714 PolarHBondContact O-N 2.93Å; M712-F714 HydrophobicContact SD-CE1 4.45Å; M712-E715 HydrophobicContact CB-CG 4.04Å; M712-E715 PolarHBondContact N-OE2 2.89Å; M712-E715 WeakPolarHBondContact O-CB 3.33Å; M712-E715 PolarHBondContact O-N 2.78Å; M712-E715 VanDerWaalsContact O-N 3.15Å; M712-R716 PolarHBondContact O-N 3.2Å
713	W	90	Very high	84	Confident	167 Å²	167	69.2 Å²	69.2	63%	0.633	33%	0.326	S	S	*	.	H	α-helix	trans	-61.7	-38.4	-175.1	68.4	-93.8	0	0	0	112.8	L695 E715 R716 L717	L695-W713 HydrophobicContact CD2-CZ2 4.24Å; W713-E715 VanDerWaalsContact C-N 3.29Å; W713-E715 PolarHBondContact O-N 3.27Å; W713-R716 PolarHBondContact O-N 2.93Å; W713-L717 HydrophobicContact CZ3-CD2 3.94Å; W713-L717 PolarHBondContact O-N 3.3Å
714	F	89	Confident	84.8	Confident	7 Å²	7	63.4 Å²	63.4	3%	0.031	30%	0.303	C	S	.	.	H	α-helix	trans	-69.7	-24.3	178.8	59	-100.3	0	0	0	112.9	L678 L695 M712 F718	L678-F714 HydrophobicContact CD2-CB 4.47Å; L695-F714 HydrophobicContact CB-CD1 4.31Å; L695-F714 HydrophobicContact CB-CD2 4.48Å; L695-F714 HydrophobicContact CB-CE1 4.18Å; L695-F714 HydrophobicContact CB-CE2 4.36Å; L695-F714 HydrophobicContact CB-CG 4.45Å; L695-F714 HydrophobicContact CB-CZ 4.21Å; L695-F714 HydrophobicContact CD1-CB 4.29Å; L695-F714 HydrophobicContact CD1-CD2 4.41Å; L695-F714 HydrophobicContact CD1-CG 4.25Å; L695-F714 HydrophobicContact CD2-CB 4.4Å; L695-F714 HydrophobicContact CD2-CD1 3.97Å; L695-F714 HydrophobicContact CD2-CG 4.24Å; M712-F714 VanDerWaalsContact C-N 3.32Å; M712-F714 HydrophobicContact CB-CD1 3.93Å; M712-F714 HydrophobicContact CB-CE1 3.52Å; M712-F714 HydrophobicContact CB-CE2 4.33Å; M712-F714 HydrophobicContact CB-CZ 3.75Å; M712-F714 HydrophobicContact CG-CE1 3.98Å; M712-F714 HydrophobicContact CG-CZ 4.07Å; M712-F714 PolarHBondContact O-N 2.93Å; M712-F714 HydrophobicContact SD-CE1 4.45Å; F714-F718 WeakPolarHBondContact O-CB 3.14Å; F714-F718 PolarHBondContact O-N 3.28Å
715	E	90	Very high	85.4	Confident	4 Å²	4	59.9 Å²	59.9	2%	0.019	28%	0.284	C	S	.	.	H	α-helix	trans	-71.8	-39.8	174.6	-49.6	-173	127.8	0	0	110.8	R682 V711 M712 W713 A719 L908 R910	R682-E715 IonicContact NH2-OE1 2.61Å; R682-E715 PolarHBondContact NH2-OE1 2.92Å; V711-E715 VanDerWaalsContact CA-OE2 3.26Å; V711-E715 WeakPolarHBondContact CA-OE2 3.49Å; V711-E715 HydrophobicContact CG1-CB 4.46Å; M712-E715 HydrophobicContact CB-CG 4.04Å; M712-E715 PolarHBondContact N-OE2 2.89Å; M712-E715 WeakPolarHBondContact O-CB 3.33Å; M712-E715 PolarHBondContact O-N 2.78Å; M712-E715 VanDerWaalsContact O-N 3.15Å; W713-E715 VanDerWaalsContact C-N 3.29Å; W713-E715 PolarHBondContact O-N 3.27Å; E715-A719 WeakPolarHBondContact O-CB 3.32Å; E715-A719 PolarHBondContact O-N 3.23Å; E715-L908 HydrophobicContact CB-CB 4.47Å; E715-L908 HydrophobicContact CB-CD2 4.37Å; E715-R910 VanDerWaalsContact CD-NE 3.33Å; E715-R910 WeakPolarHBondContact OE1-CG 3.4Å; E715-R910 IonicContact OE1-CZ 3.8Å; E715-R910 IonicContact OE1-NE 3.14Å; E715-R910 PolarHBondContact OE1-NE 3.48Å; E715-R910 IonicContact OE1-NH2 3.72Å; E715-R910 IonicContact OE2-CZ 2.83Å; E715-R910 IonicContact OE2-NE 3.07Å; E715-R910 PolarHBondContact OE2-NE 3.31Å; E715-R910 IonicContact OE2-NH2 3.96Å; E715-R910 PolarHBondContact OE2-NH2 3.31Å
716	R	90.3	Very high	85.8	Confident	133 Å²	133	61 Å²	61	50%	0.502	29%	0.292	S	S	.	.	H	α-helix	trans	-66.1	-42.4	172.9	-55.9	-178.4	-166.1	-177.2	3.9	110.7	V711 M712 W713 A719 W720	V711-R716 HydrophobicContact CG1-CG 3.74Å; M712-R716 PolarHBondContact O-N 3.2Å; W713-R716 PolarHBondContact O-N 2.93Å; R716-A719 PolarHBondContact O-N 2.87Å; R716-W720 WeakPolarHBondContact O-CB 3.45Å; R716-W720 VanDerWaalsContact O-CD1 3.29Å; R716-W720 PolarHBondContact O-N 3.22Å
717	L	90.2	Very high	86.2	Confident	72 Å²	72	57.3 Å²	57.3	38%	0.377	27%	0.27	S	S	.	.	H	α-helix	trans	-60.3	-47.1	176.1	179.4	61.3	0	0	0	111.4	W713 W720 L721	W713-L717 HydrophobicContact CZ3-CD2 3.94Å; W713-L717 PolarHBondContact O-N 3.3Å; L717-W720 PolarHBondContact O-N 2.86Å; L717-L721 HydrophobicContact CD1-CD1 3.96Å; L717-L721 HydrophobicContact CD1-CG 3.98Å; L717-L721 HydrophobicContact CG-CD1 3.84Å; L717-L721 HydrophobicContact CG-CG 4.32Å; L717-L721 WeakPolarHBondContact O-CB 3.45Å; L717-L721 VanDerWaalsContact O-CG 3.26Å; L717-L721 WeakPolarHBondContact O-CG 3.48Å; L717-L721 PolarHBondContact O-N 3.46Å
718	F	89.7	Confident	86.5	Confident	14 Å²	14	56.4 Å²	56.4	6%	0.061	27%	0.268	C	S	.	.	H	α-helix	trans	-58.2	-49.9	175.8	178.9	-97.7	0	0	0	111.9	A674 L678 F714 W720 L721 H722	A674-F718 WeakPolarHBondContact O-CE2 3.44Å; L678-F718 HydrophobicContact CD1-CB 4.43Å; L678-F718 HydrophobicContact CD1-CD2 4.48Å; F714-F718 WeakPolarHBondContact O-CB 3.14Å; F714-F718 PolarHBondContact O-N 3.28Å; F718-W720 PolarHBondContact O-N 3.45Å; F718-L721 PolarHBondContact O-N 3.29Å; F718-H722 WeakPolarHBondContact O-CB 3.38Å; F718-H722 PolarHBondContact O-N 2.8Å
719	A	87.8	Confident	86.8	Confident	8 Å²	8	54.1 Å²	54.1	7%	0.066	26%	0.255	C	S	.	.	H	α-helix	trans	-62.1	-39.2	178.7	0	0	0	0	0	113	E715 R716 C723 L908	E715-A719 WeakPolarHBondContact O-CB 3.32Å; E715-A719 PolarHBondContact O-N 3.23Å; R716-A719 PolarHBondContact O-N 2.87Å; A719-C723 WeakPolarHBondContact O-CB 3.33Å; A719-C723 PolarHBondContact O-N 3.25Å; A719-L908 HydrophobicContact CB-CD2 4.31Å
720	W	89.4	Confident	86.6	Confident	134 Å²	134	58 Å²	58	51%	0.508	27%	0.266	S	S	.	.	H	α-helix	trans	-71	-44.3	176.1	-87.8	103.2	0	0	0	112.8	R716 L717 F718 H722 C723 I724	R716-W720 WeakPolarHBondContact O-CB 3.45Å; R716-W720 VanDerWaalsContact O-CD1 3.29Å; R716-W720 PolarHBondContact O-N 3.22Å; L717-W720 PolarHBondContact O-N 2.86Å; F718-W720 PolarHBondContact O-N 3.45Å; W720-H722 PolarHBondContact O-N 2.89Å; W720-C723 PolarHBondContact O-N 2.76Å; W720-I724 HydrophobicContact CE3-CD1 4.25Å; W720-I724 HydrophobicContact CE3-CG1 4.36Å; W720-I724 WeakPolarHBondContact O-CD1 3.46Å; W720-I724 WeakPolarHBondContact O-CG1 3.16Å; W720-I724 PolarHBondContact O-N 2.68Å
721	L	89.8	Confident	86.4	Confident	28 Å²	28	55.3 Å²	55.3	15%	0.147	26%	0.259	C	S	.	.	H	α-helix	trans	-56.6	-50.3	176	-75.3	169.6	0	0	0	110.7	I670 V673 A674 L678 L717 F718 C723 I724 E725	I670-L721 HydrophobicContact CG1-CD2 4.31Å; I670-L721 HydrophobicContact CG2-CB 4.45Å; I670-L721 HydrophobicContact CG2-CD2 4.14Å; V673-L721 HydrophobicContact CG1-CD1 3.86Å; A674-L721 HydrophobicContact CB-CB 4.42Å; L678-L721 HydrophobicContact CD1-CD1 3.8Å; L717-L721 HydrophobicContact CD1-CD1 3.96Å; L717-L721 HydrophobicContact CD1-CG 3.98Å; L717-L721 HydrophobicContact CG-CD1 3.84Å; L717-L721 HydrophobicContact CG-CG 4.32Å; L717-L721 WeakPolarHBondContact O-CB 3.45Å; L717-L721 VanDerWaalsContact O-CG 3.26Å; L717-L721 WeakPolarHBondContact O-CG 3.48Å; L717-L721 PolarHBondContact O-N 3.46Å; F718-L721 PolarHBondContact O-N 3.29Å; L721-C723 PolarHBondContact O-N 2.92Å; L721-I724 PolarHBondContact O-N 3.42Å; L721-E725 VanDerWaalsContact O-CB 3.23Å; L721-E725 WeakPolarHBondContact O-CB 3.48Å; L721-E725 PolarHBondContact O-N 2.79Å
722	H	84.6	Confident	86.2	Confident	76 Å²	76	55 Å²	55	35%	0.352	26%	0.257	S	S	.	.	H	α-helix	trans	-67.7	-34	-179.9	-168.9	53.6	0	0	0	112.8	F718 W720 E725 C726	F718-H722 WeakPolarHBondContact O-CB 3.38Å; F718-H722 PolarHBondContact O-N 2.8Å; W720-H722 PolarHBondContact O-N 2.89Å; H722-E725 IonicContact CE1-OE2 3.09Å; H722-E725 IonicContact CG-OE2 3.89Å; H722-E725 IonicContact ND1-OE2 3.39Å; H722-E725 PolarHBondContact ND1-OE2 3.39Å; H722-C726 PolarHBondContact CE1-SG 2.93Å; H722-C726 WeakPolarHBondContact O-CB 3.43Å; H722-C726 PolarHBondContact O-N 2.66Å
723	C	85.6	Confident	85.6	Confident	33 Å²	33	54.1 Å²	54.1	22%	0.223	26%	0.255	C	S	.	.	H	α-helix	trans	-61.8	-47.6	172.8	-173.1	0	0	0	0	111.6	A719 W720 L721 H727 L1359	A719-C723 WeakPolarHBondContact O-CB 3.33Å; A719-C723 PolarHBondContact O-N 3.25Å; W720-C723 PolarHBondContact O-N 2.76Å; L721-C723 PolarHBondContact O-N 2.92Å; C723-H727 WeakPolarHBondContact O-CB 3.3Å; C723-H727 PolarHBondContact O-N 2.87Å; C723-H727 PolarHBondContact O-ND1 3.11Å; C723-L1359 HydrophobicContact CB-CD2 4.31Å
724	I	87.3	Confident	84.9	Confident	65 Å²	65	50.8 Å²	50.8	33%	0.333	25%	0.248	S	C	.	.	H	α-helix	trans	-70.4	-40.6	-179.1	-59.7	162.1	0	0	0	110.7	W720 L721 V728 F729	W720-I724 HydrophobicContact CE3-CD1 4.25Å; W720-I724 HydrophobicContact CE3-CG1 4.36Å; W720-I724 WeakPolarHBondContact O-CD1 3.46Å; W720-I724 WeakPolarHBondContact O-CG1 3.16Å; W720-I724 PolarHBondContact O-N 2.68Å; L721-I724 PolarHBondContact O-N 3.42Å; I724-V728 HydrophobicContact CG2-CB 4.14Å; I724-V728 HydrophobicContact CG2-CG2 4.18Å; I724-V728 WeakPolarHBondContact O-CA 3.27Å; I724-V728 VanDerWaalsContact O-CB 3.3Å; I724-V728 WeakPolarHBondContact O-CB 3.41Å; I724-V728 PolarHBondContact O-N 2.9Å; I724-F729 HydrophobicContact CG2-CD2 3.74Å; I724-F729 HydrophobicContact CG2-CE2 3.51Å; I724-F729 PolarHBondContact O-N 2.84Å; I724-F729 VanDerWaalsContact O-N 3.07Å
725	E	85.5	Confident	84.3	Confident	2 Å²	2	51.1 Å²	51.1	1%	0.009	25%	0.25	C	C	.	.	I	π-helix	trans	-51.6	-57.1	172.6	177.6	-173.3	-151.2	0	0	111.5	I670 H675 L721 H722 F729 Y730	I670-E725 HydrophobicContact CG2-CB 4.24Å; H675-E725 IonicContact CD2-OE1 3.37Å; H675-E725 PolarHBondContact CD2-OE1 2.99Å; H675-E725 IonicContact CE1-OE1 2.78Å; H675-E725 IonicContact CE1-OE2 2.63Å; H675-E725 VanDerWaalsContact NE2-CD 3.33Å; H675-E725 IonicContact NE2-OE1 3.84Å; H675-E725 PolarHBondContact NE2-OE1 3.35Å; H675-E725 IonicContact NE2-OE2 2.7Å; H675-E725 PolarHBondContact NE2-OE2 3.01Å; H675-E725 VanDerWaalsContact NE2-OE2 3.15Å; L721-E725 VanDerWaalsContact O-CB 3.23Å; L721-E725 WeakPolarHBondContact O-CB 3.48Å; L721-E725 PolarHBondContact O-N 2.79Å; H722-E725 IonicContact CE1-OE2 3.09Å; H722-E725 IonicContact CG-OE2 3.89Å; H722-E725 IonicContact ND1-OE2 3.39Å; H722-E725 PolarHBondContact ND1-OE2 3.39Å; E725-F729 PolarHBondContact O-N 2.93Å; E725-Y730 HydrophobicContact CG-CD2 4.14Å; E725-Y730 HydrophobicContact CG-CE2 3.56Å; E725-Y730 PolarHBondContact O-N 2.72Å; E725-Y730 PolarHBondContact OE1-OH 3.04Å
726	C	81.9	Confident	83.6	Confident	41 Å²	41	51.1 Å²	51.1	28%	0.277	25%	0.25	S	S	.	.	I	π-helix	trans	-77.3	-30.3	-173.2	-68.3	0	0	0	0	115.1	H722	H722-C726 PolarHBondContact CE1-SG 2.93Å; H722-C726 WeakPolarHBondContact O-CB 3.43Å; H722-C726 PolarHBondContact O-N 2.66Å
727	H	82.8	Confident	82.6	Confident	62 Å²	62	48 Å²	48	29%	0.287	24%	0.24	S	C	.	.	I	π-helix	trans	-105.7	-16	-173.2	-55.6	85.9	0	0	0	114.1	Y578 C723	Y578-H727 AromaticContact CE2-CD2 3.72Å; Y578-H727 AromaticContact CE2-NE2 3.68Å; C723-H727 WeakPolarHBondContact O-CB 3.3Å; C723-H727 PolarHBondContact O-N 2.87Å; C723-H727 PolarHBondContact O-ND1 3.11Å
728	V	84.7	Confident	81.7	Confident	68 Å²	68	46.6 Å²	46.6	41%	0.412	24%	0.235	S	C	.	.	I	π-helix	trans	-116.1	-61.2	177.8	-172.4	0	0	0	0	110.3	I724 T732	I724-V728 HydrophobicContact CG2-CB 4.14Å; I724-V728 HydrophobicContact CG2-CG2 4.18Å; I724-V728 WeakPolarHBondContact O-CA 3.27Å; I724-V728 VanDerWaalsContact O-CB 3.3Å; I724-V728 WeakPolarHBondContact O-CB 3.41Å; I724-V728 PolarHBondContact O-N 2.9Å; V728-T732 WeakPolarHBondContact O-CB 3.38Å; V728-T732 PolarHBondContact O-N 2.84Å; V728-T732 VanDerWaalsContact O-N 3.16Å; V728-T732 PolarHBondContact O-OG1 3.49Å
729	F	83.4	Confident	80.8	Confident	29 Å²	29	46.7 Å²	46.7	13%	0.127	24%	0.237	C	C	.	.	I	π-helix	trans	-70.4	-51.4	-168.2	-76.2	-69.5	0	0	0	114.1	F663 A666 V667 I670 I724 E725 T732 V733	F663-F729 HydrophobicContact CB-CD1 4.28Å; F663-F729 AromaticContact CD1-CD1 3.51Å; F663-F729 HydrophobicContact CD1-CD1 3.51Å; F663-F729 AromaticContact CD1-CE1 3.68Å; F663-F729 HydrophobicContact CD1-CE1 3.68Å; F663-F729 HydrophobicContact CE1-CD1 4.1Å; F663-F729 AromaticContact CE1-CE1 3.99Å; F663-F729 HydrophobicContact CE1-CE1 3.99Å; F663-F729 HydrophobicContact CG-CD1 4.11Å; F663-F729 HydrophobicContact CG-CE1 4.09Å; A666-F729 HydrophobicContact CB-CD1 4.16Å; A666-F729 HydrophobicContact CB-CE1 3.52Å; A666-F729 HydrophobicContact CB-CZ 3.87Å; V667-F729 HydrophobicContact CG2-CB 3.59Å; V667-F729 HydrophobicContact CG2-CD1 4.4Å; V667-F729 HydrophobicContact CG2-CG 4.21Å; I670-F729 HydrophobicContact CD1-CD2 3.79Å; I670-F729 HydrophobicContact CD1-CE2 3.23Å; I670-F729 HydrophobicContact CD1-CZ 3.82Å; I724-F729 HydrophobicContact CG2-CD2 3.74Å; I724-F729 HydrophobicContact CG2-CE2 3.51Å; I724-F729 PolarHBondContact O-N 2.84Å; I724-F729 VanDerWaalsContact O-N 3.07Å; E725-F729 PolarHBondContact O-N 2.93Å; F729-T732 PolarHBondContact O-N 3.23Å; F729-V733 WeakPolarHBondContact O-CG2 3.48Å; F729-V733 PolarHBondContact O-N 3.37Å
730	Y	78.8	Confident	79.7	Confident	99 Å²	99	48 Å²	48	39%	0.388	24%	0.243	S	C	.	.	H	α-helix	trans	-60.4	-46.7	-179.7	-69.5	-42.5	0	0	0	113.2	V667 E725 T732 V733 I734	V667-Y730 HydrophobicContact CG1-CD1 4.37Å; V667-Y730 HydrophobicContact CG1-CE1 3.7Å; V667-Y730 HydrophobicContact CG2-CD1 4.49Å; E725-Y730 HydrophobicContact CG-CD2 4.14Å; E725-Y730 HydrophobicContact CG-CE2 3.56Å; E725-Y730 PolarHBondContact O-N 2.72Å; E725-Y730 PolarHBondContact OE1-OH 3.04Å; Y730-T732 PolarHBondContact O-N 2.93Å; Y730-V733 PolarHBondContact O-N 2.9Å; Y730-I734 WeakPolarHBondContact O-CB 3.48Å; Y730-I734 WeakPolarHBondContact O-CD1 3.36Å; Y730-I734 VanDerWaalsContact O-CG1 3.26Å; Y730-I734 WeakPolarHBondContact O-CG1 3.37Å; Y730-I734 PolarHBondContact O-N 3.47Å
731	P	80.3	Confident	78	Confident	39 Å²	39	49.7 Å²	49.7	25%	0.253	26%	0.261	S	S	.	.	H	α-helix	trans	-59.4	-45.7	175.3	-25.3	35.6	0	0	0	113	I734 I735	P731-I734 PolarHBondContact O-N 3.36Å; P731-I735 WeakPolarHBondContact O-CB 3.42Å; P731-I735 WeakPolarHBondContact O-CD1 3.11Å; P731-I735 VanDerWaalsContact O-CG1 3.22Å; P731-I735 WeakPolarHBondContact O-CG1 3.44Å; P731-I735 PolarHBondContact O-N 2.92Å
732	T	80.6	Confident	75.4	Confident	20 Å²	20	52.1 Å²	52.1	12%	0.123	28%	0.281	C	S	.	.	H	α-helix	trans	-64.8	-42	-179	-62.4	0	0	0	0	112.4	F652 L659 F663 V728 F729 Y730 S736	F652-T732 HydrophobicContact CE1-CG2 3.93Å; F652-T732 HydrophobicContact CZ-CG2 4.27Å; L659-T732 HydrophobicContact CD2-CG2 3.82Å; F663-T732 HydrophobicContact CD1-CG2 3.64Å; F663-T732 HydrophobicContact CE1-CG2 3.81Å; F663-T732 HydrophobicContact CG-CG2 4.35Å; V728-T732 WeakPolarHBondContact O-CB 3.38Å; V728-T732 PolarHBondContact O-N 2.84Å; V728-T732 VanDerWaalsContact O-N 3.16Å; V728-T732 PolarHBondContact O-OG1 3.49Å; F729-T732 PolarHBondContact O-N 3.23Å; Y730-T732 PolarHBondContact O-N 2.93Å; T732-S736 VanDerWaalsContact O-CB 3.25Å; T732-S736 WeakPolarHBondContact O-CB 3.24Å; T732-S736 PolarHBondContact O-N 3.44Å
733	V	76.4	Confident	73.3	Confident	36 Å²	36	51.4 Å²	51.4	22%	0.218	29%	0.294	C	S	.	.	H	α-helix	trans	-67.4	-41.7	178.2	173.8	0	0	0	0	111.3	F663 V667 F729 Y730 S736 F737	F663-V733 HydrophobicContact CB-CG2 3.84Å; V667-V733 HydrophobicContact CG2-CG2 4.25Å; F729-V733 WeakPolarHBondContact O-CG2 3.48Å; F729-V733 PolarHBondContact O-N 3.37Å; Y730-V733 PolarHBondContact O-N 2.9Å; V733-S736 PolarHBondContact O-N 3.26Å; V733-F737 WeakPolarHBondContact O-CB 3.44Å; V733-F737 PolarHBondContact O-N 2.67Å
734	I	75.2	Confident	71.3	Confident	97 Å²	97	53.2 Å²	53.2	50%	0.497	31%	0.307	S	S	.	.	H	α-helix	trans	-65.6	-44.4	177.7	-67.6	167.4	0	0	0	110.9	Y730 P731 F737 V738	Y730-I734 WeakPolarHBondContact O-CB 3.48Å; Y730-I734 WeakPolarHBondContact O-CD1 3.36Å; Y730-I734 VanDerWaalsContact O-CG1 3.26Å; Y730-I734 WeakPolarHBondContact O-CG1 3.37Å; Y730-I734 PolarHBondContact O-N 3.47Å; P731-I734 PolarHBondContact O-N 3.36Å; I734-F737 PolarHBondContact O-N 2.78Å; I734-V738 WeakPolarHBondContact O-CG2 3.43Å; I734-V738 PolarHBondContact O-N 3.43Å
735	I	77	Confident	69.1	Low	13 Å²	13	51.7 Å²	51.7	7%	0.067	30%	0.299	C	S	.	.	H	α-helix	trans	-63.3	-45	176.3	-67.5	166.6	0	0	0	110.4	A643 F652 P731 F737 V738 T739	A643-I735 HydrophobicContact CB-CD1 3.94Å; F652-I735 HydrophobicContact CD1-CG2 4.49Å; F652-I735 HydrophobicContact CD2-CG2 4.08Å; F652-I735 HydrophobicContact CE1-CB 4.34Å; F652-I735 HydrophobicContact CE1-CG2 4.03Å; F652-I735 HydrophobicContact CE2-CG2 3.56Å; F652-I735 HydrophobicContact CZ-CB 4.01Å; F652-I735 HydrophobicContact CZ-CG2 3.54Å; P731-I735 WeakPolarHBondContact O-CB 3.42Å; P731-I735 WeakPolarHBondContact O-CD1 3.11Å; P731-I735 VanDerWaalsContact O-CG1 3.22Å; P731-I735 WeakPolarHBondContact O-CG1 3.44Å; P731-I735 PolarHBondContact O-N 2.92Å; I735-F737 VanDerWaalsContact C-N 3.28Å; I735-F737 PolarHBondContact O-N 2.88Å; I735-V738 PolarHBondContact O-N 3.47Å; I735-V738 VanDerWaalsContact O-N 3.13Å; I735-T739 PolarHBondContact O-N 3.31Å; I735-T739 PolarHBondContact O-OG1 2.93Å; I735-T739 VanDerWaalsContact O-OG1 3.14Å
736	S	74.5	Confident	67.3	Low	4 Å²	4	55.4 Å²	55.4	3%	0.028	32%	0.316	C	S	.	.	H	α-helix	trans	-58.1	-40.6	176.8	-172.3	0	0	0	0	112.1	G660 T732 V733 T739 N740	G660-S736 PolarHBondContact N-OG 2.66Å; T732-S736 VanDerWaalsContact O-CB 3.25Å; T732-S736 WeakPolarHBondContact O-CB 3.24Å; T732-S736 PolarHBondContact O-N 3.44Å; V733-S736 PolarHBondContact O-N 3.26Å; S736-T739 WeakPolarHBondContact CA-OG1 3.48Å; S736-T739 PolarHBondContact O-N 2.86Å; S736-T739 PolarHBondContact O-OG1 3.18Å; S736-N740 WeakPolarHBondContact O-CB 3.24Å; S736-N740 PolarHBondContact O-N 2.95Å; S736-N740 PolarHBondContact O-ND2 2.78Å
737	F	70.1	Confident	65.4	Low	67 Å²	67	58.3 Å²	58.3	29%	0.294	33%	0.328	S	S	.	.	H	α-helix	trans	-65.1	-43.4	175.6	-170.7	-76	0	0	0	112	V733 I734 I735 T739 L749 L767 I768	V733-F737 WeakPolarHBondContact O-CB 3.44Å; V733-F737 PolarHBondContact O-N 2.67Å; I734-F737 PolarHBondContact O-N 2.78Å; I735-F737 VanDerWaalsContact C-N 3.28Å; I735-F737 PolarHBondContact O-N 2.88Å; F737-T739 VanDerWaalsContact C-N 3.3Å; F737-T739 PolarHBondContact O-N 3.15Å; F737-L749 HydrophobicContact CD2-CD1 4.47Å; F737-L749 HydrophobicContact CE2-CD1 3.81Å; F737-L749 HydrophobicContact CZ-CD1 4.48Å; F737-L767 HydrophobicContact CE2-CD2 4.02Å; F737-L767 HydrophobicContact CZ-CB 4.33Å; F737-L767 HydrophobicContact CZ-CD2 3.96Å; F737-L767 HydrophobicContact CZ-CG 4.45Å; F737-I768 HydrophobicContact CD1-CD1 4.49Å; F737-I768 HydrophobicContact CD1-CG1 4.31Å; F737-I768 HydrophobicContact CE1-CD1 3.91Å; F737-I768 HydrophobicContact CE1-CG1 3.47Å; F737-I768 VanDerWaalsContact CE1-CG1 3.47Å; F737-I768 HydrophobicContact CZ-CG1 4.18Å
738	V	71.1	Confident	63.9	Low	44 Å²	44	59 Å²	59	27%	0.267	34%	0.339	S	S	.	.	H	α-helix	trans	-67	-29.9	178	170.1	0	0	0	0	112.1	F566 M573 I734 I735	F566-V738 HydrophobicContact CE1-CG1 3.8Å; F566-V738 HydrophobicContact CZ-CG1 3.52Å; M573-V738 HydrophobicContact CE-CG2 4.26Å; I734-V738 WeakPolarHBondContact O-CG2 3.43Å; I734-V738 PolarHBondContact O-N 3.43Å; I735-V738 PolarHBondContact O-N 3.47Å; I735-V738 VanDerWaalsContact O-N 3.13Å
739	T	71	Confident	62	Low	15 Å²	15	56.4 Å²	56.4	9%	0.092	32%	0.324	C	S	.	.	H	α-helix	trans	-79.1	-41.6	173.9	46.9	0	0	0	0	114.6	H647 F652 I735 S736 F737	H647-T739 VanDerWaalsContact CD2-CG2 3.47Å; H647-T739 WeakPolarHBondContact CD2-CG2 3.49Å; H647-T739 WeakPolarHBondContact NE2-CG2 3.21Å; F652-T739 HydrophobicContact CB-CG2 4.17Å; I735-T739 PolarHBondContact O-N 3.31Å; I735-T739 PolarHBondContact O-OG1 2.93Å; I735-T739 VanDerWaalsContact O-OG1 3.14Å; S736-T739 WeakPolarHBondContact CA-OG1 3.48Å; S736-T739 PolarHBondContact O-N 2.86Å; S736-T739 PolarHBondContact O-OG1 3.18Å; F737-T739 VanDerWaalsContact C-N 3.3Å; F737-T739 PolarHBondContact O-N 3.15Å
740	N	63.4	Low	60.2	Low	37 Å²	37	55.8 Å²	55.8	20%	0.198	33%	0.325	C	S	.	.			trans	-105.1	96.5	-170.2	-72.1	-65.3	0	0	0	110	F652 S736 S742	F652-N740 PolarHBondContact O-ND2 3.33Å; S736-N740 WeakPolarHBondContact O-CB 3.24Å; S736-N740 PolarHBondContact O-N 2.95Å; S736-N740 PolarHBondContact O-ND2 2.78Å; N740-S742 PolarHBondContact O-N 2.88Å
741	N	53.9	Low	58.8	Low	168 Å²	168	57.6 Å²	57.6	90%	0.898	34%	0.335	S	S	*	.			trans	-72.9	39.4	-175.8	-157.4	16	0	0	0	113.1
742	S	36	Very low	57.2	Low	79 Å²	79	55.8 Å²	55.8	55%	0.552	32%	0.323	S	S	*	.	S	Bend	trans	-133.9	88	-156.9	61.8	0	0	0	0	114.3	N740 S744	N740-S742 PolarHBondContact O-N 2.88Å; S742-S744 VanDerWaalsContact C-N 3.32Å; S742-S744 PolarHBondContact O-N 2.83Å
743	G	39.3	Very low	55.5	Low	61 Å²	61	56.3 Å²	56.3	63%	0.629	33%	0.325	S	S	*	.	S	Bend	trans	73.1	-25.7	138	0	0	0	0	0	120.8
744	S	44.8	Very low	54.4	Low	72 Å²	72	60.2 Å²	60.2	50%	0.503	34%	0.344	S	S	.	.			trans	-160.6	132.9	-174.8	54.7	0	0	0	0	114.4	S742	S742-S744 VanDerWaalsContact C-N 3.32Å; S742-S744 PolarHBondContact O-N 2.83Å
745	L	41.3	Very low	53.3	Low	32 Å²	32	58.5 Å²	58.5	17%	0.168	34%	0.338	C	S	.	.				174.7	165.9	126.1	-96.6	160	0	0	0	114.5	F661 S664 L749	F661-L745 HydrophobicContact CB-CD1 3.86Å; F661-L745 HydrophobicContact CB-CD2 4.35Å; F661-L745 HydrophobicContact CD2-CD1 4.06Å; F661-L745 HydrophobicContact CD2-CD2 3.41Å; F661-L745 VanDerWaalsContact CD2-CD2 3.41Å; F661-L745 HydrophobicContact CD2-CG 3.96Å; F661-L745 HydrophobicContact CE2-CD2 3.9Å; F661-L745 HydrophobicContact CG-CD1 4.36Å; F661-L745 HydrophobicContact CG-CD2 4Å; S664-L745 VanDerWaalsContact OG-CD2 3.26Å; S664-L745 WeakPolarHBondContact OG-CD2 3.48Å; L745-L749 WeakPolarHBondContact O-CB 3.37Å; L745-L749 WeakPolarHBondContact O-CD1 3.47Å
746	F	47.8	Very low	52	Low	81 Å²	81	58.8 Å²	58.8	36%	0.355	34%	0.34	S	S	.	.			trans	-150.4	116.1	-139	-130.5	-127.5	0	0	0	117.2	L749 G750 L753	F746-L749 HydrophobicContact CD2-CB 4.08Å; F746-L749 HydrophobicContact CD2-CD2 3.98Å; F746-L749 HydrophobicContact CE2-CB 4.39Å; F746-L749 HydrophobicContact CE2-CD2 3.94Å; F746-L749 WeakPolarHBondContact CE2-O 3.29Å; F746-L749 VanDerWaalsContact CZ-O 3.28Å; F746-L749 WeakPolarHBondContact CZ-O 3.39Å; F746-G750 VanDerWaalsContact CE1-CA 3.41Å; F746-G750 WeakPolarHBondContact CE1-O 3.14Å; F746-G750 VanDerWaalsContact CZ-C 3.47Å; F746-G750 WeakPolarHBondContact CZ-O 3.46Å; F746-L753 HydrophobicContact CD2-CB 4.34Å; F746-L753 HydrophobicContact CD2-CD1 4.1Å; F746-L753 HydrophobicContact CD2-CD2 4.2Å; F746-L753 HydrophobicContact CD2-CG 4.44Å; F746-L753 HydrophobicContact CE2-CB 3.26Å; F746-L753 HydrophobicContact CE2-CD1 3.6Å; F746-L753 HydrophobicContact CE2-CD2 3.87Å; F746-L753 HydrophobicContact CE2-CG 3.74Å; F746-L753 HydrophobicContact CZ-CB 3.4Å; F746-L753 HydrophobicContact CZ-CD2 4.42Å; F746-L753 HydrophobicContact CZ-CG 4.32Å
747	L	42.1	Very low	50.7	Low	102 Å²	102	64.8 Å²	64.8	53%	0.534	37%	0.371	S	S	.	.	S	Bend	trans	-163.6	-47.1	139.7	-169.4	72.7	0	0	0	112.9	V668 G750	V668-L747 HydrophobicContact CB-CD2 4.09Å; V668-L747 HydrophobicContact CG1-CD1 3.85Å; V668-L747 HydrophobicContact CG1-CD2 3.92Å; V668-L747 HydrophobicContact CG1-CG 4.45Å; V668-L747 HydrophobicContact CG2-CB 3.78Å; V668-L747 HydrophobicContact CG2-CD1 3.99Å; V668-L747 HydrophobicContact CG2-CD2 3.85Å; V668-L747 HydrophobicContact CG2-CG 4.07Å; L747-G750 WeakPolarHBondContact O-CA 3.31Å; L747-G750 PolarHBondContact O-N 2.89Å
748	S	49.6	Very low	49.9	Very low	75 Å²	75	65.8 Å²	65.8	52%	0.524	39%	0.392	S	S	.	.	S	Bend	trans	-74	-44.6	167.5	55.2	0	0	0	0	110.1	G750	S748-G750 PolarHBondContact O-N 3.42Å
749	L	46.3	Very low	49	Very low	15 Å²	15	68.4 Å²	68.4	8%	0.079	41%	0.405	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.8	-15.5	157.2	-131.7	149.6	0	0	0	112.3	F737 L745 F746 F751 S752 L753 L767	F737-L749 HydrophobicContact CD2-CD1 4.47Å; F737-L749 HydrophobicContact CE2-CD1 3.81Å; F737-L749 HydrophobicContact CZ-CD1 4.48Å; L745-L749 WeakPolarHBondContact O-CB 3.37Å; L745-L749 WeakPolarHBondContact O-CD1 3.47Å; F746-L749 HydrophobicContact CD2-CB 4.08Å; F746-L749 HydrophobicContact CD2-CD2 3.98Å; F746-L749 HydrophobicContact CE2-CB 4.39Å; F746-L749 HydrophobicContact CE2-CD2 3.94Å; F746-L749 WeakPolarHBondContact CE2-O 3.29Å; F746-L749 VanDerWaalsContact CZ-O 3.28Å; F746-L749 WeakPolarHBondContact CZ-O 3.39Å; L749-F751 VanDerWaalsContact C-N 3.27Å; L749-F751 PolarHBondContact O-N 3.41Å; L749-S752 CarbonylContact O-C 3.5Å; L749-S752 VanDerWaalsContact O-CA 3.26Å; L749-S752 WeakPolarHBondContact O-CA 3.07Å; L749-S752 VanDerWaalsContact O-CB 3.25Å; L749-S752 WeakPolarHBondContact O-CB 3.5Å; L749-S752 PolarHBondContact O-N 3.45Å; L749-L753 HydrophobicContact CD2-CD1 3.38Å; L749-L753 PolarHBondContact O-N 3.38Å; L749-L753 VanDerWaalsContact O-N 3.09Å; L749-L767 HydrophobicContact CD1-CD2 4.07Å; L749-L767 HydrophobicContact CD1-CG 4.18Å; L749-L767 HydrophobicContact CD2-CD1 3.83Å; L749-L767 HydrophobicContact CD2-CD2 3.82Å; L749-L767 HydrophobicContact CD2-CG 3.76Å; L749-L767 HydrophobicContact CG-CG 4.37Å
750	G	45.5	Very low	48.1	Very low	15 Å²	15	70.9 Å²	70.9	16%	0.155	43%	0.433	C	S	.	.	H	α-helix	trans	-48.5	-39.1	176.1	0	0	0	0	0	115.4	F746 L747 S748 L754	F746-G750 VanDerWaalsContact CE1-CA 3.41Å; F746-G750 WeakPolarHBondContact CE1-O 3.14Å; F746-G750 VanDerWaalsContact CZ-C 3.47Å; F746-G750 WeakPolarHBondContact CZ-O 3.46Å; L747-G750 WeakPolarHBondContact O-CA 3.31Å; L747-G750 PolarHBondContact O-N 2.89Å; S748-G750 PolarHBondContact O-N 3.42Å; G750-L754 WeakPolarHBondContact O-CB 3.39Å
751	F	49.7	Very low	47.8	Very low	138 Å²	138	73.3 Å²	73.3	61%	0.605	45%	0.453	S	S	*	.	H	α-helix	trans	-82.9	-25.2	172	-115.7	-101.1	0	0	0	112.3	L749 L754 V755	L749-F751 VanDerWaalsContact C-N 3.27Å; L749-F751 PolarHBondContact O-N 3.41Å; F751-L754 PolarHBondContact O-N 3.49Å; F751-V755 WeakPolarHBondContact O-CG2 3.31Å; F751-V755 PolarHBondContact O-N 2.98Å
752	S	45.6	Very low	47.9	Very low	0 Å²	0	68.2 Å²	68.2	0%	0	43%	0.425	C	S	.	.	H	α-helix	trans	-72	-46.9	-176.8	-47.2	0	0	0	0	114	L749 L754 T756	L749-S752 CarbonylContact O-C 3.5Å; L749-S752 VanDerWaalsContact O-CA 3.26Å; L749-S752 WeakPolarHBondContact O-CA 3.07Å; L749-S752 VanDerWaalsContact O-CB 3.25Å; L749-S752 WeakPolarHBondContact O-CB 3.5Å; L749-S752 PolarHBondContact O-N 3.45Å; S752-L754 VanDerWaalsContact C-N 3.35Å; S752-T756 WeakPolarHBondContact O-CG2 3.3Å; S752-T756 PolarHBondContact O-N 2.97Å; S752-T756 PolarHBondContact O-OG1 3.03Å
753	L	44.8	Very low	48.9	Very low	32 Å²	32	67.4 Å²	67.4	17%	0.168	42%	0.419	C	S	.	.	H	α-helix	trans	-72.8	-27.9	166.9	-81.2	53.9	0	0	0	111.2	F746 L749 V755 T756 L757 L767	F746-L753 HydrophobicContact CD2-CB 4.34Å; F746-L753 HydrophobicContact CD2-CD1 4.1Å; F746-L753 HydrophobicContact CD2-CD2 4.2Å; F746-L753 HydrophobicContact CD2-CG 4.44Å; F746-L753 HydrophobicContact CE2-CB 3.26Å; F746-L753 HydrophobicContact CE2-CD1 3.6Å; F746-L753 HydrophobicContact CE2-CD2 3.87Å; F746-L753 HydrophobicContact CE2-CG 3.74Å; F746-L753 HydrophobicContact CZ-CB 3.4Å; F746-L753 HydrophobicContact CZ-CD2 4.42Å; F746-L753 HydrophobicContact CZ-CG 4.32Å; L749-L753 HydrophobicContact CD2-CD1 3.38Å; L749-L753 PolarHBondContact O-N 3.38Å; L749-L753 VanDerWaalsContact O-N 3.09Å; L753-V755 PolarHBondContact O-N 3.04Å; L753-T756 WeakPolarHBondContact CA-OG1 3.34Å; L753-T756 PolarHBondContact O-N 3.37Å; L753-L757 HydrophobicContact CB-CD1 3.89Å; L753-L757 HydrophobicContact CB-CG 3.94Å; L753-L757 HydrophobicContact CD2-CD1 4.06Å; L753-L757 HydrophobicContact CD2-CG 4.46Å; L753-L757 HydrophobicContact CG-CD1 4.27Å; L753-L757 HydrophobicContact CG-CG 4.23Å; L753-L757 WeakPolarHBondContact O-CA 3.5Å; L753-L757 WeakPolarHBondContact O-CB 3.34Å; L753-L757 WeakPolarHBondContact O-CG 3.28Å; L753-L757 PolarHBondContact O-N 2.89Å; L753-L767 HydrophobicContact CD1-CD1 3.78Å; L753-L767 HydrophobicContact CD1-CD2 4.36Å
754	L	53.8	Low	49.7	Very low	118 Å²	118	67.8 Å²	67.8	62%	0.618	42%	0.415	S	S	*	.	H	α-helix	trans	-65	-31	178.7	-153.5	152.3	0	0	0	110.3	G750 F751 S752 A758	G750-L754 WeakPolarHBondContact O-CB 3.39Å; F751-L754 PolarHBondContact O-N 3.49Å; S752-L754 VanDerWaalsContact C-N 3.35Å; L754-A758 WeakPolarHBondContact O-CB 3.31Å; L754-A758 PolarHBondContact O-N 3.34Å
755	V	52.4	Low	50.3	Low	61 Å²	61	68.7 Å²	68.7	37%	0.37	42%	0.422	S	S	.	.	H	α-helix	trans	-70.6	-61.4	161.7	172.6	0	0	0	0	111.8	F751 L753 L757 A758 D759	F751-V755 WeakPolarHBondContact O-CG2 3.31Å; F751-V755 PolarHBondContact O-N 2.98Å; L753-V755 PolarHBondContact O-N 3.04Å; V755-L757 VanDerWaalsContact C-N 3.32Å; V755-L757 PolarHBondContact O-N 3.18Å; V755-A758 PolarHBondContact O-N 3.08Å; V755-A758 VanDerWaalsContact O-N 3.12Å; V755-D759 VanDerWaalsContact O-CB 3.24Å; V755-D759 WeakPolarHBondContact O-CB 3.14Å; V755-D759 PolarHBondContact O-N 2.82Å
756	T	48.8	Very low	51.3	Low	18 Å²	18	69.3 Å²	69.3	11%	0.11	42%	0.424	C	S	.	.	H	α-helix	trans	-71.1	-17	-168.9	65.9	0	0	0	0	115.8	S752 L753 G760 L762 T770	S752-T756 WeakPolarHBondContact O-CG2 3.3Å; S752-T756 PolarHBondContact O-N 2.97Å; S752-T756 PolarHBondContact O-OG1 3.03Å; L753-T756 WeakPolarHBondContact CA-OG1 3.34Å; L753-T756 PolarHBondContact O-N 3.37Å; T756-G760 PolarHBondContact O-N 3.04Å; T756-L762 HydrophobicContact CG2-CB 3.63Å; T756-L762 HydrophobicContact CG2-CD1 3.85Å; T756-L762 HydrophobicContact CG2-CG 4.36Å; T756-T770 HydrophobicContact CG2-CG2 4.28Å
757	L	47.8	Very low	51.9	Low	130 Å²	130	66 Å²	66	68%	0.681	41%	0.41	S	S	*	.	H	α-helix	trans	-86.4	-34.1	168.8	-68.8	175.1	0	0	0	112.6	L753 V755	L753-L757 HydrophobicContact CB-CD1 3.89Å; L753-L757 HydrophobicContact CB-CG 3.94Å; L753-L757 HydrophobicContact CD2-CD1 4.06Å; L753-L757 HydrophobicContact CD2-CG 4.46Å; L753-L757 HydrophobicContact CG-CD1 4.27Å; L753-L757 HydrophobicContact CG-CG 4.23Å; L753-L757 WeakPolarHBondContact O-CA 3.5Å; L753-L757 WeakPolarHBondContact O-CB 3.34Å; L753-L757 WeakPolarHBondContact O-CG 3.28Å; L753-L757 PolarHBondContact O-N 2.89Å; V755-L757 VanDerWaalsContact C-N 3.32Å; V755-L757 PolarHBondContact O-N 3.18Å
758	A	52.9	Low	53	Low	89 Å²	89	66.1 Å²	66.1	74%	0.736	41%	0.41	S	S	*	.	H	α-helix	trans	-72.7	-33.5	174.9	0	0	0	0	0	111.8	L754 V755	L754-A758 WeakPolarHBondContact O-CB 3.31Å; L754-A758 PolarHBondContact O-N 3.34Å; V755-A758 PolarHBondContact O-N 3.08Å; V755-A758 VanDerWaalsContact O-N 3.12Å
759	D	53.2	Low	53.7	Low	99 Å²	99	67.2 Å²	67.2	53%	0.529	41%	0.409	S	S	.	.	S	Bend	trans	-92.2	-11	-177.8	-152.4	23	0	0	0	112.9	V755 S761	V755-D759 VanDerWaalsContact O-CB 3.24Å; V755-D759 WeakPolarHBondContact O-CB 3.14Å; V755-D759 PolarHBondContact O-N 2.82Å; D759-S761 WeakPolarHBondContact O-CB 3.16Å; D759-S761 PolarHBondContact O-N 3.28Å; D759-S761 PolarHBondContact O-OG 2.99Å
760	G	51	Low	54.8	Low	67 Å²	67	67.5 Å²	67.5	69%	0.691	41%	0.412	S	S	*	.			trans	61.4	-10.9	166	0	0	0	0	0	118.6	T756	T756-G760 PolarHBondContact O-N 3.04Å
761	S	58.2	Low	55.9	Low	87 Å²	87	70.8 Å²	70.8	61%	0.608	42%	0.422	S	S	*	.			trans	-115.1	-7.9	-160.3	56.5	0	0	0	0	114.4	D759 P763	D759-S761 WeakPolarHBondContact O-CB 3.16Å; D759-S761 PolarHBondContact O-N 3.28Å; D759-S761 PolarHBondContact O-OG 2.99Å; S761-P763 WeakPolarHBondContact O-CD 3.31Å
762	L	55.6	Low	57	Low	61 Å²	61	68 Å²	68	32%	0.319	41%	0.408	S	S	.	.			trans	-95.6	110.8	-175.5	-83	159.5	0	0	0	111.1	T756	T756-L762 HydrophobicContact CG2-CB 3.63Å; T756-L762 HydrophobicContact CG2-CD1 3.85Å; T756-L762 HydrophobicContact CG2-CG 4.36Å
763	P	57.6	Low	58.2	Low	63 Å²	63	72.2 Å²	72.2	41%	0.409	43%	0.43	S	S	.	.			trans	-68.6	147.2	-177.6	27.6	-35	0	0	0	112.1	S761 S765 H766	S761-P763 WeakPolarHBondContact O-CD 3.31Å; P763-S765 PolarHBondContact O-N 3.25Å; P763-H766 PolarHBondContact O-N 2.87Å
764	A	54.1	Low	59.5	Low	68 Å²	68	71.8 Å²	71.8	56%	0.562	43%	0.429	S	S	*	.	G	3₁₀ helix	trans	-60.2	-12.9	-174.1	0	0	0	0	0	115.1	H766 L767	A764-H766 VanDerWaalsContact C-N 3.26Å; A764-H766 PolarHBondContact O-N 3.34Å; A764-L767 WeakPolarHBondContact O-CB 3.46Å; A764-L767 PolarHBondContact O-N 3.47Å
765	S	58.1	Low	60.4	Low	91 Å²	91	68.4 Å²	68.4	64%	0.636	42%	0.415	S	S	*	.	G	3₁₀ helix	trans	-66.3	-23.2	172.5	50.8	0	0	0	0	113.8	P763	P763-S765 PolarHBondContact O-N 3.25Å
766	H	62.1	Low	61.5	Low	45 Å²	45	67.8 Å²	67.8	21%	0.208	41%	0.409	C	S	.	.	G	3₁₀ helix	trans	-89.7	4.4	179.4	-62.2	-43.3	0	0	0	114.1	R472 P763 A764 I768 L769 T770	R472-H766 PolarHBondContact NH1-NE2 3.48Å; R472-H766 PolarHBondContact NH2-NE2 2.93Å; R472-H766 VanDerWaalsContact NH2-NE2 3.16Å; P763-H766 PolarHBondContact O-N 2.87Å; A764-H766 VanDerWaalsContact C-N 3.26Å; A764-H766 PolarHBondContact O-N 3.34Å; H766-I768 VanDerWaalsContact C-N 3.32Å; H766-I768 PolarHBondContact O-N 3.05Å; H766-L769 WeakPolarHBondContact O-CA 3.42Å; H766-L769 WeakPolarHBondContact O-CB 3.38Å; H766-L769 PolarHBondContact O-N 2.94Å; H766-T770 PolarHBondContact O-N 3.43Å; H766-T770 PolarHBondContact O-OG1 3.35Å
767	L	60.6	Low	63	Low	13 Å²	13	72.3 Å²	72.3	7%	0.068	43%	0.432	C	S	.	.	H	α-helix	trans	-59.3	-37.1	-168.1	-154.1	65	0	0	0	114.4	F737 L749 L753 A764 F771	F737-L767 HydrophobicContact CE2-CD2 4.02Å; F737-L767 HydrophobicContact CZ-CB 4.33Å; F737-L767 HydrophobicContact CZ-CD2 3.96Å; F737-L767 HydrophobicContact CZ-CG 4.45Å; L749-L767 HydrophobicContact CD1-CD2 4.07Å; L749-L767 HydrophobicContact CD1-CG 4.18Å; L749-L767 HydrophobicContact CD2-CD1 3.83Å; L749-L767 HydrophobicContact CD2-CD2 3.82Å; L749-L767 HydrophobicContact CD2-CG 3.76Å; L749-L767 HydrophobicContact CG-CG 4.37Å; L753-L767 HydrophobicContact CD1-CD1 3.78Å; L753-L767 HydrophobicContact CD1-CD2 4.36Å; A764-L767 WeakPolarHBondContact O-CB 3.46Å; A764-L767 PolarHBondContact O-N 3.47Å; L767-F771 WeakPolarHBondContact O-CB 3.31Å; L767-F771 PolarHBondContact O-N 2.79Å
768	I	65.3	Low	64.5	Low	104 Å²	104	70.8 Å²	70.8	53%	0.533	42%	0.424	S	S	.	.	H	α-helix	trans	-64.1	-43.9	174.9	-56.6	174.2	0	0	0	110.6	F737 H766 F771 Y772	F737-I768 HydrophobicContact CD1-CD1 4.49Å; F737-I768 HydrophobicContact CD1-CG1 4.31Å; F737-I768 HydrophobicContact CE1-CD1 3.91Å; F737-I768 HydrophobicContact CE1-CG1 3.47Å; F737-I768 VanDerWaalsContact CE1-CG1 3.47Å; F737-I768 HydrophobicContact CZ-CG1 4.18Å; H766-I768 VanDerWaalsContact C-N 3.32Å; H766-I768 PolarHBondContact O-N 3.05Å; I768-F771 PolarHBondContact O-N 2.8Å; I768-Y772 WeakPolarHBondContact O-CB 2.9Å; I768-Y772 PolarHBondContact O-N 2.85Å
769	L	65.4	Low	65.9	Low	97 Å²	97	68.9 Å²	68.9	51%	0.508	40%	0.404	S	S	.	.	H	α-helix	trans	-66.9	-42.3	-179.4	-174.5	66.6	0	0	0	110.7	H766 Y772 L773	H766-L769 WeakPolarHBondContact O-CA 3.42Å; H766-L769 WeakPolarHBondContact O-CB 3.38Å; H766-L769 PolarHBondContact O-N 2.94Å; L769-Y772 PolarHBondContact O-N 3.25Å; L769-L773 HydrophobicContact CG-CD1 4.19Å; L769-L773 WeakPolarHBondContact O-CB 3.25Å; L769-L773 VanDerWaalsContact O-CG 3.29Å; L769-L773 WeakPolarHBondContact O-CG 3.31Å; L769-L773 PolarHBondContact O-N 3.08Å
770	T	67.7	Low	67.6	Low	22 Å²	22	65.3 Å²	65.3	14%	0.135	38%	0.384	C	S	.	.	H	α-helix	trans	-62.6	-45	174.1	-51.2	0	0	0	0	111.5	T756 H766 Y772 L773 C774	T756-T770 HydrophobicContact CG2-CG2 4.28Å; H766-T770 PolarHBondContact O-N 3.43Å; H766-T770 PolarHBondContact O-OG1 3.35Å; T770-Y772 PolarHBondContact O-N 2.95Å; T770-L773 PolarHBondContact O-N 3.4Å; T770-C774 WeakPolarHBondContact O-CB 3.35Å; T770-C774 PolarHBondContact O-N 3.23Å; T770-C774 PolarHBondContact O-SG 2.95Å
771	F	69	Low	69.3	Low	83 Å²	83	66.4 Å²	66.4	36%	0.364	37%	0.373	S	S	.	.	H	α-helix	trans	-59.4	-46.5	175.1	163.4	-113.3	0	0	0	111.9	L767 I768 C774 S775	L767-F771 WeakPolarHBondContact O-CB 3.31Å; L767-F771 PolarHBondContact O-N 2.79Å; I768-F771 PolarHBondContact O-N 2.8Å; F771-C774 WeakPolarHBondContact O-CB 3.47Å; F771-C774 PolarHBondContact O-N 3.17Å; F771-S775 PolarHBondContact O-N 2.65Å
772	Y	72.1	Confident	70.7	Confident	81 Å²	81	66.7 Å²	66.7	32%	0.318	36%	0.361	S	S	.	.	H	α-helix	trans	-60.2	-47.6	177.2	171.9	-97.4	0	0	0	111.7	I521 I768 L769 T770 C774 S775 M776	I521-Y772 WeakPolarHBondContact CA-OH 3.11Å; I768-Y772 WeakPolarHBondContact O-CB 2.9Å; I768-Y772 PolarHBondContact O-N 2.85Å; L769-Y772 PolarHBondContact O-N 3.25Å; T770-Y772 PolarHBondContact O-N 2.95Å; Y772-C774 PolarHBondContact O-N 3.14Å; Y772-S775 WeakPolarHBondContact O-CA 3.39Å; Y772-S775 WeakPolarHBondContact O-CB 3Å; Y772-S775 PolarHBondContact O-N 2.96Å; Y772-S775 PolarHBondContact O-OG 3.29Å; Y772-M776 HydrophobicContact CD1-SD 4.19Å; Y772-M776 HydrophobicContact CE1-SD 3.59Å; Y772-M776 VanDerWaalsContact CE1-SD 3.59Å; Y772-M776 PolarHBondContact O-N 3.17Å; Y772-M776 VanDerWaalsContact O-N 3.09Å
773	L	72.9	Confident	72.3	Confident	88 Å²	88	64.4 Å²	64.4	46%	0.461	35%	0.349	S	S	.	.	H	α-helix	trans	-62.2	-40.8	175.9	-70.2	169	0	0	0	112.6	L769 T770 S775 M776 L777	L769-L773 HydrophobicContact CG-CD1 4.19Å; L769-L773 WeakPolarHBondContact O-CB 3.25Å; L769-L773 VanDerWaalsContact O-CG 3.29Å; L769-L773 WeakPolarHBondContact O-CG 3.31Å; L769-L773 PolarHBondContact O-N 3.08Å; T770-L773 PolarHBondContact O-N 3.4Å; L773-S775 VanDerWaalsContact C-N 3.28Å; L773-S775 PolarHBondContact O-N 3.09Å; L773-M776 HydrophobicContact CD2-SD 4.43Å; L773-M776 PolarHBondContact O-N 3.09Å; L773-L777 PolarHBondContact O-N 3.23Å; L773-L777 VanDerWaalsContact O-N 3.1Å
774	C	70.4	Confident	74	Confident	22 Å²	22	63.3 Å²	63.3	15%	0.149	34%	0.339	C	S	.	.	H	α-helix	trans	-60.3	-37.5	171.2	-70.5	0	0	0	0	112	T770 F771 Y772 M776 L777 L778	T770-C774 WeakPolarHBondContact O-CB 3.35Å; T770-C774 PolarHBondContact O-N 3.23Å; T770-C774 PolarHBondContact O-SG 2.95Å; F771-C774 WeakPolarHBondContact O-CB 3.47Å; F771-C774 PolarHBondContact O-N 3.17Å; Y772-C774 PolarHBondContact O-N 3.14Å; C774-M776 VanDerWaalsContact C-N 3.32Å; C774-M776 PolarHBondContact O-N 3.32Å; C774-L777 PolarHBondContact O-N 3.41Å; C774-L778 WeakPolarHBondContact O-CB 3.49Å; C774-L778 WeakPolarHBondContact O-CG 3.41Å; C774-L778 PolarHBondContact O-N 3.45Å
775	S	72.7	Confident	75.8	Confident	47 Å²	47	63.6 Å²	63.6	33%	0.329	33%	0.331	S	S	.	.	H	α-helix	trans	-67.9	-29.1	177.5	83.2	0	0	0	0	113.3	F771 Y772 L773 P779	F771-S775 PolarHBondContact O-N 2.65Å; Y772-S775 WeakPolarHBondContact O-CA 3.39Å; Y772-S775 WeakPolarHBondContact O-CB 3Å; Y772-S775 PolarHBondContact O-N 2.96Å; Y772-S775 PolarHBondContact O-OG 3.29Å; L773-S775 VanDerWaalsContact C-N 3.28Å; L773-S775 PolarHBondContact O-N 3.09Å; S775-P779 WeakPolarHBondContact O-CD 3.35Å
776	M	77.1	Confident	77.4	Confident	49 Å²	49	60.6 Å²	60.6	24%	0.241	31%	0.308	C	S	.	.	H	α-helix	trans	-74.3	-36.1	171.5	-60.4	178.4	85.9	0	0	112.2	H520 I521 Y772 L773 C774	H520-M776 HydrophobicContact CB-CE 3.79Å; H520-M776 HydrophobicContact CB-CG 4.46Å; H520-M776 WeakPolarHBondContact O-CG 3.49Å; I521-M776 HydrophobicContact CG1-CE 4.22Å; Y772-M776 HydrophobicContact CD1-SD 4.19Å; Y772-M776 HydrophobicContact CE1-SD 3.59Å; Y772-M776 VanDerWaalsContact CE1-SD 3.59Å; Y772-M776 PolarHBondContact O-N 3.17Å; Y772-M776 VanDerWaalsContact O-N 3.09Å; L773-M776 HydrophobicContact CD2-SD 4.43Å; L773-M776 PolarHBondContact O-N 3.09Å; C774-M776 VanDerWaalsContact C-N 3.32Å; C774-M776 PolarHBondContact O-N 3.32Å
777	L	79	Confident	78.9	Confident	112 Å²	112	58.6 Å²	58.6	59%	0.586	30%	0.298	S	S	*	.	H	α-helix	trans	-76.3	-37.2	-178.2	-81.6	162.7	0	0	0	113.9	L773 C774 K780 L781	L773-L777 PolarHBondContact O-N 3.23Å; L773-L777 VanDerWaalsContact O-N 3.1Å; C774-L777 PolarHBondContact O-N 3.41Å; L777-K780 PolarHBondContact O-N 3.36Å; L777-K780 VanDerWaalsContact O-N 3.16Å; L777-L781 PolarHBondContact O-N 3.33Å
778	L	80.4	Confident	80.3	Confident	98 Å²	98	60.2 Å²	60.2	51%	0.513	31%	0.307	S	S	.	.	H	α-helix	trans	-57.2	-46.1	-176.4	-85.3	163.1	0	0	0	114	C774 K780 L781 R782	C774-L778 WeakPolarHBondContact O-CB 3.49Å; C774-L778 WeakPolarHBondContact O-CG 3.41Å; C774-L778 PolarHBondContact O-N 3.45Å; L778-K780 VanDerWaalsContact C-N 3.35Å; L778-K780 PolarHBondContact O-N 2.83Å; L778-L781 PolarHBondContact O-N 3.48Å; L778-R782 PolarHBondContact O-N 2.92Å
779	P	81.9	Confident	81.5	Confident	49 Å²	49	63.1 Å²	63.1	32%	0.318	31%	0.311	S	S	.	.	H	α-helix	trans	-60.8	-39.6	174.3	-25.7	35.1	0	0	0	113.4	H520 S775 R782 E783	H520-P779 WeakPolarHBondContact NE2-CB 3.42Å; S775-P779 WeakPolarHBondContact O-CD 3.35Å; P779-R782 WeakPolarHBondContact O-CB 3.41Å; P779-R782 PolarHBondContact O-N 2.93Å; P779-E783 PolarHBondContact O-N 3.25Å
780	K	88.3	Confident	82.7	Confident	24 Å²	24	58.6 Å²	58.6	10%	0.104	29%	0.287	C	S	.	.	H	α-helix	trans	-66.5	-39.3	178.8	-60.9	-72.8	176.3	172.5	0	111.2	L777 L778 E783 L784 S829 L830 S832	L777-K780 PolarHBondContact O-N 3.36Å; L777-K780 VanDerWaalsContact O-N 3.16Å; L778-K780 VanDerWaalsContact C-N 3.35Å; L778-K780 PolarHBondContact O-N 2.83Å; K780-E783 PolarHBondContact O-N 3.15Å; K780-L784 PolarHBondContact O-N 3.09Å; K780-S829 VanDerWaalsContact CD-O 3.26Å; K780-S829 WeakPolarHBondContact CD-O 3.46Å; K780-L830 PolarHBondContact NZ-O 3.5Å; K780-S832 PolarHBondContact NZ-OG 3.05Å
781	L	87.6	Confident	83.6	Confident	90 Å²	90	58.4 Å²	58.4	47%	0.471	29%	0.285	S	S	.	.	H	α-helix	trans	-65.7	-37.9	171.9	-176.5	60.2	0	0	0	112.1	L777 L778 L784 I785	L777-L781 PolarHBondContact O-N 3.33Å; L778-L781 PolarHBondContact O-N 3.48Å; L781-L784 HydrophobicContact CD1-CD2 4.3Å; L781-L784 PolarHBondContact O-N 2.79Å; L781-I785 HydrophobicContact CD1-CD1 4.41Å; L781-I785 HydrophobicContact CG-CD1 4.18Å; L781-I785 VanDerWaalsContact O-CG1 3.31Å; L781-I785 WeakPolarHBondContact O-CG1 3.27Å; L781-I785 PolarHBondContact O-N 2.86Å
782	R	87.6	Confident	84.4	Confident	93 Å²	93	60.2 Å²	60.2	35%	0.351	29%	0.293	S	S	.	.	H	α-helix	trans	-62.6	-42.9	172.7	-166.4	-179.4	-171.4	154.4	11.9	111.3	L778 P779 I785 L786 E914 E916	L778-R782 PolarHBondContact O-N 2.92Å; P779-R782 WeakPolarHBondContact O-CB 3.41Å; P779-R782 PolarHBondContact O-N 2.93Å; R782-I785 PolarHBondContact O-N 2.79Å; R782-L786 HydrophobicContact CG-CD1 4.49Å; R782-L786 WeakPolarHBondContact O-CG 2.91Å; R782-L786 PolarHBondContact O-N 2.81Å; R782-E914 IonicContact CZ-OE2 2.75Å; R782-E914 IonicContact NH2-OE2 2.76Å; R782-E914 PolarHBondContact NH2-OE2 2.7Å; R782-E916 WeakPolarHBondContact CD-OE1 3.36Å; R782-E916 WeakPolarHBondContact CD-OE2 3.3Å; R782-E916 IonicContact CZ-OE1 2.71Å; R782-E916 IonicContact CZ-OE2 2.7Å; R782-E916 IonicContact NE-OE1 3.71Å; R782-E916 PolarHBondContact NE-OE1 3.07Å; R782-E916 IonicContact NE-OE2 3.81Å; R782-E916 VanDerWaalsContact NH1-CD 3.31Å; R782-E916 IonicContact NH1-OE1 2.81Å; R782-E916 PolarHBondContact NH1-OE1 3.45Å; R782-E916 IonicContact NH1-OE2 2.69Å
783	E	88.9	Confident	84.9	Confident	13 Å²	13	56.5 Å²	56.5	6%	0.061	28%	0.279	C	S	.	.	H	α-helix	trans	-63.7	-42.2	175.9	-167.1	179	165.9	0	0	112	P779 K780 I785 L786 K787 S832 E1290 R1293	P779-E783 PolarHBondContact O-N 3.25Å; K780-E783 PolarHBondContact O-N 3.15Å; E783-I785 PolarHBondContact O-N 3.31Å; E783-L786 PolarHBondContact O-N 3.08Å; E783-K787 HydrophobicContact CG-CD 4.42Å; E783-K787 WeakPolarHBondContact O-CG 3.41Å; E783-K787 PolarHBondContact O-N 3.45Å; E783-K787 VanDerWaalsContact OE1-CE 3.25Å; E783-K787 WeakPolarHBondContact OE1-CE 3.26Å; E783-K787 IonicContact OE1-NZ 3.22Å; E783-K787 PolarHBondContact OE1-NZ 3.46Å; E783-S832 WeakPolarHBondContact OE1-CA 2.87Å; E783-S832 VanDerWaalsContact OE2-CB 3.25Å; E783-S832 WeakPolarHBondContact OE2-CB 3.47Å; E783-S832 PolarHBondContact OE2-OG 3.07Å; E783-E1290 HydrophobicContact CG-CG 4.2Å; E783-R1293 IonicContact OE1-NH1 3.85Å; E783-R1293 PolarHBondContact OE1-NH1 3.24Å
784	L	92.3	Very high	85.3	Confident	40 Å²	40	53.8 Å²	53.8	21%	0.209	26%	0.263	C	S	.	.	H	α-helix	trans	-57.5	-47.1	173.3	178.3	55.2	0	0	0	111.9	K780 L781 L786 K787 L788 T825	K780-L784 PolarHBondContact O-N 3.09Å; L781-L784 HydrophobicContact CD1-CD2 4.3Å; L781-L784 PolarHBondContact O-N 2.79Å; L784-L786 VanDerWaalsContact C-N 3.33Å; L784-L786 PolarHBondContact O-N 3.18Å; L784-K787 PolarHBondContact O-N 2.82Å; L784-L788 HydrophobicContact CD1-CD1 4.08Å; L784-L788 HydrophobicContact CD1-CG 4.22Å; L784-L788 HydrophobicContact CG-CD1 4.13Å; L784-L788 WeakPolarHBondContact O-CG 3.43Å; L784-L788 PolarHBondContact O-N 3.31Å; L784-T825 HydrophobicContact CD1-CG2 3.77Å
785	I	92.5	Very high	85.6	Confident	75 Å²	75	54.7 Å²	54.7	39%	0.385	27%	0.268	S	S	.	.	H	α-helix	trans	-63.5	-38.2	177.6	-68.4	164.7	0	0	0	111.4	L781 R782 E783 R789	L781-I785 HydrophobicContact CD1-CD1 4.41Å; L781-I785 HydrophobicContact CG-CD1 4.18Å; L781-I785 VanDerWaalsContact O-CG1 3.31Å; L781-I785 WeakPolarHBondContact O-CG1 3.27Å; L781-I785 PolarHBondContact O-N 2.86Å; R782-I785 PolarHBondContact O-N 2.79Å; E783-I785 PolarHBondContact O-N 3.31Å; I785-R789 WeakPolarHBondContact O-CB 3.3Å; I785-R789 VanDerWaalsContact O-CG 3.3Å; I785-R789 WeakPolarHBondContact O-CG 3.1Å; I785-R789 PolarHBondContact O-N 2.82Å
786	L	91.9	Very high	85.8	Confident	28 Å²	28	52.6 Å²	52.6	15%	0.147	25%	0.253	C	S	.	.	H	α-helix	trans	-66	-42	175.7	-73.2	170.8	0	0	0	112.1	R782 E783 L784 R789 F790 N1288 E1290	R782-L786 HydrophobicContact CG-CD1 4.49Å; R782-L786 WeakPolarHBondContact O-CG 2.91Å; R782-L786 PolarHBondContact O-N 2.81Å; E783-L786 PolarHBondContact O-N 3.08Å; L784-L786 VanDerWaalsContact C-N 3.33Å; L784-L786 PolarHBondContact O-N 3.18Å; L786-R789 PolarHBondContact O-N 2.69Å; L786-F790 PolarHBondContact O-N 2.79Å; L786-N1288 PolarHBondContact O-ND2 2.88Å; L786-E1290 HydrophobicContact CB-CG 4.01Å
787	K	93.2	Very high	85.3	Confident	2 Å²	2	53.1 Å²	53.1	1%	0.009	26%	0.26	C	S	.	.	H	α-helix	trans	-64.5	-45.8	175.6	-72.2	175.3	-176.5	174.9	0	112	E783 L784 R789 F790 I791 T825 S828 A833 L835 E1290	E783-K787 HydrophobicContact CG-CD 4.42Å; E783-K787 WeakPolarHBondContact O-CG 3.41Å; E783-K787 PolarHBondContact O-N 3.45Å; E783-K787 VanDerWaalsContact OE1-CE 3.25Å; E783-K787 WeakPolarHBondContact OE1-CE 3.26Å; E783-K787 IonicContact OE1-NZ 3.22Å; E783-K787 PolarHBondContact OE1-NZ 3.46Å; L784-K787 PolarHBondContact O-N 2.82Å; K787-R789 PolarHBondContact O-N 3.18Å; K787-F790 WeakPolarHBondContact O-CB 3.3Å; K787-F790 PolarHBondContact O-N 3.43Å; K787-I791 WeakPolarHBondContact O-CG1 3.4Å; K787-I791 PolarHBondContact O-N 3.14Å; K787-T825 HydrophobicContact CB-CG2 3.65Å; K787-T825 HydrophobicContact CD-CG2 4.49Å; K787-S828 PolarHBondContact NZ-O 3.02Å; K787-S828 PolarHBondContact NZ-OG 3.18Å; K787-A833 PolarHBondContact NZ-O 2.74Å; K787-L835 HydrophobicContact CB-CD1 4.04Å; K787-L835 HydrophobicContact CD-CD1 4.18Å; K787-L835 HydrophobicContact CD-CG 4.3Å; K787-L835 HydrophobicContact CG-CD1 4.17Å; K787-E1290 WeakPolarHBondContact CE-OE2 3.29Å; K787-E1290 HydrophobicContact CG-CB 3.91Å; K787-E1290 HydrophobicContact CG-CG 3.91Å; K787-E1290 IonicContact NZ-OE2 2.93Å
788	L	90.8	Very high	84.9	Confident	48 Å²	48	54 Å²	54	25%	0.251	26%	0.256	S	S	.	.	H	α-helix	trans	-60.1	-44.5	175.6	-70.6	171.4	0	0	0	111.8	L784 F790 I791 F792 T825	L784-L788 HydrophobicContact CD1-CD1 4.08Å; L784-L788 HydrophobicContact CD1-CG 4.22Å; L784-L788 HydrophobicContact CG-CD1 4.13Å; L784-L788 WeakPolarHBondContact O-CG 3.43Å; L784-L788 PolarHBondContact O-N 3.31Å; L788-F790 VanDerWaalsContact C-N 3.33Å; L788-F790 PolarHBondContact O-N 3.45Å; L788-I791 PolarHBondContact O-N 2.99Å; L788-F792 HydrophobicContact CB-CD2 4.35Å; L788-F792 HydrophobicContact CB-CE2 4.05Å; L788-F792 WeakPolarHBondContact O-CB 3.36Å; L788-F792 WeakPolarHBondContact O-CD2 3.49Å; L788-F792 WeakPolarHBondContact O-CG 3.31Å; L788-F792 PolarHBondContact O-N 3.32Å; L788-T825 HydrophobicContact CD2-CG2 4.22Å; L788-T825 HydrophobicContact CG-CG2 4.34Å
789	R	90.5	Very high	84.1	Confident	165 Å²	165	51.1 Å²	51.1	62%	0.623	24%	0.24	S	C	*	.	H	α-helix	trans	-59.4	-40.3	174.5	-76.5	176.5	-178.5	-174.3	2.3	112.9	I785 L786 K787 A793	I785-R789 WeakPolarHBondContact O-CB 3.3Å; I785-R789 VanDerWaalsContact O-CG 3.3Å; I785-R789 WeakPolarHBondContact O-CG 3.1Å; I785-R789 PolarHBondContact O-N 2.82Å; L786-R789 PolarHBondContact O-N 2.69Å; K787-R789 PolarHBondContact O-N 3.18Å; R789-A793 WeakPolarHBondContact O-CB 2.91Å; R789-A793 PolarHBondContact O-N 3.45Å
790	F	90.2	Very high	83.2	Confident	1 Å²	1	50.4 Å²	50.4	0%	0.004	23%	0.233	C	C	.	.	H	α-helix	trans	-63.9	-47.7	175.1	164.8	-127.6	0	0	0	111.9	L786 K787 L788 F792 A793 Y794 F844 C1291 A1294 F1295 V1322	L786-F790 PolarHBondContact O-N 2.79Å; K787-F790 WeakPolarHBondContact O-CB 3.3Å; K787-F790 PolarHBondContact O-N 3.43Å; L788-F790 VanDerWaalsContact C-N 3.33Å; L788-F790 PolarHBondContact O-N 3.45Å; F790-F792 VanDerWaalsContact C-N 3.34Å; F790-F792 PolarHBondContact O-N 2.89Å; F790-A793 PolarHBondContact O-N 2.73Å; F790-Y794 HydrophobicContact CE2-CD2 4.19Å; F790-Y794 HydrophobicContact CE2-CG 4.43Å; F790-Y794 VanDerWaalsContact O-CB 3.31Å; F790-Y794 WeakPolarHBondContact O-CB 3.46Å; F790-Y794 PolarHBondContact O-N 2.92Å; F790-F844 HydrophobicContact CD1-CE1 4.29Å; F790-F844 HydrophobicContact CE1-CD1 4.27Å; F790-F844 AromaticContact CE1-CE1 3.52Å; F790-F844 HydrophobicContact CE1-CE1 3.52Å; F790-F844 HydrophobicContact CE1-CZ 4.32Å; F790-F844 AromaticContact CZ-CE1 3.82Å; F790-F844 HydrophobicContact CZ-CE1 3.82Å; F790-F844 HydrophobicContact CZ-CZ 4.44Å; F790-C1291 HydrophobicContact CB-CB 4.31Å; F790-C1291 HydrophobicContact CD1-CB 4.5Å; F790-C1291 HydrophobicContact CD2-CB 3.43Å; F790-C1291 VanDerWaalsContact CD2-CB 3.43Å; F790-C1291 HydrophobicContact CE2-CB 3.78Å; F790-C1291 WeakPolarHBondContact CE2-SG 3.17Å; F790-C1291 HydrophobicContact CG-CB 3.83Å; F790-C1291 HydrophobicContact CZ-CB 4.44Å; F790-A1294 HydrophobicContact CD1-CB 4.34Å; F790-A1294 HydrophobicContact CE1-CB 3.45Å; F790-A1294 VanDerWaalsContact CE1-CB 3.45Å; F790-A1294 HydrophobicContact CZ-CB 3.81Å; F790-F1295 HydrophobicContact CE2-CE1 4.49Å; F790-F1295 HydrophobicContact CE2-CZ 4.22Å; F790-F1295 HydrophobicContact CZ-CE1 4.43Å; F790-V1322 HydrophobicContact CD2-CG1 4.36Å; F790-V1322 HydrophobicContact CE2-CG1 4.17Å
791	I	86.9	Confident	81.5	Confident	19 Å²	19	53 Å²	53	10%	0.097	26%	0.255	C	S	.	.	H	α-helix	trans	-58.3	-47.1	177.2	-66.4	161.3	0	0	0	110.5	K787 L788 Y794 V795 T821 T825 L835 F844	K787-I791 WeakPolarHBondContact O-CG1 3.4Å; K787-I791 PolarHBondContact O-N 3.14Å; L788-I791 PolarHBondContact O-N 2.99Å; I791-Y794 PolarHBondContact O-N 2.68Å; I791-V795 HydrophobicContact CG2-CG2 4.49Å; I791-V795 WeakPolarHBondContact O-CB 3.01Å; I791-V795 WeakPolarHBondContact O-CG2 3.02Å; I791-V795 PolarHBondContact O-N 3.02Å; I791-T821 HydrophobicContact CD1-CG2 4.18Å; I791-T825 HydrophobicContact CD1-CG2 4.05Å; I791-T825 VanDerWaalsContact CD1-OG1 3.29Å; I791-T825 WeakPolarHBondContact CD1-OG1 3.45Å; I791-L835 HydrophobicContact CD1-CD1 3.9Å; I791-L835 HydrophobicContact CG1-CD1 4.4Å; I791-F844 HydrophobicContact CB-CE2 4.23Å; I791-F844 HydrophobicContact CG1-CD2 4.04Å; I791-F844 HydrophobicContact CG1-CE1 4.45Å; I791-F844 HydrophobicContact CG1-CE2 3.88Å; I791-F844 HydrophobicContact CG1-CG 4.4Å; I791-F844 HydrophobicContact CG1-CZ 4.09Å; I791-F844 HydrophobicContact CG2-CD2 4.35Å; I791-F844 HydrophobicContact CG2-CE2 3.94Å
792	F	84.7	Confident	79.8	Confident	120 Å²	120	56.6 Å²	56.6	53%	0.526	26%	0.262	S	S	.	.	H	α-helix	trans	-64.2	-41.4	179.4	-69.8	-45.2	0	0	0	113.1	L788 F790 A796 W997	L788-F792 HydrophobicContact CB-CD2 4.35Å; L788-F792 HydrophobicContact CB-CE2 4.05Å; L788-F792 WeakPolarHBondContact O-CB 3.36Å; L788-F792 WeakPolarHBondContact O-CD2 3.49Å; L788-F792 WeakPolarHBondContact O-CG 3.31Å; L788-F792 PolarHBondContact O-N 3.32Å; F790-F792 VanDerWaalsContact C-N 3.34Å; F790-F792 PolarHBondContact O-N 2.89Å; F792-A796 PolarHBondContact O-N 2.63Å; F792-W997 HydrophobicContact CB-CE3 4.45Å; F792-W997 HydrophobicContact CB-CZ3 3.85Å
793	A	83.7	Confident	78	Confident	3 Å²	3	55.3 Å²	55.3	3%	0.025	28%	0.278	C	S	.	.	H	α-helix	trans	-66.6	-39.5	174.4	0	0	0	0	0	112.9	R789 F790 W997 A999	R789-A793 WeakPolarHBondContact O-CB 2.91Å; R789-A793 PolarHBondContact O-N 3.45Å; F790-A793 PolarHBondContact O-N 2.73Å; A793-W997 VanDerWaalsContact CB-O 3.25Å; A793-W997 WeakPolarHBondContact CB-O 3.36Å; A793-A999 HydrophobicContact CB-CB 4.49Å
794	Y	80.8	Confident	76.4	Confident	32 Å²	32	57.4 Å²	57.4	13%	0.125	29%	0.294	C	S	.	.	H	α-helix	trans	-72.5	-32.9	-178.1	-169.5	-95.6	0	0	0	113.1	F790 I791 P837 G840 F844 F1295 V1322 R1324	F790-Y794 HydrophobicContact CE2-CD2 4.19Å; F790-Y794 HydrophobicContact CE2-CG 4.43Å; F790-Y794 VanDerWaalsContact O-CB 3.31Å; F790-Y794 WeakPolarHBondContact O-CB 3.46Å; F790-Y794 PolarHBondContact O-N 2.92Å; I791-Y794 PolarHBondContact O-N 2.68Å; Y794-P837 HydrophobicContact CE1-CB 4.24Å; Y794-G840 PolarHBondContact OH-O 3.41Å; Y794-F844 HydrophobicContact CD1-CE2 4.43Å; Y794-F844 AromaticContact CD1-CZ 3.76Å; Y794-F844 HydrophobicContact CD1-CZ 3.76Å; Y794-F844 HydrophobicContact CG-CZ 4.14Å; Y794-F1295 HydrophobicContact CD2-CE1 4.17Å; Y794-F1295 AromaticContact CD2-CZ 3.98Å; Y794-F1295 HydrophobicContact CD2-CZ 3.98Å; Y794-F1295 AromaticContact CE2-CE1 3.67Å; Y794-F1295 HydrophobicContact CE2-CE1 3.67Å; Y794-F1295 AromaticContact CE2-CZ 3.78Å; Y794-F1295 HydrophobicContact CE2-CZ 3.78Å; Y794-V1322 HydrophobicContact CD2-CG2 4.23Å; Y794-R1324 PolarHBondContact OH-NH1 3.31Å
795	V	77.5	Confident	74.7	Confident	40 Å²	40	59 Å²	59	24%	0.242	31%	0.312	C	S	.	.	H	α-helix	trans	-95.4	-7.1	-174.9	-178.7	0	0	0	0	113	I791 P797 Q811 F844	I791-V795 HydrophobicContact CG2-CG2 4.49Å; I791-V795 WeakPolarHBondContact O-CB 3.01Å; I791-V795 WeakPolarHBondContact O-CG2 3.02Å; I791-V795 PolarHBondContact O-N 3.02Å; V795-P797 VanDerWaalsContact O-CD 3.25Å; V795-P797 WeakPolarHBondContact O-CD 3.35Å; V795-P797 VanDerWaalsContact O-N 3.15Å; V795-Q811 PolarHBondContact O-NE2 2.77Å; V795-F844 HydrophobicContact CG2-CE2 4.08Å
796	A	76.7	Confident	73.2	Confident	3 Å²	3	59.9 Å²	59.9	3%	0.025	31%	0.313	C	S	.	.			trans	-49.6	109.1	-175.2	0	0	0	0	0	114.4	F792 W798 Q799 I800 W997	F792-A796 PolarHBondContact O-N 2.63Å; A796-W798 VanDerWaalsContact C-N 3.29Å; A796-W798 HydrophobicContact CB-CZ2 4.15Å; A796-W798 PolarHBondContact O-N 3.12Å; A796-W798 VanDerWaalsContact O-N 3.13Å; A796-Q799 HydrophobicContact CB-CB 4.32Å; A796-Q799 HydrophobicContact CB-CG 4.44Å; A796-Q799 PolarHBondContact O-N 3.01Å; A796-Q799 VanDerWaalsContact O-N 3.1Å; A796-I800 PolarHBondContact O-N 2.95Å; A796-W997 HydrophobicContact CB-CE3 4.18Å
797	P	65.9	Low	71.6	Confident	61 Å²	61	61.6 Å²	61.6	40%	0.396	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61	-26.1	-171.4	-28.2	36.1	0	0	0	116.7	V795 W802	V795-P797 VanDerWaalsContact O-CD 3.25Å; V795-P797 WeakPolarHBondContact O-CD 3.35Å; V795-P797 VanDerWaalsContact O-N 3.15Å; P797-W802 PolarHBondContact O-NE1 3.35Å
798	W	70.2	Confident	70.1	Confident	130 Å²	130	62.9 Å²	62.9	49%	0.492	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.2	-5	-179.9	56.5	88.1	0	0	0	114	A796 W997	A796-W798 VanDerWaalsContact C-N 3.29Å; A796-W798 HydrophobicContact CB-CZ2 4.15Å; A796-W798 PolarHBondContact O-N 3.12Å; A796-W798 VanDerWaalsContact O-N 3.13Å; W798-W997 HydrophobicContact CH2-CD2 4.38Å; W798-W997 HydrophobicContact CH2-CE3 4.35Å; W798-W997 AromaticContact CH2-CH2 3.8Å; W798-W997 HydrophobicContact CH2-CH2 3.8Å; W798-W997 AromaticContact CH2-CZ2 3.83Å; W798-W997 HydrophobicContact CH2-CZ2 3.83Å; W798-W997 HydrophobicContact CH2-CZ3 4.04Å; W798-W997 AromaticContact CZ2-CD2 3.58Å; W798-W997 HydrophobicContact CZ2-CD2 3.58Å; W798-W997 AromaticContact CZ2-CE2 3.5Å; W798-W997 VanDerWaalsContact CZ2-CE2 3.5Å; W798-W997 AromaticContact CZ2-CE3 3.84Å; W798-W997 HydrophobicContact CZ2-CE3 3.84Å; W798-W997 HydrophobicContact CZ2-CG 4.06Å; W798-W997 AromaticContact CZ2-CH2 3.99Å; W798-W997 HydrophobicContact CZ2-CH2 3.99Å; W798-W997 AromaticContact CZ2-CZ2 3.74Å; W798-W997 HydrophobicContact CZ2-CZ2 3.74Å; W798-W997 HydrophobicContact CZ2-CZ3 4.01Å; W798-W997 AromaticContact CZ2-NE1 3.85Å
799	Q	64.5	Low	69	Low	38 Å²	38	68.2 Å²	68.2	18%	0.178	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.2	-6.6	176.8	-63.7	-173.4	-32.2	0	0	113.4	A796 W997 Q1321	A796-Q799 HydrophobicContact CB-CB 4.32Å; A796-Q799 HydrophobicContact CB-CG 4.44Å; A796-Q799 PolarHBondContact O-N 3.01Å; A796-Q799 VanDerWaalsContact O-N 3.1Å; Q799-W997 PolarHBondContact OE1-O 2.76Å; Q799-Q1321 HydrophobicContact CB-CG 4.24Å; Q799-Q1321 PolarHBondContact O-NE2 3.02Å; Q799-Q1321 VanDerWaalsContact O-NE2 3.11Å
800	I	62	Low	67.8	Low	34 Å²	34	61.2 Å²	61.2	17%	0.174	33%	0.33	C	S	.	.	S	Bend	trans	-85.7	120.1	172.5	-74.2	159.3	0	0	0	108.5	A796 W802 Q811	A796-I800 PolarHBondContact O-N 2.95Å; I800-W802 PolarHBondContact O-N 3.07Å; I800-W802 PolarHBondContact O-NE1 3.13Å; I800-Q811 VanDerWaalsContact CD1-NE2 3.32Å
801	S	53	Low	66.8	Low	79 Å²	79	62.3 Å²	62.3	55%	0.552	34%	0.336	S	S	*	.			trans	-66	118.1	167.8	49.3	0	0	0	0	109.5	G803	S801-G803 PolarHBondContact O-N 3.45Å
802	W	51.9	Low	65.9	Low	165 Å²	165	65.1 Å²	65.1	63%	0.625	36%	0.355	S	S	*	.			trans	-71.8	33.1	-172.6	-69.4	70.6	0	0	0	114.5	P797 I800 S804 A808	P797-W802 PolarHBondContact O-NE1 3.35Å; I800-W802 PolarHBondContact O-N 3.07Å; I800-W802 PolarHBondContact O-NE1 3.13Å; W802-S804 PolarHBondContact O-N 3.36Å; W802-A808 HydrophobicContact CE3-CB 3.77Å; W802-A808 HydrophobicContact CZ3-CB 3.54Å
803	G	50.6	Low	65.2	Low	66 Å²	66	63.1 Å²	63.1	68%	0.68	36%	0.355	S	S	*	.			trans	-71.8	-2.4	-175.8	0	0	0	0	0	115.8	S801	S801-G803 PolarHBondContact O-N 3.45Å
804	S	54.9	Low	64.4	Low	57 Å²	57	63.7 Å²	63.7	40%	0.399	36%	0.36	S	S	.	.			trans	-142.9	124.7	175.8	172	0	0	0	0	111.7	W802 F806 H807	W802-S804 PolarHBondContact O-N 3.36Å; S804-F806 PolarHBondContact O-N 2.93Å; S804-F806 VanDerWaalsContact O-N 3.12Å; S804-F806 PolarHBondContact OG-N 2.92Å; S804-H807 PolarHBondContact O-N 2.91Å; S804-H807 VanDerWaalsContact O-N 3.14Å
805	A	56.8	Low	64	Low	73 Å²	73	67.9 Å²	67.9	60%	0.603	38%	0.384	S	S	*	.	H	α-helix	trans	-60.5	-20.1	177.5	0	0	0	0	0	113.4	A808 F809	A805-A808 PolarHBondContact O-N 3.08Å; A805-F809 PolarHBondContact O-N 3.43Å
806	F	60.2	Low	63.7	Low	93 Å²	93	70.5 Å²	70.5	41%	0.408	40%	0.403	S	S	.	.	H	α-helix	trans	-64.7	-41.9	174.9	-178.1	-100	0	0	0	112	S804 F809 A810	S804-F806 PolarHBondContact O-N 2.93Å; S804-F806 VanDerWaalsContact O-N 3.12Å; S804-F806 PolarHBondContact OG-N 2.92Å; F806-F809 PolarHBondContact O-N 2.85Å; F806-A810 HydrophobicContact CE1-CB 4.24Å; F806-A810 WeakPolarHBondContact O-CB 3.48Å; F806-A810 PolarHBondContact O-N 3.12Å
807	H	58	Low	63.9	Low	64 Å²	64	74.6 Å²	74.6	30%	0.296	42%	0.422	S	S	.	.	H	α-helix	trans	-67.2	-38.3	177.8	-73.8	-82.5	0	0	0	111.8	S804 F809 A810 Q811	S804-H807 PolarHBondContact O-N 2.91Å; S804-H807 VanDerWaalsContact O-N 3.14Å; H807-F809 VanDerWaalsContact C-N 3.29Å; H807-F809 PolarHBondContact O-N 3Å; H807-A810 PolarHBondContact O-N 2.79Å; H807-Q811 PolarHBondContact O-N 3.37Å
808	A	62.6	Low	64.6	Low	29 Å²	29	75 Å²	75	24%	0.24	43%	0.426	C	S	.	.	H	α-helix	trans	-57.3	-38.5	175.2	0	0	0	0	0	113.2	W802 A805 P812	W802-A808 HydrophobicContact CE3-CB 3.77Å; W802-A808 HydrophobicContact CZ3-CB 3.54Å; A805-A808 PolarHBondContact O-N 3.08Å; A808-P812 WeakPolarHBondContact O-CD 3.31Å
809	F	66.3	Low	65.2	Low	160 Å²	160	71.8 Å²	71.8	70%	0.702	43%	0.428	S	S	*	.	H	α-helix	trans	-83.9	-33.2	174.5	-86.6	-84.3	0	0	0	113.6	A805 F806 H807 C813	A805-F809 PolarHBondContact O-N 3.43Å; F806-F809 PolarHBondContact O-N 2.85Å; H807-F809 VanDerWaalsContact C-N 3.29Å; H807-F809 PolarHBondContact O-N 3Å; F809-C813 PolarHBondContact O-SG 3.5Å
810	A	66.1	Low	66.2	Low	18 Å²	18	75.2 Å²	75.2	15%	0.149	44%	0.442	C	S	.	.	H	α-helix	trans	-72.7	-28.6	-177	0	0	0	0	0	113.6	F806 H807 A814 S842	F806-A810 HydrophobicContact CE1-CB 4.24Å; F806-A810 WeakPolarHBondContact O-CB 3.48Å; F806-A810 PolarHBondContact O-N 3.12Å; H807-A810 PolarHBondContact O-N 2.79Å; A810-A814 WeakPolarHBondContact O-CB 3.45Å; A810-A814 PolarHBondContact O-N 3.02Å; A810-S842 PolarHBondContact O-OG 3.44Å
811	Q	69	Low	67.3	Low	24 Å²	24	74.3 Å²	74.3	11%	0.112	44%	0.438	C	S	.	.	H	α-helix	trans	-67.4	-50.4	178.8	-80	174.8	-70	0	0	113.3	V795 I800 H807 C813 A814	V795-Q811 PolarHBondContact O-NE2 2.77Å; I800-Q811 VanDerWaalsContact CD1-NE2 3.32Å; H807-Q811 PolarHBondContact O-N 3.37Å; Q811-C813 VanDerWaalsContact C-N 3.33Å; Q811-C813 PolarHBondContact O-N 3.46Å; Q811-A814 WeakPolarHBondContact O-CB 3.37Å; Q811-A814 PolarHBondContact O-N 3.45Å; Q811-A814 VanDerWaalsContact O-N 3.13Å
812	P	68.8	Low	69	Low	79 Å²	79	75.6 Å²	75.6	51%	0.513	44%	0.438	S	S	.	.	H	α-helix	trans	-58.2	-42.4	173.1	-26.4	35.3	0	0	0	113	A808 A814 I815	A808-P812 WeakPolarHBondContact O-CD 3.31Å; P812-A814 PolarHBondContact O-N 2.69Å; P812-I815 WeakPolarHBondContact O-CB 3.44Å; P812-I815 WeakPolarHBondContact O-CG1 3.36Å; P812-I815 PolarHBondContact O-N 2.81Å; P812-I815 VanDerWaalsContact O-N 3.11Å
813	C	69.2	Low	70.8	Confident	77 Å²	77	72.1 Å²	72.1	52%	0.52	44%	0.435	S	S	.	.	H	α-helix	trans	-66.3	-23.4	177.2	-67.2	0	0	0	0	113.4	F809 Q811 I815 S816 H817	F809-C813 PolarHBondContact O-SG 3.5Å; Q811-C813 VanDerWaalsContact C-N 3.33Å; Q811-C813 PolarHBondContact O-N 3.46Å; C813-I815 PolarHBondContact O-N 2.87Å; C813-S816 PolarHBondContact O-OG 3.24Å; C813-H817 PolarHBondContact O-CD2 3.16Å
814	A	68.1	Low	72.6	Confident	16 Å²	16	70.2 Å²	70.2	13%	0.132	41%	0.409	C	S	.	.	H	α-helix	trans	-71.9	-14.7	174.1	0	0	0	0	0	113.4	A810 Q811 P812 H817 S818	A810-A814 WeakPolarHBondContact O-CB 3.45Å; A810-A814 PolarHBondContact O-N 3.02Å; Q811-A814 WeakPolarHBondContact O-CB 3.37Å; Q811-A814 PolarHBondContact O-N 3.45Å; Q811-A814 VanDerWaalsContact O-N 3.13Å; P812-A814 PolarHBondContact O-N 2.69Å; A814-H817 CarbonylContact O-C 3.56Å; A814-H817 PolarHBondContact O-N 2.92Å; A814-S818 PolarHBondContact O-N 3.46Å
815	I	71.3	Confident	74.3	Confident	120 Å²	120	67.5 Å²	67.5	62%	0.615	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	-40.2	179.3	-59.6	173.9	0	0	0	111	P812 C813 H817 S818	P812-I815 WeakPolarHBondContact O-CB 3.44Å; P812-I815 WeakPolarHBondContact O-CG1 3.36Å; P812-I815 PolarHBondContact O-N 2.81Å; P812-I815 VanDerWaalsContact O-N 3.11Å; C813-I815 PolarHBondContact O-N 2.87Å; I815-H817 VanDerWaalsContact C-N 3.32Å; I815-H817 PolarHBondContact O-N 3.06Å; I815-S818 WeakPolarHBondContact O-CB 3.26Å; I815-S818 PolarHBondContact O-N 2.9Å; I815-S818 PolarHBondContact O-OG 2.96Å
816	S	72.4	Confident	76	Confident	94 Å²	94	65.9 Å²	65.9	66%	0.657	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-33.1	173.9	56.9	0	0	0	0	112.2	C813 S818	C813-S816 PolarHBondContact O-OG 3.24Å; S816-S818 VanDerWaalsContact C-N 3.25Å; S816-S818 PolarHBondContact O-N 3.34Å
817	H	79.7	Confident	77.4	Confident	90 Å²	90	64.6 Å²	64.6	42%	0.417	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-2.7	173.4	-68.3	-72.3	0	0	0	114.1	C813 A814 I815 A819 F820 T821	C813-H817 PolarHBondContact O-CD2 3.16Å; A814-H817 CarbonylContact O-C 3.56Å; A814-H817 PolarHBondContact O-N 2.92Å; I815-H817 VanDerWaalsContact C-N 3.32Å; I815-H817 PolarHBondContact O-N 3.06Å; H817-A819 PolarHBondContact O-N 2.84Å; H817-F820 PolarHBondContact O-N 3.31Å; H817-T821 WeakPolarHBondContact O-CB 3.05Å; H817-T821 PolarHBondContact O-N 3.05Å; H817-T821 PolarHBondContact O-OG1 3.44Å
818	S	80.3	Confident	79	Confident	68 Å²	68	61.6 Å²	61.6	48%	0.476	36%	0.362	S	S	.	.	H	α-helix	trans	-62.8	-41.6	-179.3	66.2	0	0	0	0	112.5	A814 I815 S816 T821 L822	A814-S818 PolarHBondContact O-N 3.46Å; I815-S818 WeakPolarHBondContact O-CB 3.26Å; I815-S818 PolarHBondContact O-N 2.9Å; I815-S818 PolarHBondContact O-OG 2.96Å; S816-S818 VanDerWaalsContact C-N 3.25Å; S816-S818 PolarHBondContact O-N 3.34Å; S818-T821 WeakPolarHBondContact O-CB 3.13Å; S818-T821 PolarHBondContact O-N 3.44Å; S818-L822 WeakPolarHBondContact O-CB 3.33Å; S818-L822 PolarHBondContact O-N 3.46Å
819	A	84.2	Confident	80.3	Confident	64 Å²	64	60.7 Å²	60.7	53%	0.529	35%	0.354	S	S	.	.	H	α-helix	trans	-63.1	-44.8	176.8	0	0	0	0	0	112	H817 L822 V823	H817-A819 PolarHBondContact O-N 2.84Å; A819-L822 PolarHBondContact O-N 2.99Å; A819-V823 WeakPolarHBondContact O-CG2 3.18Å; A819-V823 PolarHBondContact O-N 2.96Å
820	F	85.3	Confident	81.3	Confident	110 Å²	110	58.6 Å²	58.6	48%	0.482	35%	0.35	S	S	.	.	H	α-helix	trans	-62.3	-42.3	174.7	179.8	-113.5	0	0	0	111.7	H817 L822 V823 I824	H817-F820 PolarHBondContact O-N 3.31Å; F820-L822 VanDerWaalsContact C-N 3.34Å; F820-L822 PolarHBondContact O-N 2.95Å; F820-V823 PolarHBondContact O-N 2.83Å; F820-I824 HydrophobicContact CD1-CD1 3.91Å; F820-I824 HydrophobicContact CD2-CD1 4.47Å; F820-I824 HydrophobicContact CE1-CD1 3.41Å; F820-I824 VanDerWaalsContact CE1-CD1 3.41Å; F820-I824 HydrophobicContact CE2-CD1 4.03Å; F820-I824 HydrophobicContact CE2-CG1 4.46Å; F820-I824 HydrophobicContact CG-CD1 4.43Å; F820-I824 HydrophobicContact CZ-CD1 3.49Å; F820-I824 VanDerWaalsContact CZ-CD1 3.49Å; F820-I824 HydrophobicContact CZ-CG1 4.38Å; F820-I824 WeakPolarHBondContact O-CB 3.14Å; F820-I824 WeakPolarHBondContact O-CG1 3.33Å; F820-I824 PolarHBondContact O-N 2.72Å
821	T	85	Confident	82.3	Confident	15 Å²	15	61 Å²	61	9%	0.092	36%	0.359	C	S	.	.	H	α-helix	trans	-62.9	-39.5	175.7	-56.5	0	0	0	0	111.5	I791 H817 S818 T825 F844	I791-T821 HydrophobicContact CD1-CG2 4.18Å; H817-T821 WeakPolarHBondContact O-CB 3.05Å; H817-T821 PolarHBondContact O-N 3.05Å; H817-T821 PolarHBondContact O-OG1 3.44Å; S818-T821 WeakPolarHBondContact O-CB 3.13Å; S818-T821 PolarHBondContact O-N 3.44Å; T821-T825 VanDerWaalsContact O-CB 3.24Å; T821-T825 WeakPolarHBondContact O-CB 3.42Å; T821-T825 PolarHBondContact O-N 2.72Å; T821-T825 PolarHBondContact O-OG1 2.81Å; T821-F844 HydrophobicContact CG2-CB 4.24Å; T821-F844 HydrophobicContact CG2-CD2 4.13Å
822	L	88.2	Confident	83.2	Confident	106 Å²	106	60.2 Å²	60.2	56%	0.555	36%	0.357	S	S	*	.	H	α-helix	trans	-67.5	-45.7	177.8	-162.3	164	0	0	0	111.1	S818 A819 F820 T825 A826	S818-L822 WeakPolarHBondContact O-CB 3.33Å; S818-L822 PolarHBondContact O-N 3.46Å; A819-L822 PolarHBondContact O-N 2.99Å; F820-L822 VanDerWaalsContact C-N 3.34Å; F820-L822 PolarHBondContact O-N 2.95Å; L822-T825 PolarHBondContact O-N 3.19Å; L822-T825 VanDerWaalsContact O-N 3.15Å; L822-A826 PolarHBondContact O-N 2.84Å
823	V	89	Confident	84.1	Confident	91 Å²	91	56.5 Å²	56.5	55%	0.552	33%	0.333	S	S	*	.	H	α-helix	trans	-60.6	-46.3	174.2	172.3	0	0	0	0	111.3	A819 F820 T825 A826 V827	A819-V823 WeakPolarHBondContact O-CG2 3.18Å; A819-V823 PolarHBondContact O-N 2.96Å; F820-V823 PolarHBondContact O-N 2.83Å; V823-T825 VanDerWaalsContact C-N 3.3Å; V823-T825 PolarHBondContact O-N 3.04Å; V823-A826 PolarHBondContact O-N 3.02Å; V823-V827 WeakPolarHBondContact O-CG2 3.29Å; V823-V827 PolarHBondContact O-N 3.18Å
824	I	89.4	Confident	85	Confident	26 Å²	26	52.9 Å²	52.9	13%	0.133	31%	0.308	C	S	.	.	H	α-helix	trans	-57.2	-44.7	172.8	-81.1	178.9	0	0	0	110.7	F820 A826 V827 S828 L835 M846	F820-I824 HydrophobicContact CD1-CD1 3.91Å; F820-I824 HydrophobicContact CD2-CD1 4.47Å; F820-I824 HydrophobicContact CE1-CD1 3.41Å; F820-I824 VanDerWaalsContact CE1-CD1 3.41Å; F820-I824 HydrophobicContact CE2-CD1 4.03Å; F820-I824 HydrophobicContact CE2-CG1 4.46Å; F820-I824 HydrophobicContact CG-CD1 4.43Å; F820-I824 HydrophobicContact CZ-CD1 3.49Å; F820-I824 VanDerWaalsContact CZ-CD1 3.49Å; F820-I824 HydrophobicContact CZ-CG1 4.38Å; F820-I824 WeakPolarHBondContact O-CB 3.14Å; F820-I824 WeakPolarHBondContact O-CG1 3.33Å; F820-I824 PolarHBondContact O-N 2.72Å; I824-A826 PolarHBondContact O-N 3.03Å; I824-V827 PolarHBondContact O-N 3.48Å; I824-S828 WeakPolarHBondContact O-CA 3.43Å; I824-S828 WeakPolarHBondContact O-CB 3.29Å; I824-S828 PolarHBondContact O-N 3.3Å; I824-L835 HydrophobicContact CG2-CD2 3.6Å; I824-M846 HydrophobicContact CG2-CB 4.23Å
825	T	90.9	Very high	85.9	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-66.3	-36.8	-178.3	-59.6	0	0	0	0	112	L784 K787 L788 I791 T821 L822 V823 S829 L835	L784-T825 HydrophobicContact CD1-CG2 3.77Å; K787-T825 HydrophobicContact CB-CG2 3.65Å; K787-T825 HydrophobicContact CD-CG2 4.49Å; L788-T825 HydrophobicContact CD2-CG2 4.22Å; L788-T825 HydrophobicContact CG-CG2 4.34Å; I791-T825 HydrophobicContact CD1-CG2 4.05Å; I791-T825 VanDerWaalsContact CD1-OG1 3.29Å; I791-T825 WeakPolarHBondContact CD1-OG1 3.45Å; T821-T825 VanDerWaalsContact O-CB 3.24Å; T821-T825 WeakPolarHBondContact O-CB 3.42Å; T821-T825 PolarHBondContact O-N 2.72Å; T821-T825 PolarHBondContact O-OG1 2.81Å; L822-T825 PolarHBondContact O-N 3.19Å; L822-T825 VanDerWaalsContact O-N 3.15Å; V823-T825 VanDerWaalsContact C-N 3.3Å; V823-T825 PolarHBondContact O-N 3.04Å; T825-S829 WeakPolarHBondContact O-CB 3.35Å; T825-S829 PolarHBondContact O-N 2.95Å; T825-S829 PolarHBondContact O-OG 3Å; T825-L835 HydrophobicContact CG2-CD1 4.24Å
826	A	91.3	Very high	86.4	Confident	39 Å²	39	46.7 Å²	46.7	32%	0.322	27%	0.274	S	S	.	.	H	α-helix	trans	-64	-53	172.8	0	0	0	0	0	111.7	L822 V823 I824 S828 S829 L830	L822-A826 PolarHBondContact O-N 2.84Å; V823-A826 PolarHBondContact O-N 3.02Å; I824-A826 PolarHBondContact O-N 3.03Å; A826-S828 VanDerWaalsContact C-N 3.33Å; A826-S828 PolarHBondContact O-N 2.72Å; A826-S829 PolarHBondContact O-N 3.42Å; A826-S829 VanDerWaalsContact O-N 3.1Å; A826-S829 PolarHBondContact O-OG 3.13Å; A826-L830 PolarHBondContact O-N 3.13Å
827	V	89.8	Confident	86.7	Confident	67 Å²	67	42.4 Å²	42.4	41%	0.406	24%	0.244	S	C	.	.	H	α-helix	trans	-60.6	-42.9	177.5	174.2	0	0	0	0	111.4	V823 I824 S829 L830 L831 M846	V823-V827 WeakPolarHBondContact O-CG2 3.29Å; V823-V827 PolarHBondContact O-N 3.18Å; I824-V827 PolarHBondContact O-N 3.48Å; V827-S829 VanDerWaalsContact C-N 3.33Å; V827-S829 PolarHBondContact O-N 2.9Å; V827-L830 PolarHBondContact O-N 3.45Å; V827-L831 HydrophobicContact CG1-CD1 3.87Å; V827-L831 HydrophobicContact CG1-CG 4.45Å; V827-L831 WeakPolarHBondContact O-CB 3.35Å; V827-L831 WeakPolarHBondContact O-CG 3.49Å; V827-L831 PolarHBondContact O-N 3.13Å; V827-M846 HydrophobicContact CG1-SD 4.3Å
828	S	91.6	Very high	86.4	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-59.4	-38.3	173.4	163.4	0	0	0	0	112.5	K787 I824 A826 S832 A833 L835	K787-S828 PolarHBondContact NZ-O 3.02Å; K787-S828 PolarHBondContact NZ-OG 3.18Å; I824-S828 WeakPolarHBondContact O-CA 3.43Å; I824-S828 WeakPolarHBondContact O-CB 3.29Å; I824-S828 PolarHBondContact O-N 3.3Å; A826-S828 VanDerWaalsContact C-N 3.33Å; A826-S828 PolarHBondContact O-N 2.72Å; S828-S832 CarbonylContact O-C 3.23Å; S828-S832 VanDerWaalsContact O-CA 3.32Å; S828-S832 WeakPolarHBondContact O-CA 3.44Å; S828-S832 PolarHBondContact O-N 2.94Å; S828-A833 PolarHBondContact O-N 2.85Å; S828-A833 PolarHBondContact OG-O 2.66Å; S828-L835 WeakPolarHBondContact OG-CD2 3.27Å
829	S	91.1	Very high	85.7	Confident	10 Å²	10	42 Å²	42	7%	0.07	24%	0.235	C	C	.	.	H	α-helix	trans	-71.1	-39	175.4	71.3	0	0	0	0	112.5	K780 T825 A826 V827 S832	K780-S829 VanDerWaalsContact CD-O 3.26Å; K780-S829 WeakPolarHBondContact CD-O 3.46Å; T825-S829 WeakPolarHBondContact O-CB 3.35Å; T825-S829 PolarHBondContact O-N 2.95Å; T825-S829 PolarHBondContact O-OG 3Å; A826-S829 PolarHBondContact O-N 3.42Å; A826-S829 VanDerWaalsContact O-N 3.1Å; A826-S829 PolarHBondContact O-OG 3.13Å; V827-S829 VanDerWaalsContact C-N 3.33Å; V827-S829 PolarHBondContact O-N 2.9Å; S829-S832 PolarHBondContact O-N 2.97Å
830	L	86.9	Confident	84.8	Confident	116 Å²	116	39.2 Å²	39.2	61%	0.607	21%	0.212	S	C	*	.	H	α-helix	trans	-63.7	-46.7	176.9	-174.6	65.6	0	0	0	111.5	K780 A826 V827 S832	K780-L830 PolarHBondContact NZ-O 3.5Å; A826-L830 PolarHBondContact O-N 3.13Å; V827-L830 PolarHBondContact O-N 3.45Å; L830-S832 VanDerWaalsContact C-N 3.26Å; L830-S832 PolarHBondContact O-N 3.03Å
831	L	87.2	Confident	84	Confident	68 Å²	68	34.8 Å²	34.8	36%	0.356	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.9	5.8	177.8	-60.5	178.7	0	0	0	113.9	Y512 V827 A833 M846 V849	Y512-L831 VanDerWaalsContact OH-C 3.32Å; Y512-L831 PolarHBondContact OH-O 2.93Å; V827-L831 HydrophobicContact CG1-CD1 3.87Å; V827-L831 HydrophobicContact CG1-CG 4.45Å; V827-L831 WeakPolarHBondContact O-CB 3.35Å; V827-L831 WeakPolarHBondContact O-CG 3.49Å; V827-L831 PolarHBondContact O-N 3.13Å; L831-A833 HydrophobicContact CB-CB 4.37Å; L831-A833 PolarHBondContact O-N 3.27Å; L831-M846 HydrophobicContact CD1-CE 4.36Å; L831-V849 HydrophobicContact CB-CG1 3.92Å; L831-V849 WeakPolarHBondContact O-CG1 3.37Å
832	S	86.8	Confident	83.3	Confident	9 Å²	9	34.8 Å²	34.8	6%	0.063	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	41.9	32.9	-172.3	-66.3	0	0	0	0	115.1	K780 E783 S828 S829 L830 R1293	K780-S832 PolarHBondContact NZ-OG 3.05Å; E783-S832 WeakPolarHBondContact OE1-CA 2.87Å; E783-S832 VanDerWaalsContact OE2-CB 3.25Å; E783-S832 WeakPolarHBondContact OE2-CB 3.47Å; E783-S832 PolarHBondContact OE2-OG 3.07Å; S828-S832 CarbonylContact O-C 3.23Å; S828-S832 VanDerWaalsContact O-CA 3.32Å; S828-S832 WeakPolarHBondContact O-CA 3.44Å; S828-S832 PolarHBondContact O-N 2.94Å; S829-S832 PolarHBondContact O-N 2.97Å; L830-S832 VanDerWaalsContact C-N 3.26Å; L830-S832 PolarHBondContact O-N 3.03Å; S832-R1293 PolarHBondContact O-NH1 3.01Å; S832-R1293 PolarHBondContact O-NH2 3.48Å
833	A	88	Confident	82.8	Confident	0 Å²	0	31.8 Å²	31.8	0%	0	18%	0.181	C	C	.	.	P	Polyproline II helix	trans	-84.4	139.4	-175	0	0	0	0	0	111	K787 S828 L831 M846 V849	K787-A833 PolarHBondContact NZ-O 2.74Å; S828-A833 PolarHBondContact O-N 2.85Å; S828-A833 PolarHBondContact OG-O 2.66Å; L831-A833 HydrophobicContact CB-CB 4.37Å; L831-A833 PolarHBondContact O-N 3.27Å; A833-M846 HydrophobicContact CB-CG 3.8Å; A833-M846 HydrophobicContact CB-SD 3.92Å; A833-V849 HydrophobicContact CB-CG1 4.01Å
834	P	87.8	Confident	82.5	Confident	2 Å²	2	27.4 Å²	27.4	1%	0.013	16%	0.155	C	C	.	.	P	Polyproline II helix	trans	-68.5	136.1	175	20	-19	0	0	0	111.7	S847 Y848 R1293 A1297	P834-S847 WeakPolarHBondContact O-CB 3.11Å; P834-S847 PolarHBondContact O-N 3.29Å; P834-Y848 WeakPolarHBondContact CD-O 3.3Å; P834-R1293 HydrophobicContact CB-CB 4.08Å; P834-A1297 HydrophobicContact CB-CB 4.2Å; P834-A1297 HydrophobicContact CG-CB 4.24Å
835	L	87.7	Confident	82.2	Confident	2 Å²	2	28.7 Å²	28.7	1%	0.01	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	155.2	165.3	-63.2	176.2	0	0	0	109.6	K787 I791 I824 T825 S828 F844 L845 A1294	K787-L835 HydrophobicContact CB-CD1 4.04Å; K787-L835 HydrophobicContact CD-CD1 4.18Å; K787-L835 HydrophobicContact CD-CG 4.3Å; K787-L835 HydrophobicContact CG-CD1 4.17Å; I791-L835 HydrophobicContact CD1-CD1 3.9Å; I791-L835 HydrophobicContact CG1-CD1 4.4Å; I824-L835 HydrophobicContact CG2-CD2 3.6Å; T825-L835 HydrophobicContact CG2-CD1 4.24Å; S828-L835 WeakPolarHBondContact OG-CD2 3.27Å; L835-F844 HydrophobicContact CB-CD1 4.35Å; L835-L845 CarbonylContact C-O 3.59Å; L835-L845 VanDerWaalsContact CA-O 3.3Å; L835-L845 WeakPolarHBondContact CA-O 3.39Å; L835-A1294 WeakPolarHBondContact O-CA 3.14Å; L835-A1294 WeakPolarHBondContact O-CB 3.31Å
836	N	82.7	Confident	81.9	Confident	3 Å²	3	30.6 Å²	30.6	2%	0.016	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	124.8	173.5	50.3	-22	0	0	0	111.5	F838 F844 L845 M846 S847 Q1301	N836-F838 PolarHBondContact O-N 3.46Å; N836-F844 WeakPolarHBondContact O-CA 3.29Å; N836-L845 PolarHBondContact N-O 3.22Å; N836-L845 PolarHBondContact O-N 2.93Å; N836-L845 WeakPolarHBondContact OD1-CB 3.24Å; N836-L845 PolarHBondContact OD1-O 3.28Å; N836-M846 PolarHBondContact OD1-N 3.12Å; N836-S847 PolarHBondContact OD1-N 3.19Å; N836-Q1301 PolarHBondContact ND2-OE1 2.87Å
837	P	78.2	Confident	81.5	Confident	5 Å²	5	29.1 Å²	29.1	3%	0.032	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	107.1	176	28.5	-32.1	0	0	0	109.5	Y794 M839 G840 F844 F1295	Y794-P837 HydrophobicContact CE1-CB 4.24Å; P837-M839 PolarHBondContact O-N 3.12Å; P837-M839 VanDerWaalsContact O-N 3.16Å; P837-G840 PolarHBondContact O-N 3.35Å; P837-G840 VanDerWaalsContact O-N 3.16Å; P837-F844 HydrophobicContact CB-CD1 4.17Å; P837-F844 HydrophobicContact CB-CE1 3.86Å; P837-F844 HydrophobicContact CG-CE1 4.47Å; P837-F1295 HydrophobicContact CG-CD1 4.12Å; P837-F1295 HydrophobicContact CG-CE1 4.16Å
838	F	73.7	Confident	81.1	Confident	69 Å²	69	26.3 Å²	26.3	30%	0.303	14%	0.141	S	C	.	.	G	3₁₀ helix	trans	-65.5	116.2	-167.9	-179.7	-107.7	0	0	0	111.5	N836 G840 S841 V843 L845	N836-F838 PolarHBondContact O-N 3.46Å; F838-G840 PolarHBondContact O-N 3.23Å; F838-G840 VanDerWaalsContact O-N 3.15Å; F838-S841 VanDerWaalsContact O-CB 3.27Å; F838-S841 WeakPolarHBondContact O-CB 2.99Å; F838-S841 PolarHBondContact O-N 2.84Å; F838-S841 PolarHBondContact O-OG 3.49Å; F838-V843 WeakPolarHBondContact CB-O 3.47Å; F838-V843 PolarHBondContact N-O 2.96Å; F838-L845 HydrophobicContact CB-CD1 4.09Å; F838-L845 HydrophobicContact CB-CG 4.25Å; F838-L845 HydrophobicContact CD2-CD1 3.61Å; F838-L845 HydrophobicContact CE2-CD1 4.28Å; F838-L845 HydrophobicContact CG-CD1 3.98Å
839	M	65.8	Low	80.8	Confident	81 Å²	81	27 Å²	27	40%	0.399	15%	0.145	S	C	.	.	G	3₁₀ helix	trans	54.8	28.9	-177.5	-57.8	172.6	79.4	0	0	112.9	P837 S841 E1302	P837-M839 PolarHBondContact O-N 3.12Å; P837-M839 VanDerWaalsContact O-N 3.16Å; M839-S841 VanDerWaalsContact C-N 3.27Å; M839-S841 PolarHBondContact O-N 3.4Å; M839-E1302 VanDerWaalsContact CA-OE1 3.3Å; M839-E1302 WeakPolarHBondContact CA-OE1 3.32Å
840	G	63.5	Low	80.4	Confident	4 Å²	4	27 Å²	27	4%	0.041	14%	0.144	C	C	.	.	G	3₁₀ helix	trans	74.4	4.2	-174.8	0	0	0	0	0	115.9	Y794 P837 F838	Y794-G840 PolarHBondContact OH-O 3.41Å; P837-G840 PolarHBondContact O-N 3.35Å; P837-G840 VanDerWaalsContact O-N 3.16Å; F838-G840 PolarHBondContact O-N 3.23Å; F838-G840 VanDerWaalsContact O-N 3.15Å
841	S	69.6	Low	80.3	Confident	18 Å²	18	21.7 Å²	21.7	13%	0.126	12%	0.116	C	C	.	.	S	Bend	trans	-73.8	176.8	178.6	74.6	0	0	0	0	113.5	F838 M839 V843	F838-S841 VanDerWaalsContact O-CB 3.27Å; F838-S841 WeakPolarHBondContact O-CB 2.99Å; F838-S841 PolarHBondContact O-N 2.84Å; F838-S841 PolarHBondContact O-OG 3.49Å; M839-S841 VanDerWaalsContact C-N 3.27Å; M839-S841 PolarHBondContact O-N 3.4Å; S841-V843 PolarHBondContact O-N 2.95Å; S841-V843 PolarHBondContact OG-N 3.37Å
842	S	70.6	Confident	79.9	Confident	15 Å²	15	19.5 Å²	19.5	11%	0.105	11%	0.106	C	C	.	.	S	Bend	trans	-72.3	-5.4	172.1	43.5	0	0	0	0	114.4	A810	A810-S842 PolarHBondContact O-OG 3.44Å
843	V	76.6	Confident	79.1	Confident	42 Å²	42	19.7 Å²	19.7	26%	0.255	11%	0.105	S	C	.	.			trans	-89.8	118.8	178.5	-178.8	0	0	0	0	109.7	F838 S841	F838-V843 WeakPolarHBondContact CB-O 3.47Å; F838-V843 PolarHBondContact N-O 2.96Å; S841-V843 PolarHBondContact O-N 2.95Å; S841-V843 PolarHBondContact OG-N 3.37Å
844	F	83.4	Confident	78.1	Confident	0 Å²	0	20.5 Å²	20.5	0%	0	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	132.1	173.3	-65.2	-88.8	0	0	0	110.7	F790 I791 Y794 V795 T821 L835 N836 P837	F790-F844 HydrophobicContact CD1-CE1 4.29Å; F790-F844 HydrophobicContact CE1-CD1 4.27Å; F790-F844 AromaticContact CE1-CE1 3.52Å; F790-F844 HydrophobicContact CE1-CE1 3.52Å; F790-F844 HydrophobicContact CE1-CZ 4.32Å; F790-F844 AromaticContact CZ-CE1 3.82Å; F790-F844 HydrophobicContact CZ-CE1 3.82Å; F790-F844 HydrophobicContact CZ-CZ 4.44Å; I791-F844 HydrophobicContact CB-CE2 4.23Å; I791-F844 HydrophobicContact CG1-CD2 4.04Å; I791-F844 HydrophobicContact CG1-CE1 4.45Å; I791-F844 HydrophobicContact CG1-CE2 3.88Å; I791-F844 HydrophobicContact CG1-CG 4.4Å; I791-F844 HydrophobicContact CG1-CZ 4.09Å; I791-F844 HydrophobicContact CG2-CD2 4.35Å; I791-F844 HydrophobicContact CG2-CE2 3.94Å; Y794-F844 HydrophobicContact CD1-CE2 4.43Å; Y794-F844 AromaticContact CD1-CZ 3.76Å; Y794-F844 HydrophobicContact CD1-CZ 3.76Å; Y794-F844 HydrophobicContact CG-CZ 4.14Å; V795-F844 HydrophobicContact CG2-CE2 4.08Å; T821-F844 HydrophobicContact CG2-CB 4.24Å; T821-F844 HydrophobicContact CG2-CD2 4.13Å; L835-F844 HydrophobicContact CB-CD1 4.35Å; N836-F844 WeakPolarHBondContact O-CA 3.29Å; P837-F844 HydrophobicContact CB-CD1 4.17Å; P837-F844 HydrophobicContact CB-CE1 3.86Å; P837-F844 HydrophobicContact CG-CE1 4.47Å
845	L	82.3	Confident	76.9	Confident	52 Å²	52	21.2 Å²	21.2	27%	0.272	11%	0.111	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	179.7	165.4	-63.1	177.6	0	0	0	109.5	L835 N836 F838	L835-L845 CarbonylContact C-O 3.59Å; L835-L845 VanDerWaalsContact CA-O 3.3Å; L835-L845 WeakPolarHBondContact CA-O 3.39Å; N836-L845 PolarHBondContact N-O 3.22Å; N836-L845 PolarHBondContact O-N 2.93Å; N836-L845 WeakPolarHBondContact OD1-CB 3.24Å; N836-L845 PolarHBondContact OD1-O 3.28Å; F838-L845 HydrophobicContact CB-CD1 4.09Å; F838-L845 HydrophobicContact CB-CG 4.25Å; F838-L845 HydrophobicContact CD2-CD1 3.61Å; F838-L845 HydrophobicContact CE2-CD1 4.28Å; F838-L845 HydrophobicContact CG-CD1 3.98Å
846	M	85.3	Confident	75.2	Confident	40 Å²	40	25.4 Å²	25.4	20%	0.197	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	127.5	172.2	-170	176	74.8	0	0	109.3	V502 I824 V827 L831 A833 N836	V502-M846 HydrophobicContact CG1-CE 3.95Å; I824-M846 HydrophobicContact CG2-CB 4.23Å; V827-M846 HydrophobicContact CG1-SD 4.3Å; L831-M846 HydrophobicContact CD1-CE 4.36Å; A833-M846 HydrophobicContact CB-CG 3.8Å; A833-M846 HydrophobicContact CB-SD 3.92Å; N836-M846 PolarHBondContact OD1-N 3.12Å
847	S	82	Confident	74.1	Confident	9 Å²	9	31.2 Å²	31.2	6%	0.063	16%	0.156	C	C	.	.	P	Polyproline II helix	trans	-86.8	168.9	168.9	-165.8	0	0	0	0	110.4	P834 N836	P834-S847 WeakPolarHBondContact O-CB 3.11Å; P834-S847 PolarHBondContact O-N 3.29Å; N836-S847 PolarHBondContact OD1-N 3.19Å
848	Y	82.8	Confident	73	Confident	7 Å²	7	34.9 Å²	34.9	3%	0.027	18%	0.175	C	C	.	.	P	Polyproline II helix	trans	-59.2	150	178.8	57.5	-96.2	0	0	0	113.7	A424 G501 V502 P504 P834 R850 Q1300	A424-Y848 HydrophobicContact CB-CD1 4.37Å; A424-Y848 HydrophobicContact CB-CE1 4.28Å; A424-Y848 PolarHBondContact O-OH 3.06Å; A424-Y848 VanDerWaalsContact O-OH 3.04Å; G501-Y848 WeakPolarHBondContact O-CB 3.29Å; G501-Y848 WeakPolarHBondContact O-CD1 3.5Å; G501-Y848 PolarHBondContact O-N 3.41Å; V502-Y848 WeakPolarHBondContact O-CA 3.34Å; V502-Y848 WeakPolarHBondContact O-CB 3.05Å; P504-Y848 HydrophobicContact CB-CD2 3.62Å; P504-Y848 HydrophobicContact CB-CE2 4.29Å; P504-Y848 HydrophobicContact CB-CG 4.11Å; P834-Y848 WeakPolarHBondContact CD-O 3.3Å; Y848-R850 HydrophobicContact CD2-CG 3.58Å; Y848-R850 VanDerWaalsContact CE1-NH2 3.27Å; Y848-R850 HydrophobicContact CE2-CG 3.59Å; Y848-R850 VanDerWaalsContact CE2-NE 3.26Å; Y848-R850 WeakPolarHBondContact O-CG 3.46Å; Y848-R850 PolarHBondContact OH-NH2 2.83Å; Y848-Q1300 PolarHBondContact OH-NE2 2.96Å; Y848-Q1300 PolarHBondContact OH-OE1 3.14Å
849	V	85.6	Confident	72.3	Confident	15 Å²	15	32.9 Å²	32.9	9%	0.091	17%	0.166	C	C	.	.	P	Polyproline II helix	trans	-60.6	137	175.1	-59.1	0	0	0	0	111	P504 F509 Y512 L831 A833	P504-V849 HydrophobicContact CG-CG2 3.73Å; F509-V849 HydrophobicContact CD2-CG2 4.12Å; F509-V849 HydrophobicContact CE2-CG2 4.45Å; Y512-V849 HydrophobicContact CD1-CB 4.02Å; Y512-V849 HydrophobicContact CD1-CG2 3.61Å; Y512-V849 HydrophobicContact CD2-CB 4.19Å; Y512-V849 HydrophobicContact CE1-CB 3.94Å; Y512-V849 HydrophobicContact CE1-CG1 4.29Å; Y512-V849 HydrophobicContact CE1-CG2 3.81Å; Y512-V849 HydrophobicContact CE2-CB 4.09Å; Y512-V849 HydrophobicContact CG-CB 4.17Å; Y512-V849 HydrophobicContact CG-CG2 4.04Å; L831-V849 HydrophobicContact CB-CG1 3.92Å; L831-V849 WeakPolarHBondContact O-CG1 3.37Å; A833-V849 HydrophobicContact CB-CG1 4.01Å
850	R	82.6	Confident	71.6	Confident	10 Å²	10	36 Å²	36	4%	0.038	18%	0.184	C	C	.	.			trans	-136.8	144.9	-177.5	-61.8	-176.4	-162.4	-149	3	110.7	Y848 F854 Q1300	Y848-R850 HydrophobicContact CD2-CG 3.58Å; Y848-R850 VanDerWaalsContact CE1-NH2 3.27Å; Y848-R850 HydrophobicContact CE2-CG 3.59Å; Y848-R850 VanDerWaalsContact CE2-NE 3.26Å; Y848-R850 WeakPolarHBondContact O-CG 3.46Å; Y848-R850 PolarHBondContact OH-NH2 2.83Å; R850-F854 HydrophobicContact CB-CB 4.47Å; R850-Q1300 VanDerWaalsContact CZ-OE1 3.23Å
851	P	83.6	Confident	70.9	Confident	4 Å²	4	38.6 Å²	38.6	3%	0.026	20%	0.199	C	C	.	.			trans	-62.9	164.8	167.5	30.2	-35.3	0	0	0	111	T508 C511 E515 K853 F854	T508-P851 HydrophobicContact CG2-CG 4.38Å; C511-P851 HydrophobicContact CB-CG 4.43Å; E515-P851 WeakPolarHBondContact OE2-CA 3.23Å; E515-P851 WeakPolarHBondContact OE2-CB 3.33Å; P851-K853 VanDerWaalsContact C-N 3.26Å; P851-K853 CarbonylContact O-C 3.52Å; P851-K853 PolarHBondContact O-N 2.91Å; P851-F854 WeakPolarHBondContact O-CA 3.33Å; P851-F854 PolarHBondContact O-N 2.95Å
852	V	79.7	Confident	70	Confident	23 Å²	23	47.5 Å²	47.5	14%	0.139	23%	0.23	C	C	.	.	S	Bend	trans	-59.9	-37.8	178.9	174.8	0	0	0	0	111	E515 M519 A526 F854 P917 G918 H933	E515-V852 PolarHBondContact OE2-N 3.3Å; M519-V852 HydrophobicContact CE-CG2 3.84Å; A526-V852 HydrophobicContact CB-CB 4.02Å; A526-V852 HydrophobicContact CB-CG1 4.11Å; A526-V852 HydrophobicContact CB-CG2 4.45Å; V852-F854 PolarHBondContact O-N 3.1Å; V852-P917 HydrophobicContact CG1-CB 4.48Å; V852-G918 VanDerWaalsContact CG1-CA 3.46Å; V852-H933 PolarHBondContact O-CE1 3.17Å
853	K	69.8	Low	69.3	Low	13 Å²	13	48.3 Å²	48.3	6%	0.057	23%	0.232	C	C	.	.	S	Bend	trans	-75.9	72.8	163.5	-167.3	-157.2	175.4	-167.9	0	110.5	F528 P851 W855 E856 D858 I935 L1344	F528-K853 WeakPolarHBondContact O-CD 3.46Å; F528-K853 PolarHBondContact O-NZ 2.8Å; P851-K853 VanDerWaalsContact C-N 3.26Å; P851-K853 CarbonylContact O-C 3.52Å; P851-K853 PolarHBondContact O-N 2.91Å; K853-W855 VanDerWaalsContact CE-O 3.3Å; K853-W855 WeakPolarHBondContact CE-O 3.21Å; K853-W855 PolarHBondContact O-N 3.12Å; K853-W855 VanDerWaalsContact O-N 3.16Å; K853-E856 PolarHBondContact NZ-O 3.12Å; K853-D858 IonicContact NZ-OD1 3.2Å; K853-D858 PolarHBondContact NZ-OD1 3.48Å; K853-I935 HydrophobicContact CB-CG2 4.32Å; K853-I935 HydrophobicContact CG-CD1 4.33Å; K853-L1344 HydrophobicContact CD-CD1 4.42Å
854	F	67	Low	68.3	Low	17 Å²	17	50.1 Å²	50.1	8%	0.075	24%	0.24	C	C	.	.			trans	-65.9	-11.3	-172.2	73.3	-73.1	0	0	0	116.4	R850 P851 V852 H933 W1296	R850-F854 HydrophobicContact CB-CB 4.47Å; P851-F854 WeakPolarHBondContact O-CA 3.33Å; P851-F854 PolarHBondContact O-N 2.95Å; V852-F854 PolarHBondContact O-N 3.1Å; F854-H933 AromaticContact CD1-CE1 3.76Å; F854-H933 AromaticContact CE1-CE1 3.72Å; F854-H933 AromaticContact CE1-ND1 3.87Å; F854-W1296 HydrophobicContact CD1-CZ3 4.32Å; F854-W1296 AromaticContact CD2-CE3 3.99Å; F854-W1296 HydrophobicContact CD2-CE3 3.99Å; F854-W1296 AromaticContact CE1-CE3 3.81Å; F854-W1296 HydrophobicContact CE1-CE3 3.81Å; F854-W1296 HydrophobicContact CE1-CH2 4.19Å; F854-W1296 AromaticContact CE1-CZ3 3.4Å; F854-W1296 HydrophobicContact CE1-CZ3 3.4Å; F854-W1296 HydrophobicContact CE2-CB 4.2Å; F854-W1296 AromaticContact CE2-CD2 3.71Å; F854-W1296 HydrophobicContact CE2-CD2 3.71Å; F854-W1296 AromaticContact CE2-CE3 3.11Å; F854-W1296 HydrophobicContact CE2-CE3 3.11Å; F854-W1296 HydrophobicContact CE2-CG 4.22Å; F854-W1296 AromaticContact CE2-CZ3 3.63Å; F854-W1296 HydrophobicContact CE2-CZ3 3.63Å; F854-W1296 AromaticContact CZ-CD2 3.83Å; F854-W1296 HydrophobicContact CZ-CD2 3.83Å; F854-W1296 AromaticContact CZ-CE3 3.05Å; F854-W1296 HydrophobicContact CZ-CE3 3.05Å; F854-W1296 AromaticContact CZ-CH2 3.72Å; F854-W1296 HydrophobicContact CZ-CH2 3.72Å; F854-W1296 HydrophobicContact CZ-CZ2 4.4Å; F854-W1296 AromaticContact CZ-CZ3 3Å; F854-W1296 HydrophobicContact CZ-CZ3 3Å
855	W	62.8	Low	67.1	Low	16 Å²	16	51 Å²	51	6%	0.061	25%	0.245	C	C	.	.			trans	-116.6	127.7	165.4	-62.6	135.4	0	0	0	110.3	P426 K853 K857 W1296 Q1300 D1332 I1335	P426-W855 HydrophobicContact CB-CE3 4.05Å; P426-W855 HydrophobicContact CB-CZ3 3.71Å; K853-W855 VanDerWaalsContact CE-O 3.3Å; K853-W855 WeakPolarHBondContact CE-O 3.21Å; K853-W855 PolarHBondContact O-N 3.12Å; K853-W855 VanDerWaalsContact O-N 3.16Å; W855-K857 PolarHBondContact O-N 3.44Å; W855-W1296 HydrophobicContact CZ2-CB 4.18Å; W855-Q1300 HydrophobicContact CH2-CB 4.32Å; W855-D1332 HydrophobicContact CG-CB 4.26Å; W855-I1335 HydrophobicContact CH2-CD1 3.36Å; W855-I1335 HydrophobicContact CZ2-CD1 3.83Å; W855-I1335 HydrophobicContact CZ3-CD1 4.15Å
856	E	51.2	Low	66.1	Low	91 Å²	91	52.1 Å²	52.1	43%	0.425	25%	0.251	S	S	.	.			trans	-79	-16.6	-173.5	-65.4	-172.3	-178.9	0	0	114.5	T508 K853 D858	T508-E856 WeakPolarHBondContact CA-OE1 3.25Å; T508-E856 WeakPolarHBondContact CB-OE1 3.46Å; T508-E856 PolarHBondContact N-OE1 3.39Å; T508-E856 PolarHBondContact OG1-OE1 2.76Å; K853-E856 PolarHBondContact NZ-O 3.12Å; E856-D858 PolarHBondContact O-N 2.8Å
857	K	58.9	Low	64.9	Low	125 Å²	125	53.8 Å²	53.8	54%	0.543	27%	0.266	S	S	.	.			trans	-68	112.6	-170	-168.4	171.5	178.6	-175.3	0	112.2	W855 Y859	W855-K857 PolarHBondContact O-N 3.44Å; K857-Y859 HydrophobicContact CB-CD2 4.36Å; K857-Y859 HydrophobicContact CB-CE2 3.85Å; K857-Y859 HydrophobicContact CD-CE1 4.32Å; K857-Y859 HydrophobicContact CD-CE2 4.08Å; K857-Y859 HydrophobicContact CG-CD2 4.36Å; K857-Y859 HydrophobicContact CG-CE2 3.98Å; K857-Y859 WeakPolarHBondContact O-CD2 3.3Å; K857-Y859 PolarHBondContact O-N 3.11Å
858	D	56	Low	63.9	Low	81 Å²	81	56.6 Å²	56.6	43%	0.433	28%	0.281	S	S	.	.			trans	-74.5	102.3	171.7	-85.6	0	0	0	0	110.2	K853 E856 N860	K853-D858 IonicContact NZ-OD1 3.2Å; K853-D858 PolarHBondContact NZ-OD1 3.48Å; E856-D858 PolarHBondContact O-N 2.8Å; D858-N860 VanDerWaalsContact C-N 3.29Å; D858-N860 PolarHBondContact O-N 3.12Å
859	Y	58.2	Low	63	Low	27 Å²	27	57.6 Å²	57.6	11%	0.106	29%	0.288	C	S	.	.			trans	-73.2	75.1	179.5	-77.4	-92	0	0	0	112.4	K857 T861 D1332 V1341 P1343	K857-Y859 HydrophobicContact CB-CD2 4.36Å; K857-Y859 HydrophobicContact CB-CE2 3.85Å; K857-Y859 HydrophobicContact CD-CE1 4.32Å; K857-Y859 HydrophobicContact CD-CE2 4.08Å; K857-Y859 HydrophobicContact CG-CD2 4.36Å; K857-Y859 HydrophobicContact CG-CE2 3.98Å; K857-Y859 WeakPolarHBondContact O-CD2 3.3Å; K857-Y859 PolarHBondContact O-N 3.11Å; Y859-T861 HydrophobicContact CD1-CG2 3.95Å; Y859-T861 PolarHBondContact O-N 2.59Å; Y859-D1332 VanDerWaalsContact CE2-OD2 3.31Å; Y859-D1332 WeakPolarHBondContact CE2-OD2 3.35Å; Y859-D1332 WeakPolarHBondContact OH-CB 3.49Å; Y859-V1341 HydrophobicContact CD1-CB 3.8Å; Y859-V1341 HydrophobicContact CD1-CG1 3.86Å; Y859-V1341 HydrophobicContact CD2-CB 4.48Å; Y859-V1341 HydrophobicContact CD2-CG1 3.63Å; Y859-V1341 HydrophobicContact CE1-CB 4.03Å; Y859-V1341 HydrophobicContact CE1-CG1 4.15Å; Y859-V1341 HydrophobicContact CE1-CG2 4.33Å; Y859-V1341 HydrophobicContact CE2-CG1 3.97Å; Y859-V1341 HydrophobicContact CG-CB 4.05Å; Y859-V1341 HydrophobicContact CG-CG1 3.59Å; Y859-P1343 VanDerWaalsContact O-CA 3.31Å; Y859-P1343 WeakPolarHBondContact O-CA 3.46Å; Y859-P1343 WeakPolarHBondContact O-CB 3.45Å
860	N	51.3	Low	61.8	Low	146 Å²	146	62.2 Å²	62.2	78%	0.781	30%	0.303	S	S	*	.			trans	-74.7	64.6	160.7	-78.9	-17.3	0	0	0	110	D858 R862	D858-N860 VanDerWaalsContact C-N 3.29Å; D858-N860 PolarHBondContact O-N 3.12Å; N860-R862 PolarHBondContact O-N 3.14Å
861	T	49.8	Very low	60.6	Low	60 Å²	60	67.4 Å²	67.4	37%	0.368	33%	0.331	S	S	.	.			trans	-68.8	88.5	179.4	34.7	0	0	0	0	111.2	Y859 H863 V1341	Y859-T861 HydrophobicContact CD1-CG2 3.95Å; Y859-T861 PolarHBondContact O-N 2.59Å; T861-H863 PolarHBondContact O-N 3.41Å; T861-V1341 PolarHBondContact OG1-O 2.96Å; T861-V1341 VanDerWaalsContact OG1-O 3.04Å
862	R	51	Low	59.5	Low	205 Å²	205	69.9 Å²	69.9	77%	0.774	35%	0.352	S	S	*	.			trans	-69.9	115.9	154.4	-72.1	-172.7	176.9	-176.7	-0.7	107.6	N860	N860-R862 PolarHBondContact O-N 3.14Å
863	H	55.1	Low	58.5	Low	32 Å²	32	71.8 Å²	71.8	15%	0.148	36%	0.364	C	S	.	.			trans	-55.4	147.6	168.4	-168.7	-60.8	0	0	0	109.8	T861 D865 N885	T861-H863 PolarHBondContact O-N 3.41Å; H863-D865 IonicContact ND1-OD1 3.64Å; H863-D865 PolarHBondContact O-N 2.99Å; H863-D865 VanDerWaalsContact O-N 3.13Å; H863-N885 PolarHBondContact NE2-O 3.16Å
864	L	56.3	Low	58	Low	79 Å²	79	74.2 Å²	74.2	41%	0.414	38%	0.376	S	S	.	.			trans	-87.7	57	-177	-69.9	176.4	0	0	0	111.1	T869	L864-T869 HydrophobicContact CB-CG2 3.73Å; L864-T869 HydrophobicContact CD2-CG2 4.02Å; L864-T869 HydrophobicContact CG-CG2 4.37Å
865	D	57.9	Low	57.4	Low	19 Å²	19	77.3 Å²	77.3	10%	0.102	39%	0.392	C	S	.	.			trans	-60.1	159.2	174.7	-35.5	-88.7	0	0	0	110.9	H863 S867 N868 T869 R1246	H863-D865 IonicContact ND1-OD1 3.64Å; H863-D865 PolarHBondContact O-N 2.99Å; H863-D865 VanDerWaalsContact O-N 3.13Å; D865-S867 PolarHBondContact O-N 3.21Å; D865-N868 PolarHBondContact O-N 3.17Å; D865-N868 PolarHBondContact OD2-ND2 3.31Å; D865-T869 PolarHBondContact O-N 3.1Å; D865-T869 VanDerWaalsContact O-N 3.13Å; D865-T869 PolarHBondContact O-OG1 3.45Å; D865-R1246 VanDerWaalsContact CG-NH1 3.32Å; D865-R1246 WeakPolarHBondContact OD1-CD 3.46Å; D865-R1246 IonicContact OD1-CZ 2.84Å; D865-R1246 IonicContact OD1-NE 3.01Å; D865-R1246 IonicContact OD1-NH1 3.46Å; D865-R1246 PolarHBondContact OD1-NH1 2.99Å; D865-R1246 IonicContact OD2-NH1 3.58Å; D865-R1246 PolarHBondContact OD2-NH1 3.31Å
866	N	60.9	Low	56.9	Low	75 Å²	75	80.5 Å²	80.5	40%	0.401	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.4	-19.4	174.8	-75	3.7	0	0	0	114	Q874	N866-Q874 PolarHBondContact O-NE2 3.34Å
867	S	59.7	Low	57	Low	75 Å²	75	79.9 Å²	79.9	52%	0.524	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.5	-10.7	177.2	64.7	0	0	0	0	114.8	D865	D865-S867 PolarHBondContact O-N 3.21Å
868	N	61.8	Low	56.5	Low	69 Å²	69	75.6 Å²	75.6	37%	0.369	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119	-18	-175.3	-67.7	-54.7	0	0	0	113.1	D865	D865-N868 PolarHBondContact O-N 3.17Å; D865-N868 PolarHBondContact OD2-ND2 3.31Å
869	T	63.2	Low	56.1	Low	27 Å²	27	76.8 Å²	76.8	17%	0.166	41%	0.407	C	S	.	.	S	Bend	trans	-82	148.2	173.4	38.7	0	0	0	0	111.8	L864 D865 Q874	L864-T869 HydrophobicContact CB-CG2 3.73Å; L864-T869 HydrophobicContact CD2-CG2 4.02Å; L864-T869 HydrophobicContact CG-CG2 4.37Å; D865-T869 PolarHBondContact O-N 3.1Å; D865-T869 VanDerWaalsContact O-N 3.13Å; D865-T869 PolarHBondContact O-OG1 3.45Å; T869-Q874 PolarHBondContact OG1-NE2 2.84Å
870	R	61.4	Low	55.5	Low	112 Å²	112	79.5 Å²	79.5	42%	0.423	43%	0.427	S	S	.	.			trans	-75.8	140.5	170.2	-75.5	179.8	165.7	-176.1	-7.9	109	L187 A872 T873 Q874	L187-R870 VanDerWaalsContact CB-NH2 3.32Å; R870-A872 VanDerWaalsContact C-N 3.28Å; R870-A872 PolarHBondContact O-N 3.4Å; R870-T873 WeakPolarHBondContact O-CA 3.48Å; R870-T873 WeakPolarHBondContact O-CB 3.4Å; R870-T873 PolarHBondContact O-N 3.44Å; R870-Q874 PolarHBondContact O-N 3.09Å; R870-Q874 VanDerWaalsContact O-N 3.15Å
871	L	57.2	Low	55.3	Low	119 Å²	119	76.6 Å²	76.6	62%	0.623	42%	0.415	S	S	*	.	H	α-helix	trans	-53.1	-41.7	-178.8	-178	62.4	0	0	0	113	T873 Q874 I875	L871-T873 VanDerWaalsContact C-N 3.27Å; L871-T873 PolarHBondContact O-N 2.82Å; L871-Q874 WeakPolarHBondContact O-CA 3.26Å; L871-Q874 WeakPolarHBondContact O-CB 3.45Å; L871-Q874 PolarHBondContact O-N 3.09Å; L871-I875 HydrophobicContact CD1-CD1 4.36Å; L871-I875 HydrophobicContact CG-CD1 3.93Å; L871-I875 WeakPolarHBondContact O-CG1 3.38Å; L871-I875 PolarHBondContact O-N 3.14Å
872	A	60.5	Low	55.5	Low	57 Å²	57	76 Å²	76	47%	0.471	41%	0.409	S	S	.	.	H	α-helix	trans	-56.5	-40.3	173.8	0	0	0	0	0	112.7	R870 Q874 I875 D876	R870-A872 VanDerWaalsContact C-N 3.28Å; R870-A872 PolarHBondContact O-N 3.4Å; A872-Q874 VanDerWaalsContact C-N 3.28Å; A872-Q874 PolarHBondContact O-N 2.82Å; A872-I875 PolarHBondContact O-N 3.39Å; A872-I875 VanDerWaalsContact O-N 3.13Å; A872-D876 PolarHBondContact O-N 2.9Å
873	T	58.3	Low	55.7	Low	62 Å²	62	69.3 Å²	69.3	38%	0.38	39%	0.389	S	S	.	.	H	α-helix	trans	-74	-17.3	177.2	-37.2	0	0	0	0	113.1	R870 L871 R877	R870-T873 WeakPolarHBondContact O-CA 3.48Å; R870-T873 WeakPolarHBondContact O-CB 3.4Å; R870-T873 PolarHBondContact O-N 3.44Å; L871-T873 VanDerWaalsContact C-N 3.27Å; L871-T873 PolarHBondContact O-N 2.82Å; T873-R877 WeakPolarHBondContact O-CD 3.29Å; T873-R877 VanDerWaalsContact O-CG 3.28Å; T873-R877 WeakPolarHBondContact O-CG 3.4Å
874	Q	58.9	Low	55.9	Low	65 Å²	65	71 Å²	71	30%	0.304	40%	0.404	S	S	.	.	H	α-helix	trans	-82.3	-25.9	168.5	-60.3	169.2	-4.4	0	0	111.7	N866 T869 R870 L871 A872	N866-Q874 PolarHBondContact O-NE2 3.34Å; T869-Q874 PolarHBondContact OG1-NE2 2.84Å; R870-Q874 PolarHBondContact O-N 3.09Å; R870-Q874 VanDerWaalsContact O-N 3.15Å; L871-Q874 WeakPolarHBondContact O-CA 3.26Å; L871-Q874 WeakPolarHBondContact O-CB 3.45Å; L871-Q874 PolarHBondContact O-N 3.09Å; A872-Q874 VanDerWaalsContact C-N 3.28Å; A872-Q874 PolarHBondContact O-N 2.82Å
875	I	54.9	Low	56.3	Low	82 Å²	82	69.4 Å²	69.4	42%	0.421	40%	0.396	S	S	.	.	H	α-helix	trans	-83	-42.7	178.1	-66	159.8	0	0	0	111.2	F228 L871 A872 R877	F228-I875 HydrophobicContact CD2-CG2 4.2Å; F228-I875 HydrophobicContact CE2-CD1 3.62Å; F228-I875 HydrophobicContact CE2-CG1 4.18Å; F228-I875 HydrophobicContact CE2-CG2 4.23Å; F228-I875 HydrophobicContact CZ-CD1 4.06Å; L871-I875 HydrophobicContact CD1-CD1 4.36Å; L871-I875 HydrophobicContact CG-CD1 3.93Å; L871-I875 WeakPolarHBondContact O-CG1 3.38Å; L871-I875 PolarHBondContact O-N 3.14Å; A872-I875 PolarHBondContact O-N 3.39Å; A872-I875 VanDerWaalsContact O-N 3.13Å; I875-R877 PolarHBondContact O-N 3.14Å
876	D	53	Low	56.8	Low	83 Å²	83	69.6 Å²	69.6	44%	0.444	40%	0.397	S	S	.	.	S	Bend	trans	-70	-20.4	177.6	-76.6	-42.9	0	0	0	113	A872 G878	A872-D876 PolarHBondContact O-N 2.9Å; D876-G878 PolarHBondContact O-N 3.44Å
877	R	52.6	Low	57.5	Low	77 Å²	77	67.1 Å²	67.1	29%	0.291	38%	0.384	S	S	.	.	S	Bend	trans	-85	102.7	167.6	-72.6	-179.3	-176.6	-160.6	-1.2	109.2	T873 I875 D882	T873-R877 WeakPolarHBondContact O-CD 3.29Å; T873-R877 VanDerWaalsContact O-CG 3.28Å; T873-R877 WeakPolarHBondContact O-CG 3.4Å; I875-R877 PolarHBondContact O-N 3.14Å; R877-D882 WeakPolarHBondContact CD-OD2 3.46Å; R877-D882 IonicContact CZ-OD1 2.76Å; R877-D882 IonicContact NH1-OD1 3.24Å; R877-D882 PolarHBondContact NH1-OD1 3.34Å; R877-D882 IonicContact NH1-OD2 2.66Å; R877-D882 PolarHBondContact NH1-OD2 2.83Å; R877-D882 VanDerWaalsContact NH1-OD2 3.09Å
878	G	49.7	Very low	58.5	Low	35 Å²	35	63.8 Å²	63.8	36%	0.361	36%	0.361	S	S	.	.			trans	-56	155	166.3	0	0	0	0	0	111	D876 T880 T881	D876-G878 PolarHBondContact O-N 3.44Å; G878-T880 PolarHBondContact O-N 2.96Å; G878-T881 PolarHBondContact O-OG1 2.88Å
879	P	46.1	Very low	59.5	Low	106 Å²	106	60.8 Å²	60.8	69%	0.688	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-0.4	-171.1	25.6	-35.3	0	0	0	115.1
880	T	45.7	Very low	60.6	Low	85 Å²	85	60.5 Å²	60.5	52%	0.521	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.5	2.4	-161	83.3	0	0	0	0	114.2	G878 S1263	G878-T880 PolarHBondContact O-N 2.96Å; T880-S1263 WeakPolarHBondContact CA-OG 3.39Å; T880-S1263 WeakPolarHBondContact CB-OG 3.26Å; T880-S1263 WeakPolarHBondContact CG2-OG 3.44Å
881	T	47.6	Very low	61.9	Low	85 Å²	85	55.1 Å²	55.1	52%	0.521	32%	0.321	S	S	.	.	S	Bend	trans	-125.8	-7.4	-160.2	51.7	0	0	0	0	116.6	G878	G878-T881 PolarHBondContact O-OG1 2.88Å
882	D	54.3	Low	63.3	Low	47 Å²	47	50.6 Å²	50.6	25%	0.251	30%	0.296	S	S	.	.			trans	-98.6	9	-170.3	-95.6	-42.8	0	0	0	115.4	R877 S884 N885 L886	R877-D882 WeakPolarHBondContact CD-OD2 3.46Å; R877-D882 IonicContact CZ-OD1 2.76Å; R877-D882 IonicContact NH1-OD1 3.24Å; R877-D882 PolarHBondContact NH1-OD1 3.34Å; R877-D882 IonicContact NH1-OD2 2.66Å; R877-D882 PolarHBondContact NH1-OD2 2.83Å; R877-D882 VanDerWaalsContact NH1-OD2 3.09Å; D882-S884 PolarHBondContact O-N 3.24Å; D882-N885 WeakPolarHBondContact O-CA 3.18Å; D882-N885 WeakPolarHBondContact O-CB 3.38Å; D882-N885 PolarHBondContact O-N 2.82Å; D882-N885 PolarHBondContact OD1-ND2 3.04Å; D882-L886 PolarHBondContact O-N 3.25Å; D882-L886 VanDerWaalsContact O-N 3.09Å
883	D	55.2	Low	64.6	Low	65 Å²	65	48.2 Å²	48.2	35%	0.348	28%	0.276	S	S	.	.	H	α-helix	trans	-55.8	-35.7	-179.9	-134.7	14.2	0	0	0	112.4	N885 L886 N887 R1260	D883-N885 PolarHBondContact O-N 2.85Å; D883-L886 PolarHBondContact O-N 3.07Å; D883-N887 VanDerWaalsContact O-CB 3.31Å; D883-N887 WeakPolarHBondContact O-CB 3.3Å; D883-N887 PolarHBondContact O-N 2.9Å; D883-N887 PolarHBondContact O-ND2 3.16Å; D883-R1260 IonicContact OD1-CZ 3.93Å; D883-R1260 IonicContact OD1-NE 3.26Å; D883-R1260 IonicContact OD1-NH1 2.92Å; D883-R1260 PolarHBondContact OD1-NH1 3.26Å
884	S	58.3	Low	66.1	Low	66 Å²	66	45.5 Å²	45.5	46%	0.462	26%	0.259	S	S	.	.	H	α-helix	trans	-62	-38.6	171.7	-63	0	0	0	0	113.2	D882 N887 A888 I1339	D882-S884 PolarHBondContact O-N 3.24Å; S884-N887 PolarHBondContact O-N 3.2Å; S884-A888 PolarHBondContact O-N 3.48Å; S884-I1339 WeakPolarHBondContact O-CG2 3.28Å
885	N	65.8	Low	67.6	Low	47 Å²	47	42.6 Å²	42.6	25%	0.251	25%	0.245	S	C	.	.	H	α-helix	trans	-73.5	-36.6	178.4	-76.2	-52.6	0	0	0	111.5	H863 D882 D883 A888	H863-N885 PolarHBondContact NE2-O 3.16Å; D882-N885 WeakPolarHBondContact O-CA 3.18Å; D882-N885 WeakPolarHBondContact O-CB 3.38Å; D882-N885 PolarHBondContact O-N 2.82Å; D882-N885 PolarHBondContact OD1-ND2 3.04Å; D883-N885 PolarHBondContact O-N 2.85Å; N885-A888 WeakPolarHBondContact O-CB 3.48Å; N885-A888 PolarHBondContact O-N 3.46Å
886	L	67.4	Low	69.1	Low	22 Å²	22	41.8 Å²	41.8	12%	0.115	24%	0.237	C	C	.	.	H	α-helix	trans	-56.8	-51	170.2	-66.6	176.9	0	0	0	111	D882 D883 A888 I889 E1240 N1241	D882-L886 PolarHBondContact O-N 3.25Å; D882-L886 VanDerWaalsContact O-N 3.09Å; D883-L886 PolarHBondContact O-N 3.07Å; L886-A888 PolarHBondContact O-N 3.13Å; L886-I889 WeakPolarHBondContact O-CG1 3.45Å; L886-I889 PolarHBondContact O-N 2.92Å; L886-E1240 HydrophobicContact CD2-CB 3.6Å; L886-N1241 VanDerWaalsContact CD2-OD1 3.26Å; L886-N1241 WeakPolarHBondContact CD2-OD1 3.44Å
887	N	76.9	Confident	70.9	Confident	23 Å²	23	38 Å²	38	12%	0.123	22%	0.218	C	C	.	.	H	α-helix	trans	-63.4	-24.4	-177.6	-76.2	-28.5	0	0	0	114	D883 S884 I889 F890 F951 I1339	D883-N887 VanDerWaalsContact O-CB 3.31Å; D883-N887 WeakPolarHBondContact O-CB 3.3Å; D883-N887 PolarHBondContact O-N 2.9Å; D883-N887 PolarHBondContact O-ND2 3.16Å; S884-N887 PolarHBondContact O-N 3.2Å; N887-I889 PolarHBondContact O-N 2.97Å; N887-F890 PolarHBondContact O-N 2.88Å; N887-F951 HydrophobicContact CB-CD2 3.66Å; N887-F951 HydrophobicContact CB-CE2 3.56Å; N887-I1339 HydrophobicContact CB-CD1 4.09Å; N887-I1339 HydrophobicContact CB-CG2 4.36Å
888	A	80.2	Confident	72.7	Confident	5 Å²	5	34.4 Å²	34.4	4%	0.041	20%	0.204	C	C	.	.	H	α-helix	trans	-63.1	-25.5	177.1	0	0	0	0	0	114.1	S884 N885 L886 F890 Y891 E892 I1339 Y1340	S884-A888 PolarHBondContact O-N 3.48Å; N885-A888 WeakPolarHBondContact O-CB 3.48Å; N885-A888 PolarHBondContact O-N 3.46Å; L886-A888 PolarHBondContact O-N 3.13Å; A888-F890 VanDerWaalsContact C-N 3.33Å; A888-F890 PolarHBondContact O-N 2.77Å; A888-Y891 PolarHBondContact O-N 2.95Å; A888-E892 PolarHBondContact O-N 3.43Å; A888-I1339 HydrophobicContact CB-CG2 3.89Å; A888-Y1340 HydrophobicContact CB-CD2 4.24Å
889	I	83	Confident	74.6	Confident	7 Å²	7	36.1 Å²	36.1	4%	0.036	20%	0.203	C	C	.	.	H	α-helix	trans	-65.9	-36.1	-176.5	-56.7	174.6	0	0	0	111.3	L886 N887 Y891 E892 H893 R1246 V1249	L886-I889 WeakPolarHBondContact O-CG1 3.45Å; L886-I889 PolarHBondContact O-N 2.92Å; N887-I889 PolarHBondContact O-N 2.97Å; I889-Y891 VanDerWaalsContact C-N 3.32Å; I889-Y891 PolarHBondContact O-N 2.89Å; I889-E892 PolarHBondContact O-N 2.88Å; I889-H893 PolarHBondContact O-N 2.75Å; I889-R1246 HydrophobicContact CD1-CB 4.28Å; I889-R1246 HydrophobicContact CD1-CG 4.33Å; I889-R1246 HydrophobicContact CG2-CG 4.18Å; I889-V1249 HydrophobicContact CG2-CB 4.25Å; I889-V1249 HydrophobicContact CG2-CG1 3.86Å
890	F	85.9	Confident	76.6	Confident	20 Å²	20	35.9 Å²	35.9	9%	0.088	19%	0.192	C	C	.	.	H	α-helix	trans	-64	-37.4	176.3	-59.2	-70.3	0	0	0	112.1	N887 A888 H893 L894 L928 F951 V1014 L1275	N887-F890 PolarHBondContact O-N 2.88Å; A888-F890 VanDerWaalsContact C-N 3.33Å; A888-F890 PolarHBondContact O-N 2.77Å; F890-H893 PolarHBondContact O-N 2.84Å; F890-L894 WeakPolarHBondContact O-CB 3.46Å; F890-L894 PolarHBondContact O-N 3.23Å; F890-L928 HydrophobicContact CB-CD2 4.26Å; F890-F951 HydrophobicContact CB-CZ 4.1Å; F890-F951 HydrophobicContact CD2-CE2 4.21Å; F890-F951 AromaticContact CD2-CZ 3.66Å; F890-F951 HydrophobicContact CD2-CZ 3.66Å; F890-F951 HydrophobicContact CE2-CZ 4.46Å; F890-F951 HydrophobicContact CG-CZ 4.12Å; F890-V1014 HydrophobicContact CZ-CG2 4.5Å; F890-L1275 HydrophobicContact CE1-CD1 3.83Å; F890-L1275 HydrophobicContact CE1-CD2 3.92Å; F890-L1275 HydrophobicContact CZ-CD1 4.06Å; F890-L1275 HydrophobicContact CZ-CD2 3.95Å
891	Y	89.3	Confident	78.6	Confident	0 Å²	0	33 Å²	33	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-73.4	-31.1	174.9	-65.1	-62.6	0	0	0	112.8	A888 I889 L894 T895 L928 N929 C930 L946 L949 F951 I1339	A888-Y891 PolarHBondContact O-N 2.95Å; I889-Y891 VanDerWaalsContact C-N 3.32Å; I889-Y891 PolarHBondContact O-N 2.89Å; Y891-L894 HydrophobicContact CD1-CD2 4.32Å; Y891-T895 WeakPolarHBondContact O-CB 3.45Å; Y891-T895 PolarHBondContact O-N 2.96Å; Y891-T895 PolarHBondContact O-OG1 2.91Å; Y891-L928 HydrophobicContact CD1-CD2 4.25Å; Y891-L928 HydrophobicContact CE1-CD2 3.63Å; Y891-N929 PolarHBondContact OH-N 3.29Å; Y891-N929 PolarHBondContact OH-O 3.28Å; Y891-C930 HydrophobicContact CD1-CB 4.05Å; Y891-C930 HydrophobicContact CE1-CB 3.86Å; Y891-L946 HydrophobicContact CD1-CD2 4.22Å; Y891-L946 HydrophobicContact CG-CD2 4.47Å; Y891-L949 VanDerWaalsContact CE2-O 3.23Å; Y891-L949 WeakPolarHBondContact CE2-O 3.48Å; Y891-L949 PolarHBondContact OH-O 3.06Å; Y891-F951 HydrophobicContact CE2-CD2 4.28Å; Y891-F951 AromaticContact CE2-CE2 3.78Å; Y891-F951 HydrophobicContact CE2-CE2 3.78Å; Y891-I1339 HydrophobicContact CD2-CG2 4.07Å; Y891-I1339 HydrophobicContact CE2-CG2 4.21Å
892	E	85.5	Confident	80.7	Confident	23 Å²	23	29 Å²	29	11%	0.107	15%	0.148	C	C	.	.	H	α-helix	trans	-64.6	-44.7	169	-174.1	178.5	-173.2	0	0	111.3	A888 I889 T895 R896 R1246 L1250 Y1340	A888-E892 PolarHBondContact O-N 3.43Å; I889-E892 PolarHBondContact O-N 2.88Å; E892-T895 PolarHBondContact O-N 3.5Å; E892-R896 WeakPolarHBondContact O-CG 3.38Å; E892-R896 PolarHBondContact O-N 2.89Å; E892-R896 VanDerWaalsContact O-N 3.13Å; E892-R896 IonicContact OE1-CZ 3.15Å; E892-R896 IonicContact OE1-NE 3.65Å; E892-R896 IonicContact OE1-NH2 2.77Å; E892-R896 PolarHBondContact OE1-NH2 3.27Å; E892-R1246 IonicContact OE1-NH2 2.76Å; E892-R1246 PolarHBondContact OE1-NH2 3.33Å; E892-R1246 IonicContact OE2-CZ 3.78Å; E892-R1246 IonicContact OE2-NE 3.94Å; E892-R1246 PolarHBondContact OE2-NE 3.27Å; E892-R1246 IonicContact OE2-NH2 3.33Å; E892-R1246 PolarHBondContact OE2-NH2 2.95Å; E892-L1250 HydrophobicContact CB-CD2 4.26Å; E892-L1250 HydrophobicContact CG-CD2 3.95Å; E892-Y1340 HydrophobicContact CB-CE2 4.16Å
893	H	88.2	Confident	82.4	Confident	7 Å²	7	27 Å²	27	3%	0.032	14%	0.138	C	C	.	.	H	α-helix	trans	-59.6	-49.9	174.1	175.1	101.3	0	0	0	111.4	I889 F890 T895 R896 S897 Y1012 V1249 L1250 N1252	I889-H893 PolarHBondContact O-N 2.75Å; F890-H893 PolarHBondContact O-N 2.84Å; H893-T895 VanDerWaalsContact C-N 3.29Å; H893-T895 PolarHBondContact O-N 3.07Å; H893-R896 PolarHBondContact O-N 3.23Å; H893-R896 VanDerWaalsContact O-N 3.07Å; H893-S897 PolarHBondContact O-N 3.05Å; H893-Y1012 AromaticContact CE1-CE2 3.5Å; H893-Y1012 AromaticContact ND1-CE2 3.63Å; H893-V1249 PolarHBondContact ND1-O 2.82Å; H893-L1250 HydrophobicContact CB-CD2 4Å; H893-N1252 VanDerWaalsContact CE1-CG 3.48Å; H893-N1252 PolarHBondContact CE1-OD1 3.5Å; H893-N1252 PolarHBondContact ND1-OD1 2.98Å
894	L	90.3	Very high	83.9	Confident	5 Å²	5	23.9 Å²	23.9	3%	0.026	12%	0.121	C	C	.	.	H	α-helix	trans	-58.8	-39.9	177.7	-174	64.1	0	0	0	112	F890 Y891 R896 S897 L898 L946 L1009 F1282	F890-L894 WeakPolarHBondContact O-CB 3.46Å; F890-L894 PolarHBondContact O-N 3.23Å; Y891-L894 HydrophobicContact CD1-CD2 4.32Å; L894-R896 VanDerWaalsContact C-N 3.34Å; L894-R896 PolarHBondContact O-N 3.44Å; L894-S897 WeakPolarHBondContact O-CB 3.44Å; L894-S897 PolarHBondContact O-N 3.22Å; L894-L898 HydrophobicContact CG-CD1 4.19Å; L894-L898 WeakPolarHBondContact O-CB 3.5Å; L894-L898 WeakPolarHBondContact O-CG 3.48Å; L894-L898 PolarHBondContact O-N 3.48Å; L894-L946 HydrophobicContact CD2-CD1 4.2Å; L894-L946 HydrophobicContact CG-CD1 4.27Å; L894-L1009 HydrophobicContact CD1-CB 4.47Å; L894-L1009 HydrophobicContact CD1-CD1 3.56Å; L894-F1282 HydrophobicContact CD1-CE2 3.92Å; L894-F1282 HydrophobicContact CD1-CZ 3.77Å; L894-F1282 HydrophobicContact CD2-CE1 4.35Å; L894-F1282 HydrophobicContact CD2-CZ 4.12Å
895	T	89.8	Confident	85.4	Confident	4 Å²	4	21 Å²	21	3%	0.025	10%	0.101	C	C	.	.	H	α-helix	trans	-61.2	-40.9	175.2	-59.4	0	0	0	0	111.7	Y891 E892 H893 Q899 F944 T1345	Y891-T895 WeakPolarHBondContact O-CB 3.45Å; Y891-T895 PolarHBondContact O-N 2.96Å; Y891-T895 PolarHBondContact O-OG1 2.91Å; E892-T895 PolarHBondContact O-N 3.5Å; H893-T895 VanDerWaalsContact C-N 3.29Å; H893-T895 PolarHBondContact O-N 3.07Å; T895-Q899 WeakPolarHBondContact O-CB 3.41Å; T895-Q899 PolarHBondContact O-N 2.82Å; T895-F944 HydrophobicContact CG2-CE2 4.37Å; T895-T1345 HydrophobicContact CG2-CG2 3.84Å
896	R	87.1	Confident	86.5	Confident	65 Å²	65	19.9 Å²	19.9	25%	0.245	10%	0.095	C	C	.	.	H	α-helix	trans	-70.8	-38.4	176.6	-66.6	176.7	-174.2	-171.1	4.8	112.4	E892 H893 L894 Q899 Q900	E892-R896 WeakPolarHBondContact O-CG 3.38Å; E892-R896 PolarHBondContact O-N 2.89Å; E892-R896 VanDerWaalsContact O-N 3.13Å; E892-R896 IonicContact OE1-CZ 3.15Å; E892-R896 IonicContact OE1-NE 3.65Å; E892-R896 IonicContact OE1-NH2 2.77Å; E892-R896 PolarHBondContact OE1-NH2 3.27Å; H893-R896 PolarHBondContact O-N 3.23Å; H893-R896 VanDerWaalsContact O-N 3.07Å; L894-R896 VanDerWaalsContact C-N 3.34Å; L894-R896 PolarHBondContact O-N 3.44Å; R896-Q899 WeakPolarHBondContact O-CB 3.43Å; R896-Q899 PolarHBondContact O-N 3.24Å; R896-Q900 PolarHBondContact O-N 2.98Å
897	S	89	Confident	87.3	Confident	5 Å²	5	20.3 Å²	20.3	4%	0.035	10%	0.102	C	C	.	.	H	α-helix	trans	-57.9	-49.9	172.4	-173	0	0	0	0	110.5	H893 L894 Q899 Q900 H901 D1010	H893-S897 PolarHBondContact O-N 3.05Å; L894-S897 WeakPolarHBondContact O-CB 3.44Å; L894-S897 PolarHBondContact O-N 3.22Å; S897-Q899 PolarHBondContact O-N 2.86Å; S897-Q900 PolarHBondContact O-N 2.92Å; S897-H901 PolarHBondContact O-N 3.47Å; S897-H901 PolarHBondContact O-ND1 3.2Å; S897-D1010 PolarHBondContact OG-O 3.42Å
898	L	91.2	Very high	87.8	Confident	0 Å²	0	19.2 Å²	19.2	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-62	-38.8	173.3	-73.7	164.3	0	0	0	113	L894 Q900 H901 L902 L923 I932 F944 L946 Y1007 L1009	L894-L898 HydrophobicContact CG-CD1 4.19Å; L894-L898 WeakPolarHBondContact O-CB 3.5Å; L894-L898 WeakPolarHBondContact O-CG 3.48Å; L894-L898 PolarHBondContact O-N 3.48Å; L898-Q900 PolarHBondContact O-N 3.43Å; L898-H901 PolarHBondContact O-N 2.96Å; L898-L902 HydrophobicContact CD2-CD1 4.5Å; L898-L902 WeakPolarHBondContact O-CB 3.41Å; L898-L902 PolarHBondContact O-N 2.94Å; L898-L923 HydrophobicContact CD1-CD1 4.3Å; L898-L923 HydrophobicContact CD2-CD1 4.42Å; L898-I932 HydrophobicContact CD1-CD1 3.64Å; L898-I932 HydrophobicContact CD1-CG1 4.45Å; L898-I932 HydrophobicContact CD2-CD1 4.23Å; L898-F944 HydrophobicContact CB-CE1 4.47Å; L898-F944 HydrophobicContact CB-CE2 4.03Å; L898-F944 HydrophobicContact CB-CZ 3.61Å; L898-F944 HydrophobicContact CD1-CE2 4.33Å; L898-L946 HydrophobicContact CD1-CD1 3.52Å; L898-Y1007 HydrophobicContact CD2-CE1 4Å; L898-L1009 HydrophobicContact CD2-CD1 3.81Å; L898-L1009 HydrophobicContact CD2-CD2 4.32Å; L898-L1009 HydrophobicContact CG-CD1 4.05Å
899	Q	90.1	Very high	88	Confident	72 Å²	72	19 Å²	19	34%	0.336	9%	0.094	S	C	.	.	H	α-helix	trans	-59.6	-35.8	178.8	-164.9	-174.4	6.6	0	0	112.2	T895 R896 S897 T1346 S1347	T895-Q899 WeakPolarHBondContact O-CB 3.41Å; T895-Q899 PolarHBondContact O-N 2.82Å; R896-Q899 WeakPolarHBondContact O-CB 3.43Å; R896-Q899 PolarHBondContact O-N 3.24Å; S897-Q899 PolarHBondContact O-N 2.86Å; Q899-T1346 WeakPolarHBondContact CG-O 3.35Å; Q899-T1346 PolarHBondContact NE2-O 3.4Å; Q899-S1347 WeakPolarHBondContact O-CA 3.45Å; Q899-S1347 WeakPolarHBondContact O-CB 3.34Å
900	Q	87.2	Confident	88.1	Confident	101 Å²	101	19.8 Å²	19.8	47%	0.472	10%	0.097	S	C	.	.	H	α-helix	trans	-77.6	-37.1	178.1	-68.2	175.5	-5.2	0	0	112.9	R896 S897 L898 T1351 H1352	R896-Q900 PolarHBondContact O-N 2.98Å; S897-Q900 PolarHBondContact O-N 2.92Å; L898-Q900 PolarHBondContact O-N 3.43Å; Q900-T1351 CarbonylContact O-C 3.53Å; Q900-T1351 PolarHBondContact O-OG1 3.28Å; Q900-H1352 PolarHBondContact O-N 2.9Å
901	H	89.3	Confident	88.1	Confident	23 Å²	23	18.9 Å²	18.9	11%	0.106	9%	0.093	C	C	.	.	H	α-helix	trans	-101.5	-39.2	-166.8	-65	86.6	0	0	0	114.8	S897 L898 A903 G904 D905 H1352	S897-H901 PolarHBondContact O-N 3.47Å; S897-H901 PolarHBondContact O-ND1 3.2Å; L898-H901 PolarHBondContact O-N 2.96Å; H901-A903 PolarHBondContact O-N 2.94Å; H901-G904 WeakPolarHBondContact O-CA 3.41Å; H901-G904 PolarHBondContact O-N 3.31Å; H901-D905 PolarHBondContact O-N 2.99Å; H901-H1352 AromaticContact CD2-CD2 3.53Å; H901-H1352 AromaticContact CD2-NE2 3.9Å
902	L	91.5	Very high	87.5	Confident	1 Å²	1	19.1 Å²	19.1	1%	0.005	10%	0.095	C	C	.	.	H	α-helix	trans	-54.4	-51.5	-162	-178.5	66.5	0	0	0	114	L898 G904 D905 L906 F911 V942 F944	L898-L902 HydrophobicContact CD2-CD1 4.5Å; L898-L902 WeakPolarHBondContact O-CB 3.41Å; L898-L902 PolarHBondContact O-N 2.94Å; L902-G904 VanDerWaalsContact C-N 3.26Å; L902-G904 PolarHBondContact O-N 3.21Å; L902-D905 PolarHBondContact O-N 3Å; L902-L906 HydrophobicContact CD1-CD1 4.1Å; L902-L906 HydrophobicContact CD1-CG 4.29Å; L902-L906 HydrophobicContact CG-CD1 3.88Å; L902-L906 HydrophobicContact CG-CG 4.49Å; L902-L906 WeakPolarHBondContact O-CB 3.4Å; L902-L906 WeakPolarHBondContact O-CD1 3.41Å; L902-L906 VanDerWaalsContact O-CG 3.24Å; L902-L906 WeakPolarHBondContact O-CG 3.19Å; L902-L906 PolarHBondContact O-N 3.34Å; L902-F911 HydrophobicContact CD1-CB 4.29Å; L902-F911 HydrophobicContact CD1-CD1 4.1Å; L902-F911 HydrophobicContact CD1-CD2 3.6Å; L902-F911 HydrophobicContact CD1-CE1 4.33Å; L902-F911 HydrophobicContact CD1-CE2 3.83Å; L902-F911 HydrophobicContact CD1-CG 3.74Å; L902-F911 HydrophobicContact CD1-CZ 4.2Å; L902-V942 HydrophobicContact CD2-CG1 4.32Å; L902-F944 HydrophobicContact CD2-CD1 3.49Å; L902-F944 VanDerWaalsContact CD2-CD1 3.49Å; L902-F944 HydrophobicContact CD2-CE1 3.78Å; L902-F944 HydrophobicContact CD2-CG 3.99Å; L902-F944 HydrophobicContact CD2-CZ 4.49Å
903	A	88.6	Confident	86.8	Confident	5 Å²	5	19.8 Å²	19.8	4%	0.041	10%	0.102	C	C	.	.	H	α-helix	trans	-64.8	-27	179.5	0	0	0	0	0	113.6	H901 A907	H901-A903 PolarHBondContact O-N 2.94Å; A903-A907 PolarHBondContact O-N 3.07Å
904	G	88.3	Confident	86.2	Confident	0 Å²	0	22.4 Å²	22.4	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-77.3	-44.5	173.3	0	0	0	0	0	112.4	H901 L902 L906 A907 L908	H901-G904 WeakPolarHBondContact O-CA 3.41Å; H901-G904 PolarHBondContact O-N 3.31Å; L902-G904 VanDerWaalsContact C-N 3.26Å; L902-G904 PolarHBondContact O-N 3.21Å; G904-L906 VanDerWaalsContact C-N 3.3Å; G904-L906 PolarHBondContact O-N 3.33Å; G904-A907 PolarHBondContact O-N 3.33Å; G904-L908 WeakPolarHBondContact O-CG 3.06Å; G904-L908 PolarHBondContact O-N 2.75Å; G904-L908 VanDerWaalsContact O-N 3.09Å
905	D	89.7	Confident	85.7	Confident	6 Å²	6	23.8 Å²	23.8	3%	0.032	12%	0.121	C	C	.	.	H	α-helix	trans	-69.1	-27.4	178.1	-79	-39.4	0	0	0	112.8	H901 L902 L908 G909 R910 Y1007 H1352	H901-D905 PolarHBondContact O-N 2.99Å; L902-D905 PolarHBondContact O-N 3Å; D905-L908 CarbonylContact O-C 3.42Å; D905-L908 PolarHBondContact O-N 3.38Å; D905-G909 PolarHBondContact O-N 3.33Å; D905-R910 HydrophobicContact CB-CB 4.05Å; D905-R910 WeakPolarHBondContact O-CB 3.32Å; D905-R910 PolarHBondContact O-N 2.87Å; D905-R910 WeakPolarHBondContact OD1-CD 3.37Å; D905-R910 IonicContact OD1-CZ 3.05Å; D905-R910 IonicContact OD1-NE 2.67Å; D905-R910 IonicContact OD1-NH1 2.65Å; D905-R910 PolarHBondContact OD1-NH1 2.99Å; D905-Y1007 HydrophobicContact CB-CE2 4.03Å; D905-H1352 IonicContact OD1-CE1 3.12Å; D905-H1352 IonicContact OD1-NE2 2.96Å
906	L	89	Confident	85.4	Confident	23 Å²	23	25.7 Å²	25.7	12%	0.12	13%	0.13	C	C	.	.	H	α-helix	trans	-66.8	-43.7	168.3	-75.9	166.4	0	0	0	112.4	L902 G904 L908 G909 F911 A912 L915 V942	L902-L906 HydrophobicContact CD1-CD1 4.1Å; L902-L906 HydrophobicContact CD1-CG 4.29Å; L902-L906 HydrophobicContact CG-CD1 3.88Å; L902-L906 HydrophobicContact CG-CG 4.49Å; L902-L906 WeakPolarHBondContact O-CB 3.4Å; L902-L906 WeakPolarHBondContact O-CD1 3.41Å; L902-L906 VanDerWaalsContact O-CG 3.24Å; L902-L906 WeakPolarHBondContact O-CG 3.19Å; L902-L906 PolarHBondContact O-N 3.34Å; G904-L906 VanDerWaalsContact C-N 3.3Å; G904-L906 PolarHBondContact O-N 3.33Å; L906-L908 PolarHBondContact O-N 3.39Å; L906-G909 WeakPolarHBondContact O-CA 3.17Å; L906-G909 PolarHBondContact O-N 3.38Å; L906-F911 HydrophobicContact CD2-CB 3.89Å; L906-F911 HydrophobicContact CD2-CD1 4Å; L906-F911 HydrophobicContact CD2-CG 4.33Å; L906-F911 HydrophobicContact CG-CB 4.25Å; L906-A912 WeakPolarHBondContact CD2-O 3.33Å; L906-L915 HydrophobicContact CD1-CD2 3.6Å; L906-L915 HydrophobicContact CD2-CD1 4.03Å; L906-L915 HydrophobicContact CD2-CD2 3.88Å; L906-L915 HydrophobicContact CD2-CG 4.41Å; L906-L915 HydrophobicContact CG-CD2 4.41Å; L906-V942 HydrophobicContact CD1-CB 4.22Å; L906-V942 HydrophobicContact CD1-CG1 4.36Å; L906-V942 HydrophobicContact CD1-CG2 3.67Å
907	A	84	Confident	85.4	Confident	32 Å²	32	24.9 Å²	24.9	26%	0.264	13%	0.133	S	C	.	.	H	α-helix	trans	-65.1	-21.5	173.4	0	0	0	0	0	113.1	A903 G904 I1355	A903-A907 PolarHBondContact O-N 3.07Å; G904-A907 PolarHBondContact O-N 3.33Å; A907-I1355 HydrophobicContact CB-CD1 3.68Å
908	L	86.7	Confident	85.2	Confident	0 Å²	0	24.9 Å²	24.9	0%	0	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.9	-0.7	169.7	-62.9	173.5	0	0	0	113.5	R682 E715 A719 G904 D905 L906 R910 I1358	R682-L908 PolarHBondContact NH1-O 2.92Å; R682-L908 PolarHBondContact NH2-O 3.38Å; R682-L908 VanDerWaalsContact NH2-O 3.14Å; E715-L908 HydrophobicContact CB-CB 4.47Å; E715-L908 HydrophobicContact CB-CD2 4.37Å; A719-L908 HydrophobicContact CB-CD2 4.31Å; G904-L908 WeakPolarHBondContact O-CG 3.06Å; G904-L908 PolarHBondContact O-N 2.75Å; G904-L908 VanDerWaalsContact O-N 3.09Å; D905-L908 CarbonylContact O-C 3.42Å; D905-L908 PolarHBondContact O-N 3.38Å; L906-L908 PolarHBondContact O-N 3.39Å; L908-R910 VanDerWaalsContact C-N 3.26Å; L908-R910 HydrophobicContact CB-CG 4.11Å; L908-R910 PolarHBondContact O-N 2.7Å; L908-I1358 HydrophobicContact CD2-CD1 3.68Å
909	G	83.7	Confident	85.2	Confident	1 Å²	1	25.1 Å²	25.1	1%	0.01	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	65.6	18.2	-179	0	0	0	0	0	115.4	R682 D905 L906	R682-G909 VanDerWaalsContact CZ-C 3.48Å; R682-G909 PolarHBondContact NE-O 3.22Å; R682-G909 PolarHBondContact NH1-O 3.36Å; R682-G909 VanDerWaalsContact NH1-O 3.07Å; D905-G909 PolarHBondContact O-N 3.33Å; L906-G909 WeakPolarHBondContact O-CA 3.17Å; L906-G909 PolarHBondContact O-N 3.38Å
910	R	85.8	Confident	85.3	Confident	23 Å²	23	21.8 Å²	21.8	9%	0.087	12%	0.12	C	C	.	.	S	Bend	trans	-77.9	-35	-173.5	-76.4	167.9	168.2	-179.7	-1.2	114.5	A709 E715 D905 L908 T1004	A709-R910 PolarHBondContact O-NH2 3.26Å; E715-R910 VanDerWaalsContact CD-NE 3.33Å; E715-R910 WeakPolarHBondContact OE1-CG 3.4Å; E715-R910 IonicContact OE1-CZ 3.8Å; E715-R910 IonicContact OE1-NE 3.14Å; E715-R910 PolarHBondContact OE1-NE 3.48Å; E715-R910 IonicContact OE1-NH2 3.72Å; E715-R910 IonicContact OE2-CZ 2.83Å; E715-R910 IonicContact OE2-NE 3.07Å; E715-R910 PolarHBondContact OE2-NE 3.31Å; E715-R910 IonicContact OE2-NH2 3.96Å; E715-R910 PolarHBondContact OE2-NH2 3.31Å; D905-R910 HydrophobicContact CB-CB 4.05Å; D905-R910 WeakPolarHBondContact O-CB 3.32Å; D905-R910 PolarHBondContact O-N 2.87Å; D905-R910 WeakPolarHBondContact OD1-CD 3.37Å; D905-R910 IonicContact OD1-CZ 3.05Å; D905-R910 IonicContact OD1-NE 2.67Å; D905-R910 IonicContact OD1-NH1 2.65Å; D905-R910 PolarHBondContact OD1-NH1 2.99Å; L908-R910 VanDerWaalsContact C-N 3.26Å; L908-R910 HydrophobicContact CB-CG 4.11Å; L908-R910 PolarHBondContact O-N 2.7Å; R910-T1004 WeakPolarHBondContact O-CG2 3.46Å
911	F	85.9	Confident	85.7	Confident	1 Å²	1	17 Å²	17	0%	0.004	10%	0.097	C	C	.	.	S	Bend	trans	-81.5	-66.4	-178.9	-174.7	-90.6	0	0	0	110.1	L902 L906 L915 F921 L923 I932 T1004 Y1007 V1284	L902-F911 HydrophobicContact CD1-CB 4.29Å; L902-F911 HydrophobicContact CD1-CD1 4.1Å; L902-F911 HydrophobicContact CD1-CD2 3.6Å; L902-F911 HydrophobicContact CD1-CE1 4.33Å; L902-F911 HydrophobicContact CD1-CE2 3.83Å; L902-F911 HydrophobicContact CD1-CG 3.74Å; L902-F911 HydrophobicContact CD1-CZ 4.2Å; L906-F911 HydrophobicContact CD2-CB 3.89Å; L906-F911 HydrophobicContact CD2-CD1 4Å; L906-F911 HydrophobicContact CD2-CG 4.33Å; L906-F911 HydrophobicContact CG-CB 4.25Å; F911-L915 HydrophobicContact CD1-CD1 4.41Å; F911-L915 HydrophobicContact CE1-CD1 4.48Å; F911-F921 HydrophobicContact CE1-CB 4.3Å; F911-F921 AromaticContact CE1-CD1 3.88Å; F911-F921 HydrophobicContact CE1-CD1 3.88Å; F911-F921 AromaticContact CE1-CD2 3.94Å; F911-F921 HydrophobicContact CE1-CD2 3.94Å; F911-F921 HydrophobicContact CE1-CE1 4.18Å; F911-F921 HydrophobicContact CE1-CE2 4.25Å; F911-F921 AromaticContact CE1-CG 3.76Å; F911-F921 HydrophobicContact CE1-CG 3.76Å; F911-F921 HydrophobicContact CE1-CZ 4.38Å; F911-F921 HydrophobicContact CZ-CB 4.1Å; F911-F921 HydrophobicContact CZ-CD1 4.41Å; F911-F921 HydrophobicContact CZ-CD2 4.47Å; F911-F921 HydrophobicContact CZ-CG 4.08Å; F911-L923 HydrophobicContact CE2-CD2 3.99Å; F911-L923 HydrophobicContact CZ-CD2 4.49Å; F911-I932 HydrophobicContact CE2-CD1 4.29Å; F911-I932 HydrophobicContact CZ-CD1 4.19Å; F911-T1004 PolarHBondContact O-OG1 2.89Å; F911-Y1007 HydrophobicContact CB-CE2 4.44Å; F911-Y1007 HydrophobicContact CD2-CD1 4.01Å; F911-Y1007 AromaticContact CD2-CE1 3.63Å; F911-Y1007 HydrophobicContact CD2-CE1 3.63Å; F911-Y1007 HydrophobicContact CD2-CE2 4.24Å; F911-Y1007 HydrophobicContact CD2-CG 4.44Å; F911-Y1007 AromaticContact CD2-CZ 3.76Å; F911-Y1007 HydrophobicContact CE2-CD1 4.34Å; F911-Y1007 HydrophobicContact CE2-CE1 4.01Å; F911-V1284 HydrophobicContact CD1-CG1 4.31Å; F911-V1284 HydrophobicContact CD2-CG1 4.3Å; F911-V1284 HydrophobicContact CD2-CG2 4.31Å; F911-V1284 HydrophobicContact CE1-CG1 3.99Å; F911-V1284 HydrophobicContact CE2-CG1 4Å; F911-V1284 HydrophobicContact CE2-CG2 4.35Å; F911-V1284 HydrophobicContact CG-CG1 4.46Å; F911-V1284 HydrophobicContact CZ-CG1 3.83Å
912	A	77.7	Confident	85.8	Confident	5 Å²	5	16 Å²	16	4%	0.041	9%	0.093	C	C	.	.			trans	-150.4	143.1	168.2	0	0	0	0	0	108.9	L906 L915 F921 K1003	L906-A912 WeakPolarHBondContact CD2-O 3.33Å; A912-L915 HydrophobicContact CB-CD1 4.33Å; A912-F921 HydrophobicContact CB-CE1 3.88Å; A912-F921 HydrophobicContact CB-CZ 4.13Å; A912-K1003 HydrophobicContact CB-CG 4.29Å
913	S	70.7	Confident	85.9	Confident	36 Å²	36	15.9 Å²	15.9	25%	0.252	9%	0.093	S	C	.	.	S	Bend	trans	-80.3	-23	178.1	-41.5	0	0	0	0	113.5
914	E	74.7	Confident	85.9	Confident	62 Å²	62	15.7 Å²	15.7	29%	0.29	9%	0.091	S	C	.	.			trans	-117.9	108.2	177	-68.9	174.7	-99.4	0	0	109.5	R782 K1286	R782-E914 IonicContact CZ-OE2 2.75Å; R782-E914 IonicContact NH2-OE2 2.76Å; R782-E914 PolarHBondContact NH2-OE2 2.7Å; E914-K1286 PolarHBondContact O-NZ 2.8Å
915	L	80.6	Confident	85.8	Confident	35 Å²	35	16.6 Å²	16.6	18%	0.183	10%	0.097	C	C	.	.			trans	-123.9	121.7	178.4	-148.5	81.9	0	0	0	109	L906 F911 A912 F921 V934 I937 V942	L906-L915 HydrophobicContact CD1-CD2 3.6Å; L906-L915 HydrophobicContact CD2-CD1 4.03Å; L906-L915 HydrophobicContact CD2-CD2 3.88Å; L906-L915 HydrophobicContact CD2-CG 4.41Å; L906-L915 HydrophobicContact CG-CD2 4.41Å; F911-L915 HydrophobicContact CD1-CD1 4.41Å; F911-L915 HydrophobicContact CE1-CD1 4.48Å; A912-L915 HydrophobicContact CB-CD1 4.33Å; L915-F921 HydrophobicContact CD1-CD2 4.46Å; L915-F921 HydrophobicContact CD1-CE1 4.48Å; L915-F921 HydrophobicContact CD1-CE2 3.4Å; L915-F921 VanDerWaalsContact CD1-CE2 3.4Å; L915-F921 HydrophobicContact CD1-CZ 3.43Å; L915-F921 VanDerWaalsContact CD1-CZ 3.43Å; L915-F921 HydrophobicContact CG-CE2 4.48Å; L915-V934 HydrophobicContact CD1-CG2 4.37Å; L915-V934 HydrophobicContact CD2-CG1 3.9Å; L915-V934 HydrophobicContact CD2-CG2 4.25Å; L915-V934 HydrophobicContact CG-CG1 4.32Å; L915-V934 HydrophobicContact CG-CG2 4.44Å; L915-I937 VanDerWaalsContact C-CD1 3.5Å; L915-I937 HydrophobicContact CB-CD1 3.9Å; L915-I937 HydrophobicContact CD2-CD1 3.72Å; L915-I937 HydrophobicContact CD2-CG1 4.1Å; L915-I937 HydrophobicContact CG-CD1 3.72Å; L915-I937 WeakPolarHBondContact O-CD1 3.49Å; L915-V942 HydrophobicContact CD2-CG1 4.27Å; L915-V942 HydrophobicContact CD2-CG2 4.31Å
916	E	83.3	Confident	85.1	Confident	44 Å²	44	24.2 Å²	24.2	21%	0.206	13%	0.13	C	C	.	.			trans	-117.9	152.5	174	-75.4	-172.1	160.3	0	0	110.5	R782 G918 D919 R1289	R782-E916 WeakPolarHBondContact CD-OE1 3.36Å; R782-E916 WeakPolarHBondContact CD-OE2 3.3Å; R782-E916 IonicContact CZ-OE1 2.71Å; R782-E916 IonicContact CZ-OE2 2.7Å; R782-E916 IonicContact NE-OE1 3.71Å; R782-E916 PolarHBondContact NE-OE1 3.07Å; R782-E916 IonicContact NE-OE2 3.81Å; R782-E916 VanDerWaalsContact NH1-CD 3.31Å; R782-E916 IonicContact NH1-OE1 2.81Å; R782-E916 PolarHBondContact NH1-OE1 3.45Å; R782-E916 IonicContact NH1-OE2 2.69Å; E916-G918 PolarHBondContact O-N 3.05Å; E916-D919 PolarHBondContact N-OD2 3.26Å; E916-D919 VanDerWaalsContact O-CB 3.3Å; E916-D919 WeakPolarHBondContact O-CB 3.41Å; E916-D919 VanDerWaalsContact O-CG 3.29Å; E916-D919 PolarHBondContact O-N 2.96Å; E916-D919 VanDerWaalsContact O-N 3.11Å; E916-R1289 VanDerWaalsContact CB-NH1 3.29Å; E916-R1289 IonicContact OE2-CZ 2.74Å; E916-R1289 VanDerWaalsContact OE2-CZ 3.23Å; E916-R1289 IonicContact OE2-NH1 3.46Å; E916-R1289 PolarHBondContact OE2-NH1 2.9Å; E916-R1289 IonicContact OE2-NH2 3.87Å; E916-R1289 PolarHBondContact OE2-NH2 3.03Å
917	P	86	Confident	84.4	Confident	47 Å²	47	31.3 Å²	31.3	31%	0.305	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.3	135.8	173.7	24.8	-34.4	0	0	0	110.8	A526 V852 D919 I935	A526-P917 HydrophobicContact CB-CB 4.04Å; V852-P917 HydrophobicContact CG1-CB 4.48Å; P917-D919 VanDerWaalsContact C-N 3.34Å; P917-I935 WeakPolarHBondContact CA-O 3.29Å; P917-I935 WeakPolarHBondContact CB-O 3.45Å
918	G	85.9	Confident	84.4	Confident	6 Å²	6	30.8 Å²	30.8	6%	0.062	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	85.2	-2.5	-175.6	0	0	0	0	0	115	V852 E916 C920 V934 R1289	V852-G918 VanDerWaalsContact CG1-CA 3.46Å; E916-G918 PolarHBondContact O-N 3.05Å; G918-C920 PolarHBondContact O-N 3.23Å; G918-V934 VanDerWaalsContact CA-O 3.28Å; G918-V934 WeakPolarHBondContact CA-O 3.29Å; G918-V934 PolarHBondContact N-O 3.19Å; G918-R1289 WeakPolarHBondContact O-CB 3.3Å
919	D	90.8	Very high	84.5	Confident	4 Å²	4	31.3 Å²	31.3	2%	0.021	15%	0.152	C	C	.	.			trans	-64.2	136.2	174.8	-77.8	-22.9	0	0	0	111.9	E916 P917 F921 V934 K1286 R1289	E916-D919 PolarHBondContact N-OD2 3.26Å; E916-D919 VanDerWaalsContact O-CB 3.3Å; E916-D919 WeakPolarHBondContact O-CB 3.41Å; E916-D919 VanDerWaalsContact O-CG 3.29Å; E916-D919 PolarHBondContact O-N 2.96Å; E916-D919 VanDerWaalsContact O-N 3.11Å; P917-D919 VanDerWaalsContact C-N 3.34Å; D919-F921 HydrophobicContact CB-CD2 4.43Å; D919-F921 HydrophobicContact CB-CE2 3.58Å; D919-F921 HydrophobicContact CB-CZ 4.16Å; D919-V934 PolarHBondContact O-N 2.68Å; D919-K1286 WeakPolarHBondContact OD1-CE 3.31Å; D919-K1286 IonicContact OD1-NZ 2.7Å; D919-K1286 WeakPolarHBondContact OD2-CE 3.41Å; D919-K1286 IonicContact OD2-NZ 2.64Å; D919-K1286 PolarHBondContact OD2-NZ 3.15Å; D919-R1289 IonicContact OD1-CZ 2.67Å; D919-R1289 IonicContact OD1-NH1 3.19Å; D919-R1289 PolarHBondContact OD1-NH1 3.05Å
920	C	92.4	Very high	84.9	Confident	2 Å²	2	31.3 Å²	31.3	1%	0.014	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	134.7	177.3	-66.3	0	0	0	0	110.1	G918 I932 H933 L1287 V1292	G918-C920 PolarHBondContact O-N 3.23Å; C920-I932 WeakPolarHBondContact CA-O 3.19Å; C920-H933 VanDerWaalsContact SG-CD2 3.54Å; C920-L1287 HydrophobicContact CB-CB 4.25Å; C920-L1287 HydrophobicContact CB-CD1 4.22Å; C920-L1287 PolarHBondContact O-N 3.31Å; C920-V1292 HydrophobicContact CB-CG1 4.49Å; C920-V1292 HydrophobicContact CB-CG2 4.03Å
921	F	94.4	Very high	85.2	Confident	0 Å²	0	30.2 Å²	30.2	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	139.9	178.5	-64.6	-93.5	0	0	0	110.4	F911 A912 L915 D919 L931 I932 V934 V1284 I1285 K1286	F911-F921 HydrophobicContact CE1-CB 4.3Å; F911-F921 AromaticContact CE1-CD1 3.88Å; F911-F921 HydrophobicContact CE1-CD1 3.88Å; F911-F921 AromaticContact CE1-CD2 3.94Å; F911-F921 HydrophobicContact CE1-CD2 3.94Å; F911-F921 HydrophobicContact CE1-CE1 4.18Å; F911-F921 HydrophobicContact CE1-CE2 4.25Å; F911-F921 AromaticContact CE1-CG 3.76Å; F911-F921 HydrophobicContact CE1-CG 3.76Å; F911-F921 HydrophobicContact CE1-CZ 4.38Å; F911-F921 HydrophobicContact CZ-CB 4.1Å; F911-F921 HydrophobicContact CZ-CD1 4.41Å; F911-F921 HydrophobicContact CZ-CD2 4.47Å; F911-F921 HydrophobicContact CZ-CG 4.08Å; A912-F921 HydrophobicContact CB-CE1 3.88Å; A912-F921 HydrophobicContact CB-CZ 4.13Å; L915-F921 HydrophobicContact CD1-CD2 4.46Å; L915-F921 HydrophobicContact CD1-CE1 4.48Å; L915-F921 HydrophobicContact CD1-CE2 3.4Å; L915-F921 VanDerWaalsContact CD1-CE2 3.4Å; L915-F921 HydrophobicContact CD1-CZ 3.43Å; L915-F921 VanDerWaalsContact CD1-CZ 3.43Å; L915-F921 HydrophobicContact CG-CE2 4.48Å; D919-F921 HydrophobicContact CB-CD2 4.43Å; D919-F921 HydrophobicContact CB-CE2 3.58Å; D919-F921 HydrophobicContact CB-CZ 4.16Å; F921-L931 CarbonylContact O-C 3.54Å; F921-L931 WeakPolarHBondContact O-CA 3.22Å; F921-I932 PolarHBondContact N-O 3.03Å; F921-I932 PolarHBondContact O-N 2.87Å; F921-V934 HydrophobicContact CD2-CG2 4.15Å; F921-V934 HydrophobicContact CE2-CG2 4.15Å; F921-V1284 HydrophobicContact CD1-CG1 3.89Å; F921-I1285 CarbonylContact C-O 3.31Å; F921-I1285 WeakPolarHBondContact CA-O 3.39Å; F921-K1286 HydrophobicContact CD1-CB 3.91Å; F921-K1286 HydrophobicContact CD1-CG 4.18Å; F921-K1286 HydrophobicContact CE1-CB 3.58Å; F921-K1286 HydrophobicContact CE1-CD 3.83Å; F921-K1286 HydrophobicContact CE1-CG 3.59Å; F921-K1286 HydrophobicContact CZ-CB 4.38Å; F921-K1286 HydrophobicContact CZ-CD 3.85Å; F921-K1286 HydrophobicContact CZ-CG 3.88Å
922	I	93.3	Very high	85.6	Confident	2 Å²	2	30.1 Å²	30.1	1%	0.01	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	131.4	163.9	-61.5	165.8	0	0	0	107.5	A924 C930 I964 I1285 L1287 L1323 I1326	I922-A924 HydrophobicContact CG2-CB 4.19Å; I922-C930 WeakPolarHBondContact CA-O 3.24Å; I922-I964 HydrophobicContact CD1-CD1 4.21Å; I922-I1285 HydrophobicContact CB-CB 4.33Å; I922-I1285 HydrophobicContact CB-CD1 4.25Å; I922-I1285 HydrophobicContact CG2-CD1 4.27Å; I922-I1285 PolarHBondContact N-O 3.45Å; I922-I1285 PolarHBondContact O-N 3.1Å; I922-L1287 HydrophobicContact CD1-CD1 4.05Å; I922-L1287 HydrophobicContact CD1-CD2 3.81Å; I922-L1287 HydrophobicContact CD1-CG 4.2Å; I922-L1287 HydrophobicContact CG1-CD1 3.94Å; I922-L1287 HydrophobicContact CG1-CD2 4.38Å; I922-L1287 HydrophobicContact CG1-CG 4.23Å; I922-L1323 HydrophobicContact CD1-CD1 3.83Å; I922-I1326 HydrophobicContact CD1-CG2 3.75Å; I922-I1326 HydrophobicContact CG1-CG2 4.34Å
923	L	92.3	Very high	86.3	Confident	0 Å²	0	30.2 Å²	30.2	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	118.2	154.9	-62.7	-171.7	0	0	0	107.9	L898 F911 N929 C930 I932 Y1007 L1009 F1282 R1283 V1284	L898-L923 HydrophobicContact CD1-CD1 4.3Å; L898-L923 HydrophobicContact CD2-CD1 4.42Å; F911-L923 HydrophobicContact CE2-CD2 3.99Å; F911-L923 HydrophobicContact CZ-CD2 4.49Å; L923-N929 WeakPolarHBondContact O-CA 3.39Å; L923-C930 PolarHBondContact N-O 3.4Å; L923-C930 PolarHBondContact O-N 3.26Å; L923-I932 HydrophobicContact CD1-CD1 3.64Å; L923-I932 HydrophobicContact CG-CD1 3.79Å; L923-Y1007 HydrophobicContact CD2-CD1 4.39Å; L923-L1009 HydrophobicContact CD1-CD1 4.27Å; L923-F1282 HydrophobicContact CB-CB 4.27Å; L923-F1282 HydrophobicContact CB-CD1 3.77Å; L923-F1282 HydrophobicContact CB-CE1 4.46Å; L923-F1282 HydrophobicContact CB-CG 4.24Å; L923-F1282 HydrophobicContact CD1-CD1 4.49Å; L923-F1282 HydrophobicContact CD1-CG 4.45Å; L923-F1282 HydrophobicContact CD2-CB 4.27Å; L923-R1283 WeakPolarHBondContact CA-O 3.4Å; L923-V1284 HydrophobicContact CD2-CB 4.29Å; L923-V1284 HydrophobicContact CD2-CG1 4.27Å; L923-V1284 HydrophobicContact CD2-CG2 3.73Å
924	A	89.3	Confident	87.3	Confident	1 Å²	1	28.5 Å²	28.5	1%	0.008	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	132.7	176.1	0	0	0	0	0	110.3	I922 N929 I964 F1282 R1283 I1285	I922-A924 HydrophobicContact CG2-CB 4.19Å; A924-N929 WeakPolarHBondContact CA-OD1 3.49Å; A924-I964 HydrophobicContact CB-CG2 3.79Å; A924-F1282 CarbonylContact O-C 3.59Å; A924-F1282 WeakPolarHBondContact O-CA 3.43Å; A924-R1283 PolarHBondContact N-O 3.02Å; A924-R1283 VanDerWaalsContact N-O 3.09Å; A924-R1283 PolarHBondContact O-N 2.91Å; A924-I1285 HydrophobicContact CB-CD1 3.94Å
925	S	85.5	Confident	87.9	Confident	19 Å²	19	25.5 Å²	25.5	13%	0.133	12%	0.121	C	C	.	.			trans	-143.9	170.5	171.1	-164.1	0	0	0	0	108.4	Y927 L928 S1281	S925-Y927 PolarHBondContact O-N 2.77Å; S925-L928 PolarHBondContact N-O 3Å; S925-S1281 WeakPolarHBondContact CB-O 3.46Å; S925-S1281 PolarHBondContact OG-O 3.02Å
926	F	74.9	Confident	88.3	Confident	166 Å²	166	23.9 Å²	23.9	73%	0.728	11%	0.112	S	C	*	.	S	Bend	trans	-55.4	-28.6	-170.7	-70.7	-75.7	0	0	0	115
927	Y	73.7	Confident	88.4	Confident	172 Å²	172	23.7 Å²	23.7	68%	0.675	11%	0.112	S	C	*	.	S	Bend	trans	-126.3	-20.7	-180	-54.9	-78.2	0	0	0	114	S925 F951	S925-Y927 PolarHBondContact O-N 2.77Å; Y927-F951 WeakPolarHBondContact O-CD1 3.08Å
928	L	84.9	Confident	88.3	Confident	21 Å²	21	22.4 Å²	22.4	11%	0.11	11%	0.108	C	C	.	.			trans	-114.2	118.9	-173	-78.6	167	0	0	0	110.3	F890 Y891 S925 F951 F1282	F890-L928 HydrophobicContact CB-CD2 4.26Å; Y891-L928 HydrophobicContact CD1-CD2 4.25Å; Y891-L928 HydrophobicContact CE1-CD2 3.63Å; S925-L928 PolarHBondContact N-O 3Å; L928-F951 HydrophobicContact CD2-CE1 3.63Å; L928-F951 HydrophobicContact CD2-CE2 4.15Å; L928-F951 HydrophobicContact CD2-CZ 3.37Å; L928-F951 HydrophobicContact CG-CE1 4.05Å; L928-F951 HydrophobicContact CG-CZ 4.27Å; L928-F1282 HydrophobicContact CB-CE1 3.88Å; L928-F1282 HydrophobicContact CB-CZ 4.36Å; L928-F1282 HydrophobicContact CD1-CE1 4.49Å; L928-F1282 HydrophobicContact CD1-CZ 4.14Å
929	N	89.4	Confident	88.1	Confident	11 Å²	11	24 Å²	24	6%	0.059	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	123	175.6	-69.5	-65.9	0	0	0	109.5	Y891 L923 A924 L949	Y891-N929 PolarHBondContact OH-N 3.29Å; Y891-N929 PolarHBondContact OH-O 3.28Å; L923-N929 WeakPolarHBondContact O-CA 3.39Å; A924-N929 WeakPolarHBondContact CA-OD1 3.49Å; N929-L949 HydrophobicContact CB-CB 4.39Å; N929-L949 HydrophobicContact CB-CD1 4.28Å; N929-L949 VanDerWaalsContact O-CB 3.32Å; N929-L949 WeakPolarHBondContact O-CB 3.26Å; N929-L949 PolarHBondContact O-N 2.98Å
930	C	91.4	Very high	87.6	Confident	0 Å²	0	24.7 Å²	24.7	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	145.9	175.8	67.2	0	0	0	0	112.9	Y891 I922 L923 L946 R947	Y891-C930 HydrophobicContact CD1-CB 4.05Å; Y891-C930 HydrophobicContact CE1-CB 3.86Å; I922-C930 WeakPolarHBondContact CA-O 3.24Å; L923-C930 PolarHBondContact N-O 3.4Å; L923-C930 PolarHBondContact O-N 3.26Å; C930-L946 HydrophobicContact CB-CD1 4.44Å; C930-L946 HydrophobicContact CB-CD2 4.08Å; C930-L946 HydrophobicContact CB-CG 4.17Å; C930-R947 CarbonylContact C-O 3.42Å; C930-R947 WeakPolarHBondContact CA-O 3.31Å; C930-R947 VanDerWaalsContact CB-O 3.24Å; C930-R947 WeakPolarHBondContact CB-O 3.39Å
931	L	92.6	Very high	87.4	Confident	0 Å²	0	24.6 Å²	24.6	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	122.6	173.1	-176.8	142.4	0	0	0	110.1	F921 H933 R947 L1287 W1296	F921-L931 CarbonylContact O-C 3.54Å; F921-L931 WeakPolarHBondContact O-CA 3.22Å; L931-H933 HydrophobicContact CD2-CB 4.32Å; L931-R947 PolarHBondContact N-O 3.3Å; L931-R947 PolarHBondContact O-N 2.99Å; L931-L1287 HydrophobicContact CD1-CD1 3.76Å; L931-W1296 HydrophobicContact CD1-CZ2 4.4Å; L931-W1296 HydrophobicContact CD2-CH2 3.92Å; L931-W1296 HydrophobicContact CD2-CZ2 4.19Å
932	I	93.5	Very high	87.2	Confident	0 Å²	0	24.9 Å²	24.9	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	119	171.8	-61.4	175.4	0	0	0	108	L898 F911 C920 F921 L923 V934 F944 L946	L898-I932 HydrophobicContact CD1-CD1 3.64Å; L898-I932 HydrophobicContact CD1-CG1 4.45Å; L898-I932 HydrophobicContact CD2-CD1 4.23Å; F911-I932 HydrophobicContact CE2-CD1 4.29Å; F911-I932 HydrophobicContact CZ-CD1 4.19Å; C920-I932 WeakPolarHBondContact CA-O 3.19Å; F921-I932 PolarHBondContact N-O 3.03Å; F921-I932 PolarHBondContact O-N 2.87Å; L923-I932 HydrophobicContact CD1-CD1 3.64Å; L923-I932 HydrophobicContact CG-CD1 3.79Å; I932-V934 HydrophobicContact CG2-CG2 4.38Å; I932-F944 HydrophobicContact CG2-CB 3.98Å; I932-F944 HydrophobicContact CG2-CD2 4.02Å; I932-F944 HydrophobicContact CG2-CG 4.28Å; I932-L946 HydrophobicContact CG1-CD1 4.31Å
933	H	92.1	Very high	87	Confident	6 Å²	6	24.9 Å²	24.9	3%	0.028	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	115.9	170	178	-137	0	0	0	109.1	V852 F854 C920 L931 I935 F944 Q945	V852-H933 PolarHBondContact O-CE1 3.17Å; F854-H933 AromaticContact CD1-CE1 3.76Å; F854-H933 AromaticContact CE1-CE1 3.72Å; F854-H933 AromaticContact CE1-ND1 3.87Å; C920-H933 VanDerWaalsContact SG-CD2 3.54Å; L931-H933 HydrophobicContact CD2-CB 4.32Å; H933-I935 VanDerWaalsContact CE1-CG1 3.49Å; H933-I935 WeakPolarHBondContact CE1-CG1 3.33Å; H933-I935 WeakPolarHBondContact ND1-CG1 3.03Å; H933-F944 CarbonylContact O-C 3.55Å; H933-F944 VanDerWaalsContact O-CA 3.31Å; H933-F944 WeakPolarHBondContact O-CA 3.43Å; H933-Q945 PolarHBondContact N-O 3.21Å; H933-Q945 PolarHBondContact O-N 3.44Å
934	V	91.5	Very high	87	Confident	0 Å²	0	24.9 Å²	24.9	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	124.9	175.8	-178.9	0	0	0	0	108.7	L915 G918 D919 F921 I932 I937 V942	L915-V934 HydrophobicContact CD1-CG2 4.37Å; L915-V934 HydrophobicContact CD2-CG1 3.9Å; L915-V934 HydrophobicContact CD2-CG2 4.25Å; L915-V934 HydrophobicContact CG-CG1 4.32Å; L915-V934 HydrophobicContact CG-CG2 4.44Å; G918-V934 VanDerWaalsContact CA-O 3.28Å; G918-V934 WeakPolarHBondContact CA-O 3.29Å; G918-V934 PolarHBondContact N-O 3.19Å; D919-V934 PolarHBondContact O-N 2.68Å; F921-V934 HydrophobicContact CD2-CG2 4.15Å; F921-V934 HydrophobicContact CE2-CG2 4.15Å; I932-V934 HydrophobicContact CG2-CG2 4.38Å; V934-I937 HydrophobicContact CG1-CD1 3.72Å; V934-I937 HydrophobicContact CG1-CG1 3.51Å; V934-V942 HydrophobicContact CG1-CG1 3.85Å
935	I	88.4	Confident	87	Confident	0 Å²	0	25.2 Å²	25.2	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	-72.1	-177.2	-61.4	159.6	0	0	0	109.2	A526 F528 K853 P917 H933 T943 Q945 L1344	A526-I935 HydrophobicContact CB-CG2 3.96Å; A526-I935 WeakPolarHBondContact CB-O 3.35Å; F528-I935 HydrophobicContact CD1-CB 4.46Å; F528-I935 HydrophobicContact CD1-CG2 3.76Å; F528-I935 HydrophobicContact CE1-CB 4.09Å; F528-I935 HydrophobicContact CE1-CG2 3.71Å; K853-I935 HydrophobicContact CB-CG2 4.32Å; K853-I935 HydrophobicContact CG-CD1 4.33Å; P917-I935 WeakPolarHBondContact CA-O 3.29Å; P917-I935 WeakPolarHBondContact CB-O 3.45Å; H933-I935 VanDerWaalsContact CE1-CG1 3.49Å; H933-I935 WeakPolarHBondContact CE1-CG1 3.33Å; H933-I935 WeakPolarHBondContact ND1-CG1 3.03Å; I935-T943 PolarHBondContact N-O 3.16Å; I935-Q945 HydrophobicContact CD1-CB 4.33Å; I935-L1344 HydrophobicContact CD1-CD2 3.35Å
936	E	88.3	Confident	87.2	Confident	0 Å²	0	24.3 Å²	24.3	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	136.1	180	-163.1	-178.2	-178	0	0	111.1	T525 A526 F528 S585 F941 V942 T943	T525-E936 PolarHBondContact OG1-OE1 2.63Å; A526-E936 WeakPolarHBondContact O-CG 3.45Å; F528-E936 HydrophobicContact CE1-CB 3.7Å; F528-E936 VanDerWaalsContact CE2-OE2 3.23Å; F528-E936 WeakPolarHBondContact CE2-OE2 3.35Å; F528-E936 HydrophobicContact CZ-CB 3.46Å; F528-E936 VanDerWaalsContact CZ-CB 3.46Å; F528-E936 HydrophobicContact CZ-CG 4.31Å; F528-E936 WeakPolarHBondContact CZ-OE2 3.39Å; S585-E936 WeakPolarHBondContact CB-OE1 3.34Å; S585-E936 WeakPolarHBondContact CB-OE2 3.48Å; S585-E936 PolarHBondContact N-OE1 3.49Å; S585-E936 PolarHBondContact N-OE2 2.84Å; S585-E936 VanDerWaalsContact N-OE2 3.08Å; S585-E936 VanDerWaalsContact OG-CD 3.32Å; S585-E936 PolarHBondContact OG-OE2 3.09Å; E936-F941 HydrophobicContact CG-CE2 3.91Å; E936-F941 HydrophobicContact CG-CZ 4.3Å; E936-V942 WeakPolarHBondContact O-CA 3.49Å; E936-T943 PolarHBondContact N-O 3.27Å; E936-T943 PolarHBondContact O-N 2.87Å
937	I	86.7	Confident	87.9	Confident	40 Å²	40	16.4 Å²	16.4	21%	0.205	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	131.7	176.4	-55.9	172.4	0	0	0	107.3	T525 L915 V934 V942	T525-I937 WeakPolarHBondContact CG2-O 3.45Å; L915-I937 VanDerWaalsContact C-CD1 3.5Å; L915-I937 HydrophobicContact CB-CD1 3.9Å; L915-I937 HydrophobicContact CD2-CD1 3.72Å; L915-I937 HydrophobicContact CD2-CG1 4.1Å; L915-I937 HydrophobicContact CG-CD1 3.72Å; L915-I937 WeakPolarHBondContact O-CD1 3.49Å; V934-I937 HydrophobicContact CG1-CD1 3.72Å; V934-I937 HydrophobicContact CG1-CG1 3.51Å; I937-V942 HydrophobicContact CG2-CG2 4.15Å
938	G	82.7	Confident	88.6	Confident	21 Å²	21	8.2 Å²	8.2	22%	0.216	5%	0.052	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	-179.3	171.1	0	0	0	0	0	112.4	G940 F941	G938-G940 PolarHBondContact O-N 3.16Å; G938-F941 PolarHBondContact N-O 2.9Å; G938-F941 PolarHBondContact O-N 3.17Å; G938-F941 VanDerWaalsContact O-N 3.09Å
939	N	81.6	Confident	88.6	Confident	39 Å²	39	7.3 Å²	7.3	21%	0.209	5%	0.047	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.5	109.9	-174.9	176.8	-23.2	0	0	0	110.3	S581 R582 R628 F941	S581-N939 PolarHBondContact O-N 3.35Å; S581-N939 VanDerWaalsContact OG-CB 3.28Å; S581-N939 WeakPolarHBondContact OG-CB 3.34Å; R582-N939 HydrophobicContact CG-CB 3.77Å; R582-N939 PolarHBondContact NE-OD1 2.67Å; R582-N939 PolarHBondContact NH2-OD1 2.94Å; R628-N939 PolarHBondContact NH2-O 3.42Å; N939-F941 VanDerWaalsContact C-N 3.32Å; N939-F941 PolarHBondContact O-N 2.96Å
940	G	80.1	Confident	87.9	Confident	18 Å²	18	8.8 Å²	8.8	19%	0.186	5%	0.054	C	C	.	.	T	Hydrogen-bonded Turn	trans	67.2	21.2	-177.2	0	0	0	0	0	115.3	R628 G938 S1349	R628-G940 PolarHBondContact NH1-O 2.97Å; G938-G940 PolarHBondContact O-N 3.16Å; G940-S1349 VanDerWaalsContact CA-OG 3.31Å; G940-S1349 WeakPolarHBondContact CA-OG 3.42Å; G940-S1349 PolarHBondContact O-N 3.1Å; G940-S1349 PolarHBondContact O-OG 3.35Å; G940-S1349 VanDerWaalsContact O-OG 3.11Å
941	F	88.3	Confident	87.1	Confident	1 Å²	1	11 Å²	11	0%	0.004	6%	0.064	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	144.7	170	80	-86	0	0	0	112.5	T584 E936 G938 N939 S1347 Y1348	T584-F941 HydrophobicContact CG2-CD2 3.77Å; T584-F941 HydrophobicContact CG2-CE2 3.72Å; T584-F941 HydrophobicContact CG2-CG 4.22Å; T584-F941 HydrophobicContact CG2-CZ 4.12Å; E936-F941 HydrophobicContact CG-CE2 3.91Å; E936-F941 HydrophobicContact CG-CZ 4.3Å; G938-F941 PolarHBondContact N-O 2.9Å; G938-F941 PolarHBondContact O-N 3.17Å; G938-F941 VanDerWaalsContact O-N 3.09Å; N939-F941 VanDerWaalsContact C-N 3.32Å; N939-F941 PolarHBondContact O-N 2.96Å; F941-S1347 VanDerWaalsContact CA-O 3.3Å; F941-S1347 WeakPolarHBondContact CA-O 3.31Å; F941-Y1348 HydrophobicContact CB-CD1 3.75Å; F941-Y1348 HydrophobicContact CB-CE1 4Å
942	V	90.3	Very high	85.6	Confident	6 Å²	6	19.9 Å²	19.9	4%	0.036	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	133.2	174.2	174.2	0	0	0	0	110.1	L902 L906 L915 V934 E936 I937 S1347	L902-V942 HydrophobicContact CD2-CG1 4.32Å; L906-V942 HydrophobicContact CD1-CB 4.22Å; L906-V942 HydrophobicContact CD1-CG1 4.36Å; L906-V942 HydrophobicContact CD1-CG2 3.67Å; L915-V942 HydrophobicContact CD2-CG1 4.27Å; L915-V942 HydrophobicContact CD2-CG2 4.31Å; V934-V942 HydrophobicContact CG1-CG1 3.85Å; E936-V942 WeakPolarHBondContact O-CA 3.49Å; I937-V942 HydrophobicContact CG2-CG2 4.15Å; V942-S1347 PolarHBondContact N-O 3.28Å; V942-S1347 PolarHBondContact O-N 3.3Å; V942-S1347 PolarHBondContact O-OG 3.29Å
943	T	89.7	Confident	84.2	Confident	1 Å²	1	21 Å²	21	1%	0.006	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	122.6	177.6	-44.7	0	0	0	0	110.4	F528 I935 E936 L1344 T1345 T1346	F528-T943 HydrophobicContact CE1-CG2 3.6Å; F528-T943 HydrophobicContact CE2-CG2 4.17Å; F528-T943 VanDerWaalsContact CZ-CB 3.42Å; F528-T943 HydrophobicContact CZ-CG2 3.36Å; F528-T943 WeakPolarHBondContact CZ-OG1 3.31Å; I935-T943 PolarHBondContact N-O 3.16Å; E936-T943 PolarHBondContact N-O 3.27Å; E936-T943 PolarHBondContact O-N 2.87Å; T943-L1344 HydrophobicContact CG2-CB 4.4Å; T943-T1345 WeakPolarHBondContact CA-O 3.3Å; T943-T1345 WeakPolarHBondContact CG2-O 3.49Å; T943-T1346 HydrophobicContact CG2-CG2 3.81Å; T943-T1346 WeakPolarHBondContact OG1-CG2 3.3Å
944	F	91.5	Very high	83	Confident	0 Å²	0	23.7 Å²	23.7	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	164.5	-174.6	67.2	-83.2	0	0	0	111.8	T895 L898 L902 I932 H933 L946 T1345	T895-F944 HydrophobicContact CG2-CE2 4.37Å; L898-F944 HydrophobicContact CB-CE1 4.47Å; L898-F944 HydrophobicContact CB-CE2 4.03Å; L898-F944 HydrophobicContact CB-CZ 3.61Å; L898-F944 HydrophobicContact CD1-CE2 4.33Å; L902-F944 HydrophobicContact CD2-CD1 3.49Å; L902-F944 VanDerWaalsContact CD2-CD1 3.49Å; L902-F944 HydrophobicContact CD2-CE1 3.78Å; L902-F944 HydrophobicContact CD2-CG 3.99Å; L902-F944 HydrophobicContact CD2-CZ 4.49Å; I932-F944 HydrophobicContact CG2-CB 3.98Å; I932-F944 HydrophobicContact CG2-CD2 4.02Å; I932-F944 HydrophobicContact CG2-CG 4.28Å; H933-F944 CarbonylContact O-C 3.55Å; H933-F944 VanDerWaalsContact O-CA 3.31Å; H933-F944 WeakPolarHBondContact O-CA 3.43Å; F944-L946 HydrophobicContact CE2-CB 4.45Å; F944-T1345 WeakPolarHBondContact CE2-OG1 3.3Å; F944-T1345 VanDerWaalsContact CZ-OG1 3.31Å; F944-T1345 WeakPolarHBondContact CZ-OG1 3.47Å; F944-T1345 PolarHBondContact N-O 3.08Å; F944-T1345 PolarHBondContact O-N 3.37Å; F944-T1345 PolarHBondContact O-OG1 3.4Å
945	Q	89.7	Confident	81.9	Confident	8 Å²	8	30.2 Å²	30.2	4%	0.037	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	128.1	169.8	-171.8	178.1	32.8	0	0	108.5	H933 I935 V1341 S1342 L1344	H933-Q945 PolarHBondContact N-O 3.21Å; H933-Q945 PolarHBondContact O-N 3.44Å; I935-Q945 HydrophobicContact CD1-CB 4.33Å; Q945-V1341 HydrophobicContact CG-CG1 4.31Å; Q945-V1341 VanDerWaalsContact NE2-CG1 3.26Å; Q945-S1342 PolarHBondContact NE2-O 2.8Å; Q945-L1344 HydrophobicContact CB-CD2 4.46Å
946	L	91.1	Very high	81.2	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	134.9	175.8	-175.6	148.4	0	0	0	110	Y891 L894 L898 C930 I932 F944 Y1340 S1342	Y891-L946 HydrophobicContact CD1-CD2 4.22Å; Y891-L946 HydrophobicContact CG-CD2 4.47Å; L894-L946 HydrophobicContact CD2-CD1 4.2Å; L894-L946 HydrophobicContact CG-CD1 4.27Å; L898-L946 HydrophobicContact CD1-CD1 3.52Å; C930-L946 HydrophobicContact CB-CD1 4.44Å; C930-L946 HydrophobicContact CB-CD2 4.08Å; C930-L946 HydrophobicContact CB-CG 4.17Å; I932-L946 HydrophobicContact CG1-CD1 4.31Å; F944-L946 HydrophobicContact CE2-CB 4.45Å; L946-Y1340 HydrophobicContact CD2-CD1 4.04Å; L946-Y1340 HydrophobicContact CD2-CE1 4.48Å; L946-S1342 PolarHBondContact N-OG 3.28Å; L946-S1342 PolarHBondContact O-N 3Å
947	R	88.9	Confident	80.5	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	109.6	171.9	-62.1	-166.6	172	76.1	9.3	109.9	C930 L931 S1330 D1332 P1338 Y1340 V1341	C930-R947 CarbonylContact C-O 3.42Å; C930-R947 WeakPolarHBondContact CA-O 3.31Å; C930-R947 VanDerWaalsContact CB-O 3.24Å; C930-R947 WeakPolarHBondContact CB-O 3.39Å; L931-R947 PolarHBondContact N-O 3.3Å; L931-R947 PolarHBondContact O-N 2.99Å; R947-S1330 WeakPolarHBondContact CD-O 3.18Å; R947-S1330 PolarHBondContact NE-O 3.41Å; R947-D1332 IonicContact CZ-OD1 3.7Å; R947-D1332 VanDerWaalsContact CZ-OD1 3.3Å; R947-D1332 IonicContact CZ-OD2 3.5Å; R947-D1332 IonicContact NE-OD1 3.23Å; R947-D1332 PolarHBondContact NE-OD1 3.15Å; R947-D1332 IonicContact NH2-OD1 2.87Å; R947-D1332 PolarHBondContact NH2-OD1 2.86Å; R947-D1332 IonicContact NH2-OD2 3.95Å; R947-D1332 PolarHBondContact NH2-OD2 2.9Å; R947-P1338 HydrophobicContact CB-CB 4.42Å; R947-Y1340 CarbonylContact C-O 3.38Å; R947-Y1340 VanDerWaalsContact CA-O 3.29Å; R947-Y1340 WeakPolarHBondContact CA-O 3.46Å; R947-V1341 HydrophobicContact CG-CG1 4.44Å; R947-V1341 HydrophobicContact CG-CG2 4.31Å
948	G	88.3	Confident	80.2	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	135.5	175.6	0	0	0	0	0	111.4	P1338 I1339 Y1340	G948-P1338 CarbonylContact O-C 3.58Å; G948-P1338 WeakPolarHBondContact O-CA 3.45Å; G948-I1339 PolarHBondContact O-N 3.23Å; G948-Y1340 PolarHBondContact N-O 3.13Å
949	L	83.9	Confident	80.1	Confident	2 Å²	2	39.7 Å²	39.7	1%	0.01	19%	0.187	C	C	.	.	P	Polyproline II helix	trans	-99	171.3	178.8	-59.7	176.6	0	0	0	111.6	Y891 N929 I1326	Y891-L949 VanDerWaalsContact CE2-O 3.23Å; Y891-L949 WeakPolarHBondContact CE2-O 3.48Å; Y891-L949 PolarHBondContact OH-O 3.06Å; N929-L949 HydrophobicContact CB-CB 4.39Å; N929-L949 HydrophobicContact CB-CD1 4.28Å; N929-L949 VanDerWaalsContact O-CB 3.32Å; N929-L949 WeakPolarHBondContact O-CB 3.26Å; N929-L949 PolarHBondContact O-N 2.98Å; L949-I1326 HydrophobicContact CD1-CG2 3.84Å
950	E	76.3	Confident	80.3	Confident	42 Å²	42	37.8 Å²	37.8	20%	0.196	18%	0.177	C	C	.	.	P	Polyproline II helix	trans	-59.5	131.3	172.2	55.5	-173.5	-160	0	0	112.3	R952 G953 T954 Q957 Y1337 I1339	E950-R952 VanDerWaalsContact C-N 3.3Å; E950-R952 WeakPolarHBondContact CG-O 3.37Å; E950-G953 VanDerWaalsContact OE1-CA 3.29Å; E950-G953 WeakPolarHBondContact OE1-CA 3.26Å; E950-T954 PolarHBondContact OE1-N 3.43Å; E950-Q957 PolarHBondContact OE1-NE2 2.93Å; E950-Y1337 WeakPolarHBondContact OE2-CE2 3.26Å; E950-I1339 HydrophobicContact CB-CD1 4.34Å
951	F	72.8	Confident	80.5	Confident	47 Å²	47	37.5 Å²	37.5	21%	0.206	17%	0.172	C	C	.	.	S	Bend	trans	-64.8	-34.4	177.1	-84.7	-101.3	0	0	0	112	N887 F890 Y891 Y927 L928	N887-F951 HydrophobicContact CB-CD2 3.66Å; N887-F951 HydrophobicContact CB-CE2 3.56Å; F890-F951 HydrophobicContact CB-CZ 4.1Å; F890-F951 HydrophobicContact CD2-CE2 4.21Å; F890-F951 AromaticContact CD2-CZ 3.66Å; F890-F951 HydrophobicContact CD2-CZ 3.66Å; F890-F951 HydrophobicContact CE2-CZ 4.46Å; F890-F951 HydrophobicContact CG-CZ 4.12Å; Y891-F951 HydrophobicContact CE2-CD2 4.28Å; Y891-F951 AromaticContact CE2-CE2 3.78Å; Y891-F951 HydrophobicContact CE2-CE2 3.78Å; Y927-F951 WeakPolarHBondContact O-CD1 3.08Å; L928-F951 HydrophobicContact CD2-CE1 3.63Å; L928-F951 HydrophobicContact CD2-CE2 4.15Å; L928-F951 HydrophobicContact CD2-CZ 3.37Å; L928-F951 HydrophobicContact CG-CE1 4.05Å; L928-F951 HydrophobicContact CG-CZ 4.27Å
952	R	62.7	Low	80.2	Confident	187 Å²	187	41 Å²	41	71%	0.706	19%	0.188	S	C	*	.	S	Bend	trans	-106.8	109.2	167.1	-75	-179.6	171.9	174.6	-4.4	107.7	E950	E950-R952 VanDerWaalsContact C-N 3.3Å; E950-R952 WeakPolarHBondContact CG-O 3.37Å
953	G	63.6	Low	79.8	Confident	22 Å²	22	41.3 Å²	41.3	23%	0.227	19%	0.191	C	C	.	.			trans	-73.7	152.3	173.7	0	0	0	0	0	112.3	E950	E950-G953 VanDerWaalsContact OE1-CA 3.29Å; E950-G953 WeakPolarHBondContact OE1-CA 3.26Å
954	T	66.1	Low	79.5	Confident	64 Å²	64	41.2 Å²	41.2	39%	0.393	19%	0.191	S	C	.	.			trans	-49.1	149.9	155.5	62.1	0	0	0	0	110.7	E950 C956 Q957 Q958	E950-T954 PolarHBondContact OE1-N 3.43Å; T954-C956 PolarHBondContact O-N 2.87Å; T954-Q957 CarbonylContact O-C 3.53Å; T954-Q957 WeakPolarHBondContact O-CA 3.09Å; T954-Q957 WeakPolarHBondContact O-CB 3.43Å; T954-Q957 PolarHBondContact O-N 3.21Å; T954-Q957 WeakPolarHBondContact OG1-CB 3.24Å; T954-Q957 PolarHBondContact OG1-N 3.48Å; T954-Q958 PolarHBondContact O-N 2.78Å
955	Y	69.5	Low	79	Confident	137 Å²	137	43.4 Å²	43.4	54%	0.537	20%	0.204	S	C	.	.	H	α-helix	trans	-52.4	-30.1	-179.3	-86.2	-93	0	0	0	114.2	M265 R959	M265-Y955 HydrophobicContact CB-CD2 4.41Å; M265-Y955 HydrophobicContact CB-CE2 3.73Å; M265-Y955 HydrophobicContact CE-CD1 4.07Å; M265-Y955 HydrophobicContact CE-CD2 4.2Å; M265-Y955 HydrophobicContact CE-CE1 4.31Å; M265-Y955 HydrophobicContact CE-CE2 4.46Å; M265-Y955 HydrophobicContact CE-CG 3.99Å; M265-Y955 HydrophobicContact CG-CD2 3.63Å; M265-Y955 HydrophobicContact CG-CE2 3.35Å; M265-Y955 HydrophobicContact CG-CG 4.35Å; M265-Y955 HydrophobicContact SD-CD1 4.42Å; M265-Y955 HydrophobicContact SD-CD2 4.27Å; M265-Y955 HydrophobicContact SD-CE1 4.09Å; M265-Y955 HydrophobicContact SD-CE2 3.94Å; M265-Y955 HydrophobicContact SD-CG 4.49Å; Y955-R959 WeakPolarHBondContact O-CG 3.4Å; Y955-R959 PolarHBondContact O-N 3.17Å; Y955-R959 VanDerWaalsContact O-N 3.14Å
956	C	73.1	Confident	78.4	Confident	42 Å²	42	47.8 Å²	47.8	28%	0.284	23%	0.225	S	C	.	.	H	α-helix	trans	-77.5	-35.2	174.9	-65.1	0	0	0	0	112.8	T954 E960 N1325	T954-C956 PolarHBondContact O-N 2.87Å; C956-E960 PolarHBondContact O-N 3.42Å; C956-N1325 WeakPolarHBondContact CB-ND2 3.45Å
957	Q	74.7	Confident	77.3	Confident	3 Å²	3	50.7 Å²	50.7	1%	0.014	24%	0.24	C	C	.	.	H	α-helix	trans	-66.8	-41.4	170	-176.5	170	-76.5	0	0	111	E950 T954 R959 E960 V961 I1326 S1329	E950-Q957 PolarHBondContact OE1-NE2 2.93Å; T954-Q957 CarbonylContact O-C 3.53Å; T954-Q957 WeakPolarHBondContact O-CA 3.09Å; T954-Q957 WeakPolarHBondContact O-CB 3.43Å; T954-Q957 PolarHBondContact O-N 3.21Å; T954-Q957 WeakPolarHBondContact OG1-CB 3.24Å; T954-Q957 PolarHBondContact OG1-N 3.48Å; Q957-R959 VanDerWaalsContact C-N 3.3Å; Q957-R959 PolarHBondContact O-N 2.87Å; Q957-E960 WeakPolarHBondContact O-CB 3.49Å; Q957-E960 PolarHBondContact O-N 3.25Å; Q957-V961 WeakPolarHBondContact O-CG2 3.5Å; Q957-V961 PolarHBondContact O-N 3.32Å; Q957-I1326 HydrophobicContact CG-CG1 3.91Å; Q957-S1329 PolarHBondContact OE1-OG 3.18Å
958	Q	80.2	Confident	76.1	Confident	79 Å²	79	53.2 Å²	53.2	37%	0.369	25%	0.253	S	S	.	.	H	α-helix	trans	-58.3	-42.6	175.7	-172.1	62.8	18.7	0	0	111.2	T954 E960 V961 E962	T954-Q958 PolarHBondContact O-N 2.78Å; Q958-E960 VanDerWaalsContact C-N 3.28Å; Q958-E960 PolarHBondContact O-N 2.97Å; Q958-V961 PolarHBondContact O-N 3.21Å; Q958-V961 VanDerWaalsContact O-N 3.14Å; Q958-E962 WeakPolarHBondContact O-CB 3.5Å; Q958-E962 VanDerWaalsContact O-CG 3.26Å; Q958-E962 WeakPolarHBondContact O-CG 3.21Å; Q958-E962 PolarHBondContact O-N 3.18Å
959	R	79.3	Confident	74.5	Confident	135 Å²	135	56 Å²	56	51%	0.509	27%	0.272	S	S	.	.	H	α-helix	trans	-65.4	-22.6	174	-79.7	179.2	171.5	175.4	-0.5	115.7	Y955 Q957 E962 A963 N1318 R1320	Y955-R959 WeakPolarHBondContact O-CG 3.4Å; Y955-R959 PolarHBondContact O-N 3.17Å; Y955-R959 VanDerWaalsContact O-N 3.14Å; Q957-R959 VanDerWaalsContact C-N 3.3Å; Q957-R959 PolarHBondContact O-N 2.87Å; R959-E962 WeakPolarHBondContact CA-OE2 3.36Å; R959-E962 WeakPolarHBondContact CG-OE2 3.37Å; R959-A963 PolarHBondContact O-N 3.4Å; R959-N1318 WeakPolarHBondContact CB-OD1 3.46Å; R959-R1320 PolarHBondContact O-NE 3.32Å; R959-R1320 PolarHBondContact O-NH2 3.42Å
960	E	86.2	Confident	73.1	Confident	0 Å²	0	61.7 Å²	61.7	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-81.5	-37	170.7	-72	-176.1	171.5	0	0	111.2	C956 Q957 Q958 A963 I964 A1319 L1323 R1324 N1325 I1326	C956-E960 PolarHBondContact O-N 3.42Å; Q957-E960 WeakPolarHBondContact O-CB 3.49Å; Q957-E960 PolarHBondContact O-N 3.25Å; Q958-E960 VanDerWaalsContact C-N 3.28Å; Q958-E960 PolarHBondContact O-N 2.97Å; E960-A963 PolarHBondContact O-N 2.94Å; E960-I964 WeakPolarHBondContact O-CG1 3.5Å; E960-I964 PolarHBondContact O-N 3.05Å; E960-A1319 PolarHBondContact OE1-N 2.87Å; E960-L1323 HydrophobicContact CB-CD2 3.9Å; E960-L1323 HydrophobicContact CG-CD2 4.26Å; E960-L1323 WeakPolarHBondContact OE2-CA 3.47Å; E960-R1324 PolarHBondContact OE1-N 3.41Å; E960-R1324 PolarHBondContact OE2-N 3.5Å; E960-N1325 PolarHBondContact OE1-N 3.3Å; E960-N1325 WeakPolarHBondContact OE2-CA 3.2Å; E960-N1325 WeakPolarHBondContact OE2-CB 3.48Å; E960-N1325 PolarHBondContact OE2-N 2.7Å; E960-I1326 HydrophobicContact CB-CD1 3.63Å; E960-I1326 HydrophobicContact CB-CG1 4.05Å; E960-I1326 PolarHBondContact OE2-N 3.5Å
961	V	83.4	Confident	71.9	Confident	12 Å²	12	62.6 Å²	62.6	7%	0.073	31%	0.312	C	S	.	.	H	α-helix	trans	-67.7	-39.9	173.2	175.4	0	0	0	0	111.7	Q957 Q958 A963 I964 T965 I1326	Q957-V961 WeakPolarHBondContact O-CG2 3.5Å; Q957-V961 PolarHBondContact O-N 3.32Å; Q958-V961 PolarHBondContact O-N 3.21Å; Q958-V961 VanDerWaalsContact O-N 3.14Å; V961-A963 VanDerWaalsContact C-N 3.35Å; V961-A963 PolarHBondContact O-N 3.2Å; V961-I964 WeakPolarHBondContact O-CB 3.32Å; V961-I964 PolarHBondContact O-N 2.8Å; V961-T965 WeakPolarHBondContact O-CB 3.35Å; V961-T965 PolarHBondContact O-N 3Å; V961-T965 VanDerWaalsContact O-N 3.12Å; V961-T965 PolarHBondContact O-OG1 3.47Å; V961-I1326 HydrophobicContact CG2-CD1 3.89Å
962	E	82.7	Confident	70.5	Confident	73 Å²	73	67 Å²	67	34%	0.341	34%	0.337	S	S	.	.	H	α-helix	trans	-56.5	-47.5	170.7	-74.9	162.8	-174	0	0	110.7	Q958 R959 I964 T965 E966 R1320	Q958-E962 WeakPolarHBondContact O-CB 3.5Å; Q958-E962 VanDerWaalsContact O-CG 3.26Å; Q958-E962 WeakPolarHBondContact O-CG 3.21Å; Q958-E962 PolarHBondContact O-N 3.18Å; R959-E962 WeakPolarHBondContact CA-OE2 3.36Å; R959-E962 WeakPolarHBondContact CG-OE2 3.37Å; E962-I964 PolarHBondContact O-N 3.17Å; E962-I964 VanDerWaalsContact O-N 3.14Å; E962-T965 CarbonylContact O-C 3.6Å; E962-T965 WeakPolarHBondContact O-CA 3.37Å; E962-T965 PolarHBondContact O-N 2.83Å; E962-E966 VanDerWaalsContact O-CG 3.32Å; E962-E966 WeakPolarHBondContact O-CG 3.39Å; E962-E966 PolarHBondContact O-N 2.87Å; E962-R1320 IonicContact OE2-NH2 2.93Å
963	A	81.8	Confident	69.5	Low	13 Å²	13	60.3 Å²	60.3	11%	0.107	33%	0.326	C	S	.	.	H	α-helix	trans	-62.2	-23.2	178.9	0	0	0	0	0	114.4	R959 E960 V961 W1000 R1320	R959-A963 PolarHBondContact O-N 3.4Å; E960-A963 PolarHBondContact O-N 2.94Å; V961-A963 VanDerWaalsContact C-N 3.35Å; V961-A963 PolarHBondContact O-N 3.2Å; A963-W1000 WeakPolarHBondContact O-CH2 3.45Å; A963-R1320 HydrophobicContact CB-CB 4.05Å; A963-R1320 HydrophobicContact CB-CG 3.69Å
964	I	83.8	Confident	68.5	Low	0 Å²	0	63.6 Å²	63.6	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-83.9	-23.9	174.1	-67.9	165.1	0	0	0	111.5	I922 A924 E960 V961 E962 W1000 R1283 I1285 L1323 I1326	I922-I964 HydrophobicContact CD1-CD1 4.21Å; A924-I964 HydrophobicContact CB-CG2 3.79Å; E960-I964 WeakPolarHBondContact O-CG1 3.5Å; E960-I964 PolarHBondContact O-N 3.05Å; V961-I964 WeakPolarHBondContact O-CB 3.32Å; V961-I964 PolarHBondContact O-N 2.8Å; E962-I964 PolarHBondContact O-N 3.17Å; E962-I964 VanDerWaalsContact O-N 3.14Å; I964-W1000 HydrophobicContact CG1-CH2 4.43Å; I964-R1283 WeakPolarHBondContact O-CD 3.22Å; I964-R1283 PolarHBondContact O-NH1 3.15Å; I964-I1285 HydrophobicContact CG2-CD1 3.38Å; I964-I1285 HydrophobicContact CG2-CG1 3.78Å; I964-L1323 HydrophobicContact CD1-CD1 3.77Å; I964-L1323 HydrophobicContact CD1-CD2 3.99Å; I964-L1323 HydrophobicContact CG1-CD1 4.12Å; I964-L1323 HydrophobicContact CG1-CD2 4.1Å; I964-I1326 HydrophobicContact CD1-CD1 3.8Å
965	T	80.4	Confident	67.2	Low	46 Å²	46	65.8 Å²	65.8	28%	0.282	36%	0.362	S	S	.	.	H	α-helix	trans	-102.7	-25.9	-170.4	-51.2	0	0	0	0	113	V961 E962 D967 R1283	V961-T965 WeakPolarHBondContact O-CB 3.35Å; V961-T965 PolarHBondContact O-N 3Å; V961-T965 VanDerWaalsContact O-N 3.12Å; V961-T965 PolarHBondContact O-OG1 3.47Å; E962-T965 CarbonylContact O-C 3.6Å; E962-T965 WeakPolarHBondContact O-CA 3.37Å; E962-T965 PolarHBondContact O-N 2.83Å; T965-D967 PolarHBondContact O-N 3.12Å; T965-R1283 VanDerWaalsContact O-CZ 3.28Å; T965-R1283 PolarHBondContact O-NH1 3.17Å; T965-R1283 PolarHBondContact O-NH2 3.35Å
966	E	76.7	Confident	66.1	Low	99 Å²	99	66.1 Å²	66.1	46%	0.463	38%	0.382	S	S	.	.	S	Bend	trans	-57.6	122.9	166.7	-74.1	163.3	-156.8	0	0	110	E962 R1320	E962-E966 VanDerWaalsContact O-CG 3.32Å; E962-E966 WeakPolarHBondContact O-CG 3.39Å; E962-E966 PolarHBondContact O-N 2.87Å; E966-R1320 VanDerWaalsContact CD-NH1 3.35Å; E966-R1320 IonicContact OE1-CZ 2.67Å; E966-R1320 IonicContact OE1-NH1 2.79Å; E966-R1320 PolarHBondContact OE1-NH1 2.99Å; E966-R1320 IonicContact OE1-NH2 3.52Å; E966-R1320 PolarHBondContact OE1-NH2 3.49Å; E966-R1320 IonicContact OE2-CZ 3.62Å; E966-R1320 IonicContact OE2-NH1 3.25Å; E966-R1320 PolarHBondContact OE2-NH1 3.47Å; E966-R1320 IonicContact OE2-NH2 2.65Å
967	D	68.4	Low	64.7	Low	62 Å²	62	67 Å²	67	33%	0.332	39%	0.392	S	S	.	.			trans	-87.7	126.1	178.2	-82.8	1	0	0	0	110.7	T965 S969 D970 R1283	T965-D967 PolarHBondContact O-N 3.12Å; D967-S969 PolarHBondContact O-N 3.05Å; D967-D970 PolarHBondContact O-N 3.23Å; D967-R1283 IonicContact OD1-CZ 3.89Å; D967-R1283 IonicContact OD1-NH1 2.67Å; D967-R1283 PolarHBondContact OD1-NH1 3.2Å; D967-R1283 IonicContact OD1-NH2 2.71Å; D967-R1283 PolarHBondContact OD1-NH2 2.71Å; D967-R1283 IonicContact OD2-NH2 3.47Å
968	I	64.2	Low	63.2	Low	52 Å²	52	69.3 Å²	69.3	27%	0.267	42%	0.417	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.7	8.3	-166.3	-28.6	88.5	0	0	0	114.1	V971 A991 M995	I968-V971 HydrophobicContact CG2-CG2 3.68Å; I968-A991 HydrophobicContact CG2-CB 3.97Å; I968-M995 HydrophobicContact CB-CE 3.62Å; I968-M995 HydrophobicContact CD1-CE 3.96Å; I968-M995 HydrophobicContact CG1-CE 3.82Å; I968-M995 HydrophobicContact CG2-CE 3.63Å
969	S	55.4	Low	61.8	Low	58 Å²	58	71.5 Å²	71.5	41%	0.406	43%	0.431	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-27.9	163.2	40.5	0	0	0	0	112.4	D967 R982	D967-S969 PolarHBondContact O-N 3.05Å; S969-R982 PolarHBondContact O-NH1 2.74Å
970	D	53.3	Low	60.6	Low	123 Å²	123	72 Å²	72	66%	0.658	45%	0.449	S	S	*	.	S	Bend	trans	-97.2	0.4	-161.3	-53.9	-3.2	0	0	0	111.7	D967 D972	D967-D970 PolarHBondContact O-N 3.23Å; D970-D972 PolarHBondContact O-N 2.82Å
971	V	52.1	Low	59	Low	61 Å²	61	76.8 Å²	76.8	37%	0.37	48%	0.482	S	S	.	.	S	Bend	trans	-69.1	116.6	171.2	-177.9	0	0	0	0	109.2	I968 R982	I968-V971 HydrophobicContact CG2-CG2 3.68Å; V971-R982 PolarHBondContact O-NH2 3.08Å
972	D	43.5	Very low	57.7	Low	139 Å²	139	81 Å²	81	74%	0.743	50%	0.496	S	S	*	.	P	Polyproline II helix	trans	-55.7	151.6	180	-84.3	-47.4	0	0	0	113.9	D970	D970-D972 PolarHBondContact O-N 2.82Å
973	G	41.2	Very low	56.9	Low	46 Å²	46	83.2 Å²	83.2	47%	0.474	51%	0.51	S	S	.	.	P	Polyproline II helix	trans	-65.8	142.9	178.6	0	0	0	0	0	112.4
974	C	42.2	Very low	56.2	Low	91 Å²	91	88.5 Å²	88.5	62%	0.615	54%	0.543	S	S	*	.	P	Polyproline II helix	trans	-67.2	153.2	168.4	-165	0	0	0	0	110.4
975	C	39.1	Very low	55.7	Low	111 Å²	111	90.1 Å²	90.1	75%	0.75	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-35.7	139.4	-165.8	-58	0	0	0	0	117.7	A977	C975-A977 VanDerWaalsContact C-N 3.34Å; C975-A977 PolarHBondContact O-N 3.18Å
976	C	47	Very low	55.6	Low	144 Å²	144	93 Å²	93	97%	0.973	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	71.9	-0.7	158.9	-55.5	0	0	0	0	118.8
977	A	42.1	Very low	55.6	Low	59 Å²	59	89.3 Å²	89.3	49%	0.488	55%	0.553	S	S	.	*			trans	-121.1	116.7	165.3	0	0	0	0	0	110.6	C975	C975-A977 VanDerWaalsContact C-N 3.34Å; C975-A977 PolarHBondContact O-N 3.18Å
978	G	44.1	Very low	56.1	Low	53 Å²	53	88.2 Å²	88.2	55%	0.546	55%	0.548	S	S	.	.			trans	-74.2	-167.1	174.7	0	0	0	0	0	113.2	V980 C981	G978-V980 PolarHBondContact O-N 3.36Å; G978-C981 PolarHBondContact O-N 3.3Å
979	D	51.4	Low	56.7	Low	124 Å²	124	95.6 Å²	95.6	66%	0.663	57%	0.573	S	S	*	*	G	3₁₀ helix	trans	-56.9	-13.9	-169.8	-60.2	-69.4	0	0	0	116.3	C981 R982	D979-C981 PolarHBondContact O-N 2.97Å; D979-R982 PolarHBondContact O-N 2.94Å; D979-R982 IonicContact OD1-NE 3.91Å
980	V	53.9	Low	57.9	Low	146 Å²	146	96.1 Å²	96.1	89%	0.885	57%	0.571	S	S	*	*	G	3₁₀ helix	trans	-48.4	-29.9	172.3	-171.6	0	0	0	0	112.8	G978	G978-V980 PolarHBondContact O-N 3.36Å
981	C	52	Low	59.1	Low	101 Å²	101	90.3 Å²	90.3	68%	0.682	54%	0.541	S	S	*	.	G	3₁₀ helix	trans	-92.3	-2.4	178.8	-67.3	0	0	0	0	115.1	G978 D979 L983	G978-C981 PolarHBondContact O-N 3.3Å; D979-C981 PolarHBondContact O-N 2.97Å; C981-L983 PolarHBondContact O-N 2.96Å
982	R	56.9	Low	60.5	Low	100 Å²	100	87.7 Å²	87.7	38%	0.377	53%	0.525	S	S	.	.			trans	-84.1	90.8	175.5	-72.3	-172.9	178.7	-128.8	-2.8	110.4	S969 V971 D979	S969-R982 PolarHBondContact O-NH1 2.74Å; V971-R982 PolarHBondContact O-NH2 3.08Å; D979-R982 PolarHBondContact O-N 2.94Å; D979-R982 IonicContact OD1-NE 3.91Å
983	L	64.8	Low	62.3	Low	120 Å²	120	87.4 Å²	87.4	63%	0.628	51%	0.514	S	S	*	.			trans	-55.1	124.2	165.9	-85.6	167.1	0	0	0	109.6	C981 G985 F986	C981-L983 PolarHBondContact O-N 2.96Å; L983-G985 PolarHBondContact O-N 3.48Å; L983-G985 VanDerWaalsContact O-N 3.16Å; L983-F986 HydrophobicContact CB-CB 4.21Å; L983-F986 HydrophobicContact CB-CD2 3.7Å; L983-F986 HydrophobicContact CB-CE2 4.45Å; L983-F986 HydrophobicContact CB-CG 4.19Å; L983-F986 PolarHBondContact O-N 3.04Å
984	P	68.1	Low	64.2	Low	124 Å²	124	87.8 Å²	87.8	81%	0.805	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	119.9	-170.7	23.8	-33.3	0	0	0	111.1
985	G	73.7	Confident	66.1	Low	34 Å²	34	84.9 Å²	84.9	35%	0.351	48%	0.483	S	S	.	.	T	Hydrogen-bonded Turn	trans	95.6	1.9	-176.1	0	0	0	0	0	115.4	L690 S691 L983	L690-G985 WeakPolarHBondContact CA-O 3.29Å; S691-G985 PolarHBondContact N-O 2.89Å; S691-G985 WeakPolarHBondContact OG-CA 3.39Å; S691-G985 PolarHBondContact OG-O 3.28Å; L983-G985 PolarHBondContact O-N 3.48Å; L983-G985 VanDerWaalsContact O-N 3.16Å
986	F	77.9	Confident	68.3	Low	106 Å²	106	87.4 Å²	87.4	47%	0.465	48%	0.477	S	S	.	.	B	Isolated β-bridge	trans	-101.8	154.4	173.1	-73.1	-97.5	0	0	0	112.7	F689 L690 L983	F689-F986 HydrophobicContact CB-CD1 4.32Å; F689-F986 CarbonylContact O-C 3.6Å; F689-F986 VanDerWaalsContact O-CA 3.29Å; F689-F986 WeakPolarHBondContact O-CA 3.45Å; F689-F986 WeakPolarHBondContact O-CD1 3.42Å; L690-F986 HydrophobicContact CD2-CE1 4.49Å; L690-F986 HydrophobicContact CD2-CZ 4.37Å; L983-F986 HydrophobicContact CB-CB 4.21Å; L983-F986 HydrophobicContact CB-CD2 3.7Å; L983-F986 HydrophobicContact CB-CE2 4.45Å; L983-F986 HydrophobicContact CB-CG 4.19Å; L983-F986 PolarHBondContact O-N 3.04Å
987	V	76.5	Confident	70	Confident	22 Å²	22	83.2 Å²	83.2	13%	0.133	44%	0.44	C	S	.	.	P	Polyproline II helix	trans	-86.6	145	171.9	-178.6	0	0	0	0	109.2	T685 I688 F689 A991 A992 M995	T685-V987 HydrophobicContact CG2-CG2 4.31Å; I688-V987 WeakPolarHBondContact O-CG2 3.48Å; F689-V987 PolarHBondContact O-N 3.4Å; V987-A991 HydrophobicContact CG1-CB 3.63Å; V987-A992 HydrophobicContact CG1-CB 4.23Å; V987-M995 HydrophobicContact CG1-CE 3.89Å; V987-M995 HydrophobicContact CG2-CE 4.49Å
988	T	78.1	Confident	72.2	Confident	38 Å²	38	82.7 Å²	82.7	23%	0.233	43%	0.429	C	S	.	.	P	Polyproline II helix	trans	-66.1	145.3	175.2	68.3	0	0	0	0	110.8	N990 A991 A992	T988-N990 PolarHBondContact O-N 3.11Å; T988-N990 VanDerWaalsContact O-N 3.14Å; T988-A991 PolarHBondContact O-N 2.84Å; T988-A991 WeakPolarHBondContact OG1-CB 3.35Å; T988-A991 PolarHBondContact OG1-N 3.01Å; T988-A992 WeakPolarHBondContact O-CB 3.35Å; T988-A992 PolarHBondContact O-N 3.48Å
989	W	78.2	Confident	74.3	Confident	207 Å²	207	80.7 Å²	80.7	78%	0.784	41%	0.407	S	S	*	.	H	α-helix	trans	-57.1	-32	-179.9	-81.8	100.9	0	0	0	113.5	F689 W993	F689-W989 AromaticContact CE1-CH2 3.73Å; F689-W989 HydrophobicContact CE1-CH2 3.73Å; F689-W989 HydrophobicContact CE1-CZ2 4.34Å; F689-W989 AromaticContact CE1-CZ3 3.93Å; F689-W989 HydrophobicContact CE1-CZ3 3.93Å; F689-W989 HydrophobicContact CZ-CH2 4.46Å; W989-W993 VanDerWaalsContact O-CB 3.31Å; W989-W993 WeakPolarHBondContact O-CB 3.42Å; W989-W993 PolarHBondContact O-N 2.87Å
990	N	79.6	Confident	76.2	Confident	69 Å²	69	76.1 Å²	76.1	37%	0.369	38%	0.381	S	S	.	.	H	α-helix	trans	-66.7	-46.7	174.7	-171.6	27.8	0	0	0	111.9	T988 W993 N994	T988-N990 PolarHBondContact O-N 3.11Å; T988-N990 VanDerWaalsContact O-N 3.14Å; N990-W993 PolarHBondContact O-N 2.86Å; N990-N994 PolarHBondContact O-N 3.01Å; N990-N994 PolarHBondContact O-ND2 2.97Å; N990-N994 VanDerWaalsContact O-ND2 3.15Å; N990-N994 PolarHBondContact OD1-ND2 3.36Å
991	A	78.9	Confident	77.8	Confident	2 Å²	2	73 Å²	73	2%	0.017	36%	0.357	C	S	.	.	H	α-helix	trans	-64.9	-42.5	175.2	0	0	0	0	0	111.7	I968 V987 T988 W993 N994 M995	I968-A991 HydrophobicContact CG2-CB 3.97Å; V987-A991 HydrophobicContact CG1-CB 3.63Å; T988-A991 PolarHBondContact O-N 2.84Å; T988-A991 WeakPolarHBondContact OG1-CB 3.35Å; T988-A991 PolarHBondContact OG1-N 3.01Å; A991-W993 VanDerWaalsContact C-N 3.31Å; A991-W993 PolarHBondContact O-N 3.42Å; A991-N994 PolarHBondContact O-N 3.3Å; A991-M995 WeakPolarHBondContact O-CG 3.45Å; A991-M995 PolarHBondContact O-N 3.46Å
992	A	82.1	Confident	79.5	Confident	6 Å²	6	69.2 Å²	69.2	5%	0.05	33%	0.329	C	S	.	.	H	α-helix	trans	-63.6	-33.6	175.9	0	0	0	0	0	113	I688 V987 T988	I688-A992 HydrophobicContact CG2-CB 3.83Å; V987-A992 HydrophobicContact CG1-CB 4.23Å; T988-A992 WeakPolarHBondContact O-CB 3.35Å; T988-A992 PolarHBondContact O-N 3.48Å
993	W	81.8	Confident	80.9	Confident	132 Å²	132	65 Å²	65	50%	0.5	31%	0.314	S	S	.	.	H	α-helix	trans	-66.1	-54.5	169.9	-178.2	-100.4	0	0	0	110.6	W989 N990 A991 M995 R996 W997	W989-W993 VanDerWaalsContact O-CB 3.31Å; W989-W993 WeakPolarHBondContact O-CB 3.42Å; W989-W993 PolarHBondContact O-N 2.87Å; N990-W993 PolarHBondContact O-N 2.86Å; A991-W993 VanDerWaalsContact C-N 3.31Å; A991-W993 PolarHBondContact O-N 3.42Å; W993-M995 VanDerWaalsContact C-N 3.3Å; W993-M995 PolarHBondContact O-N 3.49Å; W993-R996 WeakPolarHBondContact O-CB 3.31Å; W993-R996 PolarHBondContact O-N 2.89Å; W993-W997 AromaticContact CD2-NE1 3.83Å; W993-W997 AromaticContact CE2-CD1 4Å; W993-W997 AromaticContact CE2-NE1 3.26Å; W993-W997 VanDerWaalsContact CE2-NE1 3.26Å; W993-W997 HydrophobicContact CH2-CZ2 4.3Å; W993-W997 AromaticContact CZ2-CE2 3.95Å; W993-W997 AromaticContact CZ2-CZ2 3.93Å; W993-W997 HydrophobicContact CZ2-CZ2 3.93Å; W993-W997 AromaticContact CZ2-NE1 3.39Å; W993-W997 AromaticContact NE1-CD1 3.78Å; W993-W997 AromaticContact NE1-NE1 3.45Å; W993-W997 VanDerWaalsContact O-CD1 3.25Å
994	N	80.4	Confident	81.9	Confident	54 Å²	54	60.2 Å²	60.2	29%	0.289	29%	0.29	S	S	.	.	H	α-helix	trans	-58.8	-38.2	-177.9	-70.9	-34	0	0	0	112.9	N990 A991 R996 W997	N990-N994 PolarHBondContact O-N 3.01Å; N990-N994 PolarHBondContact O-ND2 2.97Å; N990-N994 VanDerWaalsContact O-ND2 3.15Å; N990-N994 PolarHBondContact OD1-ND2 3.36Å; A991-N994 PolarHBondContact O-N 3.3Å; N994-R996 PolarHBondContact O-N 3.23Å; N994-W997 PolarHBondContact O-N 2.89Å; N994-W997 VanDerWaalsContact O-N 3.08Å
995	M	81.3	Confident	82.5	Confident	31 Å²	31	55.3 Å²	55.3	15%	0.153	26%	0.26	C	S	.	.	H	α-helix	trans	-56.1	-33	172.9	-75.1	-177.9	-160.3	0	0	113.5	T685 I688 I968 V987 A991 W993 W997 L998	T685-M995 HydrophobicContact CG2-CE 4.2Å; T685-M995 HydrophobicContact CG2-SD 4.48Å; I688-M995 HydrophobicContact CG2-CB 4.18Å; I688-M995 HydrophobicContact CG2-SD 3.85Å; I968-M995 HydrophobicContact CB-CE 3.62Å; I968-M995 HydrophobicContact CD1-CE 3.96Å; I968-M995 HydrophobicContact CG1-CE 3.82Å; I968-M995 HydrophobicContact CG2-CE 3.63Å; V987-M995 HydrophobicContact CG1-CE 3.89Å; V987-M995 HydrophobicContact CG2-CE 4.49Å; A991-M995 WeakPolarHBondContact O-CG 3.45Å; A991-M995 PolarHBondContact O-N 3.46Å; W993-M995 VanDerWaalsContact C-N 3.3Å; W993-M995 PolarHBondContact O-N 3.49Å; M995-W997 PolarHBondContact O-N 2.85Å; M995-L998 PolarHBondContact O-N 2.97Å
996	R	85	Confident	83	Confident	164 Å²	164	57.8 Å²	57.8	62%	0.619	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.9	-15.5	179.4	-71.8	-177	171.5	-151.3	-0.7	113.9	I688 W993 N994	I688-R996 HydrophobicContact CD1-CG 3.88Å; W993-R996 WeakPolarHBondContact O-CB 3.31Å; W993-R996 PolarHBondContact O-N 2.89Å; N994-R996 PolarHBondContact O-N 3.23Å
997	W	83.8	Confident	83.5	Confident	55 Å²	55	53.1 Å²	53.1	21%	0.208	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.8	4.8	-180	-62.8	95.5	0	0	0	113.1	F792 A793 A796 W798 Q799 W993 N994 M995	F792-W997 HydrophobicContact CB-CE3 4.45Å; F792-W997 HydrophobicContact CB-CZ3 3.85Å; A793-W997 VanDerWaalsContact CB-O 3.25Å; A793-W997 WeakPolarHBondContact CB-O 3.36Å; A796-W997 HydrophobicContact CB-CE3 4.18Å; W798-W997 HydrophobicContact CH2-CD2 4.38Å; W798-W997 HydrophobicContact CH2-CE3 4.35Å; W798-W997 AromaticContact CH2-CH2 3.8Å; W798-W997 HydrophobicContact CH2-CH2 3.8Å; W798-W997 AromaticContact CH2-CZ2 3.83Å; W798-W997 HydrophobicContact CH2-CZ2 3.83Å; W798-W997 HydrophobicContact CH2-CZ3 4.04Å; W798-W997 AromaticContact CZ2-CD2 3.58Å; W798-W997 HydrophobicContact CZ2-CD2 3.58Å; W798-W997 AromaticContact CZ2-CE2 3.5Å; W798-W997 VanDerWaalsContact CZ2-CE2 3.5Å; W798-W997 AromaticContact CZ2-CE3 3.84Å; W798-W997 HydrophobicContact CZ2-CE3 3.84Å; W798-W997 HydrophobicContact CZ2-CG 4.06Å; W798-W997 AromaticContact CZ2-CH2 3.99Å; W798-W997 HydrophobicContact CZ2-CH2 3.99Å; W798-W997 AromaticContact CZ2-CZ2 3.74Å; W798-W997 HydrophobicContact CZ2-CZ2 3.74Å; W798-W997 HydrophobicContact CZ2-CZ3 4.01Å; W798-W997 AromaticContact CZ2-NE1 3.85Å; Q799-W997 PolarHBondContact OE1-O 2.76Å; W993-W997 AromaticContact CD2-NE1 3.83Å; W993-W997 AromaticContact CE2-CD1 4Å; W993-W997 AromaticContact CE2-NE1 3.26Å; W993-W997 VanDerWaalsContact CE2-NE1 3.26Å; W993-W997 HydrophobicContact CH2-CZ2 4.3Å; W993-W997 AromaticContact CZ2-CE2 3.95Å; W993-W997 AromaticContact CZ2-CZ2 3.93Å; W993-W997 HydrophobicContact CZ2-CZ2 3.93Å; W993-W997 AromaticContact CZ2-NE1 3.39Å; W993-W997 AromaticContact NE1-CD1 3.78Å; W993-W997 AromaticContact NE1-NE1 3.45Å; W993-W997 VanDerWaalsContact O-CD1 3.25Å; N994-W997 PolarHBondContact O-N 2.89Å; N994-W997 VanDerWaalsContact O-N 3.08Å; M995-W997 PolarHBondContact O-N 2.85Å
998	L	87.5	Confident	84.2	Confident	48 Å²	48	53.2 Å²	53.2	25%	0.251	24%	0.237	S	C	.	.			trans	-79.2	140.7	168.6	-55.4	177.3	0	0	0	110.2	M995 W1000 Q1321	M995-L998 PolarHBondContact O-N 2.97Å; L998-W1000 HydrophobicContact CB-CD2 4.4Å; L998-W1000 HydrophobicContact CB-CG 4.35Å; L998-W1000 WeakPolarHBondContact CB-O 3.28Å; L998-W1000 HydrophobicContact CD1-CD2 4.27Å; L998-W1000 HydrophobicContact CD1-CE3 4.4Å; L998-W1000 HydrophobicContact CD1-CH2 4.09Å; L998-W1000 HydrophobicContact CD1-CZ2 3.93Å; L998-W1000 HydrophobicContact CD1-CZ3 4.32Å; L998-W1000 HydrophobicContact CD2-CZ2 4.32Å; L998-W1000 PolarHBondContact O-N 3.09Å; L998-Q1321 HydrophobicContact CD2-CB 4Å
999	A	88.8	Confident	84.7	Confident	11 Å²	11	51.6 Å²	51.6	9%	0.091	23%	0.227	C	C	.	.	S	Bend	trans	-79.8	10.5	170	0	0	0	0	0	113.1	A793 N1288 Q1321 V1322	A793-A999 HydrophobicContact CB-CB 4.49Å; A999-N1288 VanDerWaalsContact O-CB 3.29Å; A999-N1288 WeakPolarHBondContact O-CB 3.39Å; A999-N1288 PolarHBondContact O-N 2.8Å; A999-Q1321 PolarHBondContact N-O 2.84Å; A999-V1322 HydrophobicContact CB-CG1 3.82Å
1000	W	90.8	Very high	85.2	Confident	28 Å²	28	42.9 Å²	42.9	11%	0.106	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	149.2	-172.6	58.6	-95.8	0	0	0	112	A963 I964 L998 I1002 I1285 K1286 L1287 R1320 L1323	A963-W1000 WeakPolarHBondContact O-CH2 3.45Å; I964-W1000 HydrophobicContact CG1-CH2 4.43Å; L998-W1000 HydrophobicContact CB-CD2 4.4Å; L998-W1000 HydrophobicContact CB-CG 4.35Å; L998-W1000 WeakPolarHBondContact CB-O 3.28Å; L998-W1000 HydrophobicContact CD1-CD2 4.27Å; L998-W1000 HydrophobicContact CD1-CE3 4.4Å; L998-W1000 HydrophobicContact CD1-CH2 4.09Å; L998-W1000 HydrophobicContact CD1-CZ2 3.93Å; L998-W1000 HydrophobicContact CD1-CZ3 4.32Å; L998-W1000 HydrophobicContact CD2-CZ2 4.32Å; L998-W1000 PolarHBondContact O-N 3.09Å; W1000-I1002 HydrophobicContact CZ3-CD1 4.35Å; W1000-I1002 HydrophobicContact CZ3-CG1 4Å; W1000-I1285 HydrophobicContact CB-CG2 3.89Å; W1000-I1285 HydrophobicContact CD2-CG2 4.26Å; W1000-I1285 HydrophobicContact CE3-CG2 3.7Å; W1000-I1285 HydrophobicContact CG-CG2 4.41Å; W1000-K1286 CarbonylContact C-O 3.47Å; W1000-K1286 VanDerWaalsContact CA-O 3.3Å; W1000-K1286 WeakPolarHBondContact CA-O 3.45Å; W1000-L1287 HydrophobicContact CB-CD2 3.89Å; W1000-R1320 PolarHBondContact NE1-O 3.24Å; W1000-L1323 HydrophobicContact CB-CD1 4.2Å; W1000-L1323 HydrophobicContact CD2-CD1 4.06Å; W1000-L1323 HydrophobicContact CG-CD1 3.7Å; W1000-L1323 HydrophobicContact CG-CG 4.29Å
1001	E	87.4	Confident	85.5	Confident	81 Å²	81	40 Å²	40	38%	0.379	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	136.5	177.1	64.1	175.8	135.7	0	0	111.8	K683 K1003 I1285 K1286	K683-E1001 IonicContact NZ-OE2 2.73Å; E1001-K1003 HydrophobicContact CG-CD 4.22Å; E1001-K1003 PolarHBondContact O-N 3.47Å; E1001-K1003 VanDerWaalsContact OE1-CE 3.26Å; E1001-K1003 WeakPolarHBondContact OE1-CE 3.16Å; E1001-K1003 IonicContact OE1-NZ 3.99Å; E1001-K1003 PolarHBondContact OE1-NZ 3.38Å; E1001-K1003 WeakPolarHBondContact OE2-CE 3.36Å; E1001-K1003 IonicContact OE2-NZ 2.71Å; E1001-K1003 PolarHBondContact OE2-NZ 2.91Å; E1001-I1285 CarbonylContact O-C 3.51Å; E1001-I1285 WeakPolarHBondContact O-CA 3.48Å; E1001-K1286 HydrophobicContact CG-CB 4.02Å; E1001-K1286 PolarHBondContact N-O 2.87Å; E1001-K1286 PolarHBondContact O-N 2.95Å
1002	I	87.4	Confident	85.9	Confident	21 Å²	21	40.6 Å²	40.6	11%	0.108	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75	108.9	171.8	-55.9	177.1	0	0	0	108.2	H684 W1000 I1285	H684-I1002 HydrophobicContact CB-CG2 4.23Å; W1000-I1002 HydrophobicContact CZ3-CD1 4.35Å; W1000-I1002 HydrophobicContact CZ3-CG1 4Å; I1002-I1285 HydrophobicContact CG1-CG1 4.2Å
1003	K	86.3	Confident	85.9	Confident	12 Å²	12	41.7 Å²	41.7	5%	0.052	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	-52.1	176.4	-71.3	-63.1	-170.2	-169.6	0	110.6	A912 E1001 V1284 K1286	A912-K1003 HydrophobicContact CB-CG 4.29Å; E1001-K1003 HydrophobicContact CG-CD 4.22Å; E1001-K1003 PolarHBondContact O-N 3.47Å; E1001-K1003 VanDerWaalsContact OE1-CE 3.26Å; E1001-K1003 WeakPolarHBondContact OE1-CE 3.16Å; E1001-K1003 IonicContact OE1-NZ 3.99Å; E1001-K1003 PolarHBondContact OE1-NZ 3.38Å; E1001-K1003 WeakPolarHBondContact OE2-CE 3.36Å; E1001-K1003 IonicContact OE2-NZ 2.71Å; E1001-K1003 PolarHBondContact OE2-NZ 2.91Å; K1003-V1284 PolarHBondContact N-O 3.5Å; K1003-K1286 HydrophobicContact CD-CB 4.48Å; K1003-K1286 VanDerWaalsContact CE-CD 3.48Å; K1003-K1286 HydrophobicContact CG-CB 3.83Å
1004	T	86	Confident	85.9	Confident	20 Å²	20	38.3 Å²	38.3	12%	0.123	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	131.8	177.2	55.4	0	0	0	0	110.6	R910 F911 V1284	R910-T1004 WeakPolarHBondContact O-CG2 3.46Å; F911-T1004 PolarHBondContact O-OG1 2.89Å; T1004-V1284 PolarHBondContact N-O 2.87Å; T1004-V1284 PolarHBondContact O-N 3.21Å; T1004-V1284 WeakPolarHBondContact OG1-CB 3.17Å; T1004-V1284 VanDerWaalsContact OG1-CG2 3.3Å; T1004-V1284 WeakPolarHBondContact OG1-CG2 3.41Å
1005	A	81.5	Confident	86	Confident	21 Å²	21	38.6 Å²	38.6	17%	0.174	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80	-20.8	-175.9	0	0	0	0	0	113.4
1006	R	84.4	Confident	85.9	Confident	85 Å²	85	41.1 Å²	41.1	32%	0.321	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	93.4	-178.6	-67.9	-177.5	174.2	-163	-11.1	110.7	E699 Y700 L702	E699-R1006 PolarHBondContact O-NH1 3.38Å; Y700-R1006 PolarHBondContact O-NH1 3.05Å; L702-R1006 PolarHBondContact O-NH1 3.47Å; L702-R1006 PolarHBondContact O-NH2 2.92Å
1007	Y	88.8	Confident	85.9	Confident	8 Å²	8	36.6 Å²	36.6	3%	0.031	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	135.9	163.4	-179.9	-121.4	0	0	0	108.1	L898 D905 F911 L923 L1009 S1281 F1282 V1284	L898-Y1007 HydrophobicContact CD2-CE1 4Å; D905-Y1007 HydrophobicContact CB-CE2 4.03Å; F911-Y1007 HydrophobicContact CB-CE2 4.44Å; F911-Y1007 HydrophobicContact CD2-CD1 4.01Å; F911-Y1007 AromaticContact CD2-CE1 3.63Å; F911-Y1007 HydrophobicContact CD2-CE1 3.63Å; F911-Y1007 HydrophobicContact CD2-CE2 4.24Å; F911-Y1007 HydrophobicContact CD2-CG 4.44Å; F911-Y1007 AromaticContact CD2-CZ 3.76Å; F911-Y1007 HydrophobicContact CE2-CD1 4.34Å; F911-Y1007 HydrophobicContact CE2-CE1 4.01Å; L923-Y1007 HydrophobicContact CD2-CD1 4.39Å; Y1007-L1009 HydrophobicContact CD1-CD1 4.16Å; Y1007-L1009 HydrophobicContact CD1-CG 4.14Å; Y1007-L1009 HydrophobicContact CE1-CD1 3.77Å; Y1007-L1009 HydrophobicContact CE1-CD2 3.76Å; Y1007-L1009 HydrophobicContact CE1-CG 3.79Å; Y1007-S1281 WeakPolarHBondContact O-CA 3.33Å; Y1007-F1282 PolarHBondContact N-O 3.38Å; Y1007-F1282 PolarHBondContact O-N 2.93Å; Y1007-V1284 VanDerWaalsContact CB-CG2 3.44Å; Y1007-V1284 HydrophobicContact CD1-CG2 4.08Å; Y1007-V1284 HydrophobicContact CG-CG2 3.95Å
1008	I	89.5	Confident	85.8	Confident	24 Å²	24	35.4 Å²	35.4	12%	0.123	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	126.6	-164.2	-63.6	160.3	0	0	0	108.8	E699 V705 A709 F1279	E699-I1008 HydrophobicContact CB-CD1 3.72Å; E699-I1008 HydrophobicContact CG-CD1 3.72Å; V705-I1008 HydrophobicContact CG1-CD1 4.27Å; V705-I1008 HydrophobicContact CG1-CG2 4.21Å; V705-I1008 HydrophobicContact CG2-CD1 4.38Å; A709-I1008 HydrophobicContact CB-CB 4.48Å; A709-I1008 HydrophobicContact CB-CD1 4.01Å; I1008-F1279 HydrophobicContact CG2-CB 3.73Å; I1008-F1279 HydrophobicContact CG2-CD1 4.22Å; I1008-F1279 HydrophobicContact CG2-CG 4.29Å
1009	L	89.7	Confident	85.5	Confident	4 Å²	4	33.1 Å²	33.1	2%	0.021	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	154.4	-178.1	-68.2	173.4	0	0	0	111.9	L894 L898 L923 Y1007 G1011 F1279 V1280 F1282	L894-L1009 HydrophobicContact CD1-CB 4.47Å; L894-L1009 HydrophobicContact CD1-CD1 3.56Å; L898-L1009 HydrophobicContact CD2-CD1 3.81Å; L898-L1009 HydrophobicContact CD2-CD2 4.32Å; L898-L1009 HydrophobicContact CG-CD1 4.05Å; L923-L1009 HydrophobicContact CD1-CD1 4.27Å; Y1007-L1009 HydrophobicContact CD1-CD1 4.16Å; Y1007-L1009 HydrophobicContact CD1-CG 4.14Å; Y1007-L1009 HydrophobicContact CE1-CD1 3.77Å; Y1007-L1009 HydrophobicContact CE1-CD2 3.76Å; Y1007-L1009 HydrophobicContact CE1-CG 3.79Å; L1009-G1011 PolarHBondContact O-N 3.03Å; L1009-F1279 CarbonylContact O-C 3.4Å; L1009-F1279 WeakPolarHBondContact O-CA 3.31Å; L1009-V1280 PolarHBondContact N-O 2.97Å; L1009-V1280 VanDerWaalsContact N-O 3.09Å; L1009-V1280 PolarHBondContact O-N 2.88Å; L1009-F1282 HydrophobicContact CB-CD2 4.42Å; L1009-F1282 HydrophobicContact CB-CE2 4.15Å; L1009-F1282 HydrophobicContact CD1-CD2 4.06Å; L1009-F1282 HydrophobicContact CD1-CE2 4.04Å; L1009-F1282 HydrophobicContact CG-CD2 4.46Å
1010	D	87.5	Confident	84.9	Confident	25 Å²	25	33.9 Å²	33.9	13%	0.134	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-55.7	131	162.1	-104.4	26.4	0	0	0	109.5	S897 N1252 K1277 F1279	S897-D1010 PolarHBondContact OG-O 3.42Å; D1010-N1252 PolarHBondContact OD2-ND2 2.85Å; D1010-K1277 WeakPolarHBondContact OD1-CE 3.39Å; D1010-K1277 IonicContact OD1-NZ 2.72Å; D1010-K1277 PolarHBondContact OD1-NZ 2.78Å; D1010-K1277 WeakPolarHBondContact OD2-CE 3.31Å; D1010-K1277 IonicContact OD2-NZ 2.72Å; D1010-K1277 PolarHBondContact OD2-NZ 3.41Å; D1010-F1279 WeakPolarHBondContact OD1-CE1 3.36Å
1011	G	86.5	Confident	84.2	Confident	8 Å²	8	35.7 Å²	35.7	8%	0.082	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-164.8	-163.7	174.8	0	0	0	0	0	112.2	L1009 R1278	L1009-G1011 PolarHBondContact O-N 3.03Å; G1011-R1278 CarbonylContact C-O 3.45Å; G1011-R1278 PolarHBondContact N-O 3.14Å; G1011-R1278 VanDerWaalsContact N-O 3.11Å; G1011-R1278 PolarHBondContact O-N 3.45Å
1012	Y	86.6	Confident	83.5	Confident	14 Å²	14	33.3 Å²	33.3	6%	0.055	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	136.7	177.5	-65.8	-85.4	0	0	0	110.8	H893 V1249 N1252 T1253 L1256 L1275 N1276 K1277	H893-Y1012 AromaticContact CE1-CE2 3.5Å; H893-Y1012 AromaticContact ND1-CE2 3.63Å; Y1012-V1249 HydrophobicContact CD2-CG1 4.31Å; Y1012-V1249 HydrophobicContact CE2-CB 4.5Å; Y1012-V1249 HydrophobicContact CE2-CG1 3.7Å; Y1012-V1249 WeakPolarHBondContact CE2-O 3.49Å; Y1012-V1249 WeakPolarHBondContact OH-CA 3.21Å; Y1012-V1249 PolarHBondContact OH-O 3.08Å; Y1012-N1252 WeakPolarHBondContact OH-CA 3.41Å; Y1012-T1253 WeakPolarHBondContact CE1-O 3.32Å; Y1012-L1256 HydrophobicContact CD1-CD1 4.05Å; Y1012-L1256 HydrophobicContact CE1-CD1 3.42Å; Y1012-L1256 VanDerWaalsContact CE1-CD1 3.42Å; Y1012-L1275 HydrophobicContact CD1-CB 3.96Å; Y1012-L1275 HydrophobicContact CG-CB 4.36Å; Y1012-N1276 WeakPolarHBondContact CA-O 3.31Å; Y1012-K1277 HydrophobicContact CD1-CB 4.23Å; Y1012-K1277 HydrophobicContact CE1-CB 4.03Å
1013	S	82.2	Confident	82.6	Confident	30 Å²	30	32.4 Å²	32.4	21%	0.21	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	120.3	160	58	0	0	0	0	108.6	N1276 R1278	S1013-N1276 PolarHBondContact N-O 3.04Å; S1013-N1276 PolarHBondContact O-N 3.38Å; S1013-N1276 VanDerWaalsContact O-N 3.09Å; S1013-N1276 PolarHBondContact OG-O 2.74Å; S1013-R1278 WeakPolarHBondContact OG-CD 3.45Å; S1013-R1278 PolarHBondContact OG-NE 3.12Å
1014	V	81.7	Confident	81.4	Confident	61 Å²	61	38 Å²	38	37%	0.37	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	135.9	171.4	-169.3	0	0	0	0	108.7	F890 I1273 L1275	F890-V1014 HydrophobicContact CZ-CG2 4.5Å; V1014-I1273 HydrophobicContact CG1-CG2 3.85Å; V1014-L1275 HydrophobicContact CB-CD2 4.22Å; V1014-L1275 HydrophobicContact CG1-CD2 4.14Å; V1014-L1275 HydrophobicContact CG2-CD2 3.8Å
1015	T	82.5	Confident	79.7	Confident	59 Å²	59	41.7 Å²	41.7	36%	0.362	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	115.8	164.9	54.6	0	0	0	0	108.8	M1274	T1015-M1274 PolarHBondContact N-O 3.42Å; T1015-M1274 PolarHBondContact O-N 2.75Å; T1015-M1274 PolarHBondContact OG1-O 3.14Å
1016	D	80.2	Confident	78.1	Confident	85 Å²	85	45.7 Å²	45.7	46%	0.455	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	104.2	-178.8	62.8	-49.4	0	0	0	112	K1271 I1273	D1016-K1271 HydrophobicContact CB-CD 4.33Å; D1016-K1271 IonicContact OD2-NZ 3Å; D1016-I1273 HydrophobicContact CB-CG1 4.46Å
1017	N	83.9	Confident	76.6	Confident	68 Å²	68	46.5 Å²	46.5	36%	0.364	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	128.7	172.3	-68.5	-34.4	0	0	0	108.9	A1019 L1022 Q1209 K1271 I1272	N1017-A1019 PolarHBondContact O-N 3.13Å; N1017-L1022 HydrophobicContact CB-CD1 4.34Å; N1017-Q1209 PolarHBondContact ND2-NE2 2.83Å; N1017-K1271 CarbonylContact O-C 3.55Å; N1017-K1271 VanDerWaalsContact O-CA 3.31Å; N1017-K1271 WeakPolarHBondContact O-CA 3.48Å; N1017-I1272 PolarHBondContact N-O 3.29Å; N1017-I1272 PolarHBondContact O-N 3.41Å
1018	S	82.1	Confident	75	Confident	30 Å²	30	48.6 Å²	48.6	21%	0.21	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65	125.8	170.3	-176	0	0	0	0	109.5	I1020 S1021 L1022 D1269 F1270	S1018-I1020 PolarHBondContact O-N 3Å; S1018-I1020 PolarHBondContact OG-N 3.05Å; S1018-S1021 PolarHBondContact O-N 2.96Å; S1018-S1021 PolarHBondContact O-OG 2.78Å; S1018-L1022 PolarHBondContact O-N 3.03Å; S1018-D1269 PolarHBondContact OG-OD1 3.06Å; S1018-F1270 CarbonylContact C-O 3.56Å; S1018-F1270 WeakPolarHBondContact CA-O 3.44Å; S1018-F1270 PolarHBondContact OG-O 3.35Å
1019	A	81.2	Confident	73.6	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-67.2	-25.8	173.6	0	0	0	0	0	110.9	N1017 L1022 F1023 L1165 L1259 F1270 I1272	N1017-A1019 PolarHBondContact O-N 3.13Å; A1019-L1022 PolarHBondContact O-N 3.42Å; A1019-F1023 HydrophobicContact CB-CE2 4.48Å; A1019-F1023 WeakPolarHBondContact O-CD2 3.37Å; A1019-F1023 PolarHBondContact O-N 3.5Å; A1019-L1165 HydrophobicContact CB-CD1 4.44Å; A1019-L1165 HydrophobicContact CB-CD2 3.59Å; A1019-L1259 HydrophobicContact CB-CD1 4.15Å; A1019-F1270 HydrophobicContact CB-CB 3.99Å; A1019-F1270 WeakPolarHBondContact CB-O 3.37Å; A1019-F1270 PolarHBondContact N-O 2.83Å; A1019-I1272 HydrophobicContact CB-CG1 4.12Å
1020	I	77.6	Confident	72.4	Confident	28 Å²	28	57 Å²	57	14%	0.144	32%	0.319	C	S	.	.	H	α-helix	trans	-62	-48.6	176.6	-60.3	173.2	0	0	0	110	S1018 L1022 F1023 Q1024 L1165	S1018-I1020 PolarHBondContact O-N 3Å; S1018-I1020 PolarHBondContact OG-N 3.05Å; I1020-L1022 VanDerWaalsContact C-N 3.32Å; I1020-L1022 PolarHBondContact O-N 2.85Å; I1020-F1023 PolarHBondContact O-N 3.4Å; I1020-F1023 VanDerWaalsContact O-N 3.13Å; I1020-Q1024 HydrophobicContact CG2-CB 4.36Å; I1020-Q1024 WeakPolarHBondContact O-CB 3.37Å; I1020-Q1024 PolarHBondContact O-N 3.4Å; I1020-L1165 HydrophobicContact CB-CD1 4.39Å; I1020-L1165 HydrophobicContact CG1-CD1 3.6Å
1021	S	74.4	Confident	71.5	Confident	66 Å²	66	57.3 Å²	57.3	46%	0.462	32%	0.32	S	S	.	.	H	α-helix	trans	-66.8	-31.6	178.8	57.8	0	0	0	0	113.1	S1018 F1023 V1025	S1018-S1021 PolarHBondContact O-N 2.96Å; S1018-S1021 PolarHBondContact O-OG 2.78Å; S1021-F1023 PolarHBondContact O-N 2.99Å; S1021-V1025 WeakPolarHBondContact O-CG2 3.39Å
1022	L	72.7	Confident	70.9	Confident	30 Å²	30	58.3 Å²	58.3	16%	0.157	32%	0.321	C	S	.	.	H	α-helix	trans	-65.5	-20.2	173.5	-73.8	168.2	0	0	0	114	N1017 S1018 A1019 I1020 F1212 I1272	N1017-L1022 HydrophobicContact CB-CD1 4.34Å; S1018-L1022 PolarHBondContact O-N 3.03Å; A1019-L1022 PolarHBondContact O-N 3.42Å; I1020-L1022 VanDerWaalsContact C-N 3.32Å; I1020-L1022 PolarHBondContact O-N 2.85Å; L1022-F1212 HydrophobicContact CD2-CD2 4.33Å; L1022-F1212 HydrophobicContact CD2-CE2 3.89Å; L1022-F1212 HydrophobicContact CD2-CZ 4.4Å; L1022-I1272 HydrophobicContact CD1-CD1 3.58Å; L1022-I1272 HydrophobicContact CD1-CG1 4.31Å
1023	F	68.8	Low	70.6	Confident	2 Å²	2	60.7 Å²	60.7	1%	0.009	33%	0.332	C	S	.	.	H	α-helix	trans	-114	-16.9	177.9	-62.7	-59.6	0	0	0	114.7	A1019 I1020 S1021 L1028 L1035 L1165 L1168 L1205 H1208	A1019-F1023 HydrophobicContact CB-CE2 4.48Å; A1019-F1023 WeakPolarHBondContact O-CD2 3.37Å; A1019-F1023 PolarHBondContact O-N 3.5Å; I1020-F1023 PolarHBondContact O-N 3.4Å; I1020-F1023 VanDerWaalsContact O-N 3.13Å; S1021-F1023 PolarHBondContact O-N 2.99Å; F1023-L1028 WeakPolarHBondContact O-CD1 3.41Å; F1023-L1035 HydrophobicContact CE1-CD2 3.84Å; F1023-L1035 HydrophobicContact CZ-CD2 3.82Å; F1023-L1165 HydrophobicContact CD2-CD2 3.8Å; F1023-L1165 HydrophobicContact CD2-CG 4.28Å; F1023-L1165 HydrophobicContact CE2-CD2 3.75Å; F1023-L1168 HydrophobicContact CE2-CD2 4.36Å; F1023-L1168 HydrophobicContact CZ-CD2 4.38Å; F1023-L1205 HydrophobicContact CZ-CD1 4.43Å; F1023-H1208 AromaticContact CE1-CE1 3.44Å; F1023-H1208 VanDerWaalsContact CE1-CE1 3.44Å; F1023-H1208 WeakPolarHBondContact CE1-CE1 3.36Å; F1023-H1208 AromaticContact CE1-NE2 3.66Å
1024	Q	61.6	Low	70.7	Confident	129 Å²	129	60.9 Å²	60.9	60%	0.603	33%	0.33	S	S	*	.	H	α-helix	trans	-89.7	-19.8	-171	-169.3	175.8	28	0	0	114.9	I1020 S1026	I1020-Q1024 HydrophobicContact CG2-CB 4.36Å; I1020-Q1024 WeakPolarHBondContact O-CB 3.37Å; I1020-Q1024 PolarHBondContact O-N 3.4Å; Q1024-S1026 PolarHBondContact O-N 2.82Å
1025	V	51.2	Low	70.9	Confident	98 Å²	98	58.1 Å²	58.1	59%	0.594	31%	0.313	S	S	*	.	S	Bend	trans	-78.6	81.9	-169.8	-177	0	0	0	0	112.7	S1021 H1027	S1021-V1025 WeakPolarHBondContact O-CG2 3.39Å; V1025-H1027 PolarHBondContact O-N 3.33Å
1026	S	46.1	Very low	71.2	Confident	106 Å²	106	56 Å²	56	74%	0.741	30%	0.299	S	S	*	.	S	Bend	trans	58.1	-25.7	166.3	42.6	0	0	0	0	119.5	Q1024	Q1024-S1026 PolarHBondContact O-N 2.82Å
1027	H	52.9	Low	71.6	Confident	102 Å²	102	52.3 Å²	52.3	47%	0.472	28%	0.28	S	S	.	.			trans	-100.9	37.7	177.6	-68.6	-100.1	0	0	0	111.5	V1025 I1029 E1030 L1031	V1025-H1027 PolarHBondContact O-N 3.33Å; H1027-I1029 PolarHBondContact O-N 3.27Å; H1027-E1030 IonicContact CE1-OE2 3.45Å; H1027-E1030 IonicContact CG-OE2 3.71Å; H1027-E1030 IonicContact ND1-OE2 2.71Å; H1027-E1030 PolarHBondContact ND1-OE2 2.88Å; H1027-E1030 PolarHBondContact O-N 2.98Å; H1027-L1031 HydrophobicContact CB-CD1 4.31Å; H1027-L1031 HydrophobicContact CB-CG 4.34Å; H1027-L1031 PolarHBondContact O-N 3.1Å
1028	L	55.3	Low	71.9	Confident	51 Å²	51	49.3 Å²	49.3	27%	0.267	26%	0.264	S	S	.	.	H	α-helix	trans	-51.8	-31.6	-176	-177.8	68.8	0	0	0	113.2	F1023 R1032	F1023-L1028 WeakPolarHBondContact O-CD1 3.41Å; L1028-R1032 WeakPolarHBondContact O-CB 3.4Å; L1028-R1032 VanDerWaalsContact O-CD 3.3Å; L1028-R1032 WeakPolarHBondContact O-CD 3.45Å; L1028-R1032 WeakPolarHBondContact O-CG 3.4Å
1029	I	60.6	Low	72.4	Confident	82 Å²	82	48.2 Å²	48.2	42%	0.421	26%	0.256	S	S	.	.	H	α-helix	trans	-78.4	-55.4	179.8	-65.9	167.7	0	0	0	110.6	H1027 L1031 R1032 K1033 Q1085	H1027-I1029 PolarHBondContact O-N 3.27Å; I1029-L1031 PolarHBondContact O-N 3.19Å; I1029-R1032 PolarHBondContact O-N 3.11Å; I1029-K1033 WeakPolarHBondContact O-CB 3.3Å; I1029-K1033 PolarHBondContact O-N 2.96Å; I1029-Q1085 HydrophobicContact CG2-CB 3.95Å; I1029-Q1085 WeakPolarHBondContact CG2-O 3.3Å
1030	E	64.9	Low	72.9	Confident	124 Å²	124	48.2 Å²	48.2	58%	0.579	26%	0.256	S	S	*	.	H	α-helix	trans	-64.1	-38.4	-174.9	-65.7	175	151.3	0	0	112.3	H1027 K1033 L1034	H1027-E1030 IonicContact CE1-OE2 3.45Å; H1027-E1030 IonicContact CG-OE2 3.71Å; H1027-E1030 IonicContact ND1-OE2 2.71Å; H1027-E1030 PolarHBondContact ND1-OE2 2.88Å; H1027-E1030 PolarHBondContact O-N 2.98Å; E1030-K1033 PolarHBondContact O-N 3.49Å; E1030-L1034 VanDerWaalsContact O-CB 3.3Å; E1030-L1034 WeakPolarHBondContact O-CB 3.43Å; E1030-L1034 PolarHBondContact O-N 3.23Å
1031	L	67.7	Low	73.7	Confident	30 Å²	30	48.5 Å²	48.5	16%	0.157	26%	0.256	C	S	.	.	H	α-helix	trans	-70.9	-35.5	177	-66.1	172	0	0	0	112.7	H1027 I1029 L1034 L1035 H1208 F1212	H1027-L1031 HydrophobicContact CB-CD1 4.31Å; H1027-L1031 HydrophobicContact CB-CG 4.34Å; H1027-L1031 PolarHBondContact O-N 3.1Å; I1029-L1031 PolarHBondContact O-N 3.19Å; L1031-L1034 HydrophobicContact CD2-CD2 4.38Å; L1031-L1035 WeakPolarHBondContact O-CB 3.38Å; L1031-L1035 PolarHBondContact O-N 3.5Å; L1031-H1208 PolarHBondContact O-NE2 3.08Å; L1031-F1212 HydrophobicContact CD2-CZ 4.04Å
1032	R	73.9	Confident	74.6	Confident	29 Å²	29	45.4 Å²	45.4	11%	0.109	23%	0.234	C	C	.	.	H	α-helix	trans	-67	-44.1	172.7	-77.8	177.8	180	-161.1	-2.1	111.3	L1028 I1029 L1034 L1035 I1036 N1160	L1028-R1032 WeakPolarHBondContact O-CB 3.4Å; L1028-R1032 VanDerWaalsContact O-CD 3.3Å; L1028-R1032 WeakPolarHBondContact O-CD 3.45Å; L1028-R1032 WeakPolarHBondContact O-CG 3.4Å; I1029-R1032 PolarHBondContact O-N 3.11Å; R1032-L1034 VanDerWaalsContact C-N 3.34Å; R1032-L1034 PolarHBondContact O-N 3.21Å; R1032-L1035 PolarHBondContact O-N 3.03Å; R1032-I1036 WeakPolarHBondContact O-CG1 3.49Å; R1032-I1036 PolarHBondContact O-N 3.22Å; R1032-N1160 PolarHBondContact NH2-O 3.23Å
1033	K	81.7	Confident	75.6	Confident	65 Å²	65	44 Å²	44	28%	0.283	23%	0.226	S	C	.	.	H	α-helix	trans	-58.4	-45.5	175.2	-176.2	176.5	172.7	-178.1	0	112.1	I1029 E1030 I1036 T1037 Q1085 N1086 E1088	I1029-K1033 WeakPolarHBondContact O-CB 3.3Å; I1029-K1033 PolarHBondContact O-N 2.96Å; E1030-K1033 PolarHBondContact O-N 3.49Å; K1033-I1036 PolarHBondContact O-N 3.09Å; K1033-T1037 WeakPolarHBondContact O-CB 3.25Å; K1033-T1037 PolarHBondContact O-N 3.18Å; K1033-T1037 PolarHBondContact O-OG1 3.48Å; K1033-Q1085 WeakPolarHBondContact CB-O 3.49Å; K1033-N1086 WeakPolarHBondContact CA-O 3.37Å; K1033-E1088 HydrophobicContact CD-CG 4.41Å; K1033-E1088 HydrophobicContact CG-CG 4.39Å
1034	L	84.5	Confident	76.8	Confident	33 Å²	33	43.9 Å²	43.9	17%	0.173	23%	0.226	C	C	.	.	H	α-helix	trans	-58	-51.5	174	170.7	64.6	0	0	0	112	E1030 L1031 R1032 I1036 T1037 L1038 Q1211	E1030-L1034 VanDerWaalsContact O-CB 3.3Å; E1030-L1034 WeakPolarHBondContact O-CB 3.43Å; E1030-L1034 PolarHBondContact O-N 3.23Å; L1031-L1034 HydrophobicContact CD2-CD2 4.38Å; R1032-L1034 VanDerWaalsContact C-N 3.34Å; R1032-L1034 PolarHBondContact O-N 3.21Å; L1034-I1036 VanDerWaalsContact C-N 3.28Å; L1034-I1036 PolarHBondContact O-N 3.41Å; L1034-T1037 PolarHBondContact O-N 3.01Å; L1034-T1037 VanDerWaalsContact O-N 3.15Å; L1034-L1038 HydrophobicContact CD1-CD1 3.83Å; L1034-L1038 HydrophobicContact CD1-CG 3.91Å; L1034-L1038 HydrophobicContact CG-CD1 3.94Å; L1034-L1038 HydrophobicContact CG-CG 4.4Å; L1034-L1038 WeakPolarHBondContact O-CG 3.32Å; L1034-L1038 PolarHBondContact O-N 3.32Å; L1034-Q1211 VanDerWaalsContact CD2-CD 3.43Å; L1034-Q1211 HydrophobicContact CD2-CG 4.31Å; L1034-Q1211 VanDerWaalsContact CD2-OE1 3.22Å
1035	L	85.8	Confident	78.2	Confident	4 Å²	4	37.9 Å²	37.9	2%	0.021	20%	0.198	C	C	.	.	H	α-helix	trans	-58.8	-40.4	-178.6	179.8	61.9	0	0	0	111.9	F1023 L1031 R1032 Y1039 F1164 L1168 A1204 H1208	F1023-L1035 HydrophobicContact CE1-CD2 3.84Å; F1023-L1035 HydrophobicContact CZ-CD2 3.82Å; L1031-L1035 WeakPolarHBondContact O-CB 3.38Å; L1031-L1035 PolarHBondContact O-N 3.5Å; R1032-L1035 PolarHBondContact O-N 3.03Å; L1035-Y1039 WeakPolarHBondContact O-CB 3.17Å; L1035-Y1039 PolarHBondContact O-N 2.73Å; L1035-F1164 HydrophobicContact CD2-CE1 4.02Å; L1035-F1164 HydrophobicContact CD2-CZ 3.94Å; L1035-L1168 HydrophobicContact CD2-CD2 4.15Å; L1035-A1204 HydrophobicContact CD1-CB 4.3Å; L1035-H1208 HydrophobicContact CD1-CB 3.96Å
1036	I	87.5	Confident	80.2	Confident	13 Å²	13	35.1 Å²	35.1	7%	0.067	18%	0.178	C	C	.	.	H	α-helix	trans	-67.8	-42.3	177	-70.2	164.7	0	0	0	110.9	R1032 K1033 L1034 Y1039 V1040 N1086 R1147 L1150	R1032-I1036 WeakPolarHBondContact O-CG1 3.49Å; R1032-I1036 PolarHBondContact O-N 3.22Å; K1033-I1036 PolarHBondContact O-N 3.09Å; L1034-I1036 VanDerWaalsContact C-N 3.28Å; L1034-I1036 PolarHBondContact O-N 3.41Å; I1036-Y1039 WeakPolarHBondContact O-CB 3.45Å; I1036-Y1039 PolarHBondContact O-N 3.2Å; I1036-V1040 WeakPolarHBondContact O-CG2 3.45Å; I1036-V1040 PolarHBondContact O-N 3Å; I1036-N1086 HydrophobicContact CD1-CB 3.74Å; I1036-R1147 HydrophobicContact CG2-CG 4.37Å; I1036-L1150 HydrophobicContact CD1-CD2 4.35Å; I1036-L1150 HydrophobicContact CG1-CD2 3.82Å
1037	T	89.4	Confident	82.3	Confident	9 Å²	9	30.1 Å²	30.1	6%	0.055	14%	0.143	C	C	.	.	H	α-helix	trans	-63	-45.8	176.8	-55.5	0	0	0	0	111.6	K1033 L1034 Y1039 V1040 K1041 E1088 Y1106	K1033-T1037 WeakPolarHBondContact O-CB 3.25Å; K1033-T1037 PolarHBondContact O-N 3.18Å; K1033-T1037 PolarHBondContact O-OG1 3.48Å; L1034-T1037 PolarHBondContact O-N 3.01Å; L1034-T1037 VanDerWaalsContact O-N 3.15Å; T1037-Y1039 VanDerWaalsContact C-N 3.32Å; T1037-Y1039 PolarHBondContact O-N 2.94Å; T1037-V1040 PolarHBondContact O-N 2.95Å; T1037-K1041 WeakPolarHBondContact O-CG 3.34Å; T1037-K1041 PolarHBondContact O-N 2.83Å; T1037-E1088 WeakPolarHBondContact CG2-OE2 3.22Å; T1037-Y1106 HydrophobicContact CG2-CE1 4.44Å
1038	L	90.2	Very high	84	Confident	5 Å²	5	25.4 Å²	25.4	3%	0.026	12%	0.121	C	C	.	.	H	α-helix	trans	-61.8	-39	173.5	-71.3	174	0	0	0	111.9	L1034 K1041 C1042 A1204 L1207 H1208 F1218	L1034-L1038 HydrophobicContact CD1-CD1 3.83Å; L1034-L1038 HydrophobicContact CD1-CG 3.91Å; L1034-L1038 HydrophobicContact CG-CD1 3.94Å; L1034-L1038 HydrophobicContact CG-CG 4.4Å; L1034-L1038 WeakPolarHBondContact O-CG 3.32Å; L1034-L1038 PolarHBondContact O-N 3.32Å; L1038-K1041 PolarHBondContact O-N 3.38Å; L1038-C1042 WeakPolarHBondContact O-CB 3.1Å; L1038-C1042 PolarHBondContact O-N 2.96Å; L1038-C1042 PolarHBondContact O-SG 3.08Å; L1038-A1204 HydrophobicContact CB-CB 4.31Å; L1038-L1207 HydrophobicContact CD1-CB 4.05Å; L1038-L1207 HydrophobicContact CD2-CB 4.35Å; L1038-L1207 HydrophobicContact CD2-CD1 4.33Å; L1038-H1208 HydrophobicContact CD1-CB 4.08Å; L1038-F1218 HydrophobicContact CD2-CD1 3.95Å; L1038-F1218 HydrophobicContact CD2-CE1 4.33Å
1039	Y	91.8	Very high	85.5	Confident	7 Å²	7	27.3 Å²	27.3	3%	0.027	13%	0.127	C	C	.	.	H	α-helix	trans	-65.1	-44	176.6	173.7	-139.6	0	0	0	112.4	L1035 I1036 T1037 C1042 I1043 G1146 L1150 A1200 V1201	L1035-Y1039 WeakPolarHBondContact O-CB 3.17Å; L1035-Y1039 PolarHBondContact O-N 2.73Å; I1036-Y1039 WeakPolarHBondContact O-CB 3.45Å; I1036-Y1039 PolarHBondContact O-N 3.2Å; T1037-Y1039 VanDerWaalsContact C-N 3.32Å; T1037-Y1039 PolarHBondContact O-N 2.94Å; Y1039-C1042 PolarHBondContact O-N 3.2Å; Y1039-I1043 HydrophobicContact CD2-CD1 4.05Å; Y1039-I1043 HydrophobicContact CD2-CG1 4.08Å; Y1039-I1043 HydrophobicContact CE1-CD1 4.27Å; Y1039-I1043 HydrophobicContact CE2-CD1 3.66Å; Y1039-I1043 HydrophobicContact CE2-CG1 3.84Å; Y1039-I1043 HydrophobicContact CG-CD1 4.49Å; Y1039-I1043 WeakPolarHBondContact O-CG1 3.47Å; Y1039-I1043 PolarHBondContact O-N 3.41Å; Y1039-G1146 VanDerWaalsContact CE1-O 3.28Å; Y1039-G1146 WeakPolarHBondContact CE1-O 3.27Å; Y1039-G1146 WeakPolarHBondContact OH-CA 3.48Å; Y1039-G1146 PolarHBondContact OH-O 3.39Å; Y1039-L1150 HydrophobicContact CD1-CD2 4.4Å; Y1039-L1150 HydrophobicContact CE1-CB 4.46Å; Y1039-A1200 HydrophobicContact CD2-CB 4Å; Y1039-A1200 HydrophobicContact CE2-CB 4Å; Y1039-V1201 HydrophobicContact CD2-CG2 4.06Å; Y1039-V1201 HydrophobicContact CE2-CB 4.28Å; Y1039-V1201 HydrophobicContact CE2-CG2 3.32Å
1040	V	93.2	Very high	86.7	Confident	0 Å²	0	24.4 Å²	24.4	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-63.6	-45.1	173.3	174.5	0	0	0	0	111.3	I1036 T1037 C1042 I1043 I1044 F1102 Y1106	I1036-V1040 WeakPolarHBondContact O-CG2 3.45Å; I1036-V1040 PolarHBondContact O-N 3Å; T1037-V1040 PolarHBondContact O-N 2.95Å; V1040-C1042 VanDerWaalsContact C-N 3.27Å; V1040-C1042 PolarHBondContact O-N 3.49Å; V1040-I1043 PolarHBondContact O-N 3.49Å; V1040-I1044 HydrophobicContact CG1-CD1 3.96Å; V1040-I1044 WeakPolarHBondContact O-CG1 3.37Å; V1040-I1044 PolarHBondContact O-N 3.35Å; V1040-I1044 VanDerWaalsContact O-N 3.09Å; V1040-F1102 HydrophobicContact CG1-CE2 4.17Å; V1040-Y1106 HydrophobicContact CB-CE1 4.01Å; V1040-Y1106 HydrophobicContact CG1-CD1 3.99Å; V1040-Y1106 HydrophobicContact CG1-CD2 4.22Å; V1040-Y1106 HydrophobicContact CG1-CE1 3.58Å; V1040-Y1106 HydrophobicContact CG1-CE2 3.83Å; V1040-Y1106 HydrophobicContact CG1-CG 4.29Å; V1040-Y1106 VanDerWaalsContact CG1-CZ 3.49Å
1041	K	92.9	Very high	87.5	Confident	34 Å²	34	25.2 Å²	25.2	15%	0.148	12%	0.123	C	C	.	.	H	α-helix	trans	-56.4	-40.9	172.6	-71.4	-171.3	-174.8	-176.1	0	111.4	T1037 L1038 Y1045 Y1106 W1109 L1224	T1037-K1041 WeakPolarHBondContact O-CG 3.34Å; T1037-K1041 PolarHBondContact O-N 2.83Å; L1038-K1041 PolarHBondContact O-N 3.38Å; K1041-Y1045 PolarHBondContact O-N 3.11Å; K1041-Y1045 VanDerWaalsContact O-N 3.13Å; K1041-Y1106 HydrophobicContact CG-CD1 4.26Å; K1041-Y1106 HydrophobicContact CG-CE1 4.01Å; K1041-W1109 HydrophobicContact CB-CZ2 4.42Å; K1041-W1109 HydrophobicContact CG-CG 4.33Å; K1041-W1109 PolarHBondContact O-NE1 3.29Å; K1041-L1224 HydrophobicContact CD-CD2 3.57Å
1042	C	93.3	Very high	88.3	Confident	0 Å²	0	27.9 Å²	27.9	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-68.5	-41.5	177.1	-69.5	0	0	0	0	113.5	L1038 Y1039 V1040 I1044 Y1045 F1046 A1200	L1038-C1042 WeakPolarHBondContact O-CB 3.1Å; L1038-C1042 PolarHBondContact O-N 2.96Å; L1038-C1042 PolarHBondContact O-SG 3.08Å; Y1039-C1042 PolarHBondContact O-N 3.2Å; V1040-C1042 VanDerWaalsContact C-N 3.27Å; V1040-C1042 PolarHBondContact O-N 3.49Å; C1042-I1044 VanDerWaalsContact C-N 3.32Å; C1042-I1044 PolarHBondContact O-N 3.02Å; C1042-Y1045 PolarHBondContact O-N 3.16Å; C1042-F1046 HydrophobicContact CB-CD2 4.49Å; C1042-F1046 VanDerWaalsContact O-CD2 3.24Å; C1042-F1046 WeakPolarHBondContact O-CD2 3.23Å; C1042-F1046 PolarHBondContact O-N 2.99Å; C1042-A1200 HydrophobicContact CB-CB 3.79Å
1043	I	94.6	Very high	88.8	Confident	0 Å²	0	26.5 Å²	26.5	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-56.1	-49.6	174.9	-71.8	170.2	0	0	0	109.9	Y1039 V1040 Y1045 F1046 A1047 L1142 V1196 A1200	Y1039-I1043 HydrophobicContact CD2-CD1 4.05Å; Y1039-I1043 HydrophobicContact CD2-CG1 4.08Å; Y1039-I1043 HydrophobicContact CE1-CD1 4.27Å; Y1039-I1043 HydrophobicContact CE2-CD1 3.66Å; Y1039-I1043 HydrophobicContact CE2-CG1 3.84Å; Y1039-I1043 HydrophobicContact CG-CD1 4.49Å; Y1039-I1043 WeakPolarHBondContact O-CG1 3.47Å; Y1039-I1043 PolarHBondContact O-N 3.41Å; V1040-I1043 PolarHBondContact O-N 3.49Å; I1043-Y1045 VanDerWaalsContact C-N 3.34Å; I1043-Y1045 PolarHBondContact O-N 3.28Å; I1043-F1046 PolarHBondContact O-N 3.05Å; I1043-A1047 VanDerWaalsContact O-CB 3.3Å; I1043-A1047 WeakPolarHBondContact O-CB 3.32Å; I1043-A1047 PolarHBondContact O-N 2.7Å; I1043-L1142 HydrophobicContact CG2-CB 3.67Å; I1043-V1196 HydrophobicContact CG2-CG1 4.1Å; I1043-V1196 WeakPolarHBondContact O-CG1 3.43Å; I1043-A1200 HydrophobicContact CB-CB 4.37Å; I1043-A1200 HydrophobicContact CG1-CB 3.62Å
1044	I	93.6	Very high	88.7	Confident	0 Å²	0	26.1 Å²	26.1	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-56.6	-48.3	178.9	-69.4	165.4	0	0	0	110.9	V1040 C1042 A1047 I1048 F1102 Y1106 I1110 C1139	V1040-I1044 HydrophobicContact CG1-CD1 3.96Å; V1040-I1044 WeakPolarHBondContact O-CG1 3.37Å; V1040-I1044 PolarHBondContact O-N 3.35Å; V1040-I1044 VanDerWaalsContact O-N 3.09Å; C1042-I1044 VanDerWaalsContact C-N 3.32Å; C1042-I1044 PolarHBondContact O-N 3.02Å; I1044-A1047 PolarHBondContact O-N 2.63Å; I1044-I1048 HydrophobicContact CG2-CD1 3.73Å; I1044-I1048 WeakPolarHBondContact O-CG1 3.4Å; I1044-I1048 PolarHBondContact O-N 2.78Å; I1044-F1102 HydrophobicContact CD1-CE2 4.35Å; I1044-F1102 HydrophobicContact CD1-CZ 4.07Å; I1044-Y1106 HydrophobicContact CD1-CD1 3.9Å; I1044-Y1106 HydrophobicContact CD1-CG 4.02Å; I1044-I1110 HydrophobicContact CD1-CD1 4.43Å; I1044-I1110 HydrophobicContact CD1-CG1 4.14Å; I1044-I1110 HydrophobicContact CG1-CG1 4.42Å; I1044-I1110 HydrophobicContact CG2-CB 4.45Å; I1044-I1110 HydrophobicContact CG2-CG1 3.61Å; I1044-C1139 HydrophobicContact CG1-CB 4.1Å
1045	Y	92.4	Very high	88.7	Confident	4 Å²	4	27.9 Å²	27.9	2%	0.016	14%	0.138	C	C	.	.	H	α-helix	trans	-62.7	-48.5	180	167.7	-92.6	0	0	0	112.7	K1041 C1042 I1043 A1047 I1048 K1049 Y1225 I1228 N1229	K1041-Y1045 PolarHBondContact O-N 3.11Å; K1041-Y1045 VanDerWaalsContact O-N 3.13Å; C1042-Y1045 PolarHBondContact O-N 3.16Å; I1043-Y1045 VanDerWaalsContact C-N 3.34Å; I1043-Y1045 PolarHBondContact O-N 3.28Å; Y1045-A1047 PolarHBondContact O-N 3.16Å; Y1045-I1048 PolarHBondContact O-N 3Å; Y1045-K1049 HydrophobicContact CE1-CD 3.97Å; Y1045-K1049 HydrophobicContact CE2-CD 4.25Å; Y1045-K1049 WeakPolarHBondContact O-CB 3.29Å; Y1045-K1049 PolarHBondContact O-N 2.84Å; Y1045-K1049 PolarHBondContact OH-NZ 2.9Å; Y1045-Y1225 AromaticContact CD2-CD2 3.98Å; Y1045-Y1225 HydrophobicContact CD2-CD2 3.98Å; Y1045-Y1225 AromaticContact CD2-CE2 3.88Å; Y1045-Y1225 HydrophobicContact CD2-CE2 3.88Å; Y1045-Y1225 HydrophobicContact CE2-CD2 4.02Å; Y1045-Y1225 AromaticContact CE2-CE2 3.75Å; Y1045-Y1225 HydrophobicContact CE2-CE2 3.75Å; Y1045-I1228 HydrophobicContact CD1-CG2 3.66Å; Y1045-I1228 HydrophobicContact CD2-CG2 4.48Å; Y1045-I1228 HydrophobicContact CE1-CB 4.39Å; Y1045-I1228 HydrophobicContact CE1-CG2 3.29Å; Y1045-I1228 HydrophobicContact CE2-CB 4.49Å; Y1045-I1228 HydrophobicContact CE2-CG2 4.18Å; Y1045-I1228 HydrophobicContact CG-CG2 4.22Å; Y1045-N1229 VanDerWaalsContact OH-CA 3.31Å; Y1045-N1229 WeakPolarHBondContact OH-CA 3.4Å; Y1045-N1229 PolarHBondContact OH-N 3.2Å
1046	F	91.4	Very high	88.7	Confident	40 Å²	40	27.9 Å²	27.9	18%	0.175	14%	0.138	C	C	.	.	H	α-helix	trans	-69.5	-32.3	-179.7	-75.3	-68	0	0	0	112.6	C1042 I1043 S1050 V1196 P1199 A1200 M1203	C1042-F1046 HydrophobicContact CB-CD2 4.49Å; C1042-F1046 VanDerWaalsContact O-CD2 3.24Å; C1042-F1046 WeakPolarHBondContact O-CD2 3.23Å; C1042-F1046 PolarHBondContact O-N 2.99Å; I1043-F1046 PolarHBondContact O-N 3.05Å; F1046-S1050 PolarHBondContact O-N 3.17Å; F1046-S1050 VanDerWaalsContact O-N 3.13Å; F1046-V1196 HydrophobicContact CB-CB 4.45Å; F1046-V1196 HydrophobicContact CB-CG1 4.06Å; F1046-P1199 HydrophobicContact CD1-CB 3.97Å; F1046-P1199 HydrophobicContact CD2-CB 3.9Å; F1046-P1199 HydrophobicContact CE1-CB 3.84Å; F1046-P1199 HydrophobicContact CE2-CB 3.78Å; F1046-P1199 WeakPolarHBondContact CE2-O 3.41Å; F1046-P1199 HydrophobicContact CG-CB 4.02Å; F1046-P1199 HydrophobicContact CZ-CB 3.76Å; F1046-A1200 HydrophobicContact CD2-CB 4.13Å; F1046-M1203 HydrophobicContact CE2-CB 3.9Å; F1046-M1203 HydrophobicContact CE2-CG 4.4Å; F1046-M1203 HydrophobicContact CZ-CB 4.33Å; F1046-M1203 HydrophobicContact CZ-CE 4.49Å
1047	A	90.5	Very high	88.4	Confident	1 Å²	1	28.3 Å²	28.3	1%	0.008	14%	0.14	C	C	.	.	H	α-helix	trans	-62.4	-53.5	172.4	0	0	0	0	0	111.4	I1043 I1044 Y1045 K1049 S1050 L1142 V1196	I1043-A1047 VanDerWaalsContact O-CB 3.3Å; I1043-A1047 WeakPolarHBondContact O-CB 3.32Å; I1043-A1047 PolarHBondContact O-N 2.7Å; I1044-A1047 PolarHBondContact O-N 2.63Å; Y1045-A1047 PolarHBondContact O-N 3.16Å; A1047-K1049 VanDerWaalsContact C-N 3.29Å; A1047-K1049 PolarHBondContact O-N 3.17Å; A1047-S1050 WeakPolarHBondContact O-CB 3.35Å; A1047-S1050 PolarHBondContact O-N 3.39Å; A1047-L1142 HydrophobicContact CB-CD1 3.89Å; A1047-V1196 HydrophobicContact CB-CG1 4.17Å; A1047-V1196 HydrophobicContact CB-CG2 4.49Å
1048	I	89.5	Confident	88.2	Confident	3 Å²	3	35.2 Å²	35.2	2%	0.015	17%	0.172	C	C	.	.	H	α-helix	trans	-65.7	-31.3	-178.4	-66.5	168	0	0	0	112.3	I1044 Y1045 S1050 I1110 C1113 S1117 L1121 V1135	I1044-I1048 HydrophobicContact CG2-CD1 3.73Å; I1044-I1048 WeakPolarHBondContact O-CG1 3.4Å; I1044-I1048 PolarHBondContact O-N 2.78Å; Y1045-I1048 PolarHBondContact O-N 3Å; I1048-S1050 VanDerWaalsContact C-N 3.31Å; I1048-I1110 HydrophobicContact CD1-CG2 4.11Å; I1048-C1113 HydrophobicContact CB-CB 4.45Å; I1048-C1113 HydrophobicContact CD1-CB 3.7Å; I1048-C1113 HydrophobicContact CG2-CB 4.22Å; I1048-S1117 PolarHBondContact O-OG 2.96Å; I1048-L1121 HydrophobicContact CG2-CD1 4.3Å; I1048-V1135 HydrophobicContact CG1-CG1 4.21Å
1049	K	87	Confident	87.9	Confident	90 Å²	90	37.6 Å²	37.6	39%	0.391	18%	0.184	S	C	.	.	H	α-helix	trans	-79.6	-9.8	175.6	-162.5	172.2	-169.8	178.1	0	113.4	Y1045 A1047 N1229	Y1045-K1049 HydrophobicContact CE1-CD 3.97Å; Y1045-K1049 HydrophobicContact CE2-CD 4.25Å; Y1045-K1049 WeakPolarHBondContact O-CB 3.29Å; Y1045-K1049 PolarHBondContact O-N 2.84Å; Y1045-K1049 PolarHBondContact OH-NZ 2.9Å; A1047-K1049 VanDerWaalsContact C-N 3.29Å; A1047-K1049 PolarHBondContact O-N 3.17Å; K1049-N1229 PolarHBondContact NZ-OD1 3.44Å
1050	S	86.2	Confident	87.4	Confident	21 Å²	21	44.7 Å²	44.7	15%	0.147	22%	0.218	C	C	.	.			trans	-65.3	135	-175.7	-179.9	0	0	0	0	112.8	F1046 A1047 I1048 R1052 I1053 W1056 K1119	F1046-S1050 PolarHBondContact O-N 3.17Å; F1046-S1050 VanDerWaalsContact O-N 3.13Å; A1047-S1050 WeakPolarHBondContact O-CB 3.35Å; A1047-S1050 PolarHBondContact O-N 3.39Å; I1048-S1050 VanDerWaalsContact C-N 3.31Å; S1050-R1052 PolarHBondContact O-N 2.76Å; S1050-R1052 PolarHBondContact OG-N 3.5Å; S1050-I1053 WeakPolarHBondContact O-CG2 3.31Å; S1050-I1053 PolarHBondContact O-N 3.38Å; S1050-W1056 WeakPolarHBondContact OG-CH2 3.47Å; S1050-W1056 WeakPolarHBondContact OG-CZ3 3.19Å; S1050-K1119 PolarHBondContact O-NZ 3.24Å
1051	N	81.3	Confident	86.9	Confident	141 Å²	141	46.8 Å²	46.8	75%	0.754	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-23.2	169.6	-76.4	-25.2	0	0	0	112.5	K1119	N1051-K1119 PolarHBondContact O-NZ 3.44Å
1052	R	83.3	Confident	86.4	Confident	86 Å²	86	45.2 Å²	45.2	33%	0.325	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.8	-3	-177.4	-78.2	-101.1	-96	-77.9	0.4	115.5	S1050 T1054 D1055 W1056 D1189 D1191	S1050-R1052 PolarHBondContact O-N 2.76Å; S1050-R1052 PolarHBondContact OG-N 3.5Å; R1052-T1054 PolarHBondContact O-N 2.67Å; R1052-T1054 VanDerWaalsContact O-N 3.16Å; R1052-D1055 WeakPolarHBondContact CD-OD2 3.33Å; R1052-D1055 WeakPolarHBondContact O-CA 3.46Å; R1052-D1055 WeakPolarHBondContact O-CB 3.3Å; R1052-D1055 PolarHBondContact O-N 3.39Å; R1052-W1056 HydrophobicContact CB-CD2 4.15Å; R1052-W1056 HydrophobicContact CB-CH2 4.37Å; R1052-W1056 HydrophobicContact CB-CZ2 3.71Å; R1052-W1056 PolarHBondContact O-N 2.71Å; R1052-D1189 IonicContact CZ-OD1 3.77Å; R1052-D1189 IonicContact CZ-OD2 3.78Å; R1052-D1189 IonicContact NE-OD2 3.87Å; R1052-D1189 PolarHBondContact NE-OD2 3.13Å; R1052-D1189 IonicContact NH2-OD1 3.88Å; R1052-D1189 PolarHBondContact NH2-OD1 3.31Å; R1052-D1189 IonicContact NH2-OD2 3.35Å; R1052-D1189 PolarHBondContact NH2-OD2 3.41Å; R1052-D1191 IonicContact CZ-OD2 3.84Å; R1052-D1191 VanDerWaalsContact CZ-OD2 3.23Å; R1052-D1191 IonicContact NH1-OD2 2.76Å; R1052-D1191 PolarHBondContact NH1-OD2 3.01Å; R1052-D1191 IonicContact NH2-OD2 2.68Å; R1052-D1191 PolarHBondContact NH2-OD2 3.11Å
1053	I	84	Confident	86	Confident	1 Å²	1	47.6 Å²	47.6	1%	0.005	24%	0.238	C	C	.	.	H	α-helix	trans	-58.1	-33.9	-176.3	-168.9	169.9	0	0	0	113.8	S1050 D1055 W1056 L1057 K1119 V1135 L1138	S1050-I1053 WeakPolarHBondContact O-CG2 3.31Å; S1050-I1053 PolarHBondContact O-N 3.38Å; I1053-D1055 PolarHBondContact O-N 2.94Å; I1053-W1056 HydrophobicContact CB-CE3 4.26Å; I1053-L1057 HydrophobicContact CG1-CD1 4.25Å; I1053-L1057 WeakPolarHBondContact O-CB 3.41Å; I1053-L1057 WeakPolarHBondContact O-CD1 3.36Å; I1053-L1057 WeakPolarHBondContact O-CG 3.26Å; I1053-L1057 PolarHBondContact O-N 3.29Å; I1053-L1057 VanDerWaalsContact O-N 3.16Å; I1053-K1119 HydrophobicContact CG2-CD 4.43Å; I1053-V1135 HydrophobicContact CD1-CG1 4.32Å; I1053-V1135 HydrophobicContact CD1-CG2 4.15Å; I1053-L1138 HydrophobicContact CG1-CD2 4.48Å
1054	T	81	Confident	85.5	Confident	57 Å²	57	52.5 Å²	52.5	35%	0.35	26%	0.264	S	S	.	.	H	α-helix	trans	-62.5	-28.7	173.5	32.7	0	0	0	0	113.2	R1052 Q1058 K1119	R1052-T1054 PolarHBondContact O-N 2.67Å; R1052-T1054 VanDerWaalsContact O-N 3.16Å; T1054-Q1058 WeakPolarHBondContact O-CG 3.47Å; T1054-K1119 PolarHBondContact OG1-NZ 2.89Å; T1054-K1119 VanDerWaalsContact OG1-NZ 3.14Å
1055	D	83.6	Confident	85	Confident	70 Å²	70	54 Å²	54	37%	0.374	27%	0.273	S	S	.	.	H	α-helix	trans	-93.7	-39	-169.8	-35.8	-9.1	0	0	0	108.2	R1052 I1053 L1057 Q1058 L1059	R1052-D1055 WeakPolarHBondContact CD-OD2 3.33Å; R1052-D1055 WeakPolarHBondContact O-CA 3.46Å; R1052-D1055 WeakPolarHBondContact O-CB 3.3Å; R1052-D1055 PolarHBondContact O-N 3.39Å; I1053-D1055 PolarHBondContact O-N 2.94Å; D1055-L1057 VanDerWaalsContact C-N 3.3Å; D1055-L1057 PolarHBondContact O-N 3.45Å; D1055-Q1058 PolarHBondContact O-N 3.32Å; D1055-L1059 PolarHBondContact O-N 3.15Å
1056	W	85.4	Confident	84.6	Confident	3 Å²	3	53.8 Å²	53.8	1%	0.011	27%	0.272	C	S	.	.	H	α-helix	trans	-60.1	-36.5	168.6	-60.3	-26.7	0	0	0	112.7	S1050 R1052 I1053 Q1058 L1059 I1062 D1189 I1192 V1196	S1050-W1056 WeakPolarHBondContact OG-CH2 3.47Å; S1050-W1056 WeakPolarHBondContact OG-CZ3 3.19Å; R1052-W1056 HydrophobicContact CB-CD2 4.15Å; R1052-W1056 HydrophobicContact CB-CH2 4.37Å; R1052-W1056 HydrophobicContact CB-CZ2 3.71Å; R1052-W1056 PolarHBondContact O-N 2.71Å; I1053-W1056 HydrophobicContact CB-CE3 4.26Å; W1056-Q1058 PolarHBondContact O-N 3.36Å; W1056-L1059 PolarHBondContact O-N 3.04Å; W1056-I1062 HydrophobicContact CB-CD1 4.07Å; W1056-I1062 HydrophobicContact CG-CD1 4.49Å; W1056-D1189 PolarHBondContact NE1-OD2 3.39Å; W1056-I1192 HydrophobicContact CD2-CG1 4.15Å; W1056-I1192 HydrophobicContact CH2-CG1 4.26Å; W1056-I1192 HydrophobicContact CZ2-CG1 3.66Å; W1056-V1196 HydrophobicContact CH2-CG2 3.56Å; W1056-V1196 HydrophobicContact CZ3-CG2 3.9Å
1057	L	82.9	Confident	84.2	Confident	22 Å²	22	54.4 Å²	54.4	12%	0.115	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-5.4	174.8	-70.6	169.3	0	0	0	114	I1053 D1055 L1066 V1131 M1134 V1135	I1053-L1057 HydrophobicContact CG1-CD1 4.25Å; I1053-L1057 WeakPolarHBondContact O-CB 3.41Å; I1053-L1057 WeakPolarHBondContact O-CD1 3.36Å; I1053-L1057 WeakPolarHBondContact O-CG 3.26Å; I1053-L1057 PolarHBondContact O-N 3.29Å; I1053-L1057 VanDerWaalsContact O-N 3.16Å; D1055-L1057 VanDerWaalsContact C-N 3.3Å; D1055-L1057 PolarHBondContact O-N 3.45Å; L1057-L1066 HydrophobicContact CD2-CD1 4.4Å; L1057-V1131 HydrophobicContact CD1-CG1 4.31Å; L1057-M1134 HydrophobicContact CD2-CB 3.56Å; L1057-M1134 HydrophobicContact CD2-CE 4.21Å; L1057-V1135 HydrophobicContact CD1-CG2 3.87Å
1058	Q	83.8	Confident	83.7	Confident	154 Å²	154	59.8 Å²	59.8	72%	0.72	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.6	-3.5	175.3	-67.4	175.5	13.8	0	0	112.7	T1054 D1055 W1056 E1060	T1054-Q1058 WeakPolarHBondContact O-CG 3.47Å; D1055-Q1058 PolarHBondContact O-N 3.32Å; W1056-Q1058 PolarHBondContact O-N 3.36Å; Q1058-E1060 PolarHBondContact O-N 2.76Å
1059	L	84.6	Confident	83.2	Confident	55 Å²	55	59.9 Å²	59.9	29%	0.288	31%	0.306	S	S	.	.			trans	-79.4	118.3	178.8	-119.1	73.3	0	0	0	110.3	D1055 W1056 S1061 I1062 I1063	D1055-L1059 PolarHBondContact O-N 3.15Å; W1056-L1059 PolarHBondContact O-N 3.04Å; L1059-S1061 VanDerWaalsContact C-N 3.33Å; L1059-S1061 PolarHBondContact O-N 3.47Å; L1059-I1062 HydrophobicContact CB-CB 4.15Å; L1059-I1062 HydrophobicContact CB-CD1 3.88Å; L1059-I1062 HydrophobicContact CB-CG1 3.91Å; L1059-I1062 HydrophobicContact CD2-CD1 3.85Å; L1059-I1062 HydrophobicContact CD2-CG1 4.21Å; L1059-I1062 PolarHBondContact O-N 3.03Å; L1059-I1063 WeakPolarHBondContact O-CG1 3.49Å; L1059-I1063 PolarHBondContact O-N 3.17Å
1060	E	81.6	Confident	82.8	Confident	157 Å²	157	58 Å²	58	73%	0.734	30%	0.299	S	S	*	.	H	α-helix	trans	-52.1	-48	-179	-164.5	166.1	-150.2	0	0	112	Q1058 I1062 I1063 D1064	Q1058-E1060 PolarHBondContact O-N 2.76Å; E1060-I1062 PolarHBondContact O-N 2.85Å; E1060-I1062 VanDerWaalsContact O-N 3.11Å; E1060-I1063 PolarHBondContact O-N 3.27Å; E1060-I1063 VanDerWaalsContact O-N 3.08Å; E1060-D1064 PolarHBondContact O-N 3.3Å
1061	S	81.7	Confident	82.3	Confident	44 Å²	44	65.5 Å²	65.5	31%	0.308	33%	0.325	S	S	.	.	H	α-helix	trans	-64.9	-13.1	177	58.8	0	0	0	0	115.7	L1059 S1188	L1059-S1061 VanDerWaalsContact C-N 3.33Å; L1059-S1061 PolarHBondContact O-N 3.47Å; S1061-S1188 WeakPolarHBondContact OG-CB 3.38Å; S1061-S1188 PolarHBondContact OG-OG 2.84Å
1062	I	83.7	Confident	82.1	Confident	0 Å²	0	62.6 Å²	62.6	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-96.7	-38.1	172.7	-59.7	-178.7	0	0	0	109.6	W1056 L1059 E1060 D1064 V1065 L1066 L1138 W1185 I1192	W1056-I1062 HydrophobicContact CB-CD1 4.07Å; W1056-I1062 HydrophobicContact CG-CD1 4.49Å; L1059-I1062 HydrophobicContact CB-CB 4.15Å; L1059-I1062 HydrophobicContact CB-CD1 3.88Å; L1059-I1062 HydrophobicContact CB-CG1 3.91Å; L1059-I1062 HydrophobicContact CD2-CD1 3.85Å; L1059-I1062 HydrophobicContact CD2-CG1 4.21Å; L1059-I1062 PolarHBondContact O-N 3.03Å; E1060-I1062 PolarHBondContact O-N 2.85Å; E1060-I1062 VanDerWaalsContact O-N 3.11Å; I1062-D1064 PolarHBondContact O-N 3.21Å; I1062-V1065 PolarHBondContact O-N 2.88Å; I1062-L1066 HydrophobicContact CG2-CD1 3.94Å; I1062-L1066 HydrophobicContact CG2-CG 4.27Å; I1062-L1066 VanDerWaalsContact O-CG 3.27Å; I1062-L1066 WeakPolarHBondContact O-CG 3.45Å; I1062-L1066 PolarHBondContact O-N 2.75Å; I1062-L1138 HydrophobicContact CG2-CD1 3.96Å; I1062-W1185 HydrophobicContact CD1-CE3 4.48Å; I1062-W1185 HydrophobicContact CG1-CE3 4.11Å; I1062-I1192 HydrophobicContact CD1-CD1 4.33Å
1063	I	84.3	Confident	81.5	Confident	51 Å²	51	63.1 Å²	63.1	26%	0.262	32%	0.324	S	S	.	.	H	α-helix	trans	-59.6	-45	175.4	-65.7	164.7	0	0	0	110.8	L1059 E1060 V1065 L1066 D1067 M1134	L1059-I1063 WeakPolarHBondContact O-CG1 3.49Å; L1059-I1063 PolarHBondContact O-N 3.17Å; E1060-I1063 PolarHBondContact O-N 3.27Å; E1060-I1063 VanDerWaalsContact O-N 3.08Å; I1063-V1065 PolarHBondContact O-N 3.16Å; I1063-L1066 PolarHBondContact O-N 3.48Å; I1063-L1066 VanDerWaalsContact O-N 3.1Å; I1063-D1067 WeakPolarHBondContact O-CB 3.41Å; I1063-D1067 PolarHBondContact O-N 3.46Å; I1063-M1134 HydrophobicContact CG1-CE 4.15Å
1064	D	83.4	Confident	81	Confident	103 Å²	103	70.6 Å²	70.6	55%	0.551	36%	0.359	S	S	*	.	H	α-helix	trans	-52.7	-40.5	176.5	-71.2	-26.9	0	0	0	112.7	E1060 I1062 L1068	E1060-D1064 PolarHBondContact O-N 3.3Å; I1062-D1064 PolarHBondContact O-N 3.21Å; D1064-L1068 WeakPolarHBondContact O-CG 3.44Å; D1064-L1068 PolarHBondContact O-N 2.8Å
1065	V	82.8	Confident	80.9	Confident	31 Å²	31	70.5 Å²	70.5	19%	0.188	35%	0.353	C	S	.	.	H	α-helix	trans	-81.3	-32.2	-179	-169.7	0	0	0	0	111.8	I1062 I1063 L1141 W1185	I1062-V1065 PolarHBondContact O-N 2.88Å; I1063-V1065 PolarHBondContact O-N 3.16Å; V1065-L1141 HydrophobicContact CB-CD1 4.31Å; V1065-L1141 HydrophobicContact CG1-CD1 3.78Å; V1065-L1141 HydrophobicContact CG1-CD2 3.9Å; V1065-W1185 HydrophobicContact CG2-CB 4.02Å; V1065-W1185 HydrophobicContact CG2-CG 4.06Å
1066	L	83.9	Confident	80.9	Confident	0 Å²	0	68.7 Å²	68.7	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-65.8	-39.8	172.7	-71.2	168.9	0	0	0	112	L1057 I1062 I1063 V1069 Q1070 M1134 A1137 L1138 L1141	L1057-L1066 HydrophobicContact CD2-CD1 4.4Å; I1062-L1066 HydrophobicContact CG2-CD1 3.94Å; I1062-L1066 HydrophobicContact CG2-CG 4.27Å; I1062-L1066 VanDerWaalsContact O-CG 3.27Å; I1062-L1066 WeakPolarHBondContact O-CG 3.45Å; I1062-L1066 PolarHBondContact O-N 2.75Å; I1063-L1066 PolarHBondContact O-N 3.48Å; I1063-L1066 VanDerWaalsContact O-N 3.1Å; L1066-V1069 PolarHBondContact O-N 3.16Å; L1066-Q1070 WeakPolarHBondContact O-CG 3.44Å; L1066-Q1070 PolarHBondContact O-N 3.27Å; L1066-M1134 HydrophobicContact CD1-CB 4.43Å; L1066-M1134 HydrophobicContact CD1-CE 4.16Å; L1066-A1137 HydrophobicContact CD2-CB 3.62Å; L1066-L1138 HydrophobicContact CD2-CB 3.9Å; L1066-L1138 VanDerWaalsContact CD2-N 3.28Å; L1066-L1141 HydrophobicContact CD2-CD1 3.84Å; L1066-L1141 HydrophobicContact CG-CD1 4.32Å
1067	D	83	Confident	80.9	Confident	53 Å²	53	68.5 Å²	68.5	28%	0.283	34%	0.343	S	S	.	.	H	α-helix	trans	-71.1	-35.7	-178.2	-82.5	4.9	0	0	0	111.8	I1063 V1069 Q1070 Y1071	I1063-D1067 WeakPolarHBondContact O-CB 3.41Å; I1063-D1067 PolarHBondContact O-N 3.46Å; D1067-V1069 PolarHBondContact O-N 3.29Å; D1067-Q1070 PolarHBondContact O-N 3.35Å; D1067-Y1071 HydrophobicContact CB-CD2 3.83Å; D1067-Y1071 HydrophobicContact CB-CE2 3.87Å; D1067-Y1071 WeakPolarHBondContact O-CD2 3.42Å; D1067-Y1071 PolarHBondContact O-N 2.76Å
1068	L	80.5	Confident	80.9	Confident	114 Å²	114	71.8 Å²	71.8	60%	0.597	36%	0.364	S	S	*	.	H	α-helix	trans	-56	-29.8	170	-77	171.7	0	0	0	113.5	D1064 N1072	D1064-L1068 WeakPolarHBondContact O-CG 3.44Å; D1064-L1068 PolarHBondContact O-N 2.8Å; L1068-N1072 WeakPolarHBondContact O-CB 3.37Å
1069	V	79.9	Confident	80.9	Confident	4 Å²	4	66 Å²	66	2%	0.024	34%	0.338	C	S	.	.	H	α-helix	trans	-90.3	-41.8	175.9	-179.2	0	0	0	0	111.6	L1066 D1067 Y1075 Y1099 Y1140 L1141	L1066-V1069 PolarHBondContact O-N 3.16Å; D1067-V1069 PolarHBondContact O-N 3.29Å; V1069-Y1075 HydrophobicContact CG2-CD1 4.19Å; V1069-Y1075 HydrophobicContact CG2-CE1 4.28Å; V1069-Y1099 HydrophobicContact CG1-CD2 3.77Å; V1069-Y1099 HydrophobicContact CG1-CE2 4.36Å; V1069-Y1099 HydrophobicContact CG1-CG 4.09Å; V1069-Y1140 HydrophobicContact CG1-CD1 3.83Å; V1069-Y1140 HydrophobicContact CG1-CE1 3.82Å; V1069-Y1140 HydrophobicContact CG2-CD1 4.36Å; V1069-Y1140 HydrophobicContact CG2-CE1 4.2Å; V1069-L1141 HydrophobicContact CG2-CD2 3.94Å; V1069-L1141 HydrophobicContact CG2-CG 4.36Å
1070	Q	77.6	Confident	80.6	Confident	52 Å²	52	68.3 Å²	68.3	24%	0.243	36%	0.356	C	S	.	.	H	α-helix	trans	-70.4	-35.7	-175.5	-78.4	-172.4	86.8	0	0	114	L1066 D1067 A1137	L1066-Q1070 WeakPolarHBondContact O-CG 3.44Å; L1066-Q1070 PolarHBondContact O-N 3.27Å; D1067-Q1070 PolarHBondContact O-N 3.35Å; Q1070-A1137 HydrophobicContact CG-CB 4.14Å
1071	Y	75.9	Confident	80.4	Confident	177 Å²	177	62.3 Å²	62.3	69%	0.694	33%	0.331	S	S	*	.	S	Bend	trans	-88.6	-11.1	179.6	-66.6	-69.1	0	0	0	113.7	D1067 P1073	D1067-Y1071 HydrophobicContact CB-CD2 3.83Å; D1067-Y1071 HydrophobicContact CB-CE2 3.87Å; D1067-Y1071 WeakPolarHBondContact O-CD2 3.42Å; D1067-Y1071 PolarHBondContact O-N 2.76Å; Y1071-P1073 WeakPolarHBondContact O-CD 3.33Å
1072	N	76.4	Confident	80.5	Confident	80 Å²	80	60.7 Å²	60.7	43%	0.428	32%	0.318	S	S	.	.			trans	-121.1	85	-179.3	-167.6	-3	0	0	0	111.9	L1068 E1074 Y1075	L1068-N1072 WeakPolarHBondContact O-CB 3.37Å; N1072-E1074 PolarHBondContact O-N 3.03Å; N1072-E1074 VanDerWaalsContact O-N 3.14Å; N1072-E1074 PolarHBondContact OD1-N 2.98Å; N1072-Y1075 WeakPolarHBondContact O-CB 3.46Å; N1072-Y1075 PolarHBondContact O-N 2.9Å
1073	P	70.5	Confident	80.3	Confident	98 Å²	98	62.5 Å²	62.5	64%	0.636	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.4	-9.2	-178.4	29.3	-36.2	0	0	0	114.2	Y1071 Y1075	Y1071-P1073 WeakPolarHBondContact O-CD 3.33Å; P1073-Y1075 VanDerWaalsContact C-N 3.32Å
1074	E	74	Confident	80.1	Confident	157 Å²	157	67 Å²	67	73%	0.734	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.2	2.7	170	-61.9	-162.1	154	0	0	113	N1072 V1076	N1072-E1074 PolarHBondContact O-N 3.03Å; N1072-E1074 VanDerWaalsContact O-N 3.14Å; N1072-E1074 PolarHBondContact OD1-N 2.98Å; E1074-V1076 PolarHBondContact O-N 2.94Å
1075	Y	80.5	Confident	79.8	Confident	56 Å²	56	65.8 Å²	65.8	22%	0.22	34%	0.336	C	S	.	.			trans	-62.6	118.8	176.5	-171.7	-87.1	0	0	0	111.8	V1069 N1072 P1073 D1077 Y1140	V1069-Y1075 HydrophobicContact CG2-CD1 4.19Å; V1069-Y1075 HydrophobicContact CG2-CE1 4.28Å; N1072-Y1075 WeakPolarHBondContact O-CB 3.46Å; N1072-Y1075 PolarHBondContact O-N 2.9Å; P1073-Y1075 VanDerWaalsContact C-N 3.32Å; Y1075-D1077 HydrophobicContact CE1-CB 4.15Å; Y1075-Y1140 HydrophobicContact CD1-CE1 4.19Å; Y1075-Y1140 HydrophobicContact CE1-CE1 4.3Å
1076	V	82.8	Confident	79.5	Confident	31 Å²	31	66.1 Å²	66.1	19%	0.188	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	127.8	174.7	-177.7	0	0	0	0	107.3	E1074 V1078 R1094 I1097	E1074-V1076 PolarHBondContact O-N 2.94Å; V1076-V1078 HydrophobicContact CG1-CG2 4.03Å; V1076-R1094 HydrophobicContact CG1-CB 4.1Å; V1076-R1094 HydrophobicContact CG2-CB 3.92Å; V1076-R1094 VanDerWaalsContact CG2-CD 3.4Å; V1076-R1094 HydrophobicContact CG2-CG 4.28Å; V1076-I1097 WeakPolarHBondContact CA-O 3.49Å; V1076-I1097 WeakPolarHBondContact CG1-O 3.39Å
1077	D	84.8	Confident	79.5	Confident	0 Å²	0	66.4 Å²	66.4	0%	0	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	116.7	175.8	-151.3	-11.9	0	0	0	109.4	Y1075 F1082 G1096 I1097 L1144 R1148 R1182	Y1075-D1077 HydrophobicContact CE1-CB 4.15Å; D1077-F1082 HydrophobicContact CB-CE2 4.16Å; D1077-F1082 WeakPolarHBondContact O-CD2 3.28Å; D1077-G1096 WeakPolarHBondContact O-CA 3.47Å; D1077-I1097 PolarHBondContact N-O 3.39Å; D1077-I1097 PolarHBondContact O-N 2.94Å; D1077-L1144 HydrophobicContact CB-CD1 3.85Å; D1077-L1144 HydrophobicContact CB-CD2 4.17Å; D1077-R1148 VanDerWaalsContact CG-NH1 3.32Å; D1077-R1148 IonicContact OD1-NH1 3.34Å; D1077-R1148 IonicContact OD2-CZ 2.74Å; D1077-R1148 IonicContact OD2-NH1 3.83Å; D1077-R1148 PolarHBondContact OD2-NH1 3.23Å; D1077-R1148 IonicContact OD2-NH2 3.24Å; D1077-R1148 PolarHBondContact OD2-NH2 3.34Å; D1077-R1148 VanDerWaalsContact OD2-NH2 3.15Å; D1077-R1182 IonicContact OD1-CZ 3Å; D1077-R1182 IonicContact OD1-NH1 2.79Å; D1077-R1182 PolarHBondContact OD1-NH1 3Å
1078	V	84.2	Confident	79.5	Confident	91 Å²	91	68.4 Å²	68.4	55%	0.552	35%	0.346	S	S	*	.			trans	-110.3	89.8	-175.1	-179.4	0	0	0	0	108	V1076	V1076-V1078 HydrophobicContact CG1-CG2 4.03Å
1079	D	82.7	Confident	79.9	Confident	33 Å²	33	63.1 Å²	63.1	18%	0.176	32%	0.318	C	S	.	.			trans	-114.9	137.2	177.8	-170.4	-72.1	0	0	0	109.8	T1081 F1082 R1148	D1079-T1081 PolarHBondContact O-N 3.15Å; D1079-T1081 VanDerWaalsContact OD1-CB 3.27Å; D1079-T1081 WeakPolarHBondContact OD1-CB 3.37Å; D1079-T1081 WeakPolarHBondContact OD1-CG2 3.47Å; D1079-T1081 PolarHBondContact OD1-N 3.11Å; D1079-T1081 PolarHBondContact OD1-OG1 2.85Å; D1079-F1082 HydrophobicContact CB-CD1 4.5Å; D1079-F1082 HydrophobicContact CB-CD2 3.83Å; D1079-F1082 HydrophobicContact CB-CE1 4.26Å; D1079-F1082 HydrophobicContact CB-CE2 3.58Å; D1079-F1082 HydrophobicContact CB-CG 4.29Å; D1079-F1082 HydrophobicContact CB-CZ 3.81Å; D1079-F1082 PolarHBondContact O-N 3.01Å; D1079-F1082 VanDerWaalsContact O-N 3.09Å; D1079-R1148 VanDerWaalsContact OD2-CD 3.28Å; D1079-R1148 WeakPolarHBondContact OD2-CD 3.24Å
1080	P	77.9	Confident	80.3	Confident	103 Å²	103	65.2 Å²	65.2	67%	0.669	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-4.5	179.7	28.5	-37.3	0	0	0	114.9
1081	T	77.5	Confident	80.7	Confident	31 Å²	31	64 Å²	64	19%	0.19	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.8	-19.5	171	58.8	0	0	0	0	114.1	D1079	D1079-T1081 PolarHBondContact O-N 3.15Å; D1079-T1081 VanDerWaalsContact OD1-CB 3.27Å; D1079-T1081 WeakPolarHBondContact OD1-CB 3.37Å; D1079-T1081 WeakPolarHBondContact OD1-CG2 3.47Å; D1079-T1081 PolarHBondContact OD1-N 3.11Å; D1079-T1081 PolarHBondContact OD1-OG1 2.85Å
1082	F	84.1	Confident	81.1	Confident	9 Å²	9	60.4 Å²	60.4	4%	0.039	32%	0.318	C	S	.	.			trans	-88.4	137.1	-178.7	-50.2	-28	0	0	0	111.4	D1077 D1079 D1087 Y1090 I1097 L1144 R1147 R1148	D1077-F1082 HydrophobicContact CB-CE2 4.16Å; D1077-F1082 WeakPolarHBondContact O-CD2 3.28Å; D1079-F1082 HydrophobicContact CB-CD1 4.5Å; D1079-F1082 HydrophobicContact CB-CD2 3.83Å; D1079-F1082 HydrophobicContact CB-CE1 4.26Å; D1079-F1082 HydrophobicContact CB-CE2 3.58Å; D1079-F1082 HydrophobicContact CB-CG 4.29Å; D1079-F1082 HydrophobicContact CB-CZ 3.81Å; D1079-F1082 PolarHBondContact O-N 3.01Å; D1079-F1082 VanDerWaalsContact O-N 3.09Å; F1082-D1087 WeakPolarHBondContact CA-OD2 3.27Å; F1082-Y1090 HydrophobicContact CB-CD2 4.18Å; F1082-Y1090 HydrophobicContact CB-CE2 4.06Å; F1082-I1097 HydrophobicContact CB-CD1 4.15Å; F1082-I1097 HydrophobicContact CB-CG1 4.3Å; F1082-I1097 HydrophobicContact CD1-CD1 3.89Å; F1082-I1097 HydrophobicContact CD2-CD1 3.75Å; F1082-I1097 HydrophobicContact CD2-CG1 3.89Å; F1082-I1097 HydrophobicContact CE1-CD1 4.22Å; F1082-I1097 HydrophobicContact CE2-CD1 4.07Å; F1082-I1097 HydrophobicContact CE2-CG1 4.43Å; F1082-I1097 HydrophobicContact CG-CD1 3.66Å; F1082-I1097 HydrophobicContact CG-CG1 4.1Å; F1082-I1097 HydrophobicContact CZ-CD1 4.3Å; F1082-L1144 HydrophobicContact CE2-CD2 3.92Å; F1082-L1144 HydrophobicContact CZ-CB 4.4Å; F1082-L1144 HydrophobicContact CZ-CD2 3.85Å; F1082-R1147 HydrophobicContact CD1-CB 4.11Å; F1082-R1147 HydrophobicContact CE1-CB 3.68Å; F1082-R1148 HydrophobicContact CE1-CG 4.2Å; F1082-R1148 HydrophobicContact CZ-CG 4.19Å
1083	C	79.7	Confident	81.5	Confident	39 Å²	39	65.9 Å²	65.9	26%	0.264	34%	0.338	S	S	.	.			trans	-155.2	148	172.7	75.8	0	0	0	0	114.2	Q1085 N1086 D1087	C1083-Q1085 PolarHBondContact O-N 3.07Å; C1083-N1086 PolarHBondContact O-N 3.18Å; C1083-N1086 PolarHBondContact SG-ND2 3.2Å; C1083-D1087 PolarHBondContact N-OD2 3.42Å; C1083-D1087 PolarHBondContact O-N 3.11Å
1084	Y	80.7	Confident	82	Confident	145 Å²	145	65.5 Å²	65.5	57%	0.569	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	-19.3	-178.8	86.3	-91	0	0	0	115.2
1085	Q	76.4	Confident	82.4	Confident	77 Å²	77	62.9 Å²	62.9	36%	0.36	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-26.5	177.9	-66.7	-170.7	-18.2	0	0	112.5	I1029 K1033 C1083	I1029-Q1085 HydrophobicContact CG2-CB 3.95Å; I1029-Q1085 WeakPolarHBondContact CG2-O 3.3Å; K1033-Q1085 WeakPolarHBondContact CB-O 3.49Å; C1083-Q1085 PolarHBondContact O-N 3.07Å
1086	N	77	Confident	82.7	Confident	38 Å²	38	60.2 Å²	60.2	20%	0.203	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.7	-23	-174.9	-72.1	-13.4	0	0	0	113.1	K1033 I1036 C1083	K1033-N1086 WeakPolarHBondContact CA-O 3.37Å; I1036-N1086 HydrophobicContact CD1-CB 3.74Å; C1083-N1086 PolarHBondContact O-N 3.18Å; C1083-N1086 PolarHBondContact SG-ND2 3.2Å
1087	D	83.6	Confident	83	Confident	7 Å²	7	58.8 Å²	58.8	4%	0.037	30%	0.295	C	S	.	.			trans	-116.8	127.2	-171.1	-64.1	-66.1	0	0	0	111.1	F1082 C1083 R1147	F1082-D1087 WeakPolarHBondContact CA-OD2 3.27Å; C1083-D1087 PolarHBondContact N-OD2 3.42Å; C1083-D1087 PolarHBondContact O-N 3.11Å; D1087-R1147 WeakPolarHBondContact OD1-CD 3.19Å; D1087-R1147 IonicContact OD1-CZ 3.71Å; D1087-R1147 IonicContact OD1-NE 3.78Å; D1087-R1147 IonicContact OD1-NH1 3.18Å; D1087-R1147 PolarHBondContact OD1-NH1 3.38Å
1088	E	82.6	Confident	83.2	Confident	94 Å²	94	58.8 Å²	58.8	44%	0.439	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-31.8	178.6	-82.6	-167.7	160.1	0	0	114.3	K1033 T1037 V1105	K1033-E1088 HydrophobicContact CD-CG 4.41Å; K1033-E1088 HydrophobicContact CG-CG 4.39Å; T1037-E1088 WeakPolarHBondContact CG2-OE2 3.22Å; E1088-V1105 HydrophobicContact CB-CG1 4.32Å
1089	D	89.2	Confident	83.4	Confident	3 Å²	3	57 Å²	57	2%	0.016	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.5	21.1	-175.8	55.7	-32	0	0	0	113	D1091 S1101 V1105 Y1106 R1147	D1089-D1091 PolarHBondContact O-N 2.89Å; D1089-S1101 VanDerWaalsContact O-CB 3.25Å; D1089-S1101 WeakPolarHBondContact O-CB 3.31Å; D1089-S1101 PolarHBondContact O-OG 2.78Å; D1089-V1105 HydrophobicContact CB-CB 4.35Å; D1089-V1105 HydrophobicContact CB-CG2 3.95Å; D1089-Y1106 HydrophobicContact CB-CE2 4.3Å; D1089-R1147 VanDerWaalsContact CG-NH2 3.28Å; D1089-R1147 IonicContact OD1-CZ 2.63Å; D1089-R1147 VanDerWaalsContact OD1-CZ 3.3Å; D1089-R1147 IonicContact OD1-NH1 2.68Å; D1089-R1147 PolarHBondContact OD1-NH1 3.04Å; D1089-R1147 IonicContact OD1-NH2 2.73Å; D1089-R1147 PolarHBondContact OD1-NH2 2.84Å; D1089-R1147 IonicContact OD2-CZ 3.93Å; D1089-R1147 IonicContact OD2-NH1 3.55Å; D1089-R1147 IonicContact OD2-NH2 2.7Å; D1089-R1147 PolarHBondContact OD2-NH2 3.39Å
1090	Y	87.9	Confident	83.6	Confident	48 Å²	48	61 Å²	61	19%	0.188	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	114.6	175	-168.3	-86.6	0	0	0	111.3	F1082 V1092 N1095	F1082-Y1090 HydrophobicContact CB-CD2 4.18Å; F1082-Y1090 HydrophobicContact CB-CE2 4.06Å; Y1090-V1092 HydrophobicContact CD1-CG2 4.08Å; Y1090-V1092 PolarHBondContact O-N 3.05Å; Y1090-V1092 VanDerWaalsContact O-N 3.1Å; Y1090-N1095 WeakPolarHBondContact OH-CA 3.43Å; Y1090-N1095 PolarHBondContact OH-O 3.39Å
1091	D	86.7	Confident	84	Confident	26 Å²	26	57 Å²	57	14%	0.139	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	95.6	176.7	-172.5	-8.5	0	0	0	110.4	D1089 K1093 R1094 N1095 G1096	D1089-D1091 PolarHBondContact O-N 2.89Å; D1091-K1093 PolarHBondContact O-N 2.85Å; D1091-K1093 VanDerWaalsContact O-N 3.08Å; D1091-K1093 WeakPolarHBondContact OD1-CA 3.27Å; D1091-K1093 VanDerWaalsContact OD1-CB 3.27Å; D1091-K1093 WeakPolarHBondContact OD1-CB 3.43Å; D1091-K1093 PolarHBondContact OD1-N 3.06Å; D1091-R1094 HydrophobicContact CB-CB 4.32Å; D1091-R1094 CarbonylContact O-C 3.55Å; D1091-R1094 PolarHBondContact O-N 2.66Å; D1091-R1094 WeakPolarHBondContact OD2-CD 3.45Å; D1091-R1094 VanDerWaalsContact OD2-CG 3.27Å; D1091-R1094 WeakPolarHBondContact OD2-CG 3.44Å; D1091-R1094 IonicContact OD2-NE 2.77Å; D1091-R1094 PolarHBondContact OD2-NE 2.92Å; D1091-N1095 PolarHBondContact O-N 3.49Å; D1091-G1096 PolarHBondContact N-O 3.21Å
1092	V	84.1	Confident	84.7	Confident	103 Å²	103	55.6 Å²	55.6	62%	0.624	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	-20.4	176.5	-176.7	0	0	0	0	112.8	Y1090	Y1090-V1092 HydrophobicContact CD1-CG2 4.08Å; Y1090-V1092 PolarHBondContact O-N 3.05Å; Y1090-V1092 VanDerWaalsContact O-N 3.1Å
1093	K	84.8	Confident	84.9	Confident	195 Å²	195	56.3 Å²	56.3	85%	0.848	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.6	-28.7	175.5	-57	174.2	-177.6	170.8	0	112.6	D1091	D1091-K1093 PolarHBondContact O-N 2.85Å; D1091-K1093 VanDerWaalsContact O-N 3.08Å; D1091-K1093 WeakPolarHBondContact OD1-CA 3.27Å; D1091-K1093 VanDerWaalsContact OD1-CB 3.27Å; D1091-K1093 WeakPolarHBondContact OD1-CB 3.43Å; D1091-K1093 PolarHBondContact OD1-N 3.06Å
1094	R	81.5	Confident	85.3	Confident	89 Å²	89	60.3 Å²	60.3	34%	0.336	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110	-0.4	-176.3	-56.6	-174.9	-155.9	-172.7	10.3	113.8	V1076 D1091 G1096 E1100	V1076-R1094 HydrophobicContact CG1-CB 4.1Å; V1076-R1094 HydrophobicContact CG2-CB 3.92Å; V1076-R1094 VanDerWaalsContact CG2-CD 3.4Å; V1076-R1094 HydrophobicContact CG2-CG 4.28Å; D1091-R1094 HydrophobicContact CB-CB 4.32Å; D1091-R1094 CarbonylContact O-C 3.55Å; D1091-R1094 PolarHBondContact O-N 2.66Å; D1091-R1094 WeakPolarHBondContact OD2-CD 3.45Å; D1091-R1094 VanDerWaalsContact OD2-CG 3.27Å; D1091-R1094 WeakPolarHBondContact OD2-CG 3.44Å; D1091-R1094 IonicContact OD2-NE 2.77Å; D1091-R1094 PolarHBondContact OD2-NE 2.92Å; R1094-G1096 VanDerWaalsContact C-N 3.3Å; R1094-G1096 PolarHBondContact O-N 3.41Å; R1094-E1100 IonicContact CZ-OE2 3.7Å; R1094-E1100 IonicContact NH2-OE2 2.76Å; R1094-E1100 PolarHBondContact NH2-OE2 3.46Å
1095	N	81.7	Confident	85.7	Confident	103 Å²	103	55.6 Å²	55.6	55%	0.551	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.6	36.6	178.9	-70.9	-33	0	0	0	114.7	Y1090 D1091	Y1090-N1095 WeakPolarHBondContact OH-CA 3.43Å; Y1090-N1095 PolarHBondContact OH-O 3.39Å; D1091-N1095 PolarHBondContact O-N 3.49Å
1096	G	86.5	Confident	86.4	Confident	0 Å²	0	52 Å²	52	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-169.1	-169.9	177.6	0	0	0	0	0	111.4	D1077 D1091 R1094	D1077-G1096 WeakPolarHBondContact O-CA 3.47Å; D1091-G1096 PolarHBondContact N-O 3.21Å; R1094-G1096 VanDerWaalsContact C-N 3.3Å; R1094-G1096 PolarHBondContact O-N 3.41Å
1097	I	89.7	Confident	87.1	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	125.8	174.7	-55.9	172.3	0	0	0	107.2	V1076 D1077 F1082 Y1140 L1144	V1076-I1097 WeakPolarHBondContact CA-O 3.49Å; V1076-I1097 WeakPolarHBondContact CG1-O 3.39Å; D1077-I1097 PolarHBondContact N-O 3.39Å; D1077-I1097 PolarHBondContact O-N 2.94Å; F1082-I1097 HydrophobicContact CB-CD1 4.15Å; F1082-I1097 HydrophobicContact CB-CG1 4.3Å; F1082-I1097 HydrophobicContact CD1-CD1 3.89Å; F1082-I1097 HydrophobicContact CD2-CD1 3.75Å; F1082-I1097 HydrophobicContact CD2-CG1 3.89Å; F1082-I1097 HydrophobicContact CE1-CD1 4.22Å; F1082-I1097 HydrophobicContact CE2-CD1 4.07Å; F1082-I1097 HydrophobicContact CE2-CG1 4.43Å; F1082-I1097 HydrophobicContact CG-CD1 3.66Å; F1082-I1097 HydrophobicContact CG-CG1 4.1Å; F1082-I1097 HydrophobicContact CZ-CD1 4.3Å; I1097-Y1140 HydrophobicContact CG2-CE2 4.15Å; I1097-Y1140 PolarHBondContact O-OH 3.31Å; I1097-L1144 HydrophobicContact CB-CD2 3.87Å; I1097-L1144 HydrophobicContact CD1-CD2 3.96Å; I1097-L1144 HydrophobicContact CG1-CD2 4.48Å; I1097-L1144 HydrophobicContact CG2-CD2 4.03Å
1098	S	89.2	Confident	87.3	Confident	1 Å²	1	56.3 Å²	56.3	1%	0.007	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	153.8	177.5	76.9	0	0	0	0	110.7	E1100 S1101 F1102	S1098-E1100 PolarHBondContact O-N 3.28Å; S1098-S1101 PolarHBondContact N-OG 3.1Å; S1098-S1101 PolarHBondContact O-N 3.04Å; S1098-S1101 PolarHBondContact O-OG 3.04Å; S1098-S1101 VanDerWaalsContact O-OG 3.09Å; S1098-S1101 PolarHBondContact OG-N 2.82Å; S1098-S1101 VanDerWaalsContact OG-N 3.09Å; S1098-S1101 PolarHBondContact OG-OG 3.44Å; S1098-S1101 VanDerWaalsContact OG-OG 3.13Å; S1098-F1102 PolarHBondContact O-N 3.32Å
1099	Y	87.3	Confident	87.7	Confident	54 Å²	54	51.9 Å²	51.9	21%	0.212	27%	0.268	C	S	.	.	H	α-helix	trans	-60.3	-31.6	174.9	-178.5	-103	0	0	0	111.8	V1069 C1103 V1136 A1137 Y1140	V1069-Y1099 HydrophobicContact CG1-CD2 3.77Å; V1069-Y1099 HydrophobicContact CG1-CE2 4.36Å; V1069-Y1099 HydrophobicContact CG1-CG 4.09Å; Y1099-C1103 WeakPolarHBondContact O-CB 3.49Å; Y1099-C1103 PolarHBondContact O-N 2.88Å; Y1099-C1103 VanDerWaalsContact O-N 3.08Å; Y1099-C1103 PolarHBondContact O-SG 3.17Å; Y1099-V1136 HydrophobicContact CE2-CG1 3.97Å; Y1099-V1136 VanDerWaalsContact OH-CG1 3.31Å; Y1099-V1136 WeakPolarHBondContact OH-CG1 3.34Å; Y1099-A1137 HydrophobicContact CE2-CB 4.31Å; Y1099-Y1140 AromaticContact CD2-CD1 3.9Å; Y1099-Y1140 HydrophobicContact CD2-CD1 3.9Å; Y1099-Y1140 HydrophobicContact CD2-CD2 4.26Å; Y1099-Y1140 HydrophobicContact CD2-CE1 4.33Å; Y1099-Y1140 AromaticContact CD2-CG 3.84Å; Y1099-Y1140 HydrophobicContact CD2-CG 3.84Å; Y1099-Y1140 PolarHBondContact N-OH 3.3Å
1100	E	86.4	Confident	87.7	Confident	115 Å²	115	52 Å²	52	54%	0.537	27%	0.269	S	S	.	.	H	α-helix	trans	-68.1	-47.9	177	-169.7	174.6	-172.6	0	0	112.1	R1094 S1098 C1103 V1104	R1094-E1100 IonicContact CZ-OE2 3.7Å; R1094-E1100 IonicContact NH2-OE2 2.76Å; R1094-E1100 PolarHBondContact NH2-OE2 3.46Å; S1098-E1100 PolarHBondContact O-N 3.28Å; E1100-C1103 PolarHBondContact O-N 2.75Å; E1100-V1104 WeakPolarHBondContact O-CG2 3.46Å; E1100-V1104 PolarHBondContact O-N 3.13Å; E1100-V1104 VanDerWaalsContact O-N 3.08Å
1101	S	87.8	Confident	87.7	Confident	21 Å²	21	52 Å²	52	15%	0.147	27%	0.273	C	S	.	.	H	α-helix	trans	-67.3	-39.2	178.2	59.7	0	0	0	0	112.4	D1089 S1098 C1103 V1104 V1105	D1089-S1101 VanDerWaalsContact O-CB 3.25Å; D1089-S1101 WeakPolarHBondContact O-CB 3.31Å; D1089-S1101 PolarHBondContact O-OG 2.78Å; S1098-S1101 PolarHBondContact N-OG 3.1Å; S1098-S1101 PolarHBondContact O-N 3.04Å; S1098-S1101 PolarHBondContact O-OG 3.04Å; S1098-S1101 VanDerWaalsContact O-OG 3.09Å; S1098-S1101 PolarHBondContact OG-N 2.82Å; S1098-S1101 VanDerWaalsContact OG-N 3.09Å; S1098-S1101 PolarHBondContact OG-OG 3.44Å; S1098-S1101 VanDerWaalsContact OG-OG 3.13Å; S1101-C1103 VanDerWaalsContact C-N 3.33Å; S1101-C1103 PolarHBondContact O-N 2.76Å; S1101-V1104 PolarHBondContact O-N 3.41Å; S1101-V1105 PolarHBondContact O-N 3.07Å
1102	F	91.2	Very high	87.8	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-58.7	-43.5	172.4	175.4	-97	0	0	0	112	V1040 I1044 S1098 V1105 Y1106 I1110 V1136 C1139 Y1140 S1143	V1040-F1102 HydrophobicContact CG1-CE2 4.17Å; I1044-F1102 HydrophobicContact CD1-CE2 4.35Å; I1044-F1102 HydrophobicContact CD1-CZ 4.07Å; S1098-F1102 PolarHBondContact O-N 3.32Å; F1102-V1105 PolarHBondContact O-N 3.45Å; F1102-Y1106 AromaticContact CD2-CD2 3.48Å; F1102-Y1106 HydrophobicContact CD2-CD2 3.48Å; F1102-Y1106 VanDerWaalsContact CD2-CD2 3.48Å; F1102-Y1106 HydrophobicContact CD2-CE2 4.1Å; F1102-Y1106 HydrophobicContact CD2-CG 4.29Å; F1102-Y1106 AromaticContact CE2-CD2 3.59Å; F1102-Y1106 HydrophobicContact CE2-CD2 3.59Å; F1102-Y1106 HydrophobicContact CE2-CE2 4.29Å; F1102-Y1106 HydrophobicContact CE2-CG 4.01Å; F1102-Y1106 HydrophobicContact CG-CD2 4.26Å; F1102-Y1106 HydrophobicContact CZ-CD2 4.45Å; F1102-Y1106 PolarHBondContact O-N 3.42Å; F1102-I1110 HydrophobicContact CE1-CD1 3.8Å; F1102-I1110 HydrophobicContact CZ-CD1 4.05Å; F1102-V1136 HydrophobicContact CE1-CG1 4.46Å; F1102-C1139 HydrophobicContact CE1-CB 4.49Å; F1102-C1139 HydrophobicContact CZ-CB 4.19Å; F1102-Y1140 HydrophobicContact CB-CD2 3.64Å; F1102-Y1140 HydrophobicContact CB-CE2 4Å; F1102-Y1140 AromaticContact CD1-CD2 3.83Å; F1102-Y1140 HydrophobicContact CD1-CD2 3.83Å; F1102-Y1140 HydrophobicContact CD1-CG 4.28Å; F1102-Y1140 HydrophobicContact CD2-CD2 4.11Å; F1102-Y1140 AromaticContact CG-CD2 3.59Å; F1102-Y1140 HydrophobicContact CG-CD2 3.59Å; F1102-Y1140 HydrophobicContact CG-CE2 4.43Å; F1102-Y1140 HydrophobicContact CG-CG 4.45Å; F1102-S1143 WeakPolarHBondContact CE2-OG 3.37Å
1103	C	88.6	Confident	87.9	Confident	25 Å²	25	46.7 Å²	46.7	17%	0.169	24%	0.243	C	C	.	.	H	α-helix	trans	-64.1	-39.8	177	-73.5	0	0	0	0	112.4	Y1099 E1100 S1101 V1105 L1107	Y1099-C1103 WeakPolarHBondContact O-CB 3.49Å; Y1099-C1103 PolarHBondContact O-N 2.88Å; Y1099-C1103 VanDerWaalsContact O-N 3.08Å; Y1099-C1103 PolarHBondContact O-SG 3.17Å; E1100-C1103 PolarHBondContact O-N 2.75Å; S1101-C1103 VanDerWaalsContact C-N 3.33Å; S1101-C1103 PolarHBondContact O-N 2.76Å; C1103-V1105 VanDerWaalsContact C-N 3.31Å; C1103-V1105 PolarHBondContact O-N 2.88Å; C1103-L1107 WeakPolarHBondContact O-CB 3.49Å; C1103-L1107 PolarHBondContact O-N 2.88Å
1104	V	89.2	Confident	87.9	Confident	123 Å²	123	37.8 Å²	37.8	75%	0.745	21%	0.206	S	C	*	.	H	α-helix	trans	-60.7	-39.3	177.9	170.1	0	0	0	0	112	E1100 S1101	E1100-V1104 WeakPolarHBondContact O-CG2 3.46Å; E1100-V1104 PolarHBondContact O-N 3.13Å; E1100-V1104 VanDerWaalsContact O-N 3.08Å; S1101-V1104 PolarHBondContact O-N 3.41Å
1105	V	88.3	Confident	87.9	Confident	45 Å²	45	38.2 Å²	38.2	27%	0.273	21%	0.214	S	C	.	.	H	α-helix	trans	-83	-51.8	-178.8	179.4	0	0	0	0	112.2	E1088 D1089 S1101 F1102 C1103	E1088-V1105 HydrophobicContact CB-CG1 4.32Å; D1089-V1105 HydrophobicContact CB-CB 4.35Å; D1089-V1105 HydrophobicContact CB-CG2 3.95Å; S1101-V1105 PolarHBondContact O-N 3.07Å; F1102-V1105 PolarHBondContact O-N 3.45Å; C1103-V1105 VanDerWaalsContact C-N 3.31Å; C1103-V1105 PolarHBondContact O-N 2.88Å
1106	Y	91.8	Very high	87.9	Confident	2 Å²	2	37.8 Å²	37.8	1%	0.008	21%	0.205	C	C	.	.	H	α-helix	trans	-101.7	-10.8	-164	-64.5	-76.5	0	0	0	115.6	T1037 V1040 K1041 I1044 D1089 F1102 S1108 W1109 I1110	T1037-Y1106 HydrophobicContact CG2-CE1 4.44Å; V1040-Y1106 HydrophobicContact CB-CE1 4.01Å; V1040-Y1106 HydrophobicContact CG1-CD1 3.99Å; V1040-Y1106 HydrophobicContact CG1-CD2 4.22Å; V1040-Y1106 HydrophobicContact CG1-CE1 3.58Å; V1040-Y1106 HydrophobicContact CG1-CE2 3.83Å; V1040-Y1106 HydrophobicContact CG1-CG 4.29Å; V1040-Y1106 VanDerWaalsContact CG1-CZ 3.49Å; K1041-Y1106 HydrophobicContact CG-CD1 4.26Å; K1041-Y1106 HydrophobicContact CG-CE1 4.01Å; I1044-Y1106 HydrophobicContact CD1-CD1 3.9Å; I1044-Y1106 HydrophobicContact CD1-CG 4.02Å; D1089-Y1106 HydrophobicContact CB-CE2 4.3Å; F1102-Y1106 AromaticContact CD2-CD2 3.48Å; F1102-Y1106 HydrophobicContact CD2-CD2 3.48Å; F1102-Y1106 VanDerWaalsContact CD2-CD2 3.48Å; F1102-Y1106 HydrophobicContact CD2-CE2 4.1Å; F1102-Y1106 HydrophobicContact CD2-CG 4.29Å; F1102-Y1106 AromaticContact CE2-CD2 3.59Å; F1102-Y1106 HydrophobicContact CE2-CD2 3.59Å; F1102-Y1106 HydrophobicContact CE2-CE2 4.29Å; F1102-Y1106 HydrophobicContact CE2-CG 4.01Å; F1102-Y1106 HydrophobicContact CG-CD2 4.26Å; F1102-Y1106 HydrophobicContact CZ-CD2 4.45Å; F1102-Y1106 PolarHBondContact O-N 3.42Å; Y1106-S1108 VanDerWaalsContact C-N 3.25Å; Y1106-S1108 PolarHBondContact O-N 3.28Å; Y1106-W1109 PolarHBondContact O-N 3.09Å; Y1106-I1110 WeakPolarHBondContact O-CG1 3.48Å; Y1106-I1110 PolarHBondContact O-N 2.9Å
1107	L	89.9	Confident	87.2	Confident	73 Å²	73	38.7 Å²	38.7	38%	0.382	21%	0.212	S	C	.	.	H	α-helix	trans	-60.7	-34.8	-176.9	-176.8	62.9	0	0	0	112.7	C1103 W1109 I1110 T1111 V1136	C1103-L1107 WeakPolarHBondContact O-CB 3.49Å; C1103-L1107 PolarHBondContact O-N 2.88Å; L1107-W1109 VanDerWaalsContact C-N 3.29Å; L1107-W1109 PolarHBondContact O-N 3.06Å; L1107-I1110 PolarHBondContact O-N 3.13Å; L1107-T1111 HydrophobicContact CD1-CG2 4.46Å; L1107-T1111 PolarHBondContact O-N 3.28Å; L1107-T1111 PolarHBondContact O-OG1 2.94Å; L1107-T1111 VanDerWaalsContact O-OG1 3.13Å; L1107-V1136 HydrophobicContact CD1-CG2 4Å
1108	S	89.8	Confident	85.8	Confident	63 Å²	63	44.9 Å²	44.9	44%	0.441	25%	0.252	S	S	.	.	H	α-helix	trans	-64.8	-30.1	176.2	66.1	0	0	0	0	113.5	Y1106 T1111 C1112 N1221	Y1106-S1108 VanDerWaalsContact C-N 3.25Å; Y1106-S1108 PolarHBondContact O-N 3.28Å; S1108-T1111 PolarHBondContact O-OG1 3.4Å; S1108-C1112 VanDerWaalsContact O-CB 3.28Å; S1108-C1112 WeakPolarHBondContact O-CB 3.36Å; S1108-C1112 PolarHBondContact O-N 3.35Å; S1108-N1221 PolarHBondContact O-ND2 2.67Å; S1108-N1221 PolarHBondContact OG-ND2 3.42Å
1109	W	90.7	Very high	84.5	Confident	1 Å²	1	47.5 Å²	47.5	0%	0.004	26%	0.263	C	S	.	.	H	α-helix	trans	-82.4	-38.5	174.9	174.5	-114.6	0	0	0	111.5	K1041 Y1106 L1107 C1112 C1113 N1221 L1224 I1228	K1041-W1109 HydrophobicContact CB-CZ2 4.42Å; K1041-W1109 HydrophobicContact CG-CG 4.33Å; K1041-W1109 PolarHBondContact O-NE1 3.29Å; Y1106-W1109 PolarHBondContact O-N 3.09Å; L1107-W1109 VanDerWaalsContact C-N 3.29Å; L1107-W1109 PolarHBondContact O-N 3.06Å; W1109-C1112 PolarHBondContact O-N 3.48Å; W1109-C1113 VanDerWaalsContact CE2-SG 3.5Å; W1109-C1113 WeakPolarHBondContact O-CB 3.45Å; W1109-C1113 PolarHBondContact O-N 3.22Å; W1109-C1113 PolarHBondContact O-SG 2.98Å; W1109-N1221 HydrophobicContact CE3-CB 4.03Å; W1109-N1221 WeakPolarHBondContact CZ3-O 3.44Å; W1109-L1224 HydrophobicContact CE3-CD2 4.37Å; W1109-L1224 HydrophobicContact CH2-CB 4.21Å; W1109-L1224 HydrophobicContact CH2-CD2 3.94Å; W1109-L1224 HydrophobicContact CH2-CG 3.74Å; W1109-L1224 HydrophobicContact CZ2-CD2 4.42Å; W1109-L1224 HydrophobicContact CZ3-CB 3.98Å; W1109-L1224 HydrophobicContact CZ3-CD2 3.91Å; W1109-L1224 HydrophobicContact CZ3-CG 3.91Å; W1109-I1228 HydrophobicContact CH2-CD1 4.02Å; W1109-I1228 HydrophobicContact CZ2-CD1 4.01Å
1110	I	89.6	Confident	82.9	Confident	6 Å²	6	49.1 Å²	49.1	3%	0.031	28%	0.282	C	S	.	.	H	α-helix	trans	-61.5	-46.8	175.9	-67.4	164.5	0	0	0	110.9	I1044 I1048 F1102 Y1106 L1107 C1113 A1114 V1136 C1139	I1044-I1110 HydrophobicContact CD1-CD1 4.43Å; I1044-I1110 HydrophobicContact CD1-CG1 4.14Å; I1044-I1110 HydrophobicContact CG1-CG1 4.42Å; I1044-I1110 HydrophobicContact CG2-CB 4.45Å; I1044-I1110 HydrophobicContact CG2-CG1 3.61Å; I1048-I1110 HydrophobicContact CD1-CG2 4.11Å; F1102-I1110 HydrophobicContact CE1-CD1 3.8Å; F1102-I1110 HydrophobicContact CZ-CD1 4.05Å; Y1106-I1110 WeakPolarHBondContact O-CG1 3.48Å; Y1106-I1110 PolarHBondContact O-N 2.9Å; L1107-I1110 PolarHBondContact O-N 3.13Å; I1110-C1113 PolarHBondContact O-N 3.4Å; I1110-A1114 WeakPolarHBondContact O-CB 3.44Å; I1110-A1114 PolarHBondContact O-N 2.83Å; I1110-V1136 HydrophobicContact CD1-CG1 4.25Å; I1110-V1136 HydrophobicContact CD1-CG2 4.45Å; I1110-V1136 HydrophobicContact CG2-CG2 4Å; I1110-C1139 HydrophobicContact CD1-CB 4.18Å
1111	T	87.6	Confident	81.5	Confident	47 Å²	47	44.8 Å²	44.8	29%	0.288	26%	0.262	S	S	.	.	H	α-helix	trans	-63.3	-48	175.8	51.5	0	0	0	0	111.3	L1107 S1108 C1113 A1114 D1115	L1107-T1111 HydrophobicContact CD1-CG2 4.46Å; L1107-T1111 PolarHBondContact O-N 3.28Å; L1107-T1111 PolarHBondContact O-OG1 2.94Å; L1107-T1111 VanDerWaalsContact O-OG1 3.13Å; S1108-T1111 PolarHBondContact O-OG1 3.4Å; T1111-C1113 PolarHBondContact O-N 3.25Å; T1111-A1114 PolarHBondContact O-N 3.19Å; T1111-D1115 WeakPolarHBondContact O-CB 3.44Å; T1111-D1115 PolarHBondContact O-N 3.33Å
1112	C	87.6	Confident	79.7	Confident	15 Å²	15	46.7 Å²	46.7	10%	0.101	27%	0.273	C	S	.	.	H	α-helix	trans	-53.9	-39.2	176.5	-170.2	0	0	0	0	113.3	S1108 W1109 R1116 N1221	S1108-C1112 VanDerWaalsContact O-CB 3.28Å; S1108-C1112 WeakPolarHBondContact O-CB 3.36Å; S1108-C1112 PolarHBondContact O-N 3.35Å; W1109-C1112 PolarHBondContact O-N 3.48Å; C1112-R1116 PolarHBondContact SG-NH1 3.45Å; C1112-N1221 HydrophobicContact CB-CB 4.2Å; C1112-N1221 PolarHBondContact SG-O 2.9Å
1113	C	87	Confident	77.7	Confident	2 Å²	2	52.7 Å²	52.7	1%	0.014	30%	0.301	C	S	.	.	H	α-helix	trans	-74.3	-41	175.1	-69.7	0	0	0	0	113.1	I1048 W1109 I1110 T1111 R1116 S1117 Y1225	I1048-C1113 HydrophobicContact CB-CB 4.45Å; I1048-C1113 HydrophobicContact CD1-CB 3.7Å; I1048-C1113 HydrophobicContact CG2-CB 4.22Å; W1109-C1113 VanDerWaalsContact CE2-SG 3.5Å; W1109-C1113 WeakPolarHBondContact O-CB 3.45Å; W1109-C1113 PolarHBondContact O-N 3.22Å; W1109-C1113 PolarHBondContact O-SG 2.98Å; I1110-C1113 PolarHBondContact O-N 3.4Å; T1111-C1113 PolarHBondContact O-N 3.25Å; C1113-R1116 PolarHBondContact O-N 3.41Å; C1113-S1117 PolarHBondContact O-N 3.38Å; C1113-Y1225 HydrophobicContact CB-CE2 4.4Å
1114	A	84.1	Confident	75.8	Confident	9 Å²	9	61.4 Å²	61.4	7%	0.074	34%	0.34	C	S	.	.	H	α-helix	trans	-66.8	-45.7	-178.9	0	0	0	0	0	111.8	I1110 T1111 R1116 S1117	I1110-A1114 WeakPolarHBondContact O-CB 3.44Å; I1110-A1114 PolarHBondContact O-N 2.83Å; T1111-A1114 PolarHBondContact O-N 3.19Å; A1114-R1116 PolarHBondContact O-N 3.09Å; A1114-R1116 VanDerWaalsContact O-N 3.12Å; A1114-S1117 WeakPolarHBondContact O-CB 3.39Å; A1114-S1117 PolarHBondContact O-N 2.92Å
1115	D	82.1	Confident	73.8	Confident	97 Å²	97	58.7 Å²	58.7	52%	0.519	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-11	-178.2	-59.7	-22.2	0	0	0	112.8	T1111 R1132	T1111-D1115 WeakPolarHBondContact O-CB 3.44Å; T1111-D1115 PolarHBondContact O-N 3.33Å; D1115-R1132 IonicContact OD1-NH2 2.84Å
1116	R	80.5	Confident	72.1	Confident	94 Å²	94	66 Å²	66	36%	0.355	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.8	1.8	173.9	-64.8	-172.7	-178.1	125.4	11.1	114.3	C1112 C1113 A1114 V1222 Y1225	C1112-R1116 PolarHBondContact SG-NH1 3.45Å; C1113-R1116 PolarHBondContact O-N 3.41Å; A1114-R1116 PolarHBondContact O-N 3.09Å; A1114-R1116 VanDerWaalsContact O-N 3.12Å; R1116-V1222 VanDerWaalsContact NH2-CG2 3.27Å; R1116-Y1225 HydrophobicContact CB-CD1 4.47Å; R1116-Y1225 HydrophobicContact CB-CE1 3.77Å; R1116-Y1225 HydrophobicContact CB-CE2 4.09Å; R1116-Y1225 HydrophobicContact CG-CE1 4.39Å; R1116-Y1225 PolarHBondContact O-OH 3.25Å
1117	S	73.1	Confident	70.2	Confident	20 Å²	20	74.3 Å²	74.3	14%	0.14	38%	0.384	C	S	.	.	S	Bend	trans	-71	139.6	174.4	-167.4	0	0	0	0	110.1	I1048 C1113 A1114 K1119	I1048-S1117 PolarHBondContact O-OG 2.96Å; C1113-S1117 PolarHBondContact O-N 3.38Å; A1114-S1117 WeakPolarHBondContact O-CB 3.39Å; A1114-S1117 PolarHBondContact O-N 2.92Å; S1117-K1119 PolarHBondContact O-N 2.88Å; S1117-K1119 VanDerWaalsContact O-N 3.14Å
1118	P	59.6	Low	68.9	Low	129 Å²	129	71.5 Å²	71.5	84%	0.838	37%	0.372	S	S	*	.	S	Bend	trans	-70.1	-4.1	176.1	30.2	-36.5	0	0	0	113.5
1119	K	61.9	Low	68	Low	57 Å²	57	73.4 Å²	73.4	25%	0.248	38%	0.378	C	S	.	.	S	Bend	trans	-98.7	128.2	170.6	-66.4	-178	173.2	-173.5	0	109.2	S1050 N1051 I1053 T1054 S1117 L1121	S1050-K1119 PolarHBondContact O-NZ 3.24Å; N1051-K1119 PolarHBondContact O-NZ 3.44Å; I1053-K1119 HydrophobicContact CG2-CD 4.43Å; T1054-K1119 PolarHBondContact OG1-NZ 2.89Å; T1054-K1119 VanDerWaalsContact OG1-NZ 3.14Å; S1117-K1119 PolarHBondContact O-N 2.88Å; S1117-K1119 VanDerWaalsContact O-N 3.14Å; K1119-L1121 VanDerWaalsContact C-N 3.26Å; K1119-L1121 PolarHBondContact O-N 3.43Å
1120	S	53.6	Low	67.2	Low	87 Å²	87	78 Å²	78	61%	0.608	40%	0.399	S	S	*	.			trans	-71	76.1	175	45.4	0	0	0	0	112.3	T1122	S1120-T1122 PolarHBondContact O-N 2.92Å; S1120-T1122 VanDerWaalsContact O-N 3.09Å
1121	L	57.1	Low	66.6	Low	24 Å²	24	80.3 Å²	80.3	13%	0.126	41%	0.413	C	S	.	.			trans	-68.9	7.2	164.8	-68.3	163.7	0	0	0	112.5	I1048 K1119 V1131 V1135	I1048-L1121 HydrophobicContact CG2-CD1 4.3Å; K1119-L1121 VanDerWaalsContact C-N 3.26Å; K1119-L1121 PolarHBondContact O-N 3.43Å; L1121-V1131 HydrophobicContact CD2-CG1 4.16Å; L1121-V1135 HydrophobicContact CD2-CG2 4.37Å
1122	T	50.9	Low	66.2	Low	61 Å²	61	82.8 Å²	82.8	37%	0.374	42%	0.417	S	S	.	.			trans	-137.3	47.1	-164.6	45	0	0	0	0	112.1	S1120	S1120-T1122 PolarHBondContact O-N 2.92Å; S1120-T1122 VanDerWaalsContact O-N 3.09Å
1123	E	49	Very low	65.9	Low	126 Å²	126	88.2 Å²	88.2	59%	0.589	44%	0.439	S	S	*	.			trans	-85	134.1	157.8	-69.5	-169.5	176.3	0	0	110.3	T1125	E1123-T1125 HydrophobicContact CB-CG2 4.5Å; E1123-T1125 PolarHBondContact O-N 3.38Å
1124	E	48.4	Very low	65.8	Low	209 Å²	209	89.2 Å²	89.2	98%	0.977	44%	0.444	S	S	*	.			trans	-75.3	35.1	-174.3	-58.5	-169.3	133.9	0	0	114.2
1125	T	47.7	Very low	65.9	Low	66 Å²	66	89.1 Å²	89.1	41%	0.405	44%	0.443	S	S	.	.	S	Bend	trans	-86	159.6	174.2	68.2	0	0	0	0	111.1	E1123 Y1127 G1128	E1123-T1125 HydrophobicContact CB-CG2 4.5Å; E1123-T1125 PolarHBondContact O-N 3.38Å; T1125-Y1127 PolarHBondContact O-N 3.17Å; T1125-G1128 PolarHBondContact O-N 2.94Å; T1125-G1128 PolarHBondContact OG1-N 3.46Å
1126	K	51.4	Low	66.2	Low	198 Å²	198	84.9 Å²	84.9	86%	0.861	42%	0.42	S	S	*	.	H	α-helix	trans	-53.8	-35.1	172.1	-93.5	-174.6	172.7	-178.8	0	112.6
1127	Y	53.3	Low	66.6	Low	177 Å²	177	80.4 Å²	80.4	69%	0.694	40%	0.403	S	S	*	.	H	α-helix	trans	-70	-35.3	176.5	-67	-78.6	0	0	0	112.6	T1125 N1129 Q1130 V1131	T1125-Y1127 PolarHBondContact O-N 3.17Å; Y1127-N1129 VanDerWaalsContact C-N 3.28Å; Y1127-N1129 PolarHBondContact O-N 3.5Å; Y1127-Q1130 WeakPolarHBondContact O-CB 3.29Å; Y1127-Q1130 PolarHBondContact O-N 2.92Å; Y1127-V1131 WeakPolarHBondContact O-CG2 3.25Å; Y1127-V1131 PolarHBondContact O-N 2.84Å
1128	G	62.5	Low	67.4	Low	13 Å²	13	79.6 Å²	79.6	13%	0.134	40%	0.397	C	S	.	.	H	α-helix	trans	-56.8	-39	175.6	0	0	0	0	0	113.3	T1125 V1131 R1132	T1125-G1128 PolarHBondContact O-N 2.94Å; T1125-G1128 PolarHBondContact OG1-N 3.46Å; G1128-V1131 PolarHBondContact O-N 2.99Å; G1128-R1132 VanDerWaalsContact O-CB 3.31Å; G1128-R1132 WeakPolarHBondContact O-CB 3.33Å; G1128-R1132 PolarHBondContact O-N 2.75Å
1129	N	69.8	Low	68.9	Low	103 Å²	103	73.5 Å²	73.5	55%	0.551	36%	0.358	S	S	*	.	H	α-helix	trans	-68.4	-31.8	174.1	-85	-32.5	0	0	0	113.5	Y1127 K1133	Y1127-N1129 VanDerWaalsContact C-N 3.28Å; Y1127-N1129 PolarHBondContact O-N 3.5Å; N1129-K1133 WeakPolarHBondContact O-CG 3.3Å; N1129-K1133 PolarHBondContact O-N 3.2Å; N1129-K1133 VanDerWaalsContact O-N 3.17Å
1130	Q	75.2	Confident	70.3	Confident	99 Å²	99	70.8 Å²	70.8	46%	0.463	35%	0.346	S	S	.	.	H	α-helix	trans	-72.9	-45.1	174	-172.9	172.5	-4.1	0	0	110.9	Y1127 R1132 K1133 M1134	Y1127-Q1130 WeakPolarHBondContact O-CB 3.29Å; Y1127-Q1130 PolarHBondContact O-N 2.92Å; Q1130-R1132 VanDerWaalsContact C-N 3.33Å; Q1130-R1132 PolarHBondContact O-N 3.12Å; Q1130-K1133 WeakPolarHBondContact O-CB 3.29Å; Q1130-K1133 PolarHBondContact O-N 3.32Å; Q1130-K1133 VanDerWaalsContact O-N 3.13Å; Q1130-M1134 HydrophobicContact CG-SD 4.44Å; Q1130-M1134 WeakPolarHBondContact O-CG 3.31Å; Q1130-M1134 PolarHBondContact O-N 3.27Å
1131	V	76.8	Confident	72.1	Confident	53 Å²	53	67 Å²	67	32%	0.321	32%	0.319	S	S	.	.	H	α-helix	trans	-58.3	-44.4	173.6	171.8	0	0	0	0	111	L1057 L1121 Y1127 G1128 K1133 M1134 V1135	L1057-V1131 HydrophobicContact CD1-CG1 4.31Å; L1121-V1131 HydrophobicContact CD2-CG1 4.16Å; Y1127-V1131 WeakPolarHBondContact O-CG2 3.25Å; Y1127-V1131 PolarHBondContact O-N 2.84Å; G1128-V1131 PolarHBondContact O-N 2.99Å; V1131-K1133 VanDerWaalsContact C-N 3.33Å; V1131-K1133 PolarHBondContact O-N 3.14Å; V1131-M1134 PolarHBondContact O-N 3.07Å; V1131-V1135 HydrophobicContact CG1-CG2 4.46Å; V1131-V1135 WeakPolarHBondContact O-CG2 3.47Å; V1131-V1135 PolarHBondContact O-N 3.01Å
1132	R	78	Confident	73.7	Confident	99 Å²	99	65.9 Å²	65.9	37%	0.374	31%	0.313	S	S	.	.	H	α-helix	trans	-60.2	-40.2	175.6	-176	179.2	-96.3	170.2	-13.7	112	D1115 G1128 Q1130 V1135 V1136	D1115-R1132 IonicContact OD1-NH2 2.84Å; G1128-R1132 VanDerWaalsContact O-CB 3.31Å; G1128-R1132 WeakPolarHBondContact O-CB 3.33Å; G1128-R1132 PolarHBondContact O-N 2.75Å; Q1130-R1132 VanDerWaalsContact C-N 3.33Å; Q1130-R1132 PolarHBondContact O-N 3.12Å; R1132-V1135 PolarHBondContact O-N 2.88Å; R1132-V1136 WeakPolarHBondContact O-CG2 3.1Å; R1132-V1136 PolarHBondContact O-N 3.49Å
1133	K	81.8	Confident	75.7	Confident	130 Å²	130	63 Å²	63	57%	0.565	30%	0.295	S	S	*	.	H	α-helix	trans	-64.3	-45.1	172.6	-77.7	-179.3	171.4	-168.3	0	112.6	N1129 Q1130 V1131 V1135 V1136 A1137	N1129-K1133 WeakPolarHBondContact O-CG 3.3Å; N1129-K1133 PolarHBondContact O-N 3.2Å; N1129-K1133 VanDerWaalsContact O-N 3.17Å; Q1130-K1133 WeakPolarHBondContact O-CB 3.29Å; Q1130-K1133 PolarHBondContact O-N 3.32Å; Q1130-K1133 VanDerWaalsContact O-N 3.13Å; V1131-K1133 VanDerWaalsContact C-N 3.33Å; V1131-K1133 PolarHBondContact O-N 3.14Å; K1133-V1135 VanDerWaalsContact C-N 3.3Å; K1133-V1135 PolarHBondContact O-N 3.22Å; K1133-V1136 PolarHBondContact O-N 3.35Å; K1133-A1137 WeakPolarHBondContact O-CB 3.44Å; K1133-A1137 PolarHBondContact O-N 3.41Å
1134	M	84.9	Confident	77.6	Confident	23 Å²	23	57 Å²	57	11%	0.113	27%	0.267	C	S	.	.	H	α-helix	trans	-61.4	-38.1	176.4	-65.5	172.2	78.6	0	0	111.8	L1057 I1063 L1066 Q1130 V1131 A1137 L1138	L1057-M1134 HydrophobicContact CD2-CB 3.56Å; L1057-M1134 HydrophobicContact CD2-CE 4.21Å; I1063-M1134 HydrophobicContact CG1-CE 4.15Å; L1066-M1134 HydrophobicContact CD1-CB 4.43Å; L1066-M1134 HydrophobicContact CD1-CE 4.16Å; Q1130-M1134 HydrophobicContact CG-SD 4.44Å; Q1130-M1134 WeakPolarHBondContact O-CG 3.31Å; Q1130-M1134 PolarHBondContact O-N 3.27Å; V1131-M1134 PolarHBondContact O-N 3.07Å; M1134-A1137 PolarHBondContact O-N 3.46Å; M1134-L1138 VanDerWaalsContact O-CB 3.25Å; M1134-L1138 WeakPolarHBondContact O-CB 3.49Å; M1134-L1138 PolarHBondContact O-N 2.9Å
1135	V	86.4	Confident	79.7	Confident	7 Å²	7	47 Å²	47	4%	0.042	22%	0.221	C	C	.	.	H	α-helix	trans	-65.7	-42.3	174.5	171.4	0	0	0	0	112	I1048 I1053 L1057 L1121 V1131 R1132 K1133 L1138 C1139	I1048-V1135 HydrophobicContact CG1-CG1 4.21Å; I1053-V1135 HydrophobicContact CD1-CG1 4.32Å; I1053-V1135 HydrophobicContact CD1-CG2 4.15Å; L1057-V1135 HydrophobicContact CD1-CG2 3.87Å; L1121-V1135 HydrophobicContact CD2-CG2 4.37Å; V1131-V1135 HydrophobicContact CG1-CG2 4.46Å; V1131-V1135 WeakPolarHBondContact O-CG2 3.47Å; V1131-V1135 PolarHBondContact O-N 3.01Å; R1132-V1135 PolarHBondContact O-N 2.88Å; K1133-V1135 VanDerWaalsContact C-N 3.3Å; K1133-V1135 PolarHBondContact O-N 3.22Å; V1135-L1138 PolarHBondContact O-N 2.95Å; V1135-C1139 WeakPolarHBondContact O-CB 3.47Å; V1135-C1139 PolarHBondContact O-N 2.68Å; V1135-C1139 PolarHBondContact O-SG 2.94Å
1136	V	88.6	Confident	81.6	Confident	7 Å²	7	43.9 Å²	43.9	4%	0.042	20%	0.201	C	C	.	.	H	α-helix	trans	-65.1	-43.2	175.9	177.2	0	0	0	0	110.9	Y1099 F1102 L1107 I1110 R1132 K1133 C1139 Y1140	Y1099-V1136 HydrophobicContact CE2-CG1 3.97Å; Y1099-V1136 VanDerWaalsContact OH-CG1 3.31Å; Y1099-V1136 WeakPolarHBondContact OH-CG1 3.34Å; F1102-V1136 HydrophobicContact CE1-CG1 4.46Å; L1107-V1136 HydrophobicContact CD1-CG2 4Å; I1110-V1136 HydrophobicContact CD1-CG1 4.25Å; I1110-V1136 HydrophobicContact CD1-CG2 4.45Å; I1110-V1136 HydrophobicContact CG2-CG2 4Å; R1132-V1136 WeakPolarHBondContact O-CG2 3.1Å; R1132-V1136 PolarHBondContact O-N 3.49Å; K1133-V1136 PolarHBondContact O-N 3.35Å; V1136-C1139 PolarHBondContact O-N 2.92Å; V1136-Y1140 WeakPolarHBondContact O-CB 3.33Å; V1136-Y1140 PolarHBondContact O-N 2.91Å
1137	A	88.9	Confident	83.4	Confident	0 Å²	0	35 Å²	35	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-65.1	-37.3	175.5	0	0	0	0	0	112.8	L1066 Q1070 Y1099 K1133 M1134 Y1140 L1141	L1066-A1137 HydrophobicContact CD2-CB 3.62Å; Q1070-A1137 HydrophobicContact CG-CB 4.14Å; Y1099-A1137 HydrophobicContact CE2-CB 4.31Å; K1133-A1137 WeakPolarHBondContact O-CB 3.44Å; K1133-A1137 PolarHBondContact O-N 3.41Å; M1134-A1137 PolarHBondContact O-N 3.46Å; A1137-Y1140 WeakPolarHBondContact O-CB 3.08Å; A1137-Y1140 PolarHBondContact O-N 3.11Å; A1137-L1141 WeakPolarHBondContact O-CG 3.43Å; A1137-L1141 PolarHBondContact O-N 3.49Å
1138	L	89.9	Confident	85	Confident	3 Å²	3	27.1 Å²	27.1	2%	0.016	13%	0.131	C	C	.	.	H	α-helix	trans	-66.6	-41.8	173.9	-175.8	61.3	0	0	0	111.3	I1053 I1062 L1066 M1134 V1135 Y1140 L1141 L1142 W1185	I1053-L1138 HydrophobicContact CG1-CD2 4.48Å; I1062-L1138 HydrophobicContact CG2-CD1 3.96Å; L1066-L1138 HydrophobicContact CD2-CB 3.9Å; L1066-L1138 VanDerWaalsContact CD2-N 3.28Å; M1134-L1138 VanDerWaalsContact O-CB 3.25Å; M1134-L1138 WeakPolarHBondContact O-CB 3.49Å; M1134-L1138 PolarHBondContact O-N 2.9Å; V1135-L1138 PolarHBondContact O-N 2.95Å; L1138-Y1140 VanDerWaalsContact C-N 3.34Å; L1138-L1141 PolarHBondContact O-N 3.01Å; L1138-L1142 HydrophobicContact CD1-CD1 4.29Å; L1138-L1142 HydrophobicContact CD1-CG 4.36Å; L1138-L1142 HydrophobicContact CG-CD1 4.01Å; L1138-L1142 WeakPolarHBondContact O-CB 3.35Å; L1138-L1142 VanDerWaalsContact O-CG 3.25Å; L1138-L1142 WeakPolarHBondContact O-CG 3.4Å; L1138-L1142 PolarHBondContact O-N 3.01Å; L1138-W1185 HydrophobicContact CD1-CH2 4.31Å; L1138-W1185 HydrophobicContact CD1-CZ3 4.22Å
1139	C	91.1	Very high	86.1	Confident	1 Å²	1	26.7 Å²	26.7	1%	0.007	13%	0.126	C	C	.	.	H	α-helix	trans	-62.5	-39.8	173.7	-72.6	0	0	0	0	112.3	I1044 F1102 I1110 V1135 V1136 S1143	I1044-C1139 HydrophobicContact CG1-CB 4.1Å; F1102-C1139 HydrophobicContact CE1-CB 4.49Å; F1102-C1139 HydrophobicContact CZ-CB 4.19Å; I1110-C1139 HydrophobicContact CD1-CB 4.18Å; V1135-C1139 WeakPolarHBondContact O-CB 3.47Å; V1135-C1139 PolarHBondContact O-N 2.68Å; V1135-C1139 PolarHBondContact O-SG 2.94Å; V1136-C1139 PolarHBondContact O-N 2.92Å; C1139-S1143 WeakPolarHBondContact O-CB 3.33Å; C1139-S1143 PolarHBondContact O-N 2.93Å
1140	Y	91.8	Very high	86.7	Confident	0 Å²	0	22.3 Å²	22.3	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-60.5	-55.4	173.8	171.6	-110.7	0	0	0	111.3	V1069 Y1075 I1097 Y1099 F1102 V1136 A1137 L1138 L1142 S1143 L1144	V1069-Y1140 HydrophobicContact CG1-CD1 3.83Å; V1069-Y1140 HydrophobicContact CG1-CE1 3.82Å; V1069-Y1140 HydrophobicContact CG2-CD1 4.36Å; V1069-Y1140 HydrophobicContact CG2-CE1 4.2Å; Y1075-Y1140 HydrophobicContact CD1-CE1 4.19Å; Y1075-Y1140 HydrophobicContact CE1-CE1 4.3Å; I1097-Y1140 HydrophobicContact CG2-CE2 4.15Å; I1097-Y1140 PolarHBondContact O-OH 3.31Å; Y1099-Y1140 AromaticContact CD2-CD1 3.9Å; Y1099-Y1140 HydrophobicContact CD2-CD1 3.9Å; Y1099-Y1140 HydrophobicContact CD2-CD2 4.26Å; Y1099-Y1140 HydrophobicContact CD2-CE1 4.33Å; Y1099-Y1140 AromaticContact CD2-CG 3.84Å; Y1099-Y1140 HydrophobicContact CD2-CG 3.84Å; Y1099-Y1140 PolarHBondContact N-OH 3.3Å; F1102-Y1140 HydrophobicContact CB-CD2 3.64Å; F1102-Y1140 HydrophobicContact CB-CE2 4Å; F1102-Y1140 AromaticContact CD1-CD2 3.83Å; F1102-Y1140 HydrophobicContact CD1-CD2 3.83Å; F1102-Y1140 HydrophobicContact CD1-CG 4.28Å; F1102-Y1140 HydrophobicContact CD2-CD2 4.11Å; F1102-Y1140 AromaticContact CG-CD2 3.59Å; F1102-Y1140 HydrophobicContact CG-CD2 3.59Å; F1102-Y1140 HydrophobicContact CG-CE2 4.43Å; F1102-Y1140 HydrophobicContact CG-CG 4.45Å; V1136-Y1140 WeakPolarHBondContact O-CB 3.33Å; V1136-Y1140 PolarHBondContact O-N 2.91Å; A1137-Y1140 WeakPolarHBondContact O-CB 3.08Å; A1137-Y1140 PolarHBondContact O-N 3.11Å; L1138-Y1140 VanDerWaalsContact C-N 3.34Å; Y1140-L1142 PolarHBondContact O-N 3.16Å; Y1140-S1143 WeakPolarHBondContact O-CA 3.25Å; Y1140-S1143 WeakPolarHBondContact O-CB 3.44Å; Y1140-S1143 PolarHBondContact O-N 3.14Å; Y1140-S1143 PolarHBondContact O-OG 3.42Å; Y1140-L1144 HydrophobicContact CD1-CD1 4.13Å; Y1140-L1144 HydrophobicContact CE1-CD1 3.65Å; Y1140-L1144 HydrophobicContact CE2-CD1 4.13Å; Y1140-L1144 HydrophobicContact CE2-CD2 4.38Å; Y1140-L1144 HydrophobicContact CE2-CG 4.34Å; Y1140-L1144 PolarHBondContact O-N 3.04Å
1141	L	91.1	Very high	86.8	Confident	8 Å²	8	18.3 Å²	18.3	4%	0.042	9%	0.088	C	C	.	.	H	α-helix	trans	-57.5	-45.3	178.5	-72.5	170.6	0	0	0	112.5	V1065 L1066 V1069 A1137 L1138 S1143 L1144 F1145 W1185	V1065-L1141 HydrophobicContact CB-CD1 4.31Å; V1065-L1141 HydrophobicContact CG1-CD1 3.78Å; V1065-L1141 HydrophobicContact CG1-CD2 3.9Å; L1066-L1141 HydrophobicContact CD2-CD1 3.84Å; L1066-L1141 HydrophobicContact CG-CD1 4.32Å; V1069-L1141 HydrophobicContact CG2-CD2 3.94Å; V1069-L1141 HydrophobicContact CG2-CG 4.36Å; A1137-L1141 WeakPolarHBondContact O-CG 3.43Å; A1137-L1141 PolarHBondContact O-N 3.49Å; L1138-L1141 PolarHBondContact O-N 3.01Å; L1141-S1143 VanDerWaalsContact C-N 3.27Å; L1141-S1143 PolarHBondContact O-N 3.37Å; L1141-L1144 PolarHBondContact O-N 3.02Å; L1141-F1145 WeakPolarHBondContact O-CB 3.43Å; L1141-F1145 PolarHBondContact O-N 3.38Å; L1141-W1185 HydrophobicContact CB-CH2 4.28Å; L1141-W1185 HydrophobicContact CB-CZ2 3.9Å
1142	L	91.2	Very high	86.5	Confident	1 Å²	1	17.6 Å²	17.6	1%	0.005	9%	0.087	C	C	.	.	H	α-helix	trans	-63.2	-31.7	175.1	-72.5	170.5	0	0	0	112.5	I1043 A1047 L1138 Y1140 G1146 W1185 I1192	I1043-L1142 HydrophobicContact CG2-CB 3.67Å; A1047-L1142 HydrophobicContact CB-CD1 3.89Å; L1138-L1142 HydrophobicContact CD1-CD1 4.29Å; L1138-L1142 HydrophobicContact CD1-CG 4.36Å; L1138-L1142 HydrophobicContact CG-CD1 4.01Å; L1138-L1142 WeakPolarHBondContact O-CB 3.35Å; L1138-L1142 VanDerWaalsContact O-CG 3.25Å; L1138-L1142 WeakPolarHBondContact O-CG 3.4Å; L1138-L1142 PolarHBondContact O-N 3.01Å; Y1140-L1142 PolarHBondContact O-N 3.16Å; L1142-G1146 PolarHBondContact O-N 3.11Å; L1142-W1185 HydrophobicContact CD2-CH2 3.74Å; L1142-W1185 HydrophobicContact CD2-CZ3 4.38Å; L1142-W1185 HydrophobicContact CG-CH2 4.12Å; L1142-I1192 HydrophobicContact CD2-CG2 3.59Å
1143	S	91.2	Very high	85.7	Confident	0 Å²	0	14 Å²	14	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-72.1	-39.1	175.9	85.2	0	0	0	0	112.7	F1102 C1139 Y1140 L1141 G1146 R1147	F1102-S1143 WeakPolarHBondContact CE2-OG 3.37Å; C1139-S1143 WeakPolarHBondContact O-CB 3.33Å; C1139-S1143 PolarHBondContact O-N 2.93Å; Y1140-S1143 WeakPolarHBondContact O-CA 3.25Å; Y1140-S1143 WeakPolarHBondContact O-CB 3.44Å; Y1140-S1143 PolarHBondContact O-N 3.14Å; Y1140-S1143 PolarHBondContact O-OG 3.42Å; L1141-S1143 VanDerWaalsContact C-N 3.27Å; L1141-S1143 PolarHBondContact O-N 3.37Å; S1143-G1146 PolarHBondContact O-N 3.19Å; S1143-R1147 VanDerWaalsContact O-CG 3.28Å; S1143-R1147 WeakPolarHBondContact O-CG 3.39Å; S1143-R1147 PolarHBondContact O-N 3.28Å; S1143-R1147 VanDerWaalsContact O-N 3.09Å; S1143-R1147 PolarHBondContact O-NE 3.09Å
1144	L	90.4	Very high	84.8	Confident	0 Å²	0	8.4 Å²	8.4	0%	0	6%	0.057	C	C	.	.	H	α-helix	trans	-64.1	-47.7	174.6	-65	174.9	0	0	0	110.5	D1077 F1082 I1097 Y1140 L1141 G1146 R1147 R1148	D1077-L1144 HydrophobicContact CB-CD1 3.85Å; D1077-L1144 HydrophobicContact CB-CD2 4.17Å; F1082-L1144 HydrophobicContact CE2-CD2 3.92Å; F1082-L1144 HydrophobicContact CZ-CB 4.4Å; F1082-L1144 HydrophobicContact CZ-CD2 3.85Å; I1097-L1144 HydrophobicContact CB-CD2 3.87Å; I1097-L1144 HydrophobicContact CD1-CD2 3.96Å; I1097-L1144 HydrophobicContact CG1-CD2 4.48Å; I1097-L1144 HydrophobicContact CG2-CD2 4.03Å; Y1140-L1144 HydrophobicContact CD1-CD1 4.13Å; Y1140-L1144 HydrophobicContact CE1-CD1 3.65Å; Y1140-L1144 HydrophobicContact CE2-CD1 4.13Å; Y1140-L1144 HydrophobicContact CE2-CD2 4.38Å; Y1140-L1144 HydrophobicContact CE2-CG 4.34Å; Y1140-L1144 PolarHBondContact O-N 3.04Å; L1141-L1144 PolarHBondContact O-N 3.02Å; L1144-G1146 PolarHBondContact O-N 3.38Å; L1144-R1147 PolarHBondContact O-N 2.98Å; L1144-R1148 PolarHBondContact O-N 3.41Å
1145	F	90.8	Very high	83.6	Confident	0 Å²	0	14.1 Å²	14.1	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-58	-47.7	175.2	173.9	-124.4	0	0	0	112.3	L1141 R1147 R1148 L1149 I1178 D1183 V1186 L1193 V1197	L1141-F1145 WeakPolarHBondContact O-CB 3.43Å; L1141-F1145 PolarHBondContact O-N 3.38Å; F1145-R1147 VanDerWaalsContact C-N 3.33Å; F1145-R1147 PolarHBondContact O-N 3.33Å; F1145-R1148 PolarHBondContact O-N 2.89Å; F1145-L1149 HydrophobicContact CD1-CD1 4.25Å; F1145-L1149 HydrophobicContact CD2-CD1 4.36Å; F1145-L1149 HydrophobicContact CD2-CG 4.32Å; F1145-L1149 HydrophobicContact CE1-CD1 3.69Å; F1145-L1149 HydrophobicContact CE2-CD1 3.85Å; F1145-L1149 HydrophobicContact CE2-CD2 4.33Å; F1145-L1149 HydrophobicContact CE2-CG 3.88Å; F1145-L1149 HydrophobicContact CZ-CD1 3.48Å; F1145-L1149 VanDerWaalsContact CZ-CD1 3.48Å; F1145-L1149 HydrophobicContact CZ-CD2 4.44Å; F1145-L1149 HydrophobicContact CZ-CG 4.03Å; F1145-L1149 PolarHBondContact O-N 3.46Å; F1145-I1178 HydrophobicContact CE2-CD1 3.78Å; F1145-I1178 HydrophobicContact CE2-CG1 3.89Å; F1145-I1178 HydrophobicContact CE2-CG2 4.42Å; F1145-I1178 HydrophobicContact CZ-CD1 3.69Å; F1145-I1178 HydrophobicContact CZ-CG1 4.11Å; F1145-D1183 HydrophobicContact CD2-CB 3.55Å; F1145-D1183 HydrophobicContact CE2-CB 3.84Å; F1145-V1186 HydrophobicContact CD1-CG2 3.93Å; F1145-V1186 HydrophobicContact CD2-CG2 4.39Å; F1145-V1186 HydrophobicContact CE1-CB 4.31Å; F1145-V1186 HydrophobicContact CE1-CG1 3.81Å; F1145-V1186 HydrophobicContact CE1-CG2 3.81Å; F1145-V1186 HydrophobicContact CE2-CG2 4.26Å; F1145-V1186 HydrophobicContact CG-CG2 4.21Å; F1145-V1186 HydrophobicContact CZ-CB 4.22Å; F1145-V1186 HydrophobicContact CZ-CG1 3.96Å; F1145-V1186 HydrophobicContact CZ-CG2 3.97Å; F1145-L1193 HydrophobicContact CE1-CD2 3.69Å; F1145-L1193 HydrophobicContact CZ-CD2 3.69Å; F1145-V1197 HydrophobicContact CD1-CG2 4.37Å; F1145-V1197 HydrophobicContact CE1-CG2 4.06Å
1146	G	88.6	Confident	82	Confident	0 Å²	0	16.7 Å²	16.7	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-59	-41.3	178	0	0	0	0	0	113	Y1039 L1142 S1143 L1144 L1150	Y1039-G1146 VanDerWaalsContact CE1-O 3.28Å; Y1039-G1146 WeakPolarHBondContact CE1-O 3.27Å; Y1039-G1146 WeakPolarHBondContact OH-CA 3.48Å; Y1039-G1146 PolarHBondContact OH-O 3.39Å; L1142-G1146 PolarHBondContact O-N 3.11Å; S1143-G1146 PolarHBondContact O-N 3.19Å; L1144-G1146 PolarHBondContact O-N 3.38Å; G1146-L1150 PolarHBondContact O-N 2.96Å
1147	R	88.3	Confident	80.1	Confident	11 Å²	11	24 Å²	24	4%	0.042	14%	0.135	C	C	.	.	H	α-helix	trans	-68.4	-44.9	175.7	-69.8	172.4	-142.8	-139.2	19.1	112.4	I1036 F1082 D1087 D1089 S1143 L1144 F1145 L1149 L1150 G1151	I1036-R1147 HydrophobicContact CG2-CG 4.37Å; F1082-R1147 HydrophobicContact CD1-CB 4.11Å; F1082-R1147 HydrophobicContact CE1-CB 3.68Å; D1087-R1147 WeakPolarHBondContact OD1-CD 3.19Å; D1087-R1147 IonicContact OD1-CZ 3.71Å; D1087-R1147 IonicContact OD1-NE 3.78Å; D1087-R1147 IonicContact OD1-NH1 3.18Å; D1087-R1147 PolarHBondContact OD1-NH1 3.38Å; D1089-R1147 VanDerWaalsContact CG-NH2 3.28Å; D1089-R1147 IonicContact OD1-CZ 2.63Å; D1089-R1147 VanDerWaalsContact OD1-CZ 3.3Å; D1089-R1147 IonicContact OD1-NH1 2.68Å; D1089-R1147 PolarHBondContact OD1-NH1 3.04Å; D1089-R1147 IonicContact OD1-NH2 2.73Å; D1089-R1147 PolarHBondContact OD1-NH2 2.84Å; D1089-R1147 IonicContact OD2-CZ 3.93Å; D1089-R1147 IonicContact OD2-NH1 3.55Å; D1089-R1147 IonicContact OD2-NH2 2.7Å; D1089-R1147 PolarHBondContact OD2-NH2 3.39Å; S1143-R1147 VanDerWaalsContact O-CG 3.28Å; S1143-R1147 WeakPolarHBondContact O-CG 3.39Å; S1143-R1147 PolarHBondContact O-N 3.28Å; S1143-R1147 VanDerWaalsContact O-N 3.09Å; S1143-R1147 PolarHBondContact O-NE 3.09Å; L1144-R1147 PolarHBondContact O-N 2.98Å; F1145-R1147 VanDerWaalsContact C-N 3.33Å; F1145-R1147 PolarHBondContact O-N 3.33Å; R1147-L1149 VanDerWaalsContact C-N 3.33Å; R1147-L1149 PolarHBondContact O-N 3.18Å; R1147-L1150 PolarHBondContact O-N 3.48Å; R1147-L1150 VanDerWaalsContact O-N 3.1Å; R1147-G1151 PolarHBondContact O-N 2.83Å
1148	R	87.1	Confident	78.3	Confident	11 Å²	11	27 Å²	27	4%	0.042	15%	0.153	C	C	.	.	H	α-helix	trans	-57.3	-44.5	175.3	-89.5	-166.6	-76.6	-88.3	5.9	112	D1077 D1079 F1082 L1144 F1145 L1150 G1151 A1152 D1183	D1077-R1148 VanDerWaalsContact CG-NH1 3.32Å; D1077-R1148 IonicContact OD1-NH1 3.34Å; D1077-R1148 IonicContact OD2-CZ 2.74Å; D1077-R1148 IonicContact OD2-NH1 3.83Å; D1077-R1148 PolarHBondContact OD2-NH1 3.23Å; D1077-R1148 IonicContact OD2-NH2 3.24Å; D1077-R1148 PolarHBondContact OD2-NH2 3.34Å; D1077-R1148 VanDerWaalsContact OD2-NH2 3.15Å; D1079-R1148 VanDerWaalsContact OD2-CD 3.28Å; D1079-R1148 WeakPolarHBondContact OD2-CD 3.24Å; F1082-R1148 HydrophobicContact CE1-CG 4.2Å; F1082-R1148 HydrophobicContact CZ-CG 4.19Å; L1144-R1148 PolarHBondContact O-N 3.41Å; F1145-R1148 PolarHBondContact O-N 2.89Å; R1148-L1150 VanDerWaalsContact C-N 3.33Å; R1148-L1150 PolarHBondContact O-N 3.37Å; R1148-G1151 PolarHBondContact O-N 3.34Å; R1148-A1152 WeakPolarHBondContact O-CB 3.32Å; R1148-A1152 PolarHBondContact O-N 3.49Å; R1148-D1183 WeakPolarHBondContact CD-OD2 3.25Å; R1148-D1183 IonicContact CZ-OD1 2.7Å; R1148-D1183 IonicContact CZ-OD2 3.62Å; R1148-D1183 IonicContact NE-OD1 3.93Å; R1148-D1183 PolarHBondContact NE-OD1 2.99Å; R1148-D1183 IonicContact NE-OD2 3.49Å; R1148-D1183 PolarHBondContact NE-OD2 2.93Å; R1148-D1183 IonicContact NH2-OD1 2.75Å; R1148-D1183 PolarHBondContact NH2-OD1 2.84Å; R1148-D1183 IonicContact NH2-OD2 3.84Å
1149	L	85.7	Confident	76.7	Confident	5 Å²	5	32.4 Å²	32.4	3%	0.026	19%	0.187	C	C	.	.	H	α-helix	trans	-55.1	-46.4	173.4	-82.1	173	0	0	0	112.1	F1145 R1147 A1153 L1171 F1176 I1178 V1197	F1145-L1149 HydrophobicContact CD1-CD1 4.25Å; F1145-L1149 HydrophobicContact CD2-CD1 4.36Å; F1145-L1149 HydrophobicContact CD2-CG 4.32Å; F1145-L1149 HydrophobicContact CE1-CD1 3.69Å; F1145-L1149 HydrophobicContact CE2-CD1 3.85Å; F1145-L1149 HydrophobicContact CE2-CD2 4.33Å; F1145-L1149 HydrophobicContact CE2-CG 3.88Å; F1145-L1149 HydrophobicContact CZ-CD1 3.48Å; F1145-L1149 VanDerWaalsContact CZ-CD1 3.48Å; F1145-L1149 HydrophobicContact CZ-CD2 4.44Å; F1145-L1149 HydrophobicContact CZ-CG 4.03Å; F1145-L1149 PolarHBondContact O-N 3.46Å; R1147-L1149 VanDerWaalsContact C-N 3.33Å; R1147-L1149 PolarHBondContact O-N 3.18Å; L1149-A1153 VanDerWaalsContact O-CB 3.28Å; L1149-A1153 WeakPolarHBondContact O-CB 3.41Å; L1149-A1153 PolarHBondContact O-N 3.26Å; L1149-A1153 VanDerWaalsContact O-N 3.13Å; L1149-L1171 HydrophobicContact CB-CD1 4.3Å; L1149-L1171 HydrophobicContact CB-CD2 4.07Å; L1149-L1171 HydrophobicContact CD2-CD2 4.29Å; L1149-F1176 HydrophobicContact CD1-CD1 3.83Å; L1149-F1176 HydrophobicContact CD1-CE1 4.31Å; L1149-F1176 HydrophobicContact CD2-CB 4.2Å; L1149-F1176 HydrophobicContact CD2-CD1 4.19Å; L1149-I1178 HydrophobicContact CD2-CG1 4.16Å; L1149-V1197 HydrophobicContact CD1-CG1 3.93Å
1150	L	82.5	Confident	75.4	Confident	10 Å²	10	36.4 Å²	36.4	5%	0.052	21%	0.208	C	C	.	.	H	α-helix	trans	-67.6	-44.2	-179.8	-172.9	64.1	0	0	0	112.2	I1036 Y1039 G1146 R1147 R1148 A1153 A1154 F1164 L1168 L1171	I1036-L1150 HydrophobicContact CD1-CD2 4.35Å; I1036-L1150 HydrophobicContact CG1-CD2 3.82Å; Y1039-L1150 HydrophobicContact CD1-CD2 4.4Å; Y1039-L1150 HydrophobicContact CE1-CB 4.46Å; G1146-L1150 PolarHBondContact O-N 2.96Å; R1147-L1150 PolarHBondContact O-N 3.48Å; R1147-L1150 VanDerWaalsContact O-N 3.1Å; R1148-L1150 VanDerWaalsContact C-N 3.33Å; R1148-L1150 PolarHBondContact O-N 3.37Å; L1150-A1153 PolarHBondContact O-N 3.37Å; L1150-A1154 VanDerWaalsContact O-CB 3.26Å; L1150-A1154 WeakPolarHBondContact O-CB 3.27Å; L1150-A1154 PolarHBondContact O-N 2.86Å; L1150-F1164 HydrophobicContact CD1-CE2 4.18Å; L1150-F1164 HydrophobicContact CD1-CZ 4.45Å; L1150-F1164 HydrophobicContact CD2-CE2 4.24Å; L1150-F1164 HydrophobicContact CD2-CZ 4.47Å; L1150-F1164 HydrophobicContact CG-CE2 4.2Å; L1150-L1168 HydrophobicContact CD1-CD1 4.13Å; L1150-L1171 HydrophobicContact CB-CD1 4.13Å; L1150-L1171 HydrophobicContact CD1-CD1 3.92Å
1151	G	76.9	Confident	74.3	Confident	15 Å²	15	37 Å²	37	16%	0.155	21%	0.213	C	C	.	.	H	α-helix	trans	-68.8	-38.6	178.9	0	0	0	0	0	113.9	R1147 R1148 A1153 A1154 Q1155	R1147-G1151 PolarHBondContact O-N 2.83Å; R1148-G1151 PolarHBondContact O-N 3.34Å; G1151-A1153 VanDerWaalsContact C-N 3.33Å; G1151-A1154 PolarHBondContact O-N 3.2Å; G1151-Q1155 PolarHBondContact O-N 3.1Å
1152	A	70.4	Confident	73.4	Confident	38 Å²	38	41.3 Å²	41.3	31%	0.314	23%	0.233	S	C	.	.	H	α-helix	trans	-65.5	-36.7	174.4	0	0	0	0	0	111.9	R1148 T1179	R1148-A1152 WeakPolarHBondContact O-CB 3.32Å; R1148-A1152 PolarHBondContact O-N 3.49Å; A1152-T1179 HydrophobicContact CB-CG2 4.29Å
1153	A	61.5	Low	72.6	Confident	23 Å²	23	42.6 Å²	42.6	19%	0.19	24%	0.242	C	C	.	.	H	α-helix	trans	-74.1	-32.4	177.2	0	0	0	0	0	113	L1149 L1150 G1151 G1167 L1171	L1149-A1153 VanDerWaalsContact O-CB 3.28Å; L1149-A1153 WeakPolarHBondContact O-CB 3.41Å; L1149-A1153 PolarHBondContact O-N 3.26Å; L1149-A1153 VanDerWaalsContact O-N 3.13Å; L1150-A1153 PolarHBondContact O-N 3.37Å; G1151-A1153 VanDerWaalsContact C-N 3.33Å; A1153-G1167 VanDerWaalsContact CB-CA 3.49Å; A1153-G1167 VanDerWaalsContact O-CA 3.29Å; A1153-G1167 WeakPolarHBondContact O-CA 3.46Å; A1153-L1171 HydrophobicContact CB-CD1 4.38Å; A1153-L1171 HydrophobicContact CB-CG 4.35Å
1154	A	62.7	Low	72	Confident	14 Å²	14	43.3 Å²	43.3	12%	0.116	25%	0.245	C	C	.	.	H	α-helix	trans	-84.5	-7.4	-173.9	0	0	0	0	0	116.1	L1150 G1151 F1164	L1150-A1154 VanDerWaalsContact O-CB 3.26Å; L1150-A1154 WeakPolarHBondContact O-CB 3.27Å; L1150-A1154 PolarHBondContact O-N 2.86Å; G1151-A1154 PolarHBondContact O-N 3.2Å; A1154-F1164 HydrophobicContact CB-CB 4.46Å; A1154-F1164 HydrophobicContact CB-CD2 3.85Å
1155	Q	60.8	Low	71.6	Confident	142 Å²	142	43.3 Å²	43.3	66%	0.664	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.3	82.7	-169	-59.1	-172.7	16.2	0	0	112.9	G1151 H1157 T1158	G1151-Q1155 PolarHBondContact O-N 3.1Å; Q1155-H1157 PolarHBondContact O-N 3.33Å; Q1155-T1158 PolarHBondContact O-N 3.03Å; Q1155-T1158 PolarHBondContact O-OG1 3.05Å
1156	S	51.8	Low	71.1	Confident	61 Å²	61	49.4 Å²	49.4	43%	0.427	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-32.8	-9.7	-173.6	57.5	0	0	0	0	121.5
1157	H	49.3	Very low	70.6	Confident	160 Å²	160	49.4 Å²	49.4	74%	0.741	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-129.4	13	-172	-56	-45.9	0	0	0	114.8	Q1155	Q1155-H1157 PolarHBondContact O-N 3.33Å
1158	T	51.3	Low	70.5	Confident	63 Å²	63	49.1 Å²	49.1	39%	0.387	27%	0.269	S	S	.	.			trans	-108.5	130.5	175.6	57.8	0	0	0	0	112.2	Q1155 N1160 S1163	Q1155-T1158 PolarHBondContact O-N 3.03Å; Q1155-T1158 PolarHBondContact O-OG1 3.05Å; T1158-N1160 VanDerWaalsContact C-N 3.28Å; T1158-S1163 WeakPolarHBondContact OG1-CB 3.41Å; T1158-S1163 PolarHBondContact OG1-OG 3.22Å
1159	T	55.7	Low	70.4	Confident	118 Å²	118	49.6 Å²	49.6	72%	0.724	27%	0.271	S	S	*	.			trans	-81.6	-4.4	176.9	45.5	0	0	0	0	113.5
1160	N	64.1	Low	70.3	Confident	84 Å²	84	50.2 Å²	50.2	45%	0.449	28%	0.277	S	S	.	.			trans	-61.3	150.3	175.9	-71.7	35.3	0	0	0	111.3	R1032 T1158 E1162	R1032-N1160 PolarHBondContact NH2-O 3.23Å; T1158-N1160 VanDerWaalsContact C-N 3.28Å; N1160-E1162 PolarHBondContact ND2-OE2 3.19Å
1161	A	68.5	Low	70.5	Confident	13 Å²	13	49.8 Å²	49.8	11%	0.107	28%	0.275	C	S	.	.	H	α-helix	trans	-77.7	-33.1	169.7	0	0	0	0	0	111.6	F1164 L1165	A1161-F1164 PolarHBondContact O-N 3.05Å; A1161-L1165 HydrophobicContact CB-CD1 4.35Å; A1161-L1165 WeakPolarHBondContact O-CB 3.46Å; A1161-L1165 WeakPolarHBondContact O-CG 3.41Å; A1161-L1165 PolarHBondContact O-N 3.26Å
1162	E	73	Confident	71	Confident	98 Å²	98	49.1 Å²	49.1	46%	0.458	27%	0.268	S	S	.	.	H	α-helix	trans	-61.5	-46.2	-174.1	-59.5	139.3	171.4	0	0	112.9	N1160 L1165 Y1166	N1160-E1162 PolarHBondContact ND2-OE2 3.19Å; E1162-L1165 PolarHBondContact O-N 3.43Å; E1162-Y1166 WeakPolarHBondContact O-CB 3.38Å; E1162-Y1166 PolarHBondContact O-N 3.39Å
1163	S	73.3	Confident	71.5	Confident	28 Å²	28	50.7 Å²	50.7	20%	0.196	27%	0.268	C	S	.	.	H	α-helix	trans	-65.4	-41.2	178.5	44.8	0	0	0	0	112.5	T1158 G1167	T1158-S1163 WeakPolarHBondContact OG1-CB 3.41Å; T1158-S1163 PolarHBondContact OG1-OG 3.22Å; S1163-G1167 PolarHBondContact O-N 3.36Å; S1163-G1167 VanDerWaalsContact O-N 3.12Å
1164	F	78.9	Confident	72.4	Confident	15 Å²	15	51 Å²	51	7%	0.066	27%	0.272	C	S	.	.	H	α-helix	trans	-63.5	-43.8	172.6	178.9	-99.2	0	0	0	112	L1035 L1150 A1154 A1161 G1167 L1168	L1035-F1164 HydrophobicContact CD2-CE1 4.02Å; L1035-F1164 HydrophobicContact CD2-CZ 3.94Å; L1150-F1164 HydrophobicContact CD1-CE2 4.18Å; L1150-F1164 HydrophobicContact CD1-CZ 4.45Å; L1150-F1164 HydrophobicContact CD2-CE2 4.24Å; L1150-F1164 HydrophobicContact CD2-CZ 4.47Å; L1150-F1164 HydrophobicContact CG-CE2 4.2Å; A1154-F1164 HydrophobicContact CB-CB 4.46Å; A1154-F1164 HydrophobicContact CB-CD2 3.85Å; A1161-F1164 PolarHBondContact O-N 3.05Å; F1164-G1167 PolarHBondContact O-N 2.78Å; F1164-L1168 HydrophobicContact CE1-CD2 4.27Å; F1164-L1168 WeakPolarHBondContact O-CB 3.35Å; F1164-L1168 PolarHBondContact O-N 3.44Å
1165	L	81.6	Confident	73.2	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-65.5	-39.4	177.9	-81.2	164.5	0	0	0	112.7	A1019 I1020 F1023 A1161 E1162 G1167 L1168 H1169 F1270	A1019-L1165 HydrophobicContact CB-CD1 4.44Å; A1019-L1165 HydrophobicContact CB-CD2 3.59Å; I1020-L1165 HydrophobicContact CB-CD1 4.39Å; I1020-L1165 HydrophobicContact CG1-CD1 3.6Å; F1023-L1165 HydrophobicContact CD2-CD2 3.8Å; F1023-L1165 HydrophobicContact CD2-CG 4.28Å; F1023-L1165 HydrophobicContact CE2-CD2 3.75Å; A1161-L1165 HydrophobicContact CB-CD1 4.35Å; A1161-L1165 WeakPolarHBondContact O-CB 3.46Å; A1161-L1165 WeakPolarHBondContact O-CG 3.41Å; A1161-L1165 PolarHBondContact O-N 3.26Å; E1162-L1165 PolarHBondContact O-N 3.43Å; L1165-G1167 VanDerWaalsContact C-N 3.34Å; L1165-G1167 PolarHBondContact O-N 3.16Å; L1165-L1168 PolarHBondContact O-N 2.94Å; L1165-H1169 VanDerWaalsContact O-CB 3.22Å; L1165-H1169 WeakPolarHBondContact O-CB 3.38Å; L1165-H1169 PolarHBondContact O-N 2.99Å; L1165-F1270 HydrophobicContact CB-CB 4.38Å; L1165-F1270 HydrophobicContact CB-CD1 4.15Å; L1165-F1270 HydrophobicContact CB-CD2 3.65Å; L1165-F1270 HydrophobicContact CB-CE1 4.34Å; L1165-F1270 HydrophobicContact CB-CE2 3.86Å; L1165-F1270 HydrophobicContact CB-CG 3.8Å; L1165-F1270 HydrophobicContact CB-CZ 4.21Å; L1165-F1270 HydrophobicContact CD1-CB 4.18Å; L1165-F1270 HydrophobicContact CD1-CD2 4.07Å; L1165-F1270 HydrophobicContact CD1-CG 4.32Å; L1165-F1270 HydrophobicContact CD2-CB 4.19Å; L1165-F1270 HydrophobicContact CD2-CG 4.45Å; L1165-F1270 HydrophobicContact CG-CB 4.5Å; L1165-F1270 HydrophobicContact CG-CD2 4.41Å; L1165-F1270 HydrophobicContact CG-CG 4.43Å
1166	Y	80.4	Confident	74.3	Confident	128 Å²	128	49.2 Å²	49.2	50%	0.502	26%	0.264	S	S	.	.	H	α-helix	trans	-60.1	-44.7	173.3	-170.1	-85.5	0	0	0	111.2	E1162 H1169 A1170 F1270	E1162-Y1166 WeakPolarHBondContact O-CB 3.38Å; E1162-Y1166 PolarHBondContact O-N 3.39Å; Y1166-H1169 PolarHBondContact O-N 3.33Å; Y1166-A1170 PolarHBondContact O-N 3.31Å; Y1166-F1270 HydrophobicContact CD2-CZ 4.23Å
1167	G	79.8	Confident	75.6	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-64	-45.2	175.6	0	0	0	0	0	113.5	A1153 S1163 F1164 L1165 H1169 A1170 L1171	A1153-G1167 VanDerWaalsContact CB-CA 3.49Å; A1153-G1167 VanDerWaalsContact O-CA 3.29Å; A1153-G1167 WeakPolarHBondContact O-CA 3.46Å; S1163-G1167 PolarHBondContact O-N 3.36Å; S1163-G1167 VanDerWaalsContact O-N 3.12Å; F1164-G1167 PolarHBondContact O-N 2.78Å; L1165-G1167 VanDerWaalsContact C-N 3.34Å; L1165-G1167 PolarHBondContact O-N 3.16Å; G1167-H1169 VanDerWaalsContact C-N 3.34Å; G1167-H1169 PolarHBondContact O-N 3.19Å; G1167-A1170 PolarHBondContact O-N 2.87Å; G1167-L1171 PolarHBondContact O-N 3.17Å
1168	L	86	Confident	77.2	Confident	6 Å²	6	48.7 Å²	48.7	3%	0.031	25%	0.248	C	C	.	.	H	α-helix	trans	-62.3	-39.9	176	-177.2	62.8	0	0	0	111.9	F1023 L1035 L1150 F1164 L1165 L1171 F1172 V1201 L1205 L1259	F1023-L1168 HydrophobicContact CE2-CD2 4.36Å; F1023-L1168 HydrophobicContact CZ-CD2 4.38Å; L1035-L1168 HydrophobicContact CD2-CD2 4.15Å; L1150-L1168 HydrophobicContact CD1-CD1 4.13Å; F1164-L1168 HydrophobicContact CE1-CD2 4.27Å; F1164-L1168 WeakPolarHBondContact O-CB 3.35Å; F1164-L1168 PolarHBondContact O-N 3.44Å; L1165-L1168 PolarHBondContact O-N 2.94Å; L1168-L1171 PolarHBondContact O-N 2.76Å; L1168-F1172 WeakPolarHBondContact O-CB 3.37Å; L1168-F1172 PolarHBondContact O-N 3.2Å; L1168-V1201 HydrophobicContact CD1-CG1 3.89Å; L1168-L1205 HydrophobicContact CD2-CD1 4.32Å; L1168-L1259 HydrophobicContact CG-CD2 4.47Å
1169	H	84.8	Confident	78.5	Confident	21 Å²	21	50.8 Å²	50.8	10%	0.097	26%	0.261	C	S	.	.	H	α-helix	trans	-65	-42.1	176.7	179.5	-116.4	0	0	0	112.3	L1165 Y1166 G1167 L1171 F1172 K1173 H1239 L1259 H1261 F1270	L1165-H1169 VanDerWaalsContact O-CB 3.22Å; L1165-H1169 WeakPolarHBondContact O-CB 3.38Å; L1165-H1169 PolarHBondContact O-N 2.99Å; Y1166-H1169 PolarHBondContact O-N 3.33Å; G1167-H1169 VanDerWaalsContact C-N 3.34Å; G1167-H1169 PolarHBondContact O-N 3.19Å; H1169-L1171 PolarHBondContact O-N 3.11Å; H1169-F1172 PolarHBondContact O-N 2.97Å; H1169-K1173 WeakPolarHBondContact O-CB 3.45Å; H1169-K1173 PolarHBondContact O-N 3.42Å; H1169-H1239 AromaticContact NE2-CD2 3.71Å; H1169-H1239 AromaticContact NE2-NE2 3.6Å; H1169-L1259 HydrophobicContact CB-CD2 4.03Å; H1169-H1261 VanDerWaalsContact CE1-CB 3.43Å; H1169-H1261 WeakPolarHBondContact CE1-CB 3.48Å; H1169-F1270 HydrophobicContact CB-CD1 4.22Å; H1169-F1270 HydrophobicContact CB-CE1 3.85Å
1170	A	82.6	Confident	79.8	Confident	17 Å²	17	46.4 Å²	46.4	14%	0.14	24%	0.235	C	C	.	.	H	α-helix	trans	-58	-46.4	173.6	0	0	0	0	0	111.7	Y1166 G1167 K1173 G1174 D1175	Y1166-A1170 PolarHBondContact O-N 3.31Å; G1167-A1170 PolarHBondContact O-N 2.87Å; A1170-K1173 PolarHBondContact O-N 3.02Å; A1170-G1174 PolarHBondContact O-N 2.76Å; A1170-D1175 HydrophobicContact CB-CB 4.26Å; A1170-D1175 PolarHBondContact O-N 3.17Å
1171	L	86.1	Confident	80.6	Confident	2 Å²	2	46.4 Å²	46.4	1%	0.01	24%	0.242	C	C	.	.	H	α-helix	trans	-68.5	-38.2	177.4	-65.6	177.1	0	0	0	113.3	L1149 L1150 A1153 G1167 L1168 H1169 K1173 G1174 F1176 V1201	L1149-L1171 HydrophobicContact CB-CD1 4.3Å; L1149-L1171 HydrophobicContact CB-CD2 4.07Å; L1149-L1171 HydrophobicContact CD2-CD2 4.29Å; L1150-L1171 HydrophobicContact CB-CD1 4.13Å; L1150-L1171 HydrophobicContact CD1-CD1 3.92Å; A1153-L1171 HydrophobicContact CB-CD1 4.38Å; A1153-L1171 HydrophobicContact CB-CG 4.35Å; G1167-L1171 PolarHBondContact O-N 3.17Å; L1168-L1171 PolarHBondContact O-N 2.76Å; H1169-L1171 PolarHBondContact O-N 3.11Å; L1171-K1173 VanDerWaalsContact C-N 3.3Å; L1171-K1173 PolarHBondContact O-N 2.92Å; L1171-G1174 PolarHBondContact O-N 3.12Å; L1171-G1174 VanDerWaalsContact O-N 3.09Å; L1171-F1176 HydrophobicContact CD2-CD1 3.7Å; L1171-F1176 HydrophobicContact CD2-CE1 4.11Å; L1171-V1201 HydrophobicContact CB-CG1 4.37Å; L1171-V1201 HydrophobicContact CB-CG2 4.31Å
1172	F	87.5	Confident	81.3	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-61.6	-39	175.6	-174.2	-87.9	0	0	0	112	L1168 H1169 V1201 R1202 L1205 I1237 S1238 H1239 L1257 L1259	L1168-F1172 WeakPolarHBondContact O-CB 3.37Å; L1168-F1172 PolarHBondContact O-N 3.2Å; H1169-F1172 PolarHBondContact O-N 2.97Å; F1172-V1201 HydrophobicContact CB-CG1 4.44Å; F1172-R1202 HydrophobicContact CD2-CB 4.46Å; F1172-R1202 HydrophobicContact CD2-CG 3.74Å; F1172-R1202 HydrophobicContact CE2-CB 4.17Å; F1172-R1202 HydrophobicContact CE2-CG 3.66Å; F1172-R1202 HydrophobicContact CG-CG 4.37Å; F1172-R1202 HydrophobicContact CZ-CG 4.22Å; F1172-R1202 PolarHBondContact O-NE 2.94Å; F1172-R1202 PolarHBondContact O-NH2 3Å; F1172-L1205 HydrophobicContact CD2-CD2 3.91Å; F1172-L1205 HydrophobicContact CE2-CD2 3.87Å; F1172-I1237 HydrophobicContact CE2-CG2 3.79Å; F1172-I1237 HydrophobicContact CZ-CG2 3.76Å; F1172-S1238 VanDerWaalsContact CE1-C 3.48Å; F1172-S1238 WeakPolarHBondContact CE1-O 3.24Å; F1172-H1239 HydrophobicContact CD1-CB 4.22Å; F1172-H1239 HydrophobicContact CE1-CB 4.29Å; F1172-L1257 HydrophobicContact CE2-CD2 4.24Å; F1172-L1257 HydrophobicContact CZ-CD2 4.17Å; F1172-L1259 HydrophobicContact CB-CD2 4.45Å; F1172-L1259 HydrophobicContact CD1-CB 3.9Å; F1172-L1259 HydrophobicContact CD2-CB 4.36Å; F1172-L1259 HydrophobicContact CE1-CB 3.98Å; F1172-L1259 VanDerWaalsContact CE1-N 3.32Å; F1172-L1259 HydrophobicContact CE2-CB 4.42Å; F1172-L1259 HydrophobicContact CG-CB 4.12Å; F1172-L1259 HydrophobicContact CZ-CB 4.26Å
1173	K	81.8	Confident	81.9	Confident	72 Å²	72	47.9 Å²	47.9	31%	0.313	24%	0.24	S	C	.	.	H	α-helix	trans	-68.8	-29.1	172.6	178.4	170.5	171.2	-80.2	0	113.1	H1169 A1170 L1171 D1175 H1239	H1169-K1173 WeakPolarHBondContact O-CB 3.45Å; H1169-K1173 PolarHBondContact O-N 3.42Å; A1170-K1173 PolarHBondContact O-N 3.02Å; L1171-K1173 VanDerWaalsContact C-N 3.3Å; L1171-K1173 PolarHBondContact O-N 2.92Å; K1173-D1175 IonicContact NZ-OD1 3.4Å; K1173-D1175 PolarHBondContact NZ-OD1 3.44Å; K1173-D1175 IonicContact NZ-OD2 3.74Å; K1173-D1175 PolarHBondContact NZ-OD2 3.48Å; K1173-H1239 HydrophobicContact CB-CB 4.41Å
1174	G	79.9	Confident	82.4	Confident	28 Å²	28	51.9 Å²	51.9	29%	0.289	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	101.3	15.3	-178.6	0	0	0	0	0	114.5	A1170 L1171 F1176	A1170-G1174 PolarHBondContact O-N 2.76Å; L1171-G1174 PolarHBondContact O-N 3.12Å; L1171-G1174 VanDerWaalsContact O-N 3.09Å; G1174-F1176 WeakPolarHBondContact O-CD2 3.27Å; G1174-F1176 PolarHBondContact O-N 2.86Å
1175	D	79.9	Confident	82.8	Confident	74 Å²	74	52 Å²	52	40%	0.396	26%	0.256	S	S	.	.			trans	-80.3	67.4	177.4	-64.9	-9.9	0	0	0	110.7	A1170 K1173 R1177	A1170-D1175 HydrophobicContact CB-CB 4.26Å; A1170-D1175 PolarHBondContact O-N 3.17Å; K1173-D1175 IonicContact NZ-OD1 3.4Å; K1173-D1175 PolarHBondContact NZ-OD1 3.44Å; K1173-D1175 IonicContact NZ-OD2 3.74Å; K1173-D1175 PolarHBondContact NZ-OD2 3.48Å; D1175-R1177 PolarHBondContact O-N 2.95Å
1176	F	84	Confident	82.9	Confident	46 Å²	46	52 Å²	52	20%	0.202	26%	0.256	C	S	.	.			trans	-67.5	122.8	-178.3	-59	-70.2	0	0	0	112.2	L1149 L1171 G1174 L1193 V1197 A1198	L1149-F1176 HydrophobicContact CD1-CD1 3.83Å; L1149-F1176 HydrophobicContact CD1-CE1 4.31Å; L1149-F1176 HydrophobicContact CD2-CB 4.2Å; L1149-F1176 HydrophobicContact CD2-CD1 4.19Å; L1171-F1176 HydrophobicContact CD2-CD1 3.7Å; L1171-F1176 HydrophobicContact CD2-CE1 4.11Å; G1174-F1176 WeakPolarHBondContact O-CD2 3.27Å; G1174-F1176 PolarHBondContact O-N 2.86Å; F1176-L1193 HydrophobicContact CD1-CD2 4.48Å; F1176-L1193 HydrophobicContact CD2-CB 4.02Å; F1176-L1193 HydrophobicContact CD2-CD1 4.1Å; F1176-L1193 HydrophobicContact CD2-CD2 4.28Å; F1176-L1193 HydrophobicContact CD2-CG 4.37Å; F1176-L1193 HydrophobicContact CE2-CB 3.78Å; F1176-L1193 HydrophobicContact CG-CD2 4.24Å; F1176-L1193 HydrophobicContact CZ-CB 4.35Å; F1176-V1197 HydrophobicContact CE1-CB 4.17Å; F1176-V1197 HydrophobicContact CE1-CG1 3.68Å; F1176-V1197 HydrophobicContact CZ-CB 4.28Å; F1176-V1197 HydrophobicContact CZ-CG1 4.26Å; F1176-A1198 HydrophobicContact CZ-CB 3.94Å
1177	R	79.2	Confident	83.2	Confident	169 Å²	169	51.5 Å²	51.5	64%	0.638	26%	0.257	S	S	*	.			trans	-110.8	94.5	173.5	-66.5	-174.3	-179.7	-162.6	-1.2	109.9	D1175 T1179	D1175-R1177 PolarHBondContact O-N 2.95Å; R1177-T1179 PolarHBondContact O-N 3.42Å
1178	I	82.8	Confident	83.3	Confident	40 Å²	40	54.1 Å²	54.1	21%	0.205	28%	0.275	C	S	.	.			trans	-81.7	111.3	177.2	-56.7	-176.6	0	0	0	107.9	F1145 L1149 D1183 F1187	F1145-I1178 HydrophobicContact CE2-CD1 3.78Å; F1145-I1178 HydrophobicContact CE2-CG1 3.89Å; F1145-I1178 HydrophobicContact CE2-CG2 4.42Å; F1145-I1178 HydrophobicContact CZ-CD1 3.69Å; F1145-I1178 HydrophobicContact CZ-CG1 4.11Å; L1149-I1178 HydrophobicContact CD2-CG1 4.16Å; I1178-D1183 HydrophobicContact CG2-CB 3.94Å; I1178-F1187 HydrophobicContact CB-CZ 4.22Å; I1178-F1187 HydrophobicContact CD1-CE1 3.95Å; I1178-F1187 HydrophobicContact CD1-CE2 4.14Å; I1178-F1187 HydrophobicContact CD1-CZ 3.67Å; I1178-F1187 HydrophobicContact CG1-CZ 4.32Å; I1178-F1187 HydrophobicContact CG2-CE2 4.49Å
1179	T	78.3	Confident	83.2	Confident	107 Å²	107	54.9 Å²	54.9	66%	0.656	28%	0.279	S	S	*	.			trans	-108.8	-13.1	-174.8	53.4	0	0	0	0	113.9	A1152 R1177	A1152-T1179 HydrophobicContact CB-CG2 4.29Å; R1177-T1179 PolarHBondContact O-N 3.42Å
1180	C	82.3	Confident	83.2	Confident	26 Å²	26	59 Å²	59	18%	0.176	30%	0.301	C	S	.	.			trans	-106.7	125.1	-179.7	-171.7	0	0	0	0	109.8	R1182 D1183	C1180-R1182 PolarHBondContact O-N 2.75Å; C1180-D1183 PolarHBondContact O-N 3.43Å; C1180-D1183 VanDerWaalsContact O-N 3.1Å
1181	S	82.1	Confident	83.3	Confident	85 Å²	85	61.6 Å²	61.6	59%	0.594	31%	0.313	S	S	*	.	G	3₁₀ helix	trans	-65.9	-17.8	179.6	52	0	0	0	0	113.7	D1183 E1184	S1181-D1183 PolarHBondContact O-N 2.87Å; S1181-E1184 WeakPolarHBondContact CA-OE1 3.07Å; S1181-E1184 WeakPolarHBondContact CB-OE1 3.48Å; S1181-E1184 WeakPolarHBondContact O-CG 3.31Å; S1181-E1184 PolarHBondContact O-N 3.03Å
1182	R	82.9	Confident	83.4	Confident	137 Å²	137	61.6 Å²	61.6	52%	0.517	31%	0.313	S	S	.	.	G	3₁₀ helix	trans	-63.1	-17.2	171.8	-64	-178.1	177.8	170.9	1.6	113.6	D1077 C1180 W1185	D1077-R1182 IonicContact OD1-CZ 3Å; D1077-R1182 IonicContact OD1-NH1 2.79Å; D1077-R1182 PolarHBondContact OD1-NH1 3Å; C1180-R1182 PolarHBondContact O-N 2.75Å; R1182-W1185 PolarHBondContact O-NE1 2.91Å
1183	D	85	Confident	83.5	Confident	4 Å²	4	62.3 Å²	62.3	2%	0.021	32%	0.316	C	S	.	.	G	3₁₀ helix	trans	-103.7	3.6	-175.7	-57.2	-36.5	0	0	0	113.2	F1145 R1148 I1178 C1180 S1181 W1185 V1186	F1145-D1183 HydrophobicContact CD2-CB 3.55Å; F1145-D1183 HydrophobicContact CE2-CB 3.84Å; R1148-D1183 WeakPolarHBondContact CD-OD2 3.25Å; R1148-D1183 IonicContact CZ-OD1 2.7Å; R1148-D1183 IonicContact CZ-OD2 3.62Å; R1148-D1183 IonicContact NE-OD1 3.93Å; R1148-D1183 PolarHBondContact NE-OD1 2.99Å; R1148-D1183 IonicContact NE-OD2 3.49Å; R1148-D1183 PolarHBondContact NE-OD2 2.93Å; R1148-D1183 IonicContact NH2-OD1 2.75Å; R1148-D1183 PolarHBondContact NH2-OD1 2.84Å; R1148-D1183 IonicContact NH2-OD2 3.84Å; I1178-D1183 HydrophobicContact CG2-CB 3.94Å; C1180-D1183 PolarHBondContact O-N 3.43Å; C1180-D1183 VanDerWaalsContact O-N 3.1Å; S1181-D1183 PolarHBondContact O-N 2.87Å; D1183-W1185 PolarHBondContact O-N 3.38Å; D1183-W1185 VanDerWaalsContact O-N 3.16Å; D1183-V1186 WeakPolarHBondContact O-CB 3.5Å; D1183-V1186 WeakPolarHBondContact O-CG2 3.25Å; D1183-V1186 PolarHBondContact O-N 3.07Å; D1183-V1186 VanDerWaalsContact O-N 3.16Å
1184	E	84.2	Confident	83.6	Confident	113 Å²	113	62.1 Å²	62.1	53%	0.528	32%	0.324	S	S	.	.	G	3₁₀ helix	trans	-62.7	-22.8	-177	-73.8	173.6	-151.3	0	0	113.5	S1181 V1186 F1187	S1181-E1184 WeakPolarHBondContact CA-OE1 3.07Å; S1181-E1184 WeakPolarHBondContact CB-OE1 3.48Å; S1181-E1184 WeakPolarHBondContact O-CG 3.31Å; S1181-E1184 PolarHBondContact O-N 3.03Å; E1184-V1186 PolarHBondContact O-N 3.1Å; E1184-V1186 VanDerWaalsContact O-N 3.11Å; E1184-F1187 HydrophobicContact CB-CD2 4.32Å; E1184-F1187 HydrophobicContact CG-CD2 4.45Å; E1184-F1187 HydrophobicContact CG-CE2 4.39Å; E1184-F1187 WeakPolarHBondContact O-CB 3.32Å; E1184-F1187 WeakPolarHBondContact O-CD2 3.16Å; E1184-F1187 PolarHBondContact O-N 3.04Å
1185	W	86.8	Confident	83.9	Confident	17 Å²	17	62.4 Å²	62.4	6%	0.064	33%	0.327	C	S	.	.	G	3₁₀ helix	trans	-55.9	-27.6	174.6	61.5	-91.6	0	0	0	113.1	I1062 V1065 L1138 L1141 L1142 R1182 D1183 F1187 S1188 I1192	I1062-W1185 HydrophobicContact CD1-CE3 4.48Å; I1062-W1185 HydrophobicContact CG1-CE3 4.11Å; V1065-W1185 HydrophobicContact CG2-CB 4.02Å; V1065-W1185 HydrophobicContact CG2-CG 4.06Å; L1138-W1185 HydrophobicContact CD1-CH2 4.31Å; L1138-W1185 HydrophobicContact CD1-CZ3 4.22Å; L1141-W1185 HydrophobicContact CB-CH2 4.28Å; L1141-W1185 HydrophobicContact CB-CZ2 3.9Å; L1142-W1185 HydrophobicContact CD2-CH2 3.74Å; L1142-W1185 HydrophobicContact CD2-CZ3 4.38Å; L1142-W1185 HydrophobicContact CG-CH2 4.12Å; R1182-W1185 PolarHBondContact O-NE1 2.91Å; D1183-W1185 PolarHBondContact O-N 3.38Å; D1183-W1185 VanDerWaalsContact O-N 3.16Å; W1185-F1187 PolarHBondContact O-N 3.17Å; W1185-S1188 WeakPolarHBondContact O-CB 3.34Å; W1185-S1188 PolarHBondContact O-N 2.67Å; W1185-S1188 PolarHBondContact O-OG 3.31Å; W1185-I1192 HydrophobicContact CZ3-CD1 4.29Å
1186	V	85.3	Confident	84.4	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	31%	0.308	C	S	.	.	G	3₁₀ helix	trans	-63.6	-26.6	177.3	-178.1	0	0	0	0	112	F1145 D1183 E1184 S1188 D1189 I1192 L1193	F1145-V1186 HydrophobicContact CD1-CG2 3.93Å; F1145-V1186 HydrophobicContact CD2-CG2 4.39Å; F1145-V1186 HydrophobicContact CE1-CB 4.31Å; F1145-V1186 HydrophobicContact CE1-CG1 3.81Å; F1145-V1186 HydrophobicContact CE1-CG2 3.81Å; F1145-V1186 HydrophobicContact CE2-CG2 4.26Å; F1145-V1186 HydrophobicContact CG-CG2 4.21Å; F1145-V1186 HydrophobicContact CZ-CB 4.22Å; F1145-V1186 HydrophobicContact CZ-CG1 3.96Å; F1145-V1186 HydrophobicContact CZ-CG2 3.97Å; D1183-V1186 WeakPolarHBondContact O-CB 3.5Å; D1183-V1186 WeakPolarHBondContact O-CG2 3.25Å; D1183-V1186 PolarHBondContact O-N 3.07Å; D1183-V1186 VanDerWaalsContact O-N 3.16Å; E1184-V1186 PolarHBondContact O-N 3.1Å; E1184-V1186 VanDerWaalsContact O-N 3.11Å; V1186-S1188 PolarHBondContact O-N 3.28Å; V1186-D1189 CarbonylContact O-C 3.56Å; V1186-D1189 VanDerWaalsContact O-C 3.32Å; V1186-D1189 PolarHBondContact O-N 3.36Å; V1186-I1192 HydrophobicContact CG1-CB 4.14Å; V1186-I1192 HydrophobicContact CG1-CG2 3.98Å; V1186-L1193 HydrophobicContact CG1-CD2 3.78Å; V1186-L1193 HydrophobicContact CG1-CG 4.01Å
1187	F	84.7	Confident	84.7	Confident	118 Å²	118	56.7 Å²	56.7	52%	0.518	30%	0.299	S	S	.	.	G	3₁₀ helix	trans	-67.9	-14.8	174.9	-65.1	-61.8	0	0	0	113.7	I1178 E1184 W1185 D1189	I1178-F1187 HydrophobicContact CB-CZ 4.22Å; I1178-F1187 HydrophobicContact CD1-CE1 3.95Å; I1178-F1187 HydrophobicContact CD1-CE2 4.14Å; I1178-F1187 HydrophobicContact CD1-CZ 3.67Å; I1178-F1187 HydrophobicContact CG1-CZ 4.32Å; I1178-F1187 HydrophobicContact CG2-CE2 4.49Å; E1184-F1187 HydrophobicContact CB-CD2 4.32Å; E1184-F1187 HydrophobicContact CG-CD2 4.45Å; E1184-F1187 HydrophobicContact CG-CE2 4.39Å; E1184-F1187 WeakPolarHBondContact O-CB 3.32Å; E1184-F1187 WeakPolarHBondContact O-CD2 3.16Å; E1184-F1187 PolarHBondContact O-N 3.04Å; W1185-F1187 PolarHBondContact O-N 3.17Å; F1187-D1189 PolarHBondContact O-N 3.11Å
1188	S	83.6	Confident	85.1	Confident	55 Å²	55	49.1 Å²	49.1	39%	0.385	27%	0.272	S	S	.	.	G	3₁₀ helix	trans	-61.6	-29.9	172.8	-44.4	0	0	0	0	112	S1061 W1185 V1186	S1061-S1188 WeakPolarHBondContact OG-CB 3.38Å; S1061-S1188 PolarHBondContact OG-OG 2.84Å; W1185-S1188 WeakPolarHBondContact O-CB 3.34Å; W1185-S1188 PolarHBondContact O-N 2.67Å; W1185-S1188 PolarHBondContact O-OG 3.31Å; V1186-S1188 PolarHBondContact O-N 3.28Å
1189	D	83.8	Confident	85.5	Confident	21 Å²	21	48.8 Å²	48.8	11%	0.112	27%	0.272	C	S	.	.			trans	-146.5	99.9	170.1	-171	-0	0	0	0	112.3	R1052 W1056 V1186 F1187 D1191 I1192	R1052-D1189 IonicContact CZ-OD1 3.77Å; R1052-D1189 IonicContact CZ-OD2 3.78Å; R1052-D1189 IonicContact NE-OD2 3.87Å; R1052-D1189 PolarHBondContact NE-OD2 3.13Å; R1052-D1189 IonicContact NH2-OD1 3.88Å; R1052-D1189 PolarHBondContact NH2-OD1 3.31Å; R1052-D1189 IonicContact NH2-OD2 3.35Å; R1052-D1189 PolarHBondContact NH2-OD2 3.41Å; W1056-D1189 PolarHBondContact NE1-OD2 3.39Å; V1186-D1189 CarbonylContact O-C 3.56Å; V1186-D1189 VanDerWaalsContact O-C 3.32Å; V1186-D1189 PolarHBondContact O-N 3.36Å; F1187-D1189 PolarHBondContact O-N 3.11Å; D1189-D1191 PolarHBondContact O-N 2.84Å; D1189-D1191 VanDerWaalsContact O-N 3.07Å; D1189-D1191 WeakPolarHBondContact OD1-CB 3.33Å; D1189-D1191 PolarHBondContact OD1-N 3.42Å; D1189-I1192 HydrophobicContact CB-CD1 4.28Å; D1189-I1192 HydrophobicContact CB-CG1 4.39Å; D1189-I1192 WeakPolarHBondContact O-CB 3.42Å; D1189-I1192 WeakPolarHBondContact O-CG1 3.42Å; D1189-I1192 PolarHBondContact O-N 2.92Å
1190	I	84.2	Confident	86.1	Confident	108 Å²	108	43.7 Å²	43.7	55%	0.554	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-19.9	177.6	-62.9	172.9	0	0	0	112.4	I1192 L1193 S1194	I1190-I1192 PolarHBondContact O-N 2.97Å; I1190-L1193 WeakPolarHBondContact O-CB 3.38Å; I1190-L1193 PolarHBondContact O-N 3.45Å; I1190-S1194 PolarHBondContact O-N 2.93Å
1191	D	84.9	Confident	86.6	Confident	72 Å²	72	42.7 Å²	42.7	39%	0.385	23%	0.234	S	C	.	.	H	α-helix	trans	-68.3	-11	174.2	-72.3	-29.8	0	0	0	113.5	R1052 D1189 L1193 S1194 G1195	R1052-D1191 IonicContact CZ-OD2 3.84Å; R1052-D1191 VanDerWaalsContact CZ-OD2 3.23Å; R1052-D1191 IonicContact NH1-OD2 2.76Å; R1052-D1191 PolarHBondContact NH1-OD2 3.01Å; R1052-D1191 IonicContact NH2-OD2 2.68Å; R1052-D1191 PolarHBondContact NH2-OD2 3.11Å; D1189-D1191 PolarHBondContact O-N 2.84Å; D1189-D1191 VanDerWaalsContact O-N 3.07Å; D1189-D1191 WeakPolarHBondContact OD1-CB 3.33Å; D1189-D1191 PolarHBondContact OD1-N 3.42Å; D1191-L1193 VanDerWaalsContact C-N 3.35Å; D1191-S1194 WeakPolarHBondContact CA-OG 3.34Å; D1191-S1194 PolarHBondContact OD1-OG 3.06Å; D1191-G1195 VanDerWaalsContact O-CA 3.31Å; D1191-G1195 WeakPolarHBondContact O-CA 3.35Å; D1191-G1195 PolarHBondContact O-N 3.42Å
1192	I	88.4	Confident	87	Confident	2 Å²	2	40.4 Å²	40.4	1%	0.01	21%	0.212	C	C	.	.	H	α-helix	trans	-63.4	-42.9	165.6	-64.6	169.1	0	0	0	110.2	W1056 I1062 L1142 W1185 V1186 D1189 I1190 V1196 V1197	W1056-I1192 HydrophobicContact CD2-CG1 4.15Å; W1056-I1192 HydrophobicContact CH2-CG1 4.26Å; W1056-I1192 HydrophobicContact CZ2-CG1 3.66Å; I1062-I1192 HydrophobicContact CD1-CD1 4.33Å; L1142-I1192 HydrophobicContact CD2-CG2 3.59Å; W1185-I1192 HydrophobicContact CZ3-CD1 4.29Å; V1186-I1192 HydrophobicContact CG1-CB 4.14Å; V1186-I1192 HydrophobicContact CG1-CG2 3.98Å; D1189-I1192 HydrophobicContact CB-CD1 4.28Å; D1189-I1192 HydrophobicContact CB-CG1 4.39Å; D1189-I1192 WeakPolarHBondContact O-CB 3.42Å; D1189-I1192 WeakPolarHBondContact O-CG1 3.42Å; D1189-I1192 PolarHBondContact O-N 2.92Å; I1190-I1192 PolarHBondContact O-N 2.97Å; I1192-V1196 WeakPolarHBondContact O-CA 3.29Å; I1192-V1196 WeakPolarHBondContact O-CB 3.41Å; I1192-V1196 PolarHBondContact O-N 3.49Å; I1192-V1197 PolarHBondContact O-N 3.4Å; I1192-V1197 VanDerWaalsContact O-N 3.14Å
1193	L	88.3	Confident	87.4	Confident	15 Å²	15	34.2 Å²	34.2	8%	0.079	19%	0.19	C	C	.	.	I	π-helix	trans	-68.8	-45.7	179.4	-60.3	177.5	0	0	0	111.7	F1145 F1176 V1186 I1190 D1191 V1197 A1198	F1145-L1193 HydrophobicContact CE1-CD2 3.69Å; F1145-L1193 HydrophobicContact CZ-CD2 3.69Å; F1176-L1193 HydrophobicContact CD1-CD2 4.48Å; F1176-L1193 HydrophobicContact CD2-CB 4.02Å; F1176-L1193 HydrophobicContact CD2-CD1 4.1Å; F1176-L1193 HydrophobicContact CD2-CD2 4.28Å; F1176-L1193 HydrophobicContact CD2-CG 4.37Å; F1176-L1193 HydrophobicContact CE2-CB 3.78Å; F1176-L1193 HydrophobicContact CG-CD2 4.24Å; F1176-L1193 HydrophobicContact CZ-CB 4.35Å; V1186-L1193 HydrophobicContact CG1-CD2 3.78Å; V1186-L1193 HydrophobicContact CG1-CG 4.01Å; I1190-L1193 WeakPolarHBondContact O-CB 3.38Å; I1190-L1193 PolarHBondContact O-N 3.45Å; D1191-L1193 VanDerWaalsContact C-N 3.35Å; L1193-V1197 HydrophobicContact CD2-CG2 4.44Å; L1193-A1198 PolarHBondContact O-N 3Å
1194	S	84.9	Confident	87.7	Confident	67 Å²	67	34.1 Å²	34.1	47%	0.469	19%	0.189	S	C	.	.	I	π-helix	trans	-77.7	-33.4	-176.3	76.2	0	0	0	0	113.2	I1190 D1191 P1199	I1190-S1194 PolarHBondContact O-N 2.93Å; D1191-S1194 WeakPolarHBondContact CA-OG 3.34Å; D1191-S1194 PolarHBondContact OD1-OG 3.06Å; S1194-P1199 VanDerWaalsContact O-CD 3.27Å; S1194-P1199 WeakPolarHBondContact O-CD 3.43Å; S1194-P1199 WeakPolarHBondContact O-CG 3.17Å
1195	G	86	Confident	87.9	Confident	35 Å²	35	28.8 Å²	28.8	36%	0.361	16%	0.164	S	C	.	.	I	π-helix	trans	-101.2	-21.3	-173.1	0	0	0	0	0	115.7	D1191	D1191-G1195 VanDerWaalsContact O-CA 3.31Å; D1191-G1195 WeakPolarHBondContact O-CA 3.35Å; D1191-G1195 PolarHBondContact O-N 3.42Å
1196	V	90.1	Very high	87.9	Confident	0 Å²	0	28 Å²	28	0%	0	16%	0.162	C	C	.	.	I	π-helix	trans	-115.8	-60	177.1	-173.3	0	0	0	0	111.4	I1043 F1046 A1047 W1056 I1192 A1200	I1043-V1196 HydrophobicContact CG2-CG1 4.1Å; I1043-V1196 WeakPolarHBondContact O-CG1 3.43Å; F1046-V1196 HydrophobicContact CB-CB 4.45Å; F1046-V1196 HydrophobicContact CB-CG1 4.06Å; A1047-V1196 HydrophobicContact CB-CG1 4.17Å; A1047-V1196 HydrophobicContact CB-CG2 4.49Å; W1056-V1196 HydrophobicContact CH2-CG2 3.56Å; W1056-V1196 HydrophobicContact CZ3-CG2 3.9Å; I1192-V1196 WeakPolarHBondContact O-CA 3.29Å; I1192-V1196 WeakPolarHBondContact O-CB 3.41Å; I1192-V1196 PolarHBondContact O-N 3.49Å; V1196-A1200 WeakPolarHBondContact O-CB 3.37Å; V1196-A1200 PolarHBondContact O-N 3.37Å
1197	V	90.7	Very high	88.1	Confident	0 Å²	0	28.1 Å²	28.1	0%	0	16%	0.162	C	C	.	.	I	π-helix	trans	-71.7	-50.6	-166.2	-171.9	0	0	0	0	112.5	F1145 L1149 F1176 I1192 L1193 A1200 V1201	F1145-V1197 HydrophobicContact CD1-CG2 4.37Å; F1145-V1197 HydrophobicContact CE1-CG2 4.06Å; L1149-V1197 HydrophobicContact CD1-CG1 3.93Å; F1176-V1197 HydrophobicContact CE1-CB 4.17Å; F1176-V1197 HydrophobicContact CE1-CG1 3.68Å; F1176-V1197 HydrophobicContact CZ-CB 4.28Å; F1176-V1197 HydrophobicContact CZ-CG1 4.26Å; I1192-V1197 PolarHBondContact O-N 3.4Å; I1192-V1197 VanDerWaalsContact O-N 3.14Å; L1193-V1197 HydrophobicContact CD2-CG2 4.44Å; V1197-A1200 PolarHBondContact O-N 2.95Å; V1197-V1201 PolarHBondContact O-N 3.49Å
1198	A	88.6	Confident	88.1	Confident	9 Å²	9	22.5 Å²	22.5	7%	0.074	14%	0.137	C	C	.	.	H	α-helix	trans	-59.6	-48	176.6	0	0	0	0	0	112.7	F1176 L1193 A1200 V1201 R1202	F1176-A1198 HydrophobicContact CZ-CB 3.94Å; L1193-A1198 PolarHBondContact O-N 3Å; A1198-A1200 VanDerWaalsContact C-N 3.3Å; A1198-A1200 PolarHBondContact O-N 3.43Å; A1198-V1201 PolarHBondContact O-N 3.37Å; A1198-R1202 VanDerWaalsContact O-CB 3.31Å; A1198-R1202 WeakPolarHBondContact O-CB 3.45Å; A1198-R1202 WeakPolarHBondContact O-CD 3.09Å; A1198-R1202 WeakPolarHBondContact O-CG 3.48Å; A1198-R1202 PolarHBondContact O-N 3.32Å; A1198-R1202 VanDerWaalsContact O-N 3.11Å
1199	P	89.5	Confident	88.1	Confident	33 Å²	33	21.5 Å²	21.5	21%	0.214	13%	0.126	C	C	.	.	H	α-helix	trans	-58	-37.5	172.5	-28.9	38	0	0	0	113.7	F1046 S1194 R1202 M1203	F1046-P1199 HydrophobicContact CD1-CB 3.97Å; F1046-P1199 HydrophobicContact CD2-CB 3.9Å; F1046-P1199 HydrophobicContact CE1-CB 3.84Å; F1046-P1199 HydrophobicContact CE2-CB 3.78Å; F1046-P1199 WeakPolarHBondContact CE2-O 3.41Å; F1046-P1199 HydrophobicContact CG-CB 4.02Å; F1046-P1199 HydrophobicContact CZ-CB 3.76Å; S1194-P1199 VanDerWaalsContact O-CD 3.27Å; S1194-P1199 WeakPolarHBondContact O-CD 3.43Å; S1194-P1199 WeakPolarHBondContact O-CG 3.17Å; P1199-R1202 PolarHBondContact O-N 3.01Å; P1199-M1203 WeakPolarHBondContact O-CB 3.22Å; P1199-M1203 PolarHBondContact O-N 3.48Å
1200	A	92.6	Very high	88	Confident	0 Å²	0	21.6 Å²	21.6	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-67.9	-46.1	179.5	0	0	0	0	0	113.2	Y1039 C1042 I1043 F1046 V1196 V1197 A1198 R1202 M1203 A1204	Y1039-A1200 HydrophobicContact CD2-CB 4Å; Y1039-A1200 HydrophobicContact CE2-CB 4Å; C1042-A1200 HydrophobicContact CB-CB 3.79Å; I1043-A1200 HydrophobicContact CB-CB 4.37Å; I1043-A1200 HydrophobicContact CG1-CB 3.62Å; F1046-A1200 HydrophobicContact CD2-CB 4.13Å; V1196-A1200 WeakPolarHBondContact O-CB 3.37Å; V1196-A1200 PolarHBondContact O-N 3.37Å; V1197-A1200 PolarHBondContact O-N 2.95Å; A1198-A1200 VanDerWaalsContact C-N 3.3Å; A1198-A1200 PolarHBondContact O-N 3.43Å; A1200-R1202 VanDerWaalsContact C-N 3.3Å; A1200-R1202 PolarHBondContact O-N 3.13Å; A1200-M1203 PolarHBondContact O-N 3.24Å; A1200-A1204 VanDerWaalsContact O-CB 3.27Å; A1200-A1204 WeakPolarHBondContact O-CB 3.13Å; A1200-A1204 PolarHBondContact O-N 2.89Å
1201	V	91.4	Very high	87.9	Confident	5 Å²	5	19.1 Å²	19.1	3%	0.03	11%	0.113	C	C	.	.	H	α-helix	trans	-58.6	-45.6	174	176.6	0	0	0	0	110.4	Y1039 L1168 L1171 F1172 V1197 A1198 A1204 L1205	Y1039-V1201 HydrophobicContact CD2-CG2 4.06Å; Y1039-V1201 HydrophobicContact CE2-CB 4.28Å; Y1039-V1201 HydrophobicContact CE2-CG2 3.32Å; L1168-V1201 HydrophobicContact CD1-CG1 3.89Å; L1171-V1201 HydrophobicContact CB-CG1 4.37Å; L1171-V1201 HydrophobicContact CB-CG2 4.31Å; F1172-V1201 HydrophobicContact CB-CG1 4.44Å; V1197-V1201 PolarHBondContact O-N 3.49Å; A1198-V1201 PolarHBondContact O-N 3.37Å; V1201-A1204 PolarHBondContact O-N 3.24Å; V1201-L1205 PolarHBondContact O-N 3.05Å; V1201-L1205 VanDerWaalsContact O-N 3.16Å
1202	R	91.1	Very high	87.3	Confident	37 Å²	37	21.5 Å²	21.5	14%	0.14	12%	0.12	C	C	.	.	H	α-helix	trans	-62.6	-44.3	-178.4	-75.2	171	-178.3	-165.4	6.5	112.4	F1172 A1198 P1199 A1200 K1206 I1237 D1242	F1172-R1202 HydrophobicContact CD2-CB 4.46Å; F1172-R1202 HydrophobicContact CD2-CG 3.74Å; F1172-R1202 HydrophobicContact CE2-CB 4.17Å; F1172-R1202 HydrophobicContact CE2-CG 3.66Å; F1172-R1202 HydrophobicContact CG-CG 4.37Å; F1172-R1202 HydrophobicContact CZ-CG 4.22Å; F1172-R1202 PolarHBondContact O-NE 2.94Å; F1172-R1202 PolarHBondContact O-NH2 3Å; A1198-R1202 VanDerWaalsContact O-CB 3.31Å; A1198-R1202 WeakPolarHBondContact O-CB 3.45Å; A1198-R1202 WeakPolarHBondContact O-CD 3.09Å; A1198-R1202 WeakPolarHBondContact O-CG 3.48Å; A1198-R1202 PolarHBondContact O-N 3.32Å; A1198-R1202 VanDerWaalsContact O-N 3.11Å; P1199-R1202 PolarHBondContact O-N 3.01Å; A1200-R1202 VanDerWaalsContact C-N 3.3Å; A1200-R1202 PolarHBondContact O-N 3.13Å; R1202-K1206 PolarHBondContact O-N 3.41Å; R1202-I1237 HydrophobicContact CB-CB 4.12Å; R1202-I1237 HydrophobicContact CB-CG2 3.63Å; R1202-I1237 WeakPolarHBondContact CD-O 3.36Å; R1202-I1237 HydrophobicContact CG-CG2 4.04Å; R1202-I1237 PolarHBondContact NH1-O 2.83Å; R1202-D1242 IonicContact NH1-OD2 3.78Å
1203	M	91.1	Very high	86.5	Confident	8 Å²	8	25.9 Å²	25.9	4%	0.039	15%	0.147	C	C	.	.	H	α-helix	trans	-71.6	-41.8	177.6	-174.2	59.7	68.3	0	0	112.1	F1046 P1199 A1200 L1205 K1206 L1207 I1228 E1231 I1237	F1046-M1203 HydrophobicContact CE2-CB 3.9Å; F1046-M1203 HydrophobicContact CE2-CG 4.4Å; F1046-M1203 HydrophobicContact CZ-CB 4.33Å; F1046-M1203 HydrophobicContact CZ-CE 4.49Å; P1199-M1203 WeakPolarHBondContact O-CB 3.22Å; P1199-M1203 PolarHBondContact O-N 3.48Å; A1200-M1203 PolarHBondContact O-N 3.24Å; M1203-L1205 VanDerWaalsContact C-N 3.3Å; M1203-L1205 PolarHBondContact O-N 3.09Å; M1203-K1206 WeakPolarHBondContact O-CB 3.34Å; M1203-K1206 PolarHBondContact O-N 3.26Å; M1203-L1207 HydrophobicContact CG-CD1 4.08Å; M1203-L1207 HydrophobicContact CG-CG 4.19Å; M1203-L1207 WeakPolarHBondContact O-CG 3.43Å; M1203-L1207 PolarHBondContact O-N 2.95Å; M1203-L1207 HydrophobicContact SD-CD2 4.42Å; M1203-L1207 HydrophobicContact SD-CG 4.28Å; M1203-I1228 HydrophobicContact CE-CG2 4.28Å; M1203-I1228 HydrophobicContact CG-CG2 4.02Å; M1203-I1228 HydrophobicContact SD-CG2 4.31Å; M1203-E1231 HydrophobicContact CE-CB 4.35Å; M1203-E1231 HydrophobicContact SD-CB 4.39Å; M1203-I1237 HydrophobicContact CE-CD1 4.35Å
1204	A	91	Very high	85.7	Confident	1 Å²	1	31.8 Å²	31.8	1%	0.008	17%	0.169	C	C	.	.	H	α-helix	trans	-60.6	-38.7	179.4	0	0	0	0	0	112.8	L1035 L1038 A1200 V1201 K1206 H1208	L1035-A1204 HydrophobicContact CD1-CB 4.3Å; L1038-A1204 HydrophobicContact CB-CB 4.31Å; A1200-A1204 VanDerWaalsContact O-CB 3.27Å; A1200-A1204 WeakPolarHBondContact O-CB 3.13Å; A1200-A1204 PolarHBondContact O-N 2.89Å; V1201-A1204 PolarHBondContact O-N 3.24Å; A1204-K1206 VanDerWaalsContact C-N 3.32Å; A1204-K1206 PolarHBondContact O-N 3.16Å; A1204-H1208 VanDerWaalsContact O-CB 3.28Å; A1204-H1208 WeakPolarHBondContact O-CB 3.5Å; A1204-H1208 PolarHBondContact O-N 2.8Å
1205	L	88.9	Confident	85	Confident	1 Å²	1	31 Å²	31	1%	0.005	17%	0.167	C	C	.	.	H	α-helix	trans	-62.9	-37.3	174	-176.4	62.1	0	0	0	112.6	F1023 L1168 F1172 V1201 M1203 Q1209 L1259 I1272	F1023-L1205 HydrophobicContact CZ-CD1 4.43Å; L1168-L1205 HydrophobicContact CD2-CD1 4.32Å; F1172-L1205 HydrophobicContact CD2-CD2 3.91Å; F1172-L1205 HydrophobicContact CE2-CD2 3.87Å; V1201-L1205 PolarHBondContact O-N 3.05Å; V1201-L1205 VanDerWaalsContact O-N 3.16Å; M1203-L1205 VanDerWaalsContact C-N 3.3Å; M1203-L1205 PolarHBondContact O-N 3.09Å; L1205-Q1209 PolarHBondContact O-N 3.25Å; L1205-L1259 HydrophobicContact CD2-CB 4.04Å; L1205-L1259 HydrophobicContact CD2-CD2 4.16Å; L1205-L1259 HydrophobicContact CD2-CG 4.5Å; L1205-I1272 HydrophobicContact CD1-CD1 3.73Å; L1205-I1272 HydrophobicContact CG-CD1 4.12Å
1206	K	87.8	Confident	83.9	Confident	2 Å²	2	38.1 Å²	38.1	1%	0.009	19%	0.191	C	C	.	.	H	α-helix	trans	-68	-53.5	175.6	172.5	61.3	170.2	72	0	110.9	R1202 M1203 A1204 H1208 Q1209 D1210 E1231 I1237 L1257 M1274	R1202-K1206 PolarHBondContact O-N 3.41Å; M1203-K1206 WeakPolarHBondContact O-CB 3.34Å; M1203-K1206 PolarHBondContact O-N 3.26Å; A1204-K1206 VanDerWaalsContact C-N 3.32Å; A1204-K1206 PolarHBondContact O-N 3.16Å; K1206-H1208 VanDerWaalsContact C-N 3.28Å; K1206-H1208 PolarHBondContact O-N 3.24Å; K1206-Q1209 WeakPolarHBondContact O-CA 3.46Å; K1206-Q1209 VanDerWaalsContact O-CB 3.25Å; K1206-Q1209 WeakPolarHBondContact O-CB 3.21Å; K1206-Q1209 PolarHBondContact O-N 3.11Å; K1206-D1210 IonicContact NZ-OD1 3.72Å; K1206-D1210 PolarHBondContact NZ-OD1 3.07Å; K1206-D1210 IonicContact NZ-OD2 3.3Å; K1206-D1210 PolarHBondContact NZ-OD2 3.23Å; K1206-D1210 PolarHBondContact O-N 3.48Å; K1206-D1210 VanDerWaalsContact O-N 3.11Å; K1206-E1231 WeakPolarHBondContact CE-OE2 3.32Å; K1206-E1231 WeakPolarHBondContact CG-OE2 3.31Å; K1206-E1231 IonicContact NZ-OE1 2.74Å; K1206-E1231 PolarHBondContact NZ-OE1 3.45Å; K1206-E1231 IonicContact NZ-OE2 3.74Å; K1206-E1231 PolarHBondContact NZ-OE2 3.23Å; K1206-I1237 HydrophobicContact CB-CD1 3.84Å; K1206-I1237 HydrophobicContact CG-CD1 4.23Å; K1206-L1257 HydrophobicContact CB-CD1 4.36Å; K1206-L1257 HydrophobicContact CD-CD1 3.81Å; K1206-M1274 HydrophobicContact CD-CE 4.05Å
1207	L	88.2	Confident	82.9	Confident	1 Å²	1	41.3 Å²	41.3	1%	0.005	21%	0.208	C	C	.	.	H	α-helix	trans	-56.4	-40.5	178.4	-65.4	177.4	0	0	0	112.6	L1038 M1203 Q1209 D1210 Q1211 F1218 L1224 L1227 I1228	L1038-L1207 HydrophobicContact CD1-CB 4.05Å; L1038-L1207 HydrophobicContact CD2-CB 4.35Å; L1038-L1207 HydrophobicContact CD2-CD1 4.33Å; M1203-L1207 HydrophobicContact CG-CD1 4.08Å; M1203-L1207 HydrophobicContact CG-CG 4.19Å; M1203-L1207 WeakPolarHBondContact O-CG 3.43Å; M1203-L1207 PolarHBondContact O-N 2.95Å; M1203-L1207 HydrophobicContact SD-CD2 4.42Å; M1203-L1207 HydrophobicContact SD-CG 4.28Å; L1207-Q1209 PolarHBondContact O-N 3.36Å; L1207-D1210 PolarHBondContact O-N 3.06Å; L1207-D1210 VanDerWaalsContact O-N 3.09Å; L1207-Q1211 PolarHBondContact O-N 3.13Å; L1207-F1218 HydrophobicContact CB-CE1 4.01Å; L1207-F1218 HydrophobicContact CD2-CE1 4.11Å; L1207-L1224 HydrophobicContact CD1-CD1 4.34Å; L1207-L1227 HydrophobicContact CD2-CD2 3.88Å; L1207-L1227 HydrophobicContact CD2-CG 4.22Å; L1207-I1228 HydrophobicContact CD1-CD1 3.92Å; L1207-I1228 HydrophobicContact CD1-CG1 3.89Å; L1207-I1228 HydrophobicContact CD2-CG1 4.18Å
1208	H	86.1	Confident	82.1	Confident	1 Å²	1	41.7 Å²	41.7	1%	0.005	21%	0.21	C	C	.	.	H	α-helix	trans	-62.6	-29.3	174.5	-179.1	-77.7	0	0	0	112.7	F1023 L1031 L1035 L1038 A1204 K1206 F1212	F1023-H1208 AromaticContact CE1-CE1 3.44Å; F1023-H1208 VanDerWaalsContact CE1-CE1 3.44Å; F1023-H1208 WeakPolarHBondContact CE1-CE1 3.36Å; F1023-H1208 AromaticContact CE1-NE2 3.66Å; L1031-H1208 PolarHBondContact O-NE2 3.08Å; L1035-H1208 HydrophobicContact CD1-CB 3.96Å; L1038-H1208 HydrophobicContact CD1-CB 4.08Å; A1204-H1208 VanDerWaalsContact O-CB 3.28Å; A1204-H1208 WeakPolarHBondContact O-CB 3.5Å; A1204-H1208 PolarHBondContact O-N 2.8Å; K1206-H1208 VanDerWaalsContact C-N 3.28Å; K1206-H1208 PolarHBondContact O-N 3.24Å; H1208-F1212 WeakPolarHBondContact O-CD2 3.38Å; H1208-F1212 WeakPolarHBondContact O-CE2 3.15Å
1209	Q	83.2	Confident	81.4	Confident	33 Å²	33	48.2 Å²	48.2	15%	0.154	24%	0.244	C	C	.	.	H	α-helix	trans	-73	-38.1	171.3	-170.4	-176.6	-9.9	0	0	111.7	N1017 L1205 K1206 L1207	N1017-Q1209 PolarHBondContact ND2-NE2 2.83Å; L1205-Q1209 PolarHBondContact O-N 3.25Å; K1206-Q1209 WeakPolarHBondContact O-CA 3.46Å; K1206-Q1209 VanDerWaalsContact O-CB 3.25Å; K1206-Q1209 WeakPolarHBondContact O-CB 3.21Å; K1206-Q1209 PolarHBondContact O-N 3.11Å; L1207-Q1209 PolarHBondContact O-N 3.36Å
1210	D	81.5	Confident	81.2	Confident	23 Å²	23	50.2 Å²	50.2	12%	0.123	25%	0.252	C	S	.	.	H	α-helix	trans	-78	-19	-176.7	-52.9	-58.7	0	0	0	114.2	K1206 L1207 F1212 T1213 Y1214 F1218	K1206-D1210 IonicContact NZ-OD1 3.72Å; K1206-D1210 PolarHBondContact NZ-OD1 3.07Å; K1206-D1210 IonicContact NZ-OD2 3.3Å; K1206-D1210 PolarHBondContact NZ-OD2 3.23Å; K1206-D1210 PolarHBondContact O-N 3.48Å; K1206-D1210 VanDerWaalsContact O-N 3.11Å; L1207-D1210 PolarHBondContact O-N 3.06Å; L1207-D1210 VanDerWaalsContact O-N 3.09Å; D1210-F1212 PolarHBondContact O-N 3.14Å; D1210-T1213 CarbonylContact O-C 3.46Å; D1210-T1213 WeakPolarHBondContact O-CA 3.5Å; D1210-T1213 PolarHBondContact O-N 2.82Å; D1210-T1213 PolarHBondContact O-OG1 3.33Å; D1210-Y1214 PolarHBondContact O-N 3.42Å; D1210-F1218 HydrophobicContact CB-CZ 4.28Å
1211	Q	80.7	Confident	80.8	Confident	56 Å²	56	51.7 Å²	51.7	26%	0.262	26%	0.26	S	S	.	.	H	α-helix	trans	-60.3	-28	174.6	178.9	152.7	-19.1	0	0	112.8	L1034 L1207 T1213 A1215 F1218	L1034-Q1211 VanDerWaalsContact CD2-CD 3.43Å; L1034-Q1211 HydrophobicContact CD2-CG 4.31Å; L1034-Q1211 VanDerWaalsContact CD2-OE1 3.22Å; L1207-Q1211 PolarHBondContact O-N 3.13Å; Q1211-T1213 PolarHBondContact O-N 2.97Å; Q1211-A1215 HydrophobicContact CG-CB 4.23Å; Q1211-A1215 PolarHBondContact O-N 3.03Å; Q1211-F1218 HydrophobicContact CB-CD2 4.35Å; Q1211-F1218 HydrophobicContact CB-CE2 3.99Å; Q1211-F1218 HydrophobicContact CB-CZ 4.34Å; Q1211-F1218 HydrophobicContact CG-CD2 4.45Å
1212	F	73.2	Confident	80.5	Confident	123 Å²	123	54.1 Å²	54.1	54%	0.539	28%	0.275	S	S	.	.	H	α-helix	trans	-68.2	-10	171.8	-63.8	-78.6	0	0	0	113.7	L1022 L1031 H1208 D1210	L1022-F1212 HydrophobicContact CD2-CD2 4.33Å; L1022-F1212 HydrophobicContact CD2-CE2 3.89Å; L1022-F1212 HydrophobicContact CD2-CZ 4.4Å; L1031-F1212 HydrophobicContact CD2-CZ 4.04Å; H1208-F1212 WeakPolarHBondContact O-CD2 3.38Å; H1208-F1212 WeakPolarHBondContact O-CE2 3.15Å; D1210-F1212 PolarHBondContact O-N 3.14Å
1213	T	72.8	Confident	80.2	Confident	94 Å²	94	54.2 Å²	54.2	58%	0.577	28%	0.281	S	S	*	.	H	α-helix	trans	-112.9	-32.6	174.8	40	0	0	0	0	114.5	D1210 Q1211	D1210-T1213 CarbonylContact O-C 3.46Å; D1210-T1213 WeakPolarHBondContact O-CA 3.5Å; D1210-T1213 PolarHBondContact O-N 2.82Å; D1210-T1213 PolarHBondContact O-OG1 3.33Å; Q1211-T1213 PolarHBondContact O-N 2.97Å
1214	Y	70.8	Confident	80.1	Confident	138 Å²	138	53.9 Å²	53.9	54%	0.541	28%	0.279	S	S	.	.	H	α-helix	trans	-135.6	42.5	-169.6	-58.5	-73.1	0	0	0	113.6	D1210 E1216 D1217 F1218	D1210-Y1214 PolarHBondContact O-N 3.42Å; Y1214-E1216 VanDerWaalsContact C-N 3.25Å; Y1214-E1216 PolarHBondContact O-N 3.43Å; Y1214-E1216 VanDerWaalsContact O-N 3.1Å; Y1214-D1217 PolarHBondContact O-N 3.24Å; Y1214-D1217 VanDerWaalsContact O-N 3.09Å; Y1214-F1218 WeakPolarHBondContact O-CD2 3.02Å; Y1214-F1218 VanDerWaalsContact O-CE2 3.3Å; Y1214-F1218 WeakPolarHBondContact O-CE2 3.46Å
1215	A	69	Low	80	Confident	52 Å²	52	54.8 Å²	54.8	43%	0.43	28%	0.283	S	S	.	.	G	3₁₀ helix	trans	-51.9	-36.5	-172.3	0	0	0	0	0	115.3	Q1211 D1217	Q1211-A1215 HydrophobicContact CG-CB 4.23Å; Q1211-A1215 PolarHBondContact O-N 3.03Å; A1215-D1217 VanDerWaalsContact C-N 3.29Å; A1215-D1217 PolarHBondContact O-N 3.33Å
1216	E	64.8	Low	79.8	Confident	184 Å²	184	59 Å²	59	86%	0.86	31%	0.305	S	S	*	.	G	3₁₀ helix	trans	-70.4	-20.3	-177.1	-60.6	-177.3	174.5	0	0	113.5	Y1214	Y1214-E1216 VanDerWaalsContact C-N 3.25Å; Y1214-E1216 PolarHBondContact O-N 3.43Å; Y1214-E1216 VanDerWaalsContact O-N 3.1Å
1217	D	68.3	Low	79.8	Confident	66 Å²	66	61.4 Å²	61.4	35%	0.353	32%	0.318	S	S	.	.	G	3₁₀ helix	trans	-80.5	-12.1	-178.5	-76.1	-56.5	0	0	0	114	Y1214 A1215 C1223	Y1214-D1217 PolarHBondContact O-N 3.24Å; Y1214-D1217 VanDerWaalsContact O-N 3.09Å; A1215-D1217 VanDerWaalsContact C-N 3.29Å; A1215-D1217 PolarHBondContact O-N 3.33Å; D1217-C1223 HydrophobicContact CB-CB 4.46Å; D1217-C1223 PolarHBondContact OD1-SG 2.61Å
1218	F	73.8	Confident	79.8	Confident	9 Å²	9	61.4 Å²	61.4	4%	0.039	32%	0.318	C	S	.	.	G	3₁₀ helix	trans	-85.4	-18.6	-174.4	-71	-87.2	0	0	0	114.6	L1038 L1207 D1210 Q1211 Y1214 L1224 L1227	L1038-F1218 HydrophobicContact CD2-CD1 3.95Å; L1038-F1218 HydrophobicContact CD2-CE1 4.33Å; L1207-F1218 HydrophobicContact CB-CE1 4.01Å; L1207-F1218 HydrophobicContact CD2-CE1 4.11Å; D1210-F1218 HydrophobicContact CB-CZ 4.28Å; Q1211-F1218 HydrophobicContact CB-CD2 4.35Å; Q1211-F1218 HydrophobicContact CB-CE2 3.99Å; Q1211-F1218 HydrophobicContact CB-CZ 4.34Å; Q1211-F1218 HydrophobicContact CG-CD2 4.45Å; Y1214-F1218 WeakPolarHBondContact O-CD2 3.02Å; Y1214-F1218 VanDerWaalsContact O-CE2 3.3Å; Y1214-F1218 WeakPolarHBondContact O-CE2 3.46Å; F1218-L1224 HydrophobicContact CD1-CD1 3.83Å; F1218-L1224 HydrophobicContact CE1-CD1 4.14Å; F1218-L1227 HydrophobicContact CE1-CD2 4.07Å; F1218-L1227 HydrophobicContact CZ-CD2 4.02Å
1219	D	73.7	Confident	79.8	Confident	146 Å²	146	64.6 Å²	64.6	78%	0.781	34%	0.335	S	S	*	.	S	Bend	trans	-78.9	-28.1	177.1	-72.3	-22.3	0	0	0	112	N1221	D1219-N1221 PolarHBondContact O-N 3.27Å
1220	D	84.5	Confident	79.6	Confident	75 Å²	75	64.6 Å²	64.6	40%	0.401	34%	0.344	S	S	.	.			trans	-83	111	174	177.2	28.7	0	0	0	111.9	V1222 C1223 L1224	D1220-V1222 VanDerWaalsContact CG-N 3.33Å; D1220-V1222 PolarHBondContact O-N 3.07Å; D1220-V1222 WeakPolarHBondContact OD1-CB 3.21Å; D1220-V1222 PolarHBondContact OD1-N 2.88Å; D1220-V1222 WeakPolarHBondContact OD2-CB 3.26Å; D1220-C1223 HydrophobicContact CB-CB 4.08Å; D1220-C1223 PolarHBondContact O-N 3.06Å; D1220-C1223 WeakPolarHBondContact OD2-CB 3.49Å; D1220-C1223 PolarHBondContact OD2-N 3.14Å; D1220-L1224 WeakPolarHBondContact O-CB 3.45Å; D1220-L1224 PolarHBondContact O-N 2.92Å
1221	N	84.2	Confident	79.3	Confident	31 Å²	31	64.4 Å²	64.4	17%	0.166	34%	0.342	C	S	.	.	H	α-helix	trans	-56.4	-18.8	171.3	-75.1	-26.8	0	0	0	113.6	S1108 W1109 C1112 D1219	S1108-N1221 PolarHBondContact O-ND2 2.67Å; S1108-N1221 PolarHBondContact OG-ND2 3.42Å; W1109-N1221 HydrophobicContact CE3-CB 4.03Å; W1109-N1221 WeakPolarHBondContact CZ3-O 3.44Å; C1112-N1221 HydrophobicContact CB-CB 4.2Å; C1112-N1221 PolarHBondContact SG-O 2.9Å; D1219-N1221 PolarHBondContact O-N 3.27Å
1222	V	85.8	Confident	78.8	Confident	56 Å²	56	64.2 Å²	64.2	34%	0.339	36%	0.355	S	S	.	.	H	α-helix	trans	-82.9	-51.1	174.2	-175.9	0	0	0	0	112.1	R1116 D1220 L1224 Y1225 N1226	R1116-V1222 VanDerWaalsContact NH2-CG2 3.27Å; D1220-V1222 VanDerWaalsContact CG-N 3.33Å; D1220-V1222 PolarHBondContact O-N 3.07Å; D1220-V1222 WeakPolarHBondContact OD1-CB 3.21Å; D1220-V1222 PolarHBondContact OD1-N 2.88Å; D1220-V1222 WeakPolarHBondContact OD2-CB 3.26Å; V1222-L1224 PolarHBondContact O-N 3.11Å; V1222-Y1225 PolarHBondContact O-N 3.34Å; V1222-N1226 PolarHBondContact O-N 3.27Å; V1222-N1226 PolarHBondContact O-ND2 3.3Å
1223	C	85.6	Confident	78.7	Confident	38 Å²	38	63 Å²	63	26%	0.257	36%	0.362	S	S	.	.	H	α-helix	trans	-58.1	-47.6	175.3	-159.3	0	0	0	0	111.1	D1217 D1220 Y1225 N1226 L1227	D1217-C1223 HydrophobicContact CB-CB 4.46Å; D1217-C1223 PolarHBondContact OD1-SG 2.61Å; D1220-C1223 HydrophobicContact CB-CB 4.08Å; D1220-C1223 PolarHBondContact O-N 3.06Å; D1220-C1223 WeakPolarHBondContact OD2-CB 3.49Å; D1220-C1223 PolarHBondContact OD2-N 3.14Å; C1223-Y1225 PolarHBondContact O-N 2.94Å; C1223-N1226 PolarHBondContact O-N 2.78Å; C1223-N1226 VanDerWaalsContact O-N 3.11Å; C1223-L1227 WeakPolarHBondContact O-CB 3.42Å; C1223-L1227 PolarHBondContact O-N 2.81Å
1224	L	87.9	Confident	79	Confident	2 Å²	2	62 Å²	62	1%	0.01	36%	0.356	C	S	.	.	H	α-helix	trans	-59.2	-40.5	179.1	-175.9	60.6	0	0	0	113.4	K1041 W1109 L1207 F1218 D1220 V1222 L1227 I1228	K1041-L1224 HydrophobicContact CD-CD2 3.57Å; W1109-L1224 HydrophobicContact CE3-CD2 4.37Å; W1109-L1224 HydrophobicContact CH2-CB 4.21Å; W1109-L1224 HydrophobicContact CH2-CD2 3.94Å; W1109-L1224 HydrophobicContact CH2-CG 3.74Å; W1109-L1224 HydrophobicContact CZ2-CD2 4.42Å; W1109-L1224 HydrophobicContact CZ3-CB 3.98Å; W1109-L1224 HydrophobicContact CZ3-CD2 3.91Å; W1109-L1224 HydrophobicContact CZ3-CG 3.91Å; L1207-L1224 HydrophobicContact CD1-CD1 4.34Å; F1218-L1224 HydrophobicContact CD1-CD1 3.83Å; F1218-L1224 HydrophobicContact CE1-CD1 4.14Å; D1220-L1224 WeakPolarHBondContact O-CB 3.45Å; D1220-L1224 PolarHBondContact O-N 2.92Å; V1222-L1224 PolarHBondContact O-N 3.11Å; L1224-L1227 PolarHBondContact O-N 2.88Å; L1224-I1228 HydrophobicContact CD1-CD1 3.96Å; L1224-I1228 HydrophobicContact CD1-CG1 4.19Å; L1224-I1228 HydrophobicContact CG-CD1 4.02Å; L1224-I1228 VanDerWaalsContact O-CG1 3.3Å; L1224-I1228 WeakPolarHBondContact O-CG1 3.31Å; L1224-I1228 PolarHBondContact O-N 3.28Å
1225	Y	88.6	Confident	79.7	Confident	20 Å²	20	56 Å²	56	8%	0.078	33%	0.334	C	S	.	.	H	α-helix	trans	-63.4	-43.3	175.9	-177.7	-85.9	0	0	0	111.6	Y1045 C1113 R1116 V1222 C1223 N1229	Y1045-Y1225 AromaticContact CD2-CD2 3.98Å; Y1045-Y1225 HydrophobicContact CD2-CD2 3.98Å; Y1045-Y1225 AromaticContact CD2-CE2 3.88Å; Y1045-Y1225 HydrophobicContact CD2-CE2 3.88Å; Y1045-Y1225 HydrophobicContact CE2-CD2 4.02Å; Y1045-Y1225 AromaticContact CE2-CE2 3.75Å; Y1045-Y1225 HydrophobicContact CE2-CE2 3.75Å; C1113-Y1225 HydrophobicContact CB-CE2 4.4Å; R1116-Y1225 HydrophobicContact CB-CD1 4.47Å; R1116-Y1225 HydrophobicContact CB-CE1 3.77Å; R1116-Y1225 HydrophobicContact CB-CE2 4.09Å; R1116-Y1225 HydrophobicContact CG-CE1 4.39Å; R1116-Y1225 PolarHBondContact O-OH 3.25Å; V1222-Y1225 PolarHBondContact O-N 3.34Å; C1223-Y1225 PolarHBondContact O-N 2.94Å; Y1225-N1229 WeakPolarHBondContact O-CB 3.42Å; Y1225-N1229 PolarHBondContact O-N 2.72Å; Y1225-N1229 VanDerWaalsContact O-N 3.1Å
1226	N	86.5	Confident	80.7	Confident	90 Å²	90	57 Å²	57	48%	0.481	33%	0.328	S	S	.	.	H	α-helix	trans	-68.1	-39.3	179	-67.8	-33	0	0	0	111.6	V1222 C1223 N1229 G1230	V1222-N1226 PolarHBondContact O-N 3.27Å; V1222-N1226 PolarHBondContact O-ND2 3.3Å; C1223-N1226 PolarHBondContact O-N 2.78Å; C1223-N1226 VanDerWaalsContact O-N 3.11Å; N1226-N1229 PolarHBondContact O-N 3.41Å; N1226-G1230 PolarHBondContact O-N 3.15Å
1227	L	86.1	Confident	81.9	Confident	51 Å²	51	49.3 Å²	49.3	27%	0.267	29%	0.293	S	S	.	.	H	α-helix	trans	-58.6	-56	175.1	-179.3	62.6	0	0	0	110.7	L1207 F1218 C1223 L1224 N1229 G1230 E1231	L1207-L1227 HydrophobicContact CD2-CD2 3.88Å; L1207-L1227 HydrophobicContact CD2-CG 4.22Å; F1218-L1227 HydrophobicContact CE1-CD2 4.07Å; F1218-L1227 HydrophobicContact CZ-CD2 4.02Å; C1223-L1227 WeakPolarHBondContact O-CB 3.42Å; C1223-L1227 PolarHBondContact O-N 2.81Å; L1224-L1227 PolarHBondContact O-N 2.88Å; L1227-N1229 VanDerWaalsContact C-N 3.27Å; L1227-N1229 PolarHBondContact O-N 2.87Å; L1227-G1230 PolarHBondContact O-N 2.95Å; L1227-E1231 HydrophobicContact CD1-CG 3.86Å; L1227-E1231 HydrophobicContact CG-CG 4.28Å; L1227-E1231 VanDerWaalsContact O-CB 3.25Å; L1227-E1231 WeakPolarHBondContact O-CB 3.33Å; L1227-E1231 VanDerWaalsContact O-CG 3.29Å; L1227-E1231 WeakPolarHBondContact O-CG 3.17Å; L1227-E1231 PolarHBondContact O-N 2.9Å
1228	I	88	Confident	82.8	Confident	1 Å²	1	46.1 Å²	46.1	1%	0.005	28%	0.276	C	S	.	.	H	α-helix	trans	-62.1	-35.2	-179	-61	170.7	0	0	0	111.6	Y1045 W1109 M1203 L1207 L1224 G1232	Y1045-I1228 HydrophobicContact CD1-CG2 3.66Å; Y1045-I1228 HydrophobicContact CD2-CG2 4.48Å; Y1045-I1228 HydrophobicContact CE1-CB 4.39Å; Y1045-I1228 HydrophobicContact CE1-CG2 3.29Å; Y1045-I1228 HydrophobicContact CE2-CB 4.49Å; Y1045-I1228 HydrophobicContact CE2-CG2 4.18Å; Y1045-I1228 HydrophobicContact CG-CG2 4.22Å; W1109-I1228 HydrophobicContact CH2-CD1 4.02Å; W1109-I1228 HydrophobicContact CZ2-CD1 4.01Å; M1203-I1228 HydrophobicContact CE-CG2 4.28Å; M1203-I1228 HydrophobicContact CG-CG2 4.02Å; M1203-I1228 HydrophobicContact SD-CG2 4.31Å; L1207-I1228 HydrophobicContact CD1-CD1 3.92Å; L1207-I1228 HydrophobicContact CD1-CG1 3.89Å; L1207-I1228 HydrophobicContact CD2-CG1 4.18Å; L1224-I1228 HydrophobicContact CD1-CD1 3.96Å; L1224-I1228 HydrophobicContact CD1-CG1 4.19Å; L1224-I1228 HydrophobicContact CG-CD1 4.02Å; L1224-I1228 VanDerWaalsContact O-CG1 3.3Å; L1224-I1228 WeakPolarHBondContact O-CG1 3.31Å; L1224-I1228 PolarHBondContact O-N 3.28Å; I1228-G1232 PolarHBondContact O-N 3.32Å
1229	N	86.3	Confident	83.3	Confident	69 Å²	69	46.7 Å²	46.7	37%	0.369	28%	0.278	S	S	.	.	H	α-helix	trans	-72.6	-36.9	177.3	-167.6	44.6	0	0	0	113	Y1045 K1049 Y1225 N1226 L1227	Y1045-N1229 VanDerWaalsContact OH-CA 3.31Å; Y1045-N1229 WeakPolarHBondContact OH-CA 3.4Å; Y1045-N1229 PolarHBondContact OH-N 3.2Å; K1049-N1229 PolarHBondContact NZ-OD1 3.44Å; Y1225-N1229 WeakPolarHBondContact O-CB 3.42Å; Y1225-N1229 PolarHBondContact O-N 2.72Å; Y1225-N1229 VanDerWaalsContact O-N 3.1Å; N1226-N1229 PolarHBondContact O-N 3.41Å; L1227-N1229 VanDerWaalsContact C-N 3.27Å; L1227-N1229 PolarHBondContact O-N 2.87Å
1230	G	79.8	Confident	83.5	Confident	33 Å²	33	40.2 Å²	40.2	34%	0.34	24%	0.243	S	C	.	.	H	α-helix	trans	-72.4	-47.9	175.1	0	0	0	0	0	112.9	N1226 L1227 G1232 S1233 T1234	N1226-G1230 PolarHBondContact O-N 3.15Å; L1227-G1230 PolarHBondContact O-N 2.95Å; G1230-G1232 PolarHBondContact O-N 3.38Å; G1230-S1233 PolarHBondContact O-N 2.93Å; G1230-S1233 VanDerWaalsContact O-N 3.08Å; G1230-S1233 PolarHBondContact O-OG 3.47Å; G1230-T1234 PolarHBondContact O-N 3.47Å; G1230-T1234 PolarHBondContact O-OG1 3.34Å
1231	E	75.8	Confident	83.1	Confident	19 Å²	19	39.2 Å²	39.2	9%	0.089	24%	0.238	C	C	.	.	H	α-helix	trans	-57.4	-47.6	175.6	-76.3	-103.8	119.6	0	0	111.6	M1203 K1206 L1227 S1233 T1234 V1235	M1203-E1231 HydrophobicContact CE-CB 4.35Å; M1203-E1231 HydrophobicContact SD-CB 4.39Å; K1206-E1231 WeakPolarHBondContact CE-OE2 3.32Å; K1206-E1231 WeakPolarHBondContact CG-OE2 3.31Å; K1206-E1231 IonicContact NZ-OE1 2.74Å; K1206-E1231 PolarHBondContact NZ-OE1 3.45Å; K1206-E1231 IonicContact NZ-OE2 3.74Å; K1206-E1231 PolarHBondContact NZ-OE2 3.23Å; L1227-E1231 HydrophobicContact CD1-CG 3.86Å; L1227-E1231 HydrophobicContact CG-CG 4.28Å; L1227-E1231 VanDerWaalsContact O-CB 3.25Å; L1227-E1231 WeakPolarHBondContact O-CB 3.33Å; L1227-E1231 VanDerWaalsContact O-CG 3.29Å; L1227-E1231 WeakPolarHBondContact O-CG 3.17Å; L1227-E1231 PolarHBondContact O-N 2.9Å; E1231-S1233 PolarHBondContact O-N 3.12Å; E1231-T1234 PolarHBondContact O-N 3.05Å; E1231-T1234 PolarHBondContact O-OG1 3.16Å; E1231-V1235 PolarHBondContact O-N 2.89Å
1232	G	69.9	Low	82.8	Confident	52 Å²	52	40 Å²	40	54%	0.536	24%	0.242	S	C	.	.	H	α-helix	trans	-63.1	-5.4	176.6	0	0	0	0	0	115.5	I1228 G1230	I1228-G1232 PolarHBondContact O-N 3.32Å; G1230-G1232 PolarHBondContact O-N 3.38Å
1233	S	71.5	Confident	82.4	Confident	98 Å²	98	40 Å²	40	69%	0.685	24%	0.244	S	C	*	.	H	α-helix	trans	-107.6	-12.5	171.5	75.3	0	0	0	0	114.3	G1230 E1231	G1230-S1233 PolarHBondContact O-N 2.93Å; G1230-S1233 VanDerWaalsContact O-N 3.08Å; G1230-S1233 PolarHBondContact O-OG 3.47Å; E1231-S1233 PolarHBondContact O-N 3.12Å
1234	T	79	Confident	82.3	Confident	73 Å²	73	40.1 Å²	40.1	45%	0.448	25%	0.247	S	C	.	.	H	α-helix	trans	-121.5	-23	-171.3	52.7	0	0	0	0	114.2	G1230 E1231	G1230-T1234 PolarHBondContact O-N 3.47Å; G1230-T1234 PolarHBondContact O-OG1 3.34Å; E1231-T1234 PolarHBondContact O-N 3.05Å; E1231-T1234 PolarHBondContact O-OG1 3.16Å
1235	V	84.8	Confident	82.1	Confident	12 Å²	12	40.2 Å²	40.2	7%	0.073	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	121.8	178.9	-171	0	0	0	0	109.5	E1231 I1237 K1255 L1257	E1231-V1235 PolarHBondContact O-N 2.89Å; V1235-I1237 HydrophobicContact CG1-CD1 4.39Å; V1235-I1237 HydrophobicContact CG1-CG1 3.84Å; V1235-K1255 HydrophobicContact CB-CB 4.4Å; V1235-K1255 HydrophobicContact CG1-CB 4.3Å; V1235-K1255 HydrophobicContact CG2-CB 4.07Å; V1235-K1255 HydrophobicContact CG2-CD 3.89Å; V1235-L1257 HydrophobicContact CG1-CB 4.4Å
1236	F	89	Confident	81.8	Confident	72 Å²	72	41.2 Å²	41.2	32%	0.316	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	119.7	171.3	-172.3	-93.1	0	0	0	110.5	S1238 A1244 W1245 A1248 K1255 L1256 L1257	F1236-S1238 WeakPolarHBondContact CE1-OG 3.24Å; F1236-A1244 HydrophobicContact CE1-CB 4.46Å; F1236-A1244 HydrophobicContact CZ-CB 3.77Å; F1236-W1245 HydrophobicContact CD1-CE3 4.25Å; F1236-W1245 HydrophobicContact CE1-CE3 4.5Å; F1236-A1248 HydrophobicContact CB-CB 4.35Å; F1236-A1248 HydrophobicContact CD1-CB 3.58Å; F1236-A1248 HydrophobicContact CD2-CB 4.23Å; F1236-A1248 HydrophobicContact CE1-CB 3.89Å; F1236-A1248 HydrophobicContact CG-CB 3.77Å; F1236-A1248 HydrophobicContact CZ-CB 4.36Å; F1236-K1255 PolarHBondContact N-O 3.39Å; F1236-L1256 HydrophobicContact CB-CD2 4.32Å; F1236-L1256 HydrophobicContact CB-CG 4.31Å; F1236-L1256 HydrophobicContact CD1-CD2 4.13Å; F1236-L1256 CarbonylContact O-C 3.55Å; F1236-L1256 WeakPolarHBondContact O-CA 3.14Å; F1236-L1257 PolarHBondContact O-N 3.45Å
1237	I	90.6	Very high	81.7	Confident	22 Å²	22	39.9 Å²	39.9	11%	0.113	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	116.7	-176.2	-44.1	176.4	0	0	0	110.6	F1172 R1202 M1203 K1206 V1235 L1257	F1172-I1237 HydrophobicContact CE2-CG2 3.79Å; F1172-I1237 HydrophobicContact CZ-CG2 3.76Å; R1202-I1237 HydrophobicContact CB-CB 4.12Å; R1202-I1237 HydrophobicContact CB-CG2 3.63Å; R1202-I1237 WeakPolarHBondContact CD-O 3.36Å; R1202-I1237 HydrophobicContact CG-CG2 4.04Å; R1202-I1237 PolarHBondContact NH1-O 2.83Å; M1203-I1237 HydrophobicContact CE-CD1 4.35Å; K1206-I1237 HydrophobicContact CB-CD1 3.84Å; K1206-I1237 HydrophobicContact CG-CD1 4.23Å; V1235-I1237 HydrophobicContact CG1-CD1 4.39Å; V1235-I1237 HydrophobicContact CG1-CG1 3.84Å; I1237-L1257 WeakPolarHBondContact CA-O 3.38Å; I1237-L1257 HydrophobicContact CG1-CB 4.42Å; I1237-L1257 HydrophobicContact CG2-CB 4.37Å; I1237-L1257 HydrophobicContact CG2-CD2 3.82Å; I1237-L1257 WeakPolarHBondContact CG2-O 3.49Å
1238	S	86.9	Confident	81.8	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	23%	0.234	C	C	.	.			trans	-157.8	170.7	171.5	75.4	0	0	0	0	112	F1172 F1236 W1245 L1257 A1258	F1172-S1238 VanDerWaalsContact CE1-C 3.48Å; F1172-S1238 WeakPolarHBondContact CE1-O 3.24Å; F1236-S1238 WeakPolarHBondContact CE1-OG 3.24Å; S1238-W1245 WeakPolarHBondContact OG-CB 3.39Å; S1238-L1257 PolarHBondContact N-O 2.94Å; S1238-A1258 WeakPolarHBondContact O-CA 3.41Å; S1238-A1258 VanDerWaalsContact O-CB 3.29Å; S1238-A1258 WeakPolarHBondContact O-CB 3.4Å
1239	H	84.2	Confident	81.7	Confident	20 Å²	20	37.8 Å²	37.8	9%	0.093	23%	0.234	C	C	.	.			trans	-71.7	149.3	166.6	-179.4	-90.2	0	0	0	110.5	H1169 F1172 K1173 N1241 D1242	H1169-H1239 AromaticContact NE2-CD2 3.71Å; H1169-H1239 AromaticContact NE2-NE2 3.6Å; F1172-H1239 HydrophobicContact CD1-CB 4.22Å; F1172-H1239 HydrophobicContact CE1-CB 4.29Å; K1173-H1239 HydrophobicContact CB-CB 4.41Å; H1239-N1241 PolarHBondContact ND1-N 2.76Å; H1239-N1241 PolarHBondContact O-N 2.98Å; H1239-D1242 WeakPolarHBondContact O-CB 3.36Å; H1239-D1242 PolarHBondContact O-N 2.8Å; H1239-D1242 VanDerWaalsContact O-N 3.13Å
1240	E	79	Confident	81.5	Confident	10 Å²	10	35.1 Å²	35.1	5%	0.047	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-26.7	-170.2	-58.2	-173	104.7	0	0	114.1	L886 D1242 W1245 A1258 R1260	L886-E1240 HydrophobicContact CD2-CB 3.6Å; E1240-D1242 PolarHBondContact O-N 3.4Å; E1240-W1245 HydrophobicContact CB-CG 4.45Å; E1240-W1245 HydrophobicContact CG-CD2 4.42Å; E1240-W1245 HydrophobicContact CG-CZ2 3.94Å; E1240-A1258 HydrophobicContact CG-CB 3.5Å; E1240-A1258 VanDerWaalsContact CG-CB 3.5Å; E1240-R1260 VanDerWaalsContact CD-NH2 3.32Å; E1240-R1260 IonicContact OE1-CZ 3.68Å; E1240-R1260 IonicContact OE1-NH2 2.73Å; E1240-R1260 PolarHBondContact OE1-NH2 3.29Å; E1240-R1260 IonicContact OE2-CZ 2.88Å; E1240-R1260 IonicContact OE2-NE 3.93Å; E1240-R1260 PolarHBondContact OE2-NE 2.84Å; E1240-R1260 IonicContact OE2-NH2 3.74Å; E1240-R1260 PolarHBondContact OE2-NH2 3.01Å
1241	N	75.6	Confident	81.7	Confident	55 Å²	55	37.4 Å²	37.4	29%	0.294	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.4	0.1	173.4	-59.8	4	0	0	0	113.5	L886 H1239	L886-N1241 VanDerWaalsContact CD2-OD1 3.26Å; L886-N1241 WeakPolarHBondContact CD2-OD1 3.44Å; H1239-N1241 PolarHBondContact ND1-N 2.76Å; H1239-N1241 PolarHBondContact O-N 2.98Å
1242	D	77.1	Confident	82.1	Confident	46 Å²	46	38.9 Å²	38.9	25%	0.246	24%	0.239	C	C	.	.	S	Bend	trans	-73.2	125.7	173.3	-170.3	-28.5	0	0	0	109.1	R1202 H1239 E1240 A1244 W1245	R1202-D1242 IonicContact NH1-OD2 3.78Å; H1239-D1242 WeakPolarHBondContact O-CB 3.36Å; H1239-D1242 PolarHBondContact O-N 2.8Å; H1239-D1242 VanDerWaalsContact O-N 3.13Å; E1240-D1242 PolarHBondContact O-N 3.4Å; D1242-A1244 PolarHBondContact O-N 3.28Å; D1242-A1244 VanDerWaalsContact O-N 3.07Å; D1242-A1244 VanDerWaalsContact OD1-CB 3.26Å; D1242-A1244 WeakPolarHBondContact OD1-CB 3.45Å; D1242-A1244 PolarHBondContact OD1-N 2.76Å; D1242-W1245 HydrophobicContact CB-CB 4.42Å; D1242-W1245 WeakPolarHBondContact O-CB 3.42Å; D1242-W1245 PolarHBondContact O-N 3.01Å
1243	P	78.2	Confident	82.8	Confident	58 Å²	58	38.3 Å²	38.3	38%	0.377	23%	0.225	S	C	.	.	H	α-helix	trans	-56.7	-25.4	175.6	24	-34.5	0	0	0	113	R1246 D1247	P1243-R1246 PolarHBondContact O-N 3.36Å; P1243-D1247 PolarHBondContact O-N 2.99Å; P1243-D1247 VanDerWaalsContact O-N 3.08Å
1244	A	83	Confident	83.6	Confident	39 Å²	39	36.7 Å²	36.7	32%	0.322	22%	0.217	S	C	.	.	H	α-helix	trans	-69.1	-32.1	174.9	0	0	0	0	0	112.9	F1236 D1242 R1246 D1247 A1248	F1236-A1244 HydrophobicContact CE1-CB 4.46Å; F1236-A1244 HydrophobicContact CZ-CB 3.77Å; D1242-A1244 PolarHBondContact O-N 3.28Å; D1242-A1244 VanDerWaalsContact O-N 3.07Å; D1242-A1244 VanDerWaalsContact OD1-CB 3.26Å; D1242-A1244 WeakPolarHBondContact OD1-CB 3.45Å; D1242-A1244 PolarHBondContact OD1-N 2.76Å; A1244-R1246 VanDerWaalsContact C-N 3.34Å; A1244-R1246 PolarHBondContact O-N 3.03Å; A1244-D1247 PolarHBondContact O-N 3.47Å; A1244-A1248 WeakPolarHBondContact O-CB 3.4Å; A1244-A1248 PolarHBondContact O-N 3.09Å
1245	W	85.1	Confident	84.1	Confident	4 Å²	4	36.8 Å²	36.8	2%	0.015	21%	0.212	C	C	.	.	H	α-helix	trans	-56.5	-50.8	170.1	-178.6	-112.1	0	0	0	110.6	F1236 S1238 E1240 D1242 D1247 A1248 V1249 L1256 L1257 A1258 L1275	F1236-W1245 HydrophobicContact CD1-CE3 4.25Å; F1236-W1245 HydrophobicContact CE1-CE3 4.5Å; S1238-W1245 WeakPolarHBondContact OG-CB 3.39Å; E1240-W1245 HydrophobicContact CB-CG 4.45Å; E1240-W1245 HydrophobicContact CG-CD2 4.42Å; E1240-W1245 HydrophobicContact CG-CZ2 3.94Å; D1242-W1245 HydrophobicContact CB-CB 4.42Å; D1242-W1245 WeakPolarHBondContact O-CB 3.42Å; D1242-W1245 PolarHBondContact O-N 3.01Å; W1245-D1247 PolarHBondContact O-N 3.49Å; W1245-A1248 WeakPolarHBondContact O-CB 3Å; W1245-A1248 PolarHBondContact O-N 3.37Å; W1245-V1249 HydrophobicContact CD2-CG2 4.42Å; W1245-V1249 WeakPolarHBondContact O-CG2 3.39Å; W1245-V1249 PolarHBondContact O-N 3.16Å; W1245-L1256 HydrophobicContact CD2-CD2 4.38Å; W1245-L1256 HydrophobicContact CE3-CB 4.21Å; W1245-L1256 HydrophobicContact CE3-CD2 4Å; W1245-L1256 HydrophobicContact CH2-CB 3.55Å; W1245-L1256 HydrophobicContact CH2-CD2 4.47Å; W1245-L1256 HydrophobicContact CZ2-CB 4.44Å; W1245-L1256 HydrophobicContact CZ3-CB 3.42Å; W1245-L1256 VanDerWaalsContact CZ3-CB 3.42Å; W1245-L1256 HydrophobicContact CZ3-CD2 4.05Å; W1245-L1256 HydrophobicContact CZ3-CG 4.4Å; W1245-L1257 WeakPolarHBondContact CZ3-O 3.28Å; W1245-A1258 HydrophobicContact CH2-CB 3.54Å; W1245-A1258 HydrophobicContact CZ2-CB 3.91Å; W1245-A1258 HydrophobicContact CZ3-CB 3.88Å; W1245-L1275 HydrophobicContact CH2-CD1 4.03Å; W1245-L1275 HydrophobicContact CH2-CG 4.33Å; W1245-L1275 HydrophobicContact CZ2-CD1 3.47Å; W1245-L1275 VanDerWaalsContact CZ2-CD1 3.47Å; W1245-L1275 HydrophobicContact CZ2-CG 4.12Å
1246	R	82.2	Confident	84.4	Confident	41 Å²	41	36.2 Å²	36.2	16%	0.155	21%	0.208	C	C	.	.	H	α-helix	trans	-63.3	-44.8	-178.2	-179.3	162.4	168.1	-125.1	-4.6	111.6	D865 I889 E892 P1243 A1244 A1248 L1250	D865-R1246 VanDerWaalsContact CG-NH1 3.32Å; D865-R1246 WeakPolarHBondContact OD1-CD 3.46Å; D865-R1246 IonicContact OD1-CZ 2.84Å; D865-R1246 IonicContact OD1-NE 3.01Å; D865-R1246 IonicContact OD1-NH1 3.46Å; D865-R1246 PolarHBondContact OD1-NH1 2.99Å; D865-R1246 IonicContact OD2-NH1 3.58Å; D865-R1246 PolarHBondContact OD2-NH1 3.31Å; I889-R1246 HydrophobicContact CD1-CB 4.28Å; I889-R1246 HydrophobicContact CD1-CG 4.33Å; I889-R1246 HydrophobicContact CG2-CG 4.18Å; E892-R1246 IonicContact OE1-NH2 2.76Å; E892-R1246 PolarHBondContact OE1-NH2 3.33Å; E892-R1246 IonicContact OE2-CZ 3.78Å; E892-R1246 IonicContact OE2-NE 3.94Å; E892-R1246 PolarHBondContact OE2-NE 3.27Å; E892-R1246 IonicContact OE2-NH2 3.33Å; E892-R1246 PolarHBondContact OE2-NH2 2.95Å; P1243-R1246 PolarHBondContact O-N 3.36Å; A1244-R1246 VanDerWaalsContact C-N 3.34Å; A1244-R1246 PolarHBondContact O-N 3.03Å; R1246-A1248 VanDerWaalsContact C-N 3.34Å; R1246-A1248 PolarHBondContact O-N 2.92Å; R1246-L1250 HydrophobicContact CG-CD1 3.5Å; R1246-L1250 HydrophobicContact CG-CG 4.37Å; R1246-L1250 WeakPolarHBondContact O-CB 3.44Å; R1246-L1250 VanDerWaalsContact O-CD1 3.29Å; R1246-L1250 WeakPolarHBondContact O-CD1 3.4Å; R1246-L1250 WeakPolarHBondContact O-CG 3.4Å; R1246-L1250 PolarHBondContact O-N 2.85Å
1247	D	83.3	Confident	84.5	Confident	63 Å²	63	32.8 Å²	32.8	34%	0.337	19%	0.193	S	C	.	.	H	α-helix	trans	-67.6	-30.1	175.4	-89.5	-44.3	0	0	0	113.4	P613 P1243 A1244 W1245 L1250 S1251	P613-D1247 WeakPolarHBondContact CG-OD1 3.22Å; P613-D1247 WeakPolarHBondContact CG-OD2 3.22Å; P1243-D1247 PolarHBondContact O-N 2.99Å; P1243-D1247 VanDerWaalsContact O-N 3.08Å; A1244-D1247 PolarHBondContact O-N 3.47Å; W1245-D1247 PolarHBondContact O-N 3.49Å; D1247-L1250 CarbonylContact O-C 3.39Å; D1247-S1251 VanDerWaalsContact O-CB 3.31Å; D1247-S1251 WeakPolarHBondContact O-CB 3.25Å; D1247-S1251 PolarHBondContact O-N 3.14Å; D1247-S1251 PolarHBondContact O-OG 2.93Å
1248	A	87.7	Confident	84.5	Confident	7 Å²	7	31.7 Å²	31.7	6%	0.058	19%	0.188	C	C	.	.	H	α-helix	trans	-66.2	-55	171.6	0	0	0	0	0	111.7	F1236 A1244 W1245 R1246 L1250 S1251 N1252 T1253 L1256	F1236-A1248 HydrophobicContact CB-CB 4.35Å; F1236-A1248 HydrophobicContact CD1-CB 3.58Å; F1236-A1248 HydrophobicContact CD2-CB 4.23Å; F1236-A1248 HydrophobicContact CE1-CB 3.89Å; F1236-A1248 HydrophobicContact CG-CB 3.77Å; F1236-A1248 HydrophobicContact CZ-CB 4.36Å; A1244-A1248 WeakPolarHBondContact O-CB 3.4Å; A1244-A1248 PolarHBondContact O-N 3.09Å; W1245-A1248 WeakPolarHBondContact O-CB 3Å; W1245-A1248 PolarHBondContact O-N 3.37Å; R1246-A1248 VanDerWaalsContact C-N 3.34Å; R1246-A1248 PolarHBondContact O-N 2.92Å; A1248-L1250 PolarHBondContact O-N 2.83Å; A1248-L1250 VanDerWaalsContact O-N 3.12Å; A1248-S1251 WeakPolarHBondContact CA-OG 3.39Å; A1248-S1251 PolarHBondContact O-N 2.84Å; A1248-S1251 PolarHBondContact O-OG 3.1Å; A1248-N1252 PolarHBondContact O-N 3.13Å; A1248-T1253 HydrophobicContact CB-CG2 4.06Å; A1248-T1253 PolarHBondContact O-OG1 3.3Å; A1248-L1256 HydrophobicContact CB-CD2 3.62Å
1249	V	86.1	Confident	84.5	Confident	1 Å²	1	31.8 Å²	31.8	1%	0.006	19%	0.188	C	C	.	.	H	α-helix	trans	-52.7	-39.6	175.9	173.3	0	0	0	0	111.1	I889 H893 Y1012 W1245 L1256 L1275	I889-V1249 HydrophobicContact CG2-CB 4.25Å; I889-V1249 HydrophobicContact CG2-CG1 3.86Å; H893-V1249 PolarHBondContact ND1-O 2.82Å; Y1012-V1249 HydrophobicContact CD2-CG1 4.31Å; Y1012-V1249 HydrophobicContact CE2-CB 4.5Å; Y1012-V1249 HydrophobicContact CE2-CG1 3.7Å; Y1012-V1249 WeakPolarHBondContact CE2-O 3.49Å; Y1012-V1249 WeakPolarHBondContact OH-CA 3.21Å; Y1012-V1249 PolarHBondContact OH-O 3.08Å; W1245-V1249 HydrophobicContact CD2-CG2 4.42Å; W1245-V1249 WeakPolarHBondContact O-CG2 3.39Å; W1245-V1249 PolarHBondContact O-N 3.16Å; V1249-L1256 HydrophobicContact CG2-CD1 4.33Å; V1249-L1256 HydrophobicContact CG2-CD2 3.63Å; V1249-L1275 HydrophobicContact CG2-CD1 4.13Å
1250	L	83.8	Confident	84.5	Confident	13 Å²	13	32.1 Å²	32.1	7%	0.068	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.4	2.6	-178.6	-65.7	172.1	0	0	0	115.5	E892 H893 R1246 D1247 A1248	E892-L1250 HydrophobicContact CB-CD2 4.26Å; E892-L1250 HydrophobicContact CG-CD2 3.95Å; H893-L1250 HydrophobicContact CB-CD2 4Å; R1246-L1250 HydrophobicContact CG-CD1 3.5Å; R1246-L1250 HydrophobicContact CG-CG 4.37Å; R1246-L1250 WeakPolarHBondContact O-CB 3.44Å; R1246-L1250 VanDerWaalsContact O-CD1 3.29Å; R1246-L1250 WeakPolarHBondContact O-CD1 3.4Å; R1246-L1250 WeakPolarHBondContact O-CG 3.4Å; R1246-L1250 PolarHBondContact O-N 2.85Å; D1247-L1250 CarbonylContact O-C 3.39Å; A1248-L1250 PolarHBondContact O-N 2.83Å; A1248-L1250 VanDerWaalsContact O-N 3.12Å
1251	S	82.6	Confident	84.6	Confident	80 Å²	80	33 Å²	33	56%	0.559	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	-110.6	5.4	168	55.4	0	0	0	0	113	D1247 A1248	D1247-S1251 VanDerWaalsContact O-CB 3.31Å; D1247-S1251 WeakPolarHBondContact O-CB 3.25Å; D1247-S1251 PolarHBondContact O-N 3.14Å; D1247-S1251 PolarHBondContact O-OG 2.93Å; A1248-S1251 WeakPolarHBondContact CA-OG 3.39Å; A1248-S1251 PolarHBondContact O-N 2.84Å; A1248-S1251 PolarHBondContact O-OG 3.1Å
1252	N	84.3	Confident	84.5	Confident	50 Å²	50	31.7 Å²	31.7	27%	0.267	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	64.9	39.6	173.7	-55.9	24	0	0	0	112.8	H893 D1010 Y1012 A1248 K1277	H893-N1252 VanDerWaalsContact CE1-CG 3.48Å; H893-N1252 PolarHBondContact CE1-OD1 3.5Å; H893-N1252 PolarHBondContact ND1-OD1 2.98Å; D1010-N1252 PolarHBondContact OD2-ND2 2.85Å; Y1012-N1252 WeakPolarHBondContact OH-CA 3.41Å; A1248-N1252 PolarHBondContact O-N 3.13Å; N1252-K1277 HydrophobicContact CB-CD 4.4Å
1253	T	85.8	Confident	84	Confident	40 Å²	40	30.5 Å²	30.5	25%	0.245	18%	0.182	C	C	.	.			trans	-54.5	141.5	170.7	45.9	0	0	0	0	111.9	Y1012 A1248 L1256	Y1012-T1253 WeakPolarHBondContact CE1-O 3.32Å; A1248-T1253 HydrophobicContact CB-CG2 4.06Å; A1248-T1253 PolarHBondContact O-OG1 3.3Å; T1253-L1256 WeakPolarHBondContact OG1-CD1 3.48Å; T1253-L1256 WeakPolarHBondContact OG1-CG 3.31Å
1254	A	86.8	Confident	83.2	Confident	64 Å²	64	33.6 Å²	33.6	53%	0.529	19%	0.191	S	C	.	.	S	Bend	trans	-68.2	-42.3	-169.6	0	0	0	0	0	114.3	K1277	A1254-K1277 PolarHBondContact O-N 2.97Å
1255	K	90.3	Very high	82.2	Confident	75 Å²	75	40 Å²	40	33%	0.326	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	140.3	176.2	-62.1	-176	173.8	-179.3	0	110	V1235 F1236 L1275	V1235-K1255 HydrophobicContact CB-CB 4.4Å; V1235-K1255 HydrophobicContact CG1-CB 4.3Å; V1235-K1255 HydrophobicContact CG2-CB 4.07Å; V1235-K1255 HydrophobicContact CG2-CD 3.89Å; F1236-K1255 PolarHBondContact N-O 3.39Å; K1255-L1275 CarbonylContact C-O 3.59Å; K1255-L1275 WeakPolarHBondContact CA-O 3.28Å
1256	L	91.3	Very high	81.2	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	151.2	165.7	-43.1	92.3	0	0	0	110.9	Y1012 F1236 W1245 A1248 V1249 T1253 M1274 L1275	Y1012-L1256 HydrophobicContact CD1-CD1 4.05Å; Y1012-L1256 HydrophobicContact CE1-CD1 3.42Å; Y1012-L1256 VanDerWaalsContact CE1-CD1 3.42Å; F1236-L1256 HydrophobicContact CB-CD2 4.32Å; F1236-L1256 HydrophobicContact CB-CG 4.31Å; F1236-L1256 HydrophobicContact CD1-CD2 4.13Å; F1236-L1256 CarbonylContact O-C 3.55Å; F1236-L1256 WeakPolarHBondContact O-CA 3.14Å; W1245-L1256 HydrophobicContact CD2-CD2 4.38Å; W1245-L1256 HydrophobicContact CE3-CB 4.21Å; W1245-L1256 HydrophobicContact CE3-CD2 4Å; W1245-L1256 HydrophobicContact CH2-CB 3.55Å; W1245-L1256 HydrophobicContact CH2-CD2 4.47Å; W1245-L1256 HydrophobicContact CZ2-CB 4.44Å; W1245-L1256 HydrophobicContact CZ3-CB 3.42Å; W1245-L1256 VanDerWaalsContact CZ3-CB 3.42Å; W1245-L1256 HydrophobicContact CZ3-CD2 4.05Å; W1245-L1256 HydrophobicContact CZ3-CG 4.4Å; A1248-L1256 HydrophobicContact CB-CD2 3.62Å; V1249-L1256 HydrophobicContact CG2-CD1 4.33Å; V1249-L1256 HydrophobicContact CG2-CD2 3.63Å; T1253-L1256 WeakPolarHBondContact OG1-CD1 3.48Å; T1253-L1256 WeakPolarHBondContact OG1-CG 3.31Å; L1256-M1274 CarbonylContact O-C 3.57Å; L1256-M1274 WeakPolarHBondContact O-CA 3.28Å; L1256-M1274 WeakPolarHBondContact O-CG 3.38Å; L1256-L1275 HydrophobicContact CB-CB 4.25Å; L1256-L1275 HydrophobicContact CD1-CB 3.81Å; L1256-L1275 HydrophobicContact CD1-CD1 4.22Å; L1256-L1275 PolarHBondContact N-O 2.86Å; L1256-L1275 PolarHBondContact O-N 3.13Å
1257	L	91.2	Very high	80.5	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	134.2	172.8	-176.8	151.4	0	0	0	111.5	F1172 K1206 V1235 F1236 I1237 S1238 W1245 I1272 I1273 M1274	F1172-L1257 HydrophobicContact CE2-CD2 4.24Å; F1172-L1257 HydrophobicContact CZ-CD2 4.17Å; K1206-L1257 HydrophobicContact CB-CD1 4.36Å; K1206-L1257 HydrophobicContact CD-CD1 3.81Å; V1235-L1257 HydrophobicContact CG1-CB 4.4Å; F1236-L1257 PolarHBondContact O-N 3.45Å; I1237-L1257 WeakPolarHBondContact CA-O 3.38Å; I1237-L1257 HydrophobicContact CG1-CB 4.42Å; I1237-L1257 HydrophobicContact CG2-CB 4.37Å; I1237-L1257 HydrophobicContact CG2-CD2 3.82Å; I1237-L1257 WeakPolarHBondContact CG2-O 3.49Å; S1238-L1257 PolarHBondContact N-O 2.94Å; W1245-L1257 WeakPolarHBondContact CZ3-O 3.28Å; L1257-I1272 HydrophobicContact CD1-CG2 3.77Å; L1257-I1272 HydrophobicContact CD2-CG2 4.21Å; L1257-I1272 HydrophobicContact CG-CG2 3.97Å; L1257-I1273 WeakPolarHBondContact CA-O 3.45Å; L1257-M1274 HydrophobicContact CD1-CE 4.13Å
1258	A	90.3	Very high	79.9	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	153.9	170.9	0	0	0	0	0	111.2	S1238 E1240 W1245 I1273	S1238-A1258 WeakPolarHBondContact O-CA 3.41Å; S1238-A1258 VanDerWaalsContact O-CB 3.29Å; S1238-A1258 WeakPolarHBondContact O-CB 3.4Å; E1240-A1258 HydrophobicContact CG-CB 3.5Å; E1240-A1258 VanDerWaalsContact CG-CB 3.5Å; W1245-A1258 HydrophobicContact CH2-CB 3.54Å; W1245-A1258 HydrophobicContact CZ2-CB 3.91Å; W1245-A1258 HydrophobicContact CZ3-CB 3.88Å; A1258-I1273 PolarHBondContact N-O 3.31Å; A1258-I1273 PolarHBondContact O-N 2.76Å
1259	L	87.8	Confident	79.5	Confident	1 Å²	1	50 Å²	50	1%	0.005	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	117.2	162.8	179.9	63.8	0	0	0	107.6	A1019 L1168 H1169 F1172 L1205 I1272	A1019-L1259 HydrophobicContact CB-CD1 4.15Å; L1168-L1259 HydrophobicContact CG-CD2 4.47Å; H1169-L1259 HydrophobicContact CB-CD2 4.03Å; F1172-L1259 HydrophobicContact CB-CD2 4.45Å; F1172-L1259 HydrophobicContact CD1-CB 3.9Å; F1172-L1259 HydrophobicContact CD2-CB 4.36Å; F1172-L1259 HydrophobicContact CE1-CB 3.98Å; F1172-L1259 VanDerWaalsContact CE1-N 3.32Å; F1172-L1259 HydrophobicContact CE2-CB 4.42Å; F1172-L1259 HydrophobicContact CG-CB 4.12Å; F1172-L1259 HydrophobicContact CZ-CB 4.26Å; L1205-L1259 HydrophobicContact CD2-CB 4.04Å; L1205-L1259 HydrophobicContact CD2-CD2 4.16Å; L1205-L1259 HydrophobicContact CD2-CG 4.5Å; L1259-I1272 HydrophobicContact CD1-CG1 4.13Å
1260	R	84.1	Confident	79.4	Confident	28 Å²	28	50 Å²	50	11%	0.106	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	137.9	174.4	-173.8	-175.7	-63.1	-174.2	8.4	109.9	D883 E1240 V1262 F1270 K1271 I1273	D883-R1260 IonicContact OD1-CZ 3.93Å; D883-R1260 IonicContact OD1-NE 3.26Å; D883-R1260 IonicContact OD1-NH1 2.92Å; D883-R1260 PolarHBondContact OD1-NH1 3.26Å; E1240-R1260 VanDerWaalsContact CD-NH2 3.32Å; E1240-R1260 IonicContact OE1-CZ 3.68Å; E1240-R1260 IonicContact OE1-NH2 2.73Å; E1240-R1260 PolarHBondContact OE1-NH2 3.29Å; E1240-R1260 IonicContact OE2-CZ 2.88Å; E1240-R1260 IonicContact OE2-NE 3.93Å; E1240-R1260 PolarHBondContact OE2-NE 2.84Å; E1240-R1260 IonicContact OE2-NH2 3.74Å; E1240-R1260 PolarHBondContact OE2-NH2 3.01Å; R1260-V1262 VanDerWaalsContact CD-CG2 3.49Å; R1260-V1262 HydrophobicContact CG-CG2 3.82Å; R1260-F1270 WeakPolarHBondContact O-CA 3.34Å; R1260-K1271 PolarHBondContact N-O 3.25Å; R1260-K1271 PolarHBondContact O-N 2.97Å; R1260-I1273 HydrophobicContact CB-CD1 3.68Å; R1260-I1273 HydrophobicContact CB-CG1 4.36Å; R1260-I1273 HydrophobicContact CG-CD1 4.38Å; R1260-I1273 VanDerWaalsContact NE-CD1 3.32Å
1261	H	79.8	Confident	79.4	Confident	27 Å²	27	50.5 Å²	50.5	13%	0.125	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	126.4	163.9	173.6	-149	0	0	0	108.5	H1169 D1268 F1270	H1169-H1261 VanDerWaalsContact CE1-CB 3.43Å; H1169-H1261 WeakPolarHBondContact CE1-CB 3.48Å; H1261-D1268 IonicContact CD2-OD1 2.86Å; H1261-D1268 IonicContact CE1-OD1 3.68Å; H1261-D1268 PolarHBondContact CE1-OD1 3.1Å; H1261-D1268 VanDerWaalsContact NE2-CG 3.33Å; H1261-D1268 IonicContact NE2-OD1 3.91Å; H1261-D1268 PolarHBondContact NE2-OD1 3.4Å; H1261-F1270 HydrophobicContact CB-CD1 3.96Å; H1261-F1270 HydrophobicContact CB-CE1 3.8Å; H1261-F1270 AromaticContact CD2-CE1 3.75Å; H1261-F1270 AromaticContact CD2-CZ 3.74Å; H1261-F1270 AromaticContact CG-CE1 3.71Å
1262	V	73.3	Confident	79.7	Confident	29 Å²	29	46.8 Å²	46.8	18%	0.176	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	116.1	176.8	-177.6	0	0	0	0	107.9	R1260 D1269	R1260-V1262 VanDerWaalsContact CD-CG2 3.49Å; R1260-V1262 HydrophobicContact CG-CG2 3.82Å; V1262-D1269 PolarHBondContact N-O 3.47Å; V1262-D1269 PolarHBondContact O-N 2.89Å; V1262-D1269 VanDerWaalsContact O-O 3.12Å
1263	S	68.2	Low	79.8	Confident	20 Å²	20	44.8 Å²	44.8	14%	0.14	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	102.3	-176.5	59.3	0	0	0	0	109.9	T880 L1267 D1268	T880-S1263 WeakPolarHBondContact CA-OG 3.39Å; T880-S1263 WeakPolarHBondContact CB-OG 3.26Å; T880-S1263 WeakPolarHBondContact CG2-OG 3.44Å; S1263-L1267 WeakPolarHBondContact CA-O 3.39Å; S1263-D1268 WeakPolarHBondContact CB-OD1 3.28Å
1264	E	60.8	Low	80	Confident	124 Å²	124	43.7 Å²	43.7	58%	0.579	25%	0.249	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-118.6	126.7	-173.5	-160.9	166.6	-148.8	0	0	108.6	G1266 L1267	E1264-G1266 PolarHBondContact O-N 2.84Å; E1264-L1267 PolarHBondContact N-O 3.38Å; E1264-L1267 VanDerWaalsContact N-O 3.09Å; E1264-L1267 PolarHBondContact O-N 3.43Å
1265	D	61.9	Low	80.1	Confident	174 Å²	174	40.7 Å²	40.7	93%	0.93	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	47.2	27.9	-174.9	-68.4	-18.6	0	0	0	116.6
1266	G	63.3	Low	80	Confident	72 Å²	72	38.9 Å²	38.9	74%	0.742	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	86.1	12.2	179.7	0	0	0	0	0	115	E1264	E1264-G1266 PolarHBondContact O-N 2.84Å
1267	L	67.3	Low	79.8	Confident	138 Å²	138	42.3 Å²	42.3	72%	0.723	23%	0.233	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-101.6	124.1	166.1	-63.8	174.7	0	0	0	109.7	S1263 E1264	S1263-L1267 WeakPolarHBondContact CA-O 3.39Å; E1264-L1267 PolarHBondContact N-O 3.38Å; E1264-L1267 VanDerWaalsContact N-O 3.09Å; E1264-L1267 PolarHBondContact O-N 3.43Å
1268	D	71.8	Confident	79.5	Confident	71 Å²	71	47.7 Å²	47.7	38%	0.38	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	106.5	177.5	-72.2	-41.1	0	0	0	110.9	H1261 S1263 F1270	H1261-D1268 IonicContact CD2-OD1 2.86Å; H1261-D1268 IonicContact CE1-OD1 3.68Å; H1261-D1268 PolarHBondContact CE1-OD1 3.1Å; H1261-D1268 VanDerWaalsContact NE2-CG 3.33Å; H1261-D1268 IonicContact NE2-OD1 3.91Å; H1261-D1268 PolarHBondContact NE2-OD1 3.4Å; S1263-D1268 WeakPolarHBondContact CB-OD1 3.28Å; D1268-F1270 HydrophobicContact CB-CE2 4.1Å
1269	D	78	Confident	79.4	Confident	43 Å²	43	49.8 Å²	49.8	23%	0.23	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	135.5	170.3	-170.8	9.1	0	0	0	109.8	S1018 V1262 K1271	S1018-D1269 PolarHBondContact OG-OD1 3.06Å; V1262-D1269 PolarHBondContact N-O 3.47Å; V1262-D1269 PolarHBondContact O-N 2.89Å; V1262-D1269 VanDerWaalsContact O-O 3.12Å; D1269-K1271 WeakPolarHBondContact OD2-CE 3.4Å; D1269-K1271 IonicContact OD2-NZ 3.23Å; D1269-K1271 PolarHBondContact OD2-NZ 3.29Å
1270	F	84.1	Confident	79.3	Confident	1 Å²	1	50.8 Å²	50.8	0%	0.004	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	131.6	178.5	-69.1	-92.7	0	0	0	108.6	S1018 A1019 L1165 Y1166 H1169 R1260 H1261 D1268	S1018-F1270 CarbonylContact C-O 3.56Å; S1018-F1270 WeakPolarHBondContact CA-O 3.44Å; S1018-F1270 PolarHBondContact OG-O 3.35Å; A1019-F1270 HydrophobicContact CB-CB 3.99Å; A1019-F1270 WeakPolarHBondContact CB-O 3.37Å; A1019-F1270 PolarHBondContact N-O 2.83Å; L1165-F1270 HydrophobicContact CB-CB 4.38Å; L1165-F1270 HydrophobicContact CB-CD1 4.15Å; L1165-F1270 HydrophobicContact CB-CD2 3.65Å; L1165-F1270 HydrophobicContact CB-CE1 4.34Å; L1165-F1270 HydrophobicContact CB-CE2 3.86Å; L1165-F1270 HydrophobicContact CB-CG 3.8Å; L1165-F1270 HydrophobicContact CB-CZ 4.21Å; L1165-F1270 HydrophobicContact CD1-CB 4.18Å; L1165-F1270 HydrophobicContact CD1-CD2 4.07Å; L1165-F1270 HydrophobicContact CD1-CG 4.32Å; L1165-F1270 HydrophobicContact CD2-CB 4.19Å; L1165-F1270 HydrophobicContact CD2-CG 4.45Å; L1165-F1270 HydrophobicContact CG-CB 4.5Å; L1165-F1270 HydrophobicContact CG-CD2 4.41Å; L1165-F1270 HydrophobicContact CG-CG 4.43Å; Y1166-F1270 HydrophobicContact CD2-CZ 4.23Å; H1169-F1270 HydrophobicContact CB-CD1 4.22Å; H1169-F1270 HydrophobicContact CB-CE1 3.85Å; R1260-F1270 WeakPolarHBondContact O-CA 3.34Å; H1261-F1270 HydrophobicContact CB-CD1 3.96Å; H1261-F1270 HydrophobicContact CB-CE1 3.8Å; H1261-F1270 AromaticContact CD2-CE1 3.75Å; H1261-F1270 AromaticContact CD2-CZ 3.74Å; H1261-F1270 AromaticContact CG-CE1 3.71Å; D1268-F1270 HydrophobicContact CB-CE2 4.1Å
1271	K	85.3	Confident	79.4	Confident	24 Å²	24	51.4 Å²	51.4	10%	0.104	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	127.6	-174	-60.1	-173	-179.1	-170.8	0	111.7	D1016 N1017 R1260 D1269 I1273	D1016-K1271 HydrophobicContact CB-CD 4.33Å; D1016-K1271 IonicContact OD2-NZ 3Å; N1017-K1271 CarbonylContact O-C 3.55Å; N1017-K1271 VanDerWaalsContact O-CA 3.31Å; N1017-K1271 WeakPolarHBondContact O-CA 3.48Å; R1260-K1271 PolarHBondContact N-O 3.25Å; R1260-K1271 PolarHBondContact O-N 2.97Å; D1269-K1271 WeakPolarHBondContact OD2-CE 3.4Å; D1269-K1271 IonicContact OD2-NZ 3.23Å; D1269-K1271 PolarHBondContact OD2-NZ 3.29Å; K1271-I1273 HydrophobicContact CB-CG1 4.31Å; K1271-I1273 PolarHBondContact O-N 3.24Å
1272	I	88.4	Confident	79.9	Confident	2 Å²	2	50.3 Å²	50.3	1%	0.01	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	114.7	164.3	-52.5	-174.9	0	0	0	106.9	N1017 A1019 L1022 L1205 L1257 L1259	N1017-I1272 PolarHBondContact N-O 3.29Å; N1017-I1272 PolarHBondContact O-N 3.41Å; A1019-I1272 HydrophobicContact CB-CG1 4.12Å; L1022-I1272 HydrophobicContact CD1-CD1 3.58Å; L1022-I1272 HydrophobicContact CD1-CG1 4.31Å; L1205-I1272 HydrophobicContact CD1-CD1 3.73Å; L1205-I1272 HydrophobicContact CG-CD1 4.12Å; L1257-I1272 HydrophobicContact CD1-CG2 3.77Å; L1257-I1272 HydrophobicContact CD2-CG2 4.21Å; L1257-I1272 HydrophobicContact CG-CG2 3.97Å; L1259-I1272 HydrophobicContact CD1-CG1 4.13Å
1273	I	87.3	Confident	80.7	Confident	7 Å²	7	51 Å²	51	4%	0.036	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	115.7	178.3	-60.6	-178.2	0	0	0	107.8	V1014 D1016 L1257 A1258 R1260 K1271 L1275	V1014-I1273 HydrophobicContact CG1-CG2 3.85Å; D1016-I1273 HydrophobicContact CB-CG1 4.46Å; L1257-I1273 WeakPolarHBondContact CA-O 3.45Å; A1258-I1273 PolarHBondContact N-O 3.31Å; A1258-I1273 PolarHBondContact O-N 2.76Å; R1260-I1273 HydrophobicContact CB-CD1 3.68Å; R1260-I1273 HydrophobicContact CB-CG1 4.36Å; R1260-I1273 HydrophobicContact CG-CD1 4.38Å; R1260-I1273 VanDerWaalsContact NE-CD1 3.32Å; K1271-I1273 HydrophobicContact CB-CG1 4.31Å; K1271-I1273 PolarHBondContact O-N 3.24Å; I1273-L1275 HydrophobicContact CG2-CD2 4.05Å; I1273-L1275 HydrophobicContact CG2-CG 4.44Å
1274	M	88.5	Confident	81.8	Confident	18 Å²	18	50 Å²	50	9%	0.089	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	131.2	165.8	-173	179.1	-73.5	0	0	109.9	T1015 K1206 L1256 L1257 N1276	T1015-M1274 PolarHBondContact N-O 3.42Å; T1015-M1274 PolarHBondContact O-N 2.75Å; T1015-M1274 PolarHBondContact OG1-O 3.14Å; K1206-M1274 HydrophobicContact CD-CE 4.05Å; L1256-M1274 CarbonylContact O-C 3.57Å; L1256-M1274 WeakPolarHBondContact O-CA 3.28Å; L1256-M1274 WeakPolarHBondContact O-CG 3.38Å; L1257-M1274 HydrophobicContact CD1-CE 4.13Å; M1274-N1276 PolarHBondContact SD-ND2 3.47Å; M1274-N1276 VanDerWaalsContact SD-ND2 3.42Å
1275	L	88.3	Confident	83.3	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	111.3	171.8	-59.8	-176.7	0	0	0	108.5	F890 Y1012 V1014 W1245 V1249 K1255 L1256 I1273	F890-L1275 HydrophobicContact CE1-CD1 3.83Å; F890-L1275 HydrophobicContact CE1-CD2 3.92Å; F890-L1275 HydrophobicContact CZ-CD1 4.06Å; F890-L1275 HydrophobicContact CZ-CD2 3.95Å; Y1012-L1275 HydrophobicContact CD1-CB 3.96Å; Y1012-L1275 HydrophobicContact CG-CB 4.36Å; V1014-L1275 HydrophobicContact CB-CD2 4.22Å; V1014-L1275 HydrophobicContact CG1-CD2 4.14Å; V1014-L1275 HydrophobicContact CG2-CD2 3.8Å; W1245-L1275 HydrophobicContact CH2-CD1 4.03Å; W1245-L1275 HydrophobicContact CH2-CG 4.33Å; W1245-L1275 HydrophobicContact CZ2-CD1 3.47Å; W1245-L1275 VanDerWaalsContact CZ2-CD1 3.47Å; W1245-L1275 HydrophobicContact CZ2-CG 4.12Å; V1249-L1275 HydrophobicContact CG2-CD1 4.13Å; K1255-L1275 CarbonylContact C-O 3.59Å; K1255-L1275 WeakPolarHBondContact CA-O 3.28Å; L1256-L1275 HydrophobicContact CB-CB 4.25Å; L1256-L1275 HydrophobicContact CD1-CB 3.81Å; L1256-L1275 HydrophobicContact CD1-CD1 4.22Å; L1256-L1275 PolarHBondContact N-O 2.86Å; L1256-L1275 PolarHBondContact O-N 3.13Å; I1273-L1275 HydrophobicContact CG2-CD2 4.05Å; I1273-L1275 HydrophobicContact CG2-CG 4.44Å
1276	N	88.8	Confident	84.7	Confident	37 Å²	37	36.7 Å²	36.7	20%	0.198	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	128.1	171.8	-71	-81.9	0	0	0	108.9	Y1012 S1013 M1274 R1278	Y1012-N1276 WeakPolarHBondContact CA-O 3.31Å; S1013-N1276 PolarHBondContact N-O 3.04Å; S1013-N1276 PolarHBondContact O-N 3.38Å; S1013-N1276 VanDerWaalsContact O-N 3.09Å; S1013-N1276 PolarHBondContact OG-O 2.74Å; M1274-N1276 PolarHBondContact SD-ND2 3.47Å; M1274-N1276 VanDerWaalsContact SD-ND2 3.42Å; N1276-R1278 PolarHBondContact O-N 3.38Å
1277	K	86.9	Confident	86.1	Confident	73 Å²	73	33.5 Å²	33.5	32%	0.317	16%	0.163	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	123.8	175	-171.4	-170.5	178.2	-173.3	0	109.4	D1010 Y1012 N1252 A1254	D1010-K1277 WeakPolarHBondContact OD1-CE 3.39Å; D1010-K1277 IonicContact OD1-NZ 2.72Å; D1010-K1277 PolarHBondContact OD1-NZ 2.78Å; D1010-K1277 WeakPolarHBondContact OD2-CE 3.31Å; D1010-K1277 IonicContact OD2-NZ 2.72Å; D1010-K1277 PolarHBondContact OD2-NZ 3.41Å; Y1012-K1277 HydrophobicContact CD1-CB 4.23Å; Y1012-K1277 HydrophobicContact CE1-CB 4.03Å; N1252-K1277 HydrophobicContact CB-CD 4.4Å; A1254-K1277 PolarHBondContact O-N 2.97Å
1278	R	85.6	Confident	87.3	Confident	112 Å²	112	27.7 Å²	27.7	42%	0.423	13%	0.132	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-141	160.5	176.4	-69.1	-161.9	-172.4	-158.3	1.9	110.9	D704 G1011 S1013 N1276 V1280	D704-R1278 VanDerWaalsContact CG-NH1 3.27Å; D704-R1278 IonicContact OD1-NH1 3.92Å; D704-R1278 PolarHBondContact OD1-NH1 3.24Å; D704-R1278 IonicContact OD2-NH1 3.83Å; D704-R1278 PolarHBondContact OD2-NH1 3.09Å; D704-R1278 VanDerWaalsContact OD2-NH1 3.07Å; G1011-R1278 CarbonylContact C-O 3.45Å; G1011-R1278 PolarHBondContact N-O 3.14Å; G1011-R1278 VanDerWaalsContact N-O 3.11Å; G1011-R1278 PolarHBondContact O-N 3.45Å; S1013-R1278 WeakPolarHBondContact OG-CD 3.45Å; S1013-R1278 PolarHBondContact OG-NE 3.12Å; N1276-R1278 PolarHBondContact O-N 3.38Å; R1278-V1280 PolarHBondContact O-N 2.8Å
1279	F	87.6	Confident	88.2	Confident	45 Å²	45	25.7 Å²	25.7	20%	0.197	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	109.8	169.1	-67.3	-75.3	0	0	0	109.6	V705 N706 I708 I1008 L1009 D1010	V705-F1279 HydrophobicContact CB-CB 4.31Å; V705-F1279 HydrophobicContact CG1-CB 4.16Å; N706-F1279 WeakPolarHBondContact O-CE2 3.46Å; I708-F1279 HydrophobicContact CB-CE1 4.48Å; I708-F1279 HydrophobicContact CG1-CE1 3.7Å; I708-F1279 HydrophobicContact CG1-CZ 3.63Å; I1008-F1279 HydrophobicContact CG2-CB 3.73Å; I1008-F1279 HydrophobicContact CG2-CD1 4.22Å; I1008-F1279 HydrophobicContact CG2-CG 4.29Å; L1009-F1279 CarbonylContact O-C 3.4Å; L1009-F1279 WeakPolarHBondContact O-CA 3.31Å; D1010-F1279 WeakPolarHBondContact OD1-CE1 3.36Å
1280	V	85.7	Confident	88.7	Confident	22 Å²	22	23.8 Å²	23.8	13%	0.133	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	131.8	-178.3	-179.7	0	0	0	0	109.3	L1009 R1278 F1282	L1009-V1280 PolarHBondContact N-O 2.97Å; L1009-V1280 VanDerWaalsContact N-O 3.09Å; L1009-V1280 PolarHBondContact O-N 2.88Å; R1278-V1280 PolarHBondContact O-N 2.8Å; V1280-F1282 HydrophobicContact CB-CD2 4.5Å; V1280-F1282 HydrophobicContact CB-CE2 3.81Å; V1280-F1282 HydrophobicContact CB-CZ 4.29Å; V1280-F1282 HydrophobicContact CG1-CD2 4.14Å; V1280-F1282 HydrophobicContact CG1-CE1 4.39Å; V1280-F1282 HydrophobicContact CG1-CE2 3.58Å; V1280-F1282 HydrophobicContact CG1-CZ 3.73Å
1281	S	87.5	Confident	89	Confident	41 Å²	41	23.9 Å²	23.9	29%	0.287	11%	0.11	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	132.9	172	68	0	0	0	0	111.2	S925 Y1007	S925-S1281 WeakPolarHBondContact CB-O 3.46Å; S925-S1281 PolarHBondContact OG-O 3.02Å; Y1007-S1281 WeakPolarHBondContact O-CA 3.33Å
1282	F	89.6	Confident	89.2	Confident	3 Å²	3	22.7 Å²	22.7	1%	0.013	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	140.5	175.6	-65.8	-89.7	0	0	0	110.2	L894 L923 A924 L928 Y1007 L1009 V1280	L894-F1282 HydrophobicContact CD1-CE2 3.92Å; L894-F1282 HydrophobicContact CD1-CZ 3.77Å; L894-F1282 HydrophobicContact CD2-CE1 4.35Å; L894-F1282 HydrophobicContact CD2-CZ 4.12Å; L923-F1282 HydrophobicContact CB-CB 4.27Å; L923-F1282 HydrophobicContact CB-CD1 3.77Å; L923-F1282 HydrophobicContact CB-CE1 4.46Å; L923-F1282 HydrophobicContact CB-CG 4.24Å; L923-F1282 HydrophobicContact CD1-CD1 4.49Å; L923-F1282 HydrophobicContact CD1-CG 4.45Å; L923-F1282 HydrophobicContact CD2-CB 4.27Å; A924-F1282 CarbonylContact O-C 3.59Å; A924-F1282 WeakPolarHBondContact O-CA 3.43Å; L928-F1282 HydrophobicContact CB-CE1 3.88Å; L928-F1282 HydrophobicContact CB-CZ 4.36Å; L928-F1282 HydrophobicContact CD1-CE1 4.49Å; L928-F1282 HydrophobicContact CD1-CZ 4.14Å; Y1007-F1282 PolarHBondContact N-O 3.38Å; Y1007-F1282 PolarHBondContact O-N 2.93Å; L1009-F1282 HydrophobicContact CB-CD2 4.42Å; L1009-F1282 HydrophobicContact CB-CE2 4.15Å; L1009-F1282 HydrophobicContact CD1-CD2 4.06Å; L1009-F1282 HydrophobicContact CD1-CE2 4.04Å; L1009-F1282 HydrophobicContact CG-CD2 4.46Å; V1280-F1282 HydrophobicContact CB-CD2 4.5Å; V1280-F1282 HydrophobicContact CB-CE2 3.81Å; V1280-F1282 HydrophobicContact CB-CZ 4.29Å; V1280-F1282 HydrophobicContact CG1-CD2 4.14Å; V1280-F1282 HydrophobicContact CG1-CE1 4.39Å; V1280-F1282 HydrophobicContact CG1-CE2 3.58Å; V1280-F1282 HydrophobicContact CG1-CZ 3.73Å
1283	R	89.1	Confident	89.2	Confident	44 Å²	44	24 Å²	24	17%	0.166	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	133.7	160.1	-62.1	175	-178.1	-119.7	-13.2	107.9	L923 A924 I964 T965 D967 I1285	L923-R1283 WeakPolarHBondContact CA-O 3.4Å; A924-R1283 PolarHBondContact N-O 3.02Å; A924-R1283 VanDerWaalsContact N-O 3.09Å; A924-R1283 PolarHBondContact O-N 2.91Å; I964-R1283 WeakPolarHBondContact O-CD 3.22Å; I964-R1283 PolarHBondContact O-NH1 3.15Å; T965-R1283 VanDerWaalsContact O-CZ 3.28Å; T965-R1283 PolarHBondContact O-NH1 3.17Å; T965-R1283 PolarHBondContact O-NH2 3.35Å; D967-R1283 IonicContact OD1-CZ 3.89Å; D967-R1283 IonicContact OD1-NH1 2.67Å; D967-R1283 PolarHBondContact OD1-NH1 3.2Å; D967-R1283 IonicContact OD1-NH2 2.71Å; D967-R1283 PolarHBondContact OD1-NH2 2.71Å; D967-R1283 IonicContact OD2-NH2 3.47Å; R1283-I1285 HydrophobicContact CB-CD1 3.84Å
1284	V	91.8	Very high	89.2	Confident	0 Å²	0	23.7 Å²	23.7	0%	0	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	108.8	173.4	-170.6	0	0	0	0	108.9	F911 F921 L923 K1003 T1004 Y1007	F911-V1284 HydrophobicContact CD1-CG1 4.31Å; F911-V1284 HydrophobicContact CD2-CG1 4.3Å; F911-V1284 HydrophobicContact CD2-CG2 4.31Å; F911-V1284 HydrophobicContact CE1-CG1 3.99Å; F911-V1284 HydrophobicContact CE2-CG1 4Å; F911-V1284 HydrophobicContact CE2-CG2 4.35Å; F911-V1284 HydrophobicContact CG-CG1 4.46Å; F911-V1284 HydrophobicContact CZ-CG1 3.83Å; F921-V1284 HydrophobicContact CD1-CG1 3.89Å; L923-V1284 HydrophobicContact CD2-CB 4.29Å; L923-V1284 HydrophobicContact CD2-CG1 4.27Å; L923-V1284 HydrophobicContact CD2-CG2 3.73Å; K1003-V1284 PolarHBondContact N-O 3.5Å; T1004-V1284 PolarHBondContact N-O 2.87Å; T1004-V1284 PolarHBondContact O-N 3.21Å; T1004-V1284 WeakPolarHBondContact OG1-CB 3.17Å; T1004-V1284 VanDerWaalsContact OG1-CG2 3.3Å; T1004-V1284 WeakPolarHBondContact OG1-CG2 3.41Å; Y1007-V1284 VanDerWaalsContact CB-CG2 3.44Å; Y1007-V1284 HydrophobicContact CD1-CG2 4.08Å; Y1007-V1284 HydrophobicContact CG-CG2 3.95Å
1285	I	92.1	Very high	89.1	Confident	0 Å²	0	23 Å²	23	0%	0	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	124.1	180	-53.2	92	0	0	0	108.5	F921 I922 A924 I964 W1000 E1001 I1002 R1283	F921-I1285 CarbonylContact C-O 3.31Å; F921-I1285 WeakPolarHBondContact CA-O 3.39Å; I922-I1285 HydrophobicContact CB-CB 4.33Å; I922-I1285 HydrophobicContact CB-CD1 4.25Å; I922-I1285 HydrophobicContact CG2-CD1 4.27Å; I922-I1285 PolarHBondContact N-O 3.45Å; I922-I1285 PolarHBondContact O-N 3.1Å; A924-I1285 HydrophobicContact CB-CD1 3.94Å; I964-I1285 HydrophobicContact CG2-CD1 3.38Å; I964-I1285 HydrophobicContact CG2-CG1 3.78Å; W1000-I1285 HydrophobicContact CB-CG2 3.89Å; W1000-I1285 HydrophobicContact CD2-CG2 4.26Å; W1000-I1285 HydrophobicContact CE3-CG2 3.7Å; W1000-I1285 HydrophobicContact CG-CG2 4.41Å; E1001-I1285 CarbonylContact O-C 3.51Å; E1001-I1285 WeakPolarHBondContact O-CA 3.48Å; I1002-I1285 HydrophobicContact CG1-CG1 4.2Å; R1283-I1285 HydrophobicContact CB-CD1 3.84Å
1286	K	92.5	Very high	88.9	Confident	17 Å²	17	23.1 Å²	23.1	7%	0.074	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	124.2	171.5	-170.7	168.9	-169.6	169.1	0	109.1	E914 D919 F921 W1000 E1001 K1003	E914-K1286 PolarHBondContact O-NZ 2.8Å; D919-K1286 WeakPolarHBondContact OD1-CE 3.31Å; D919-K1286 IonicContact OD1-NZ 2.7Å; D919-K1286 WeakPolarHBondContact OD2-CE 3.41Å; D919-K1286 IonicContact OD2-NZ 2.64Å; D919-K1286 PolarHBondContact OD2-NZ 3.15Å; F921-K1286 HydrophobicContact CD1-CB 3.91Å; F921-K1286 HydrophobicContact CD1-CG 4.18Å; F921-K1286 HydrophobicContact CE1-CB 3.58Å; F921-K1286 HydrophobicContact CE1-CD 3.83Å; F921-K1286 HydrophobicContact CE1-CG 3.59Å; F921-K1286 HydrophobicContact CZ-CB 4.38Å; F921-K1286 HydrophobicContact CZ-CD 3.85Å; F921-K1286 HydrophobicContact CZ-CG 3.88Å; W1000-K1286 CarbonylContact C-O 3.47Å; W1000-K1286 VanDerWaalsContact CA-O 3.3Å; W1000-K1286 WeakPolarHBondContact CA-O 3.45Å; E1001-K1286 HydrophobicContact CG-CB 4.02Å; E1001-K1286 PolarHBondContact N-O 2.87Å; E1001-K1286 PolarHBondContact O-N 2.95Å; K1003-K1286 HydrophobicContact CD-CB 4.48Å; K1003-K1286 VanDerWaalsContact CE-CD 3.48Å; K1003-K1286 HydrophobicContact CG-CB 3.83Å
1287	L	92.5	Very high	88.6	Confident	6 Å²	6	21.4 Å²	21.4	3%	0.031	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	150.6	170.9	-61.4	175.2	0	0	0	110.2	C920 I922 L931 W1000 R1289 V1292 L1323 I1327	C920-L1287 HydrophobicContact CB-CB 4.25Å; C920-L1287 HydrophobicContact CB-CD1 4.22Å; C920-L1287 PolarHBondContact O-N 3.31Å; I922-L1287 HydrophobicContact CD1-CD1 4.05Å; I922-L1287 HydrophobicContact CD1-CD2 3.81Å; I922-L1287 HydrophobicContact CD1-CG 4.2Å; I922-L1287 HydrophobicContact CG1-CD1 3.94Å; I922-L1287 HydrophobicContact CG1-CD2 4.38Å; I922-L1287 HydrophobicContact CG1-CG 4.23Å; L931-L1287 HydrophobicContact CD1-CD1 3.76Å; W1000-L1287 HydrophobicContact CB-CD2 3.89Å; L1287-R1289 PolarHBondContact O-N 2.92Å; L1287-R1289 VanDerWaalsContact O-N 3.12Å; L1287-V1292 HydrophobicContact CB-CG2 3.75Å; L1287-V1292 HydrophobicContact CD1-CG2 3.73Å; L1287-V1292 HydrophobicContact CG-CG2 4.37Å; L1287-L1323 HydrophobicContact CD2-CD1 3.93Å; L1287-I1327 HydrophobicContact CD1-CD1 4.44Å; L1287-I1327 HydrophobicContact CD1-CG1 4.2Å
1288	N	92.1	Very high	88.2	Confident	16 Å²	16	18.2 Å²	18.2	9%	0.086	8%	0.083	C	C	.	.			trans	-67.5	105.1	163	-178.5	-8.2	0	0	0	109.5	L786 A999 E1290 C1291 V1292	L786-N1288 PolarHBondContact O-ND2 2.88Å; A999-N1288 VanDerWaalsContact O-CB 3.29Å; A999-N1288 WeakPolarHBondContact O-CB 3.39Å; A999-N1288 PolarHBondContact O-N 2.8Å; N1288-E1290 PolarHBondContact O-N 3.27Å; N1288-E1290 PolarHBondContact OD1-N 3.42Å; N1288-C1291 HydrophobicContact CB-CB 4.27Å; N1288-C1291 VanDerWaalsContact O-CB 3.27Å; N1288-C1291 WeakPolarHBondContact O-CB 3.28Å; N1288-C1291 PolarHBondContact O-N 2.71Å; N1288-V1292 PolarHBondContact O-N 2.67Å
1289	R	89.7	Confident	87.9	Confident	28 Å²	28	13.1 Å²	13.1	11%	0.106	6%	0.064	C	C	.	.	H	α-helix	trans	-52.7	-32.8	-176.9	63.3	173.3	179.2	-109.3	1.6	114.3	E916 G918 D919 L1287 C1291 V1292 R1293	E916-R1289 VanDerWaalsContact CB-NH1 3.29Å; E916-R1289 IonicContact OE2-CZ 2.74Å; E916-R1289 VanDerWaalsContact OE2-CZ 3.23Å; E916-R1289 IonicContact OE2-NH1 3.46Å; E916-R1289 PolarHBondContact OE2-NH1 2.9Å; E916-R1289 IonicContact OE2-NH2 3.87Å; E916-R1289 PolarHBondContact OE2-NH2 3.03Å; G918-R1289 WeakPolarHBondContact O-CB 3.3Å; D919-R1289 IonicContact OD1-CZ 2.67Å; D919-R1289 IonicContact OD1-NH1 3.19Å; D919-R1289 PolarHBondContact OD1-NH1 3.05Å; L1287-R1289 PolarHBondContact O-N 2.92Å; L1287-R1289 VanDerWaalsContact O-N 3.12Å; R1289-C1291 VanDerWaalsContact C-N 3.32Å; R1289-C1291 PolarHBondContact O-N 3.39Å; R1289-V1292 PolarHBondContact O-N 3.04Å; R1289-V1292 VanDerWaalsContact O-N 3.16Å; R1289-R1293 VanDerWaalsContact O-CG 3.29Å; R1289-R1293 WeakPolarHBondContact O-CG 3.19Å; R1289-R1293 PolarHBondContact O-N 2.99Å
1290	E	89.6	Confident	87.4	Confident	4 Å²	4	11.2 Å²	11.2	2%	0.019	6%	0.056	C	C	.	.	H	α-helix	trans	-70.8	-30	-179.7	-64.1	-53.1	123.7	0	0	112.4	E783 L786 K787 N1288 R1293 A1294	E783-E1290 HydrophobicContact CG-CG 4.2Å; L786-E1290 HydrophobicContact CB-CG 4.01Å; K787-E1290 WeakPolarHBondContact CE-OE2 3.29Å; K787-E1290 HydrophobicContact CG-CB 3.91Å; K787-E1290 HydrophobicContact CG-CG 3.91Å; K787-E1290 IonicContact NZ-OE2 2.93Å; N1288-E1290 PolarHBondContact O-N 3.27Å; N1288-E1290 PolarHBondContact OD1-N 3.42Å; E1290-R1293 VanDerWaalsContact CD-NH1 3.25Å; E1290-R1293 VanDerWaalsContact OE1-CD 3.31Å; E1290-R1293 WeakPolarHBondContact OE1-CD 3.28Å; E1290-R1293 IonicContact OE1-CZ 2.68Å; E1290-R1293 IonicContact OE1-NE 3.92Å; E1290-R1293 IonicContact OE1-NH1 2.92Å; E1290-R1293 PolarHBondContact OE1-NH1 3.37Å; E1290-R1293 IonicContact OE2-CZ 3.89Å; E1290-R1293 IonicContact OE2-NH1 3.03Å; E1290-R1293 PolarHBondContact OE2-NH1 2.72Å; E1290-A1294 WeakPolarHBondContact O-CB 3.24Å; E1290-A1294 PolarHBondContact O-N 2.86Å
1291	C	89.9	Confident	86.9	Confident	2 Å²	2	11.6 Å²	11.6	1%	0.014	6%	0.056	C	C	.	.	H	α-helix	trans	-66.1	-43.5	168.5	171.6	0	0	0	0	111.8	F790 N1288 R1289 A1294 F1295 V1322	F790-C1291 HydrophobicContact CB-CB 4.31Å; F790-C1291 HydrophobicContact CD1-CB 4.5Å; F790-C1291 HydrophobicContact CD2-CB 3.43Å; F790-C1291 VanDerWaalsContact CD2-CB 3.43Å; F790-C1291 HydrophobicContact CE2-CB 3.78Å; F790-C1291 WeakPolarHBondContact CE2-SG 3.17Å; F790-C1291 HydrophobicContact CG-CB 3.83Å; F790-C1291 HydrophobicContact CZ-CB 4.44Å; N1288-C1291 HydrophobicContact CB-CB 4.27Å; N1288-C1291 VanDerWaalsContact O-CB 3.27Å; N1288-C1291 WeakPolarHBondContact O-CB 3.28Å; N1288-C1291 PolarHBondContact O-N 2.71Å; R1289-C1291 VanDerWaalsContact C-N 3.32Å; R1289-C1291 PolarHBondContact O-N 3.39Å; C1291-A1294 WeakPolarHBondContact O-CB 3.23Å; C1291-A1294 PolarHBondContact O-N 3.21Å; C1291-F1295 PolarHBondContact O-N 3.09Å; C1291-F1295 WeakPolarHBondContact SG-CE2 3.35Å; C1291-V1322 WeakPolarHBondContact SG-CG1 3.1Å
1292	V	89.8	Confident	86.3	Confident	0 Å²	0	10 Å²	10	0%	0	4%	0.044	C	C	.	.	H	α-helix	trans	-65.9	-48.1	-178.2	-166.2	0	0	0	0	110.4	C920 L1287 N1288 R1289 A1294 F1295 W1296 I1327	C920-V1292 HydrophobicContact CB-CG1 4.49Å; C920-V1292 HydrophobicContact CB-CG2 4.03Å; L1287-V1292 HydrophobicContact CB-CG2 3.75Å; L1287-V1292 HydrophobicContact CD1-CG2 3.73Å; L1287-V1292 HydrophobicContact CG-CG2 4.37Å; N1288-V1292 PolarHBondContact O-N 2.67Å; R1289-V1292 PolarHBondContact O-N 3.04Å; R1289-V1292 VanDerWaalsContact O-N 3.16Å; V1292-A1294 PolarHBondContact O-N 2.81Å; V1292-F1295 PolarHBondContact O-N 3.18Å; V1292-W1296 HydrophobicContact CB-CE3 4.5Å; V1292-W1296 HydrophobicContact CB-CZ3 4.36Å; V1292-W1296 HydrophobicContact CG1-CD2 3.86Å; V1292-W1296 HydrophobicContact CG1-CE3 3.63Å; V1292-W1296 HydrophobicContact CG1-CH2 3.35Å; V1292-W1296 HydrophobicContact CG1-CZ2 3.53Å; V1292-W1296 HydrophobicContact CG1-CZ3 3.37Å; V1292-W1296 PolarHBondContact O-N 2.93Å; V1292-I1327 HydrophobicContact CG1-CG1 4.5Å; V1292-I1327 HydrophobicContact CG1-CG2 3.91Å; V1292-I1327 HydrophobicContact CG2-CD1 4.1Å; V1292-I1327 HydrophobicContact CG2-CG1 4.45Å
1293	R	88.5	Confident	85.5	Confident	29 Å²	29	12.1 Å²	12.1	11%	0.109	6%	0.056	C	C	.	.	H	α-helix	trans	-56.5	-37.9	171.8	-64.8	169.7	84	-151.1	4.3	111.5	E783 S832 P834 R1289 E1290 A1297	E783-R1293 IonicContact OE1-NH1 3.85Å; E783-R1293 PolarHBondContact OE1-NH1 3.24Å; S832-R1293 PolarHBondContact O-NH1 3.01Å; S832-R1293 PolarHBondContact O-NH2 3.48Å; P834-R1293 HydrophobicContact CB-CB 4.08Å; R1289-R1293 VanDerWaalsContact O-CG 3.29Å; R1289-R1293 WeakPolarHBondContact O-CG 3.19Å; R1289-R1293 PolarHBondContact O-N 2.99Å; E1290-R1293 VanDerWaalsContact CD-NH1 3.25Å; E1290-R1293 VanDerWaalsContact OE1-CD 3.31Å; E1290-R1293 WeakPolarHBondContact OE1-CD 3.28Å; E1290-R1293 IonicContact OE1-CZ 2.68Å; E1290-R1293 IonicContact OE1-NE 3.92Å; E1290-R1293 IonicContact OE1-NH1 2.92Å; E1290-R1293 PolarHBondContact OE1-NH1 3.37Å; E1290-R1293 IonicContact OE2-CZ 3.89Å; E1290-R1293 IonicContact OE2-NH1 3.03Å; E1290-R1293 PolarHBondContact OE2-NH1 2.72Å; R1293-A1297 VanDerWaalsContact O-CB 3.29Å; R1293-A1297 WeakPolarHBondContact O-CB 3.46Å; R1293-A1297 PolarHBondContact O-N 3.18Å
1294	A	87.5	Confident	84.5	Confident	0 Å²	0	10.4 Å²	10.4	0%	0	5%	0.05	C	C	.	.	H	α-helix	trans	-70.5	-45.5	-177.8	0	0	0	0	0	114.4	F790 L835 E1290 C1291 V1292 A1297 G1298	F790-A1294 HydrophobicContact CD1-CB 4.34Å; F790-A1294 HydrophobicContact CE1-CB 3.45Å; F790-A1294 VanDerWaalsContact CE1-CB 3.45Å; F790-A1294 HydrophobicContact CZ-CB 3.81Å; L835-A1294 WeakPolarHBondContact O-CA 3.14Å; L835-A1294 WeakPolarHBondContact O-CB 3.31Å; E1290-A1294 WeakPolarHBondContact O-CB 3.24Å; E1290-A1294 PolarHBondContact O-N 2.86Å; C1291-A1294 WeakPolarHBondContact O-CB 3.23Å; C1291-A1294 PolarHBondContact O-N 3.21Å; V1292-A1294 PolarHBondContact O-N 2.81Å; A1294-A1297 PolarHBondContact O-N 3.39Å; A1294-G1298 PolarHBondContact O-N 2.95Å
1295	F	86	Confident	83.5	Confident	5 Å²	5	13 Å²	13	2%	0.022	6%	0.061	C	C	.	.	H	α-helix	trans	-66.3	-42.9	176.5	-71.9	-37.9	0	0	0	111.6	F790 Y794 P837 C1291 V1292 A1297 G1298 Q1299 V1322 R1324 I1327	F790-F1295 HydrophobicContact CE2-CE1 4.49Å; F790-F1295 HydrophobicContact CE2-CZ 4.22Å; F790-F1295 HydrophobicContact CZ-CE1 4.43Å; Y794-F1295 HydrophobicContact CD2-CE1 4.17Å; Y794-F1295 AromaticContact CD2-CZ 3.98Å; Y794-F1295 HydrophobicContact CD2-CZ 3.98Å; Y794-F1295 AromaticContact CE2-CE1 3.67Å; Y794-F1295 HydrophobicContact CE2-CE1 3.67Å; Y794-F1295 AromaticContact CE2-CZ 3.78Å; Y794-F1295 HydrophobicContact CE2-CZ 3.78Å; P837-F1295 HydrophobicContact CG-CD1 4.12Å; P837-F1295 HydrophobicContact CG-CE1 4.16Å; C1291-F1295 PolarHBondContact O-N 3.09Å; C1291-F1295 WeakPolarHBondContact SG-CE2 3.35Å; V1292-F1295 PolarHBondContact O-N 3.18Å; F1295-A1297 PolarHBondContact O-N 2.89Å; F1295-G1298 PolarHBondContact O-N 3.27Å; F1295-Q1299 WeakPolarHBondContact O-CB 3.4Å; F1295-Q1299 WeakPolarHBondContact O-CG 3.34Å; F1295-Q1299 PolarHBondContact O-N 3.08Å; F1295-V1322 HydrophobicContact CE2-CB 4.1Å; F1295-V1322 HydrophobicContact CE2-CG1 3.63Å; F1295-V1322 HydrophobicContact CZ-CB 4.18Å; F1295-V1322 HydrophobicContact CZ-CG1 3.79Å; F1295-R1324 HydrophobicContact CD2-CG 4.48Å; F1295-R1324 HydrophobicContact CE1-CG 4.34Å; F1295-R1324 HydrophobicContact CE2-CB 4.02Å; F1295-R1324 HydrophobicContact CE2-CG 4.2Å; F1295-R1324 HydrophobicContact CZ-CB 4.15Å; F1295-R1324 HydrophobicContact CZ-CG 4.13Å; F1295-I1327 HydrophobicContact CB-CG2 3.91Å; F1295-I1327 HydrophobicContact CD2-CB 4.27Å; F1295-I1327 HydrophobicContact CD2-CD1 3.94Å; F1295-I1327 HydrophobicContact CD2-CG2 3.98Å; F1295-I1327 HydrophobicContact CE2-CD1 4.25Å; F1295-I1327 HydrophobicContact CG-CG2 4.47Å
1296	W	84.8	Confident	82.6	Confident	2 Å²	2	17 Å²	17	1%	0.008	8%	0.082	C	C	.	.	H	α-helix	trans	-61.6	-41.5	176	-68.4	-23	0	0	0	113	F854 W855 L931 V1292 Q1300 I1327 S1330 A1331	F854-W1296 HydrophobicContact CD1-CZ3 4.32Å; F854-W1296 AromaticContact CD2-CE3 3.99Å; F854-W1296 HydrophobicContact CD2-CE3 3.99Å; F854-W1296 AromaticContact CE1-CE3 3.81Å; F854-W1296 HydrophobicContact CE1-CE3 3.81Å; F854-W1296 HydrophobicContact CE1-CH2 4.19Å; F854-W1296 AromaticContact CE1-CZ3 3.4Å; F854-W1296 HydrophobicContact CE1-CZ3 3.4Å; F854-W1296 HydrophobicContact CE2-CB 4.2Å; F854-W1296 AromaticContact CE2-CD2 3.71Å; F854-W1296 HydrophobicContact CE2-CD2 3.71Å; F854-W1296 AromaticContact CE2-CE3 3.11Å; F854-W1296 HydrophobicContact CE2-CE3 3.11Å; F854-W1296 HydrophobicContact CE2-CG 4.22Å; F854-W1296 AromaticContact CE2-CZ3 3.63Å; F854-W1296 HydrophobicContact CE2-CZ3 3.63Å; F854-W1296 AromaticContact CZ-CD2 3.83Å; F854-W1296 HydrophobicContact CZ-CD2 3.83Å; F854-W1296 AromaticContact CZ-CE3 3.05Å; F854-W1296 HydrophobicContact CZ-CE3 3.05Å; F854-W1296 AromaticContact CZ-CH2 3.72Å; F854-W1296 HydrophobicContact CZ-CH2 3.72Å; F854-W1296 HydrophobicContact CZ-CZ2 4.4Å; F854-W1296 AromaticContact CZ-CZ3 3Å; F854-W1296 HydrophobicContact CZ-CZ3 3Å; W855-W1296 HydrophobicContact CZ2-CB 4.18Å; L931-W1296 HydrophobicContact CD1-CZ2 4.4Å; L931-W1296 HydrophobicContact CD2-CH2 3.92Å; L931-W1296 HydrophobicContact CD2-CZ2 4.19Å; V1292-W1296 HydrophobicContact CB-CE3 4.5Å; V1292-W1296 HydrophobicContact CB-CZ3 4.36Å; V1292-W1296 HydrophobicContact CG1-CD2 3.86Å; V1292-W1296 HydrophobicContact CG1-CE3 3.63Å; V1292-W1296 HydrophobicContact CG1-CH2 3.35Å; V1292-W1296 HydrophobicContact CG1-CZ2 3.53Å; V1292-W1296 HydrophobicContact CG1-CZ3 3.37Å; V1292-W1296 PolarHBondContact O-N 2.93Å; W1296-Q1300 PolarHBondContact O-N 3.26Å; W1296-Q1300 VanDerWaalsContact O-N 3.13Å; W1296-I1327 PolarHBondContact NE1-O 3.12Å; W1296-S1330 WeakPolarHBondContact CZ2-OG 3.34Å; W1296-A1331 HydrophobicContact CG-CB 4.45Å
1297	A	81.3	Confident	81.7	Confident	1 Å²	1	24 Å²	24	1%	0.008	11%	0.108	C	C	.	.	H	α-helix	trans	-67	-39.8	174.7	0	0	0	0	0	112.7	P834 R1293 A1294 F1295 Q1301	P834-A1297 HydrophobicContact CB-CB 4.2Å; P834-A1297 HydrophobicContact CG-CB 4.24Å; R1293-A1297 VanDerWaalsContact O-CB 3.29Å; R1293-A1297 WeakPolarHBondContact O-CB 3.46Å; R1293-A1297 PolarHBondContact O-N 3.18Å; A1294-A1297 PolarHBondContact O-N 3.39Å; F1295-A1297 PolarHBondContact O-N 2.89Å; A1297-Q1301 PolarHBondContact O-N 3.08Å
1298	G	79.9	Confident	80.5	Confident	5 Å²	5	25.6 Å²	25.6	5%	0.052	12%	0.117	C	C	.	.	H	α-helix	trans	-64.4	-49	176.1	0	0	0	0	0	112.9	A1294 F1295 Q1300 Q1301 E1302	A1294-G1298 PolarHBondContact O-N 2.95Å; F1295-G1298 PolarHBondContact O-N 3.27Å; G1298-Q1300 VanDerWaalsContact C-N 3.33Å; G1298-Q1300 PolarHBondContact O-N 3.09Å; G1298-Q1301 PolarHBondContact O-N 3.29Å; G1298-Q1301 VanDerWaalsContact O-N 3.12Å; G1298-E1302 PolarHBondContact O-N 3.25Å
1299	Q	78.6	Confident	79.1	Confident	6 Å²	6	28.3 Å²	28.3	3%	0.028	15%	0.149	C	C	.	.	H	α-helix	trans	-64.1	-35.7	178.8	-68.2	-61.5	-72.4	0	0	112.4	F1295 Q1301 E1302 L1303 N1328 I1335	F1295-Q1299 WeakPolarHBondContact O-CB 3.4Å; F1295-Q1299 WeakPolarHBondContact O-CG 3.34Å; F1295-Q1299 PolarHBondContact O-N 3.08Å; Q1299-Q1301 PolarHBondContact O-N 3.45Å; Q1299-E1302 PolarHBondContact O-N 3.39Å; Q1299-L1303 HydrophobicContact CB-CD1 4.49Å; Q1299-L1303 WeakPolarHBondContact O-CB 3.39Å; Q1299-L1303 WeakPolarHBondContact O-CG 3.38Å; Q1299-L1303 PolarHBondContact O-N 3.04Å; Q1299-N1328 WeakPolarHBondContact CG-OD1 3.46Å; Q1299-I1335 HydrophobicContact CB-CG2 3.54Å
1300	Q	77.2	Confident	78	Confident	4 Å²	4	31 Å²	31	2%	0.019	17%	0.165	C	C	.	.	H	α-helix	trans	-57.8	-48.1	170.2	-174.7	-172.3	-18.5	0	0	111.7	S425 Y848 R850 W855 W1296 G1298 V1304 F1305 I1335	S425-Q1300 VanDerWaalsContact C-NE2 3.26Å; S425-Q1300 PolarHBondContact O-NE2 3.35Å; Y848-Q1300 PolarHBondContact OH-NE2 2.96Å; Y848-Q1300 PolarHBondContact OH-OE1 3.14Å; R850-Q1300 VanDerWaalsContact CZ-OE1 3.23Å; W855-Q1300 HydrophobicContact CH2-CB 4.32Å; W1296-Q1300 PolarHBondContact O-N 3.26Å; W1296-Q1300 VanDerWaalsContact O-N 3.13Å; G1298-Q1300 VanDerWaalsContact C-N 3.33Å; G1298-Q1300 PolarHBondContact O-N 3.09Å; Q1300-V1304 HydrophobicContact CG-CB 4.5Å; Q1300-V1304 HydrophobicContact CG-CG2 4.25Å; Q1300-V1304 WeakPolarHBondContact O-CA 3.48Å; Q1300-V1304 WeakPolarHBondContact O-CB 3.44Å; Q1300-V1304 PolarHBondContact O-N 3.34Å; Q1300-F1305 PolarHBondContact O-N 2.96Å; Q1300-I1335 HydrophobicContact CB-CD1 3.69Å; Q1300-I1335 HydrophobicContact CG-CD1 3.96Å
1301	Q	75.6	Confident	76.2	Confident	31 Å²	31	36.4 Å²	36.4	15%	0.145	20%	0.201	C	C	.	.	I	π-helix	trans	-67	-38.3	-178.4	-165.7	179.4	29.5	0	0	111.8	L500 N836 A1297 G1298 Q1299 F1305 L1306	L500-Q1301 PolarHBondContact O-NE2 3.47Å; N836-Q1301 PolarHBondContact ND2-OE1 2.87Å; A1297-Q1301 PolarHBondContact O-N 3.08Å; G1298-Q1301 PolarHBondContact O-N 3.29Å; G1298-Q1301 VanDerWaalsContact O-N 3.12Å; Q1299-Q1301 PolarHBondContact O-N 3.45Å; Q1301-F1305 HydrophobicContact CG-CB 4.35Å; Q1301-F1305 HydrophobicContact CG-CD1 4.11Å; Q1301-F1305 WeakPolarHBondContact O-CB 3.19Å; Q1301-F1305 PolarHBondContact O-N 3.15Å; Q1301-L1306 WeakPolarHBondContact O-CG 3.16Å; Q1301-L1306 PolarHBondContact O-N 3.26Å
1302	E	74.2	Confident	74.4	Confident	7 Å²	7	43.3 Å²	43.3	3%	0.033	23%	0.233	C	C	.	.	I	π-helix	trans	-70.6	-49.4	178.4	-70.8	-174.5	-143.5	0	0	113.1	M839 G1298 Q1299 R1307 N1308 R1313	M839-E1302 VanDerWaalsContact CA-OE1 3.3Å; M839-E1302 WeakPolarHBondContact CA-OE1 3.32Å; G1298-E1302 PolarHBondContact O-N 3.25Å; Q1299-E1302 PolarHBondContact O-N 3.39Å; E1302-R1307 PolarHBondContact O-N 3.05Å; E1302-N1308 VanDerWaalsContact O-CB 3.29Å; E1302-N1308 WeakPolarHBondContact O-CB 3.39Å; E1302-N1308 PolarHBondContact O-N 2.73Å; E1302-R1313 IonicContact OE2-CZ 3.7Å; E1302-R1313 IonicContact OE2-NE 2.75Å; E1302-R1313 IonicContact OE2-NH1 3.83Å; E1302-R1313 PolarHBondContact OE2-NH1 2.85Å
1303	L	72.3	Confident	72.6	Confident	48 Å²	48	46 Å²	46	25%	0.251	24%	0.243	S	C	.	.	I	π-helix	trans	-80.8	-42.9	-173.9	-61	175.4	0	0	0	112.4	Q1299 R1307 I1335	Q1299-L1303 HydrophobicContact CB-CD1 4.49Å; Q1299-L1303 WeakPolarHBondContact O-CB 3.39Å; Q1299-L1303 WeakPolarHBondContact O-CG 3.38Å; Q1299-L1303 PolarHBondContact O-N 3.04Å; L1303-R1307 WeakPolarHBondContact O-CA 3.43Å; L1303-I1335 HydrophobicContact CD1-CG2 4.3Å
1304	V	69	Low	70.9	Confident	7 Å²	7	45.5 Å²	45.5	4%	0.042	25%	0.247	C	C	.	.	I	π-helix	trans	-90.9	-51.6	-173.3	-169.5	0	0	0	0	111.4	H428 Q1300 I1335	H428-V1304 PolarHBondContact CE1-O 3.37Å; Q1300-V1304 HydrophobicContact CG-CB 4.5Å; Q1300-V1304 HydrophobicContact CG-CG2 4.25Å; Q1300-V1304 WeakPolarHBondContact O-CA 3.48Å; Q1300-V1304 WeakPolarHBondContact O-CB 3.44Å; Q1300-V1304 PolarHBondContact O-N 3.34Å; V1304-I1335 HydrophobicContact CG2-CD1 4.48Å; V1304-I1335 HydrophobicContact CG2-CG1 4.28Å
1305	F	71.5	Confident	69.4	Low	55 Å²	55	47.8 Å²	47.8	24%	0.241	26%	0.263	C	S	.	.	I	π-helix	trans	-81.9	-50.3	-174.1	178.2	-112.9	0	0	0	113	A423 T499 Q1300 Q1301 R1307	A423-F1305 HydrophobicContact CB-CD1 4.15Å; A423-F1305 HydrophobicContact CB-CD2 3.6Å; A423-F1305 HydrophobicContact CB-CE1 4.25Å; A423-F1305 HydrophobicContact CB-CE2 3.73Å; A423-F1305 HydrophobicContact CB-CG 3.82Å; A423-F1305 HydrophobicContact CB-CZ 4.04Å; T499-F1305 WeakPolarHBondContact O-CZ 3.39Å; Q1300-F1305 PolarHBondContact O-N 2.96Å; Q1301-F1305 HydrophobicContact CG-CB 4.35Å; Q1301-F1305 HydrophobicContact CG-CD1 4.11Å; Q1301-F1305 WeakPolarHBondContact O-CB 3.19Å; Q1301-F1305 PolarHBondContact O-N 3.15Å; F1305-R1307 PolarHBondContact O-N 3.32Å
1306	L	73.1	Confident	67.8	Low	85 Å²	85	51 Å²	51	45%	0.445	28%	0.279	S	S	.	.	S	Bend	trans	-79.2	-5.2	176.9	-62.4	176.8	0	0	0	113.2	Q1301 N1308	Q1301-L1306 WeakPolarHBondContact O-CG 3.16Å; Q1301-L1306 PolarHBondContact O-N 3.26Å; L1306-N1308 PolarHBondContact O-N 3.06Å
1307	R	72.8	Confident	66.3	Low	164 Å²	164	57.2 Å²	57.2	62%	0.619	31%	0.309	S	S	*	.			trans	49.1	41	-179.8	-160	-165.6	164.2	92.4	3.5	112.9	E1302 L1303 F1305 G1309	E1302-R1307 PolarHBondContact O-N 3.05Å; L1303-R1307 WeakPolarHBondContact O-CA 3.43Å; F1305-R1307 PolarHBondContact O-N 3.32Å; R1307-G1309 PolarHBondContact O-N 3.14Å
1308	N	67.3	Low	65.2	Low	38 Å²	38	59.4 Å²	59.4	20%	0.203	32%	0.32	C	S	.	.			trans	-67.7	104.3	174.4	173.2	90.1	0	0	0	109.9	E1302 L1306 N1310 R1313	E1302-N1308 VanDerWaalsContact O-CB 3.29Å; E1302-N1308 WeakPolarHBondContact O-CB 3.39Å; E1302-N1308 PolarHBondContact O-N 2.73Å; L1306-N1308 PolarHBondContact O-N 3.06Å; N1308-N1310 VanDerWaalsContact C-N 3.34Å; N1308-N1310 PolarHBondContact ND2-N 3Å; N1308-N1310 PolarHBondContact ND2-O 3.28Å; N1308-N1310 PolarHBondContact O-N 3.43Å; N1308-R1313 VanDerWaalsContact ND2-CD 3.27Å; N1308-R1313 WeakPolarHBondContact ND2-CD 3.43Å; N1308-R1313 WeakPolarHBondContact OD1-CD 3.41Å
1309	G	63.7	Low	64.8	Low	74 Å²	74	59.9 Å²	59.9	76%	0.763	32%	0.324	S	S	*	.			trans	-85.4	9.7	178.6	0	0	0	0	0	115.8	R1307 P1311	R1307-G1309 PolarHBondContact O-N 3.14Å; G1309-P1311 WeakPolarHBondContact O-CD 3.3Å
1310	N	64.6	Low	64.8	Low	83 Å²	83	63 Å²	63	44%	0.444	34%	0.335	S	S	.	.			trans	-81.9	113.8	178.2	-178.7	-8.7	0	0	0	110.3	N1308 E1312 R1313	N1308-N1310 VanDerWaalsContact C-N 3.34Å; N1308-N1310 PolarHBondContact ND2-N 3Å; N1308-N1310 PolarHBondContact ND2-O 3.28Å; N1308-N1310 PolarHBondContact O-N 3.43Å; N1310-E1312 PolarHBondContact O-N 3.38Å; N1310-E1312 PolarHBondContact OD1-N 3.17Å; N1310-R1313 WeakPolarHBondContact O-CB 3.43Å; N1310-R1313 PolarHBondContact O-N 3.09Å
1311	P	53.5	Low	65.2	Low	119 Å²	119	63.8 Å²	63.8	77%	0.773	34%	0.339	S	S	*	.	G	3₁₀ helix	trans	-66.9	-32.5	-172.5	27	-35.3	0	0	0	114	G1309 R1313	G1309-P1311 WeakPolarHBondContact O-CD 3.3Å; P1311-R1313 PolarHBondContact O-N 3.42Å; P1311-R1313 VanDerWaalsContact O-N 3.16Å
1312	E	50.8	Low	65.6	Low	147 Å²	147	62.5 Å²	62.5	69%	0.687	33%	0.333	S	S	*	.	G	3₁₀ helix	trans	-69.7	-13.6	-177.5	-62	-168.7	153.2	0	0	113.6	N1310 G1314 S1315	N1310-E1312 PolarHBondContact O-N 3.38Å; N1310-E1312 PolarHBondContact OD1-N 3.17Å; E1312-G1314 VanDerWaalsContact C-N 3.29Å; E1312-G1314 PolarHBondContact O-N 3Å; E1312-S1315 CarbonylContact O-C 3.51Å; E1312-S1315 PolarHBondContact O-N 2.7Å; E1312-S1315 PolarHBondContact O-OG 2.75Å
1313	R	53.1	Low	66.2	Low	55 Å²	55	62.1 Å²	62.1	21%	0.208	33%	0.332	C	S	.	.	G	3₁₀ helix	trans	-72.2	-20.5	-167.3	-154.7	178.9	-165.7	-139.2	15.2	114.3	E1302 N1308 N1310 P1311 S1315	E1302-R1313 IonicContact OE2-CZ 3.7Å; E1302-R1313 IonicContact OE2-NE 2.75Å; E1302-R1313 IonicContact OE2-NH1 3.83Å; E1302-R1313 PolarHBondContact OE2-NH1 2.85Å; N1308-R1313 VanDerWaalsContact ND2-CD 3.27Å; N1308-R1313 WeakPolarHBondContact ND2-CD 3.43Å; N1308-R1313 WeakPolarHBondContact OD1-CD 3.41Å; N1310-R1313 WeakPolarHBondContact O-CB 3.43Å; N1310-R1313 PolarHBondContact O-N 3.09Å; P1311-R1313 PolarHBondContact O-N 3.42Å; P1311-R1313 VanDerWaalsContact O-N 3.16Å; R1313-S1315 VanDerWaalsContact C-N 3.32Å
1314	G	52.7	Low	66.8	Low	19 Å²	19	60.2 Å²	60.2	20%	0.196	32%	0.321	C	S	.	.	G	3₁₀ helix	trans	-68	-34.4	170.2	0	0	0	0	0	112.4	E1312 N1328	E1312-G1314 VanDerWaalsContact C-N 3.29Å; E1312-G1314 PolarHBondContact O-N 3Å; G1314-N1328 PolarHBondContact O-ND2 2.96Å
1315	S	55.1	Low	67.4	Low	48 Å²	48	60 Å²	60	34%	0.336	32%	0.32	S	S	.	.			trans	-105	52.8	-170.2	55.5	0	0	0	0	113.8	E1312 R1313 N1325	E1312-S1315 CarbonylContact O-C 3.51Å; E1312-S1315 PolarHBondContact O-N 2.7Å; E1312-S1315 PolarHBondContact O-OG 2.75Å; R1313-S1315 VanDerWaalsContact C-N 3.32Å; S1315-N1325 WeakPolarHBondContact CA-OD1 3.38Å
1316	I	52.2	Low	68	Low	72 Å²	72	57.6 Å²	57.6	37%	0.369	31%	0.309	S	S	.	.			trans	-59.7	141.2	171.7	-61.7	-176.9	0	0	0	109.7	N1318	I1316-N1318 PolarHBondContact O-N 2.74Å
1317	Q	53.2	Low	68.7	Low	134 Å²	134	53.6 Å²	53.6	63%	0.626	29%	0.288	S	S	*	.	S	Bend	trans	-42.9	116	-166.5	-63.7	178	-8.6	0	0	115.3	A1319	Q1317-A1319 PolarHBondContact O-N 3.44Å
1318	N	58.1	Low	69.2	Low	46 Å²	46	46.2 Å²	46.2	25%	0.246	26%	0.261	C	S	.	.			trans	24.6	75.5	161.2	-173	36.3	0	0	0	116.7	R959 I1316 R1320	R959-N1318 WeakPolarHBondContact CB-OD1 3.46Å; I1316-N1318 PolarHBondContact O-N 2.74Å; N1318-R1320 PolarHBondContact O-N 3.26Å; N1318-R1320 VanDerWaalsContact O-N 3.16Å; N1318-R1320 WeakPolarHBondContact OD1-CG 3.43Å
1319	A	72.8	Confident	69.9	Low	16 Å²	16	44.5 Å²	44.5	13%	0.132	25%	0.252	C	S	.	.			trans	-90.2	64.1	-179.1	0	0	0	0	0	111.5	E960 Q1317 Q1321 V1322 L1323 R1324	E960-A1319 PolarHBondContact OE1-N 2.87Å; Q1317-A1319 PolarHBondContact O-N 3.44Å; A1319-Q1321 PolarHBondContact O-N 2.95Å; A1319-V1322 HydrophobicContact CB-CG2 4.4Å; A1319-V1322 CarbonylContact O-C 3.57Å; A1319-V1322 PolarHBondContact O-N 3.2Å; A1319-L1323 PolarHBondContact O-N 2.88Å; A1319-R1324 HydrophobicContact CB-CB 3.97Å
1320	R	78.6	Confident	70.9	Confident	70 Å²	70	41 Å²	41	26%	0.264	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-49.1	-34.1	-175	-73.6	-172	158.9	-156.9	-7.3	113.9	R959 E962 A963 E966 W1000 N1318 V1322	R959-R1320 PolarHBondContact O-NE 3.32Å; R959-R1320 PolarHBondContact O-NH2 3.42Å; E962-R1320 IonicContact OE2-NH2 2.93Å; A963-R1320 HydrophobicContact CB-CB 4.05Å; A963-R1320 HydrophobicContact CB-CG 3.69Å; E966-R1320 VanDerWaalsContact CD-NH1 3.35Å; E966-R1320 IonicContact OE1-CZ 2.67Å; E966-R1320 IonicContact OE1-NH1 2.79Å; E966-R1320 PolarHBondContact OE1-NH1 2.99Å; E966-R1320 IonicContact OE1-NH2 3.52Å; E966-R1320 PolarHBondContact OE1-NH2 3.49Å; E966-R1320 IonicContact OE2-CZ 3.62Å; E966-R1320 IonicContact OE2-NH1 3.25Å; E966-R1320 PolarHBondContact OE2-NH1 3.47Å; E966-R1320 IonicContact OE2-NH2 2.65Å; W1000-R1320 PolarHBondContact NE1-O 3.24Å; N1318-R1320 PolarHBondContact O-N 3.26Å; N1318-R1320 VanDerWaalsContact O-N 3.16Å; N1318-R1320 WeakPolarHBondContact OD1-CG 3.43Å; R1320-V1322 VanDerWaalsContact C-N 3.29Å; R1320-V1322 PolarHBondContact O-N 2.68Å
1321	Q	84.6	Confident	71.7	Confident	22 Å²	22	37 Å²	37	10%	0.103	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-15.8	177.7	69.9	-81.6	25.1	0	0	114.9	Q799 L998 A999 A1319	Q799-Q1321 HydrophobicContact CB-CG 4.24Å; Q799-Q1321 PolarHBondContact O-NE2 3.02Å; Q799-Q1321 VanDerWaalsContact O-NE2 3.11Å; L998-Q1321 HydrophobicContact CD2-CB 4Å; A999-Q1321 PolarHBondContact N-O 2.84Å; A1319-Q1321 PolarHBondContact O-N 2.95Å
1322	V	84.8	Confident	72.7	Confident	3 Å²	3	31.7 Å²	31.7	2%	0.018	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-127.9	-14.7	-177.2	-138.7	0	0	0	0	114.8	F790 Y794 A999 C1291 F1295 A1319 R1320 R1324 I1327	F790-V1322 HydrophobicContact CD2-CG1 4.36Å; F790-V1322 HydrophobicContact CE2-CG1 4.17Å; Y794-V1322 HydrophobicContact CD2-CG2 4.23Å; A999-V1322 HydrophobicContact CB-CG1 3.82Å; C1291-V1322 WeakPolarHBondContact SG-CG1 3.1Å; F1295-V1322 HydrophobicContact CE2-CB 4.1Å; F1295-V1322 HydrophobicContact CE2-CG1 3.63Å; F1295-V1322 HydrophobicContact CZ-CB 4.18Å; F1295-V1322 HydrophobicContact CZ-CG1 3.79Å; A1319-V1322 HydrophobicContact CB-CG2 4.4Å; A1319-V1322 CarbonylContact O-C 3.57Å; A1319-V1322 PolarHBondContact O-N 3.2Å; R1320-V1322 VanDerWaalsContact C-N 3.29Å; R1320-V1322 PolarHBondContact O-N 2.68Å; V1322-R1324 PolarHBondContact O-N 3.15Å; V1322-I1327 WeakPolarHBondContact O-CD1 3.4Å
1323	L	87	Confident	73.4	Confident	0 Å²	0	31 Å²	31	0%	0	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.3	46.8	179.9	-50.4	172.1	0	0	0	112.4	I922 E960 I964 W1000 L1287 A1319 N1325 I1326 I1327	I922-L1323 HydrophobicContact CD1-CD1 3.83Å; E960-L1323 HydrophobicContact CB-CD2 3.9Å; E960-L1323 HydrophobicContact CG-CD2 4.26Å; E960-L1323 WeakPolarHBondContact OE2-CA 3.47Å; I964-L1323 HydrophobicContact CD1-CD1 3.77Å; I964-L1323 HydrophobicContact CD1-CD2 3.99Å; I964-L1323 HydrophobicContact CG1-CD1 4.12Å; I964-L1323 HydrophobicContact CG1-CD2 4.1Å; W1000-L1323 HydrophobicContact CB-CD1 4.2Å; W1000-L1323 HydrophobicContact CD2-CD1 4.06Å; W1000-L1323 HydrophobicContact CG-CD1 3.7Å; W1000-L1323 HydrophobicContact CG-CG 4.29Å; L1287-L1323 HydrophobicContact CD2-CD1 3.93Å; A1319-L1323 PolarHBondContact O-N 2.88Å; L1323-N1325 VanDerWaalsContact C-N 3.32Å; L1323-N1325 PolarHBondContact O-N 2.59Å; L1323-I1326 HydrophobicContact CB-CB 4.43Å; L1323-I1326 HydrophobicContact CD2-CD1 4.47Å; L1323-I1326 PolarHBondContact O-N 3.42Å; L1323-I1327 WeakPolarHBondContact O-CB 3.44Å; L1323-I1327 VanDerWaalsContact O-CG1 3.31Å; L1323-I1327 WeakPolarHBondContact O-CG1 3.44Å; L1323-I1327 PolarHBondContact O-N 3.02Å
1324	R	83.4	Confident	73.7	Confident	8 Å²	8	32.7 Å²	32.7	3%	0.03	18%	0.175	C	C	.	.	H	α-helix	trans	-63.2	-37.5	-170.7	178	176.2	172.5	138.9	1.9	111.7	Y794 E960 F1295 A1319 V1322 N1328	Y794-R1324 PolarHBondContact OH-NH1 3.31Å; E960-R1324 PolarHBondContact OE1-N 3.41Å; E960-R1324 PolarHBondContact OE2-N 3.5Å; F1295-R1324 HydrophobicContact CD2-CG 4.48Å; F1295-R1324 HydrophobicContact CE1-CG 4.34Å; F1295-R1324 HydrophobicContact CE2-CB 4.02Å; F1295-R1324 HydrophobicContact CE2-CG 4.2Å; F1295-R1324 HydrophobicContact CZ-CB 4.15Å; F1295-R1324 HydrophobicContact CZ-CG 4.13Å; A1319-R1324 HydrophobicContact CB-CB 3.97Å; V1322-R1324 PolarHBondContact O-N 3.15Å; R1324-N1328 VanDerWaalsContact O-CB 3.3Å; R1324-N1328 WeakPolarHBondContact O-CB 3.43Å; R1324-N1328 PolarHBondContact O-N 2.87Å; R1324-N1328 PolarHBondContact O-ND2 2.88Å
1325	N	82	Confident	74.6	Confident	3 Å²	3	32.6 Å²	32.6	2%	0.016	17%	0.169	C	C	.	.	H	α-helix	trans	-75.4	-44	-176.9	-68.4	3.7	0	0	0	110.9	C956 E960 S1315 L1323 I1327 N1328 S1329	C956-N1325 WeakPolarHBondContact CB-ND2 3.45Å; E960-N1325 PolarHBondContact OE1-N 3.3Å; E960-N1325 WeakPolarHBondContact OE2-CA 3.2Å; E960-N1325 WeakPolarHBondContact OE2-CB 3.48Å; E960-N1325 PolarHBondContact OE2-N 2.7Å; S1315-N1325 WeakPolarHBondContact CA-OD1 3.38Å; L1323-N1325 VanDerWaalsContact C-N 3.32Å; L1323-N1325 PolarHBondContact O-N 2.59Å; N1325-I1327 VanDerWaalsContact C-N 3.3Å; N1325-I1327 PolarHBondContact O-N 3.42Å; N1325-N1328 PolarHBondContact O-N 3.09Å; N1325-S1329 WeakPolarHBondContact O-CB 2.78Å; N1325-S1329 PolarHBondContact O-N 2.84Å; N1325-S1329 PolarHBondContact O-OG 3.2Å; N1325-S1329 VanDerWaalsContact O-OG 3.08Å
1326	I	85.1	Confident	75.5	Confident	4 Å²	4	30.6 Å²	30.6	2%	0.021	16%	0.157	C	C	.	.	H	α-helix	trans	-58	-41.8	173.2	-67.1	173.8	0	0	0	111.3	I922 L949 Q957 E960 V961 I964 L1323 S1329 S1330	I922-I1326 HydrophobicContact CD1-CG2 3.75Å; I922-I1326 HydrophobicContact CG1-CG2 4.34Å; L949-I1326 HydrophobicContact CD1-CG2 3.84Å; Q957-I1326 HydrophobicContact CG-CG1 3.91Å; E960-I1326 HydrophobicContact CB-CD1 3.63Å; E960-I1326 HydrophobicContact CB-CG1 4.05Å; E960-I1326 PolarHBondContact OE2-N 3.5Å; V961-I1326 HydrophobicContact CG2-CD1 3.89Å; I964-I1326 HydrophobicContact CD1-CD1 3.8Å; L1323-I1326 HydrophobicContact CB-CB 4.43Å; L1323-I1326 HydrophobicContact CD2-CD1 4.47Å; L1323-I1326 PolarHBondContact O-N 3.42Å; I1326-S1329 PolarHBondContact O-OG 3.29Å; I1326-S1330 WeakPolarHBondContact O-CB 3.17Å; I1326-S1330 PolarHBondContact O-N 3.45Å; I1326-S1330 PolarHBondContact O-OG 2.87Å
1327	I	87.9	Confident	76.6	Confident	1 Å²	1	32.2 Å²	32.2	1%	0.005	16%	0.159	C	C	.	.	H	α-helix	trans	-66.5	-45.3	176.2	-69.4	167.4	0	0	0	111	L1287 V1292 F1295 W1296 V1322 L1323 N1325 S1330 A1331	L1287-I1327 HydrophobicContact CD1-CD1 4.44Å; L1287-I1327 HydrophobicContact CD1-CG1 4.2Å; V1292-I1327 HydrophobicContact CG1-CG1 4.5Å; V1292-I1327 HydrophobicContact CG1-CG2 3.91Å; V1292-I1327 HydrophobicContact CG2-CD1 4.1Å; V1292-I1327 HydrophobicContact CG2-CG1 4.45Å; F1295-I1327 HydrophobicContact CB-CG2 3.91Å; F1295-I1327 HydrophobicContact CD2-CB 4.27Å; F1295-I1327 HydrophobicContact CD2-CD1 3.94Å; F1295-I1327 HydrophobicContact CD2-CG2 3.98Å; F1295-I1327 HydrophobicContact CE2-CD1 4.25Å; F1295-I1327 HydrophobicContact CG-CG2 4.47Å; W1296-I1327 PolarHBondContact NE1-O 3.12Å; V1322-I1327 WeakPolarHBondContact O-CD1 3.4Å; L1323-I1327 WeakPolarHBondContact O-CB 3.44Å; L1323-I1327 VanDerWaalsContact O-CG1 3.31Å; L1323-I1327 WeakPolarHBondContact O-CG1 3.44Å; L1323-I1327 PolarHBondContact O-N 3.02Å; N1325-I1327 VanDerWaalsContact C-N 3.3Å; N1325-I1327 PolarHBondContact O-N 3.42Å; I1327-S1330 PolarHBondContact O-N 2.79Å; I1327-S1330 PolarHBondContact O-OG 3Å; I1327-A1331 PolarHBondContact O-N 2.84Å
1328	N	83.1	Confident	77.9	Confident	9 Å²	9	26.4 Å²	26.4	5%	0.048	13%	0.133	C	C	.	.	H	α-helix	trans	-69.6	-41.6	-177.9	-73.9	-14.5	0	0	0	113	Q1299 G1314 R1324 N1325 S1330 A1331 G1336	Q1299-N1328 WeakPolarHBondContact CG-OD1 3.46Å; G1314-N1328 PolarHBondContact O-ND2 2.96Å; R1324-N1328 VanDerWaalsContact O-CB 3.3Å; R1324-N1328 WeakPolarHBondContact O-CB 3.43Å; R1324-N1328 PolarHBondContact O-N 2.87Å; R1324-N1328 PolarHBondContact O-ND2 2.88Å; N1325-N1328 PolarHBondContact O-N 3.09Å; N1328-S1330 PolarHBondContact O-N 3.29Å; N1328-A1331 VanDerWaalsContact O-CB 3.24Å; N1328-A1331 WeakPolarHBondContact O-CB 3.49Å; N1328-A1331 PolarHBondContact O-N 3.05Å; N1328-G1336 WeakPolarHBondContact O-CA 3.35Å
1329	S	80.8	Confident	78.9	Confident	1 Å²	1	25.6 Å²	25.6	1%	0.007	13%	0.128	C	C	.	.	H	α-helix	trans	-64.3	-31.2	175.6	62.5	0	0	0	0	111.7	Q957 N1325 I1326 A1331 Y1337 P1338	Q957-S1329 PolarHBondContact OE1-OG 3.18Å; N1325-S1329 WeakPolarHBondContact O-CB 2.78Å; N1325-S1329 PolarHBondContact O-N 2.84Å; N1325-S1329 PolarHBondContact O-OG 3.2Å; N1325-S1329 VanDerWaalsContact O-OG 3.08Å; I1326-S1329 PolarHBondContact O-OG 3.29Å; S1329-A1331 PolarHBondContact O-N 2.98Å; S1329-Y1337 VanDerWaalsContact CB-CE2 3.49Å; S1329-Y1337 CarbonylContact O-C 3.51Å; S1329-Y1337 PolarHBondContact O-N 3.24Å; S1329-P1338 WeakPolarHBondContact O-CD 3.41Å
1330	S	85.6	Confident	79.4	Confident	0 Å²	0	26.1 Å²	26.1	0%	0	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-0.3	171.5	81.1	0	0	0	0	115.5	R947 W1296 I1326 I1327 N1328	R947-S1330 WeakPolarHBondContact CD-O 3.18Å; R947-S1330 PolarHBondContact NE-O 3.41Å; W1296-S1330 WeakPolarHBondContact CZ2-OG 3.34Å; I1326-S1330 WeakPolarHBondContact O-CB 3.17Å; I1326-S1330 PolarHBondContact O-N 3.45Å; I1326-S1330 PolarHBondContact O-OG 2.87Å; I1327-S1330 PolarHBondContact O-N 2.79Å; I1327-S1330 PolarHBondContact O-OG 3Å; N1328-S1330 PolarHBondContact O-N 3.29Å
1331	A	80.6	Confident	79.7	Confident	0 Å²	0	23.3 Å²	23.3	0%	0	12%	0.117	C	C	.	.	S	Bend	trans	-74.3	147.4	178.2	0	0	0	0	0	112.2	W1296 I1327 N1328 S1329 I1335 G1336 P1338	W1296-A1331 HydrophobicContact CG-CB 4.45Å; I1327-A1331 PolarHBondContact O-N 2.84Å; N1328-A1331 VanDerWaalsContact O-CB 3.24Å; N1328-A1331 WeakPolarHBondContact O-CB 3.49Å; N1328-A1331 PolarHBondContact O-N 3.05Å; S1329-A1331 PolarHBondContact O-N 2.98Å; A1331-I1335 HydrophobicContact CB-CB 4.1Å; A1331-I1335 HydrophobicContact CB-CG2 3.73Å; A1331-G1336 CarbonylContact O-C 3.59Å; A1331-G1336 VanDerWaalsContact O-C 3.23Å; A1331-G1336 WeakPolarHBondContact O-CA 3.33Å; A1331-G1336 PolarHBondContact O-N 3.39Å; A1331-P1338 WeakPolarHBondContact O-CD 3.45Å
1332	D	74.9	Confident	79.7	Confident	8 Å²	8	22.2 Å²	22.2	4%	0.043	11%	0.112	C	C	.	.	P	Polyproline II helix	trans	-66.3	138.8	179.3	-75	-4	0	0	0	111.2	W855 Y859 R947 I1335	W855-D1332 HydrophobicContact CG-CB 4.26Å; Y859-D1332 VanDerWaalsContact CE2-OD2 3.31Å; Y859-D1332 WeakPolarHBondContact CE2-OD2 3.35Å; Y859-D1332 WeakPolarHBondContact OH-CB 3.49Å; R947-D1332 IonicContact CZ-OD1 3.7Å; R947-D1332 VanDerWaalsContact CZ-OD1 3.3Å; R947-D1332 IonicContact CZ-OD2 3.5Å; R947-D1332 IonicContact NE-OD1 3.23Å; R947-D1332 PolarHBondContact NE-OD1 3.15Å; R947-D1332 IonicContact NH2-OD1 2.87Å; R947-D1332 PolarHBondContact NH2-OD1 2.86Å; R947-D1332 IonicContact NH2-OD2 3.95Å; R947-D1332 PolarHBondContact NH2-OD2 2.9Å; D1332-I1335 WeakPolarHBondContact O-CB 3.35Å; D1332-I1335 PolarHBondContact O-N 3.48Å
1333	Q	65.4	Low	79.5	Confident	132 Å²	132	24.1 Å²	24.1	62%	0.617	12%	0.124	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55	134.6	177.3	-74.3	177.6	-8.4	0	0	111.5	G1336	Q1333-G1336 VanDerWaalsContact CG-O 3.26Å; Q1333-G1336 WeakPolarHBondContact CG-O 3.27Å
1334	P	60.7	Low	79.3	Confident	91 Å²	91	26.3 Å²	26.3	59%	0.591	14%	0.136	S	C	*	.	T	Hydrogen-bonded Turn	cis	-93.5	10.9	17	37.9	-38.4	0	0	0	115.4
1335	I	71.3	Confident	79.4	Confident	16 Å²	16	26.6 Å²	26.6	8%	0.082	14%	0.139	C	C	.	.	S	Bend	trans	-87.3	-34.2	-170.5	-63.1	164.3	0	0	0	111.8	W855 Q1299 Q1300 L1303 V1304 A1331 D1332	W855-I1335 HydrophobicContact CH2-CD1 3.36Å; W855-I1335 HydrophobicContact CZ2-CD1 3.83Å; W855-I1335 HydrophobicContact CZ3-CD1 4.15Å; Q1299-I1335 HydrophobicContact CB-CG2 3.54Å; Q1300-I1335 HydrophobicContact CB-CD1 3.69Å; Q1300-I1335 HydrophobicContact CG-CD1 3.96Å; L1303-I1335 HydrophobicContact CD1-CG2 4.3Å; V1304-I1335 HydrophobicContact CG2-CD1 4.48Å; V1304-I1335 HydrophobicContact CG2-CG1 4.28Å; A1331-I1335 HydrophobicContact CB-CB 4.1Å; A1331-I1335 HydrophobicContact CB-CG2 3.73Å; D1332-I1335 WeakPolarHBondContact O-CB 3.35Å; D1332-I1335 PolarHBondContact O-N 3.48Å
1336	G	72.6	Confident	79.6	Confident	7 Å²	7	27.8 Å²	27.8	7%	0.072	15%	0.146	C	C	.	.			trans	-133.6	-172.6	172.2	0	0	0	0	0	111.6	N1328 A1331 Q1333 P1338	N1328-G1336 WeakPolarHBondContact O-CA 3.35Å; A1331-G1336 CarbonylContact O-C 3.59Å; A1331-G1336 VanDerWaalsContact O-C 3.23Å; A1331-G1336 WeakPolarHBondContact O-CA 3.33Å; A1331-G1336 PolarHBondContact O-N 3.39Å; Q1333-G1336 VanDerWaalsContact CG-O 3.26Å; Q1333-G1336 WeakPolarHBondContact CG-O 3.27Å; G1336-P1338 VanDerWaalsContact C-CD 3.46Å
1337	Y	76.8	Confident	79.8	Confident	106 Å²	106	27.6 Å²	27.6	42%	0.416	15%	0.145	S	C	.	.			trans	-135.5	50.4	-169.9	45.9	-89.1	0	0	0	113.2	E950 S1329 I1339	E950-Y1337 WeakPolarHBondContact OE2-CE2 3.26Å; S1329-Y1337 VanDerWaalsContact CB-CE2 3.49Å; S1329-Y1337 CarbonylContact O-C 3.51Å; S1329-Y1337 PolarHBondContact O-N 3.24Å; Y1337-I1339 PolarHBondContact O-N 3.31Å
1338	P	79.1	Confident	79.8	Confident	12 Å²	12	28.7 Å²	28.7	8%	0.078	15%	0.149	C	C	.	.			trans	-64.4	130.4	175.9	28.1	-34.9	0	0	0	110.5	R947 G948 S1329 A1331 G1336 Y1340 V1341	R947-P1338 HydrophobicContact CB-CB 4.42Å; G948-P1338 CarbonylContact O-C 3.58Å; G948-P1338 WeakPolarHBondContact O-CA 3.45Å; S1329-P1338 WeakPolarHBondContact O-CD 3.41Å; A1331-P1338 WeakPolarHBondContact O-CD 3.45Å; G1336-P1338 VanDerWaalsContact C-CD 3.46Å; P1338-Y1340 VanDerWaalsContact C-N 3.26Å; P1338-Y1340 PolarHBondContact O-N 3.49Å; P1338-V1341 HydrophobicContact CB-CG2 3.91Å; P1338-V1341 HydrophobicContact CG-CG2 3.51Å
1339	I	79.6	Confident	79.9	Confident	29 Å²	29	29 Å²	29	15%	0.149	15%	0.152	C	C	.	.	S	Bend	trans	-59.5	-39.8	176.6	-82.5	-170.4	0	0	0	111.2	S884 N887 A888 Y891 G948 E950 Y1337	S884-I1339 WeakPolarHBondContact O-CG2 3.28Å; N887-I1339 HydrophobicContact CB-CD1 4.09Å; N887-I1339 HydrophobicContact CB-CG2 4.36Å; A888-I1339 HydrophobicContact CB-CG2 3.89Å; Y891-I1339 HydrophobicContact CD2-CG2 4.07Å; Y891-I1339 HydrophobicContact CE2-CG2 4.21Å; G948-I1339 PolarHBondContact O-N 3.23Å; E950-I1339 HydrophobicContact CB-CD1 4.34Å; Y1337-I1339 PolarHBondContact O-N 3.31Å
1340	Y	83.8	Confident	79.9	Confident	27 Å²	27	30.9 Å²	30.9	11%	0.106	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	133.6	-179.4	179.2	-103.5	0	0	0	110.1	A888 E892 L946 R947 G948 P1338	A888-Y1340 HydrophobicContact CB-CD2 4.24Å; E892-Y1340 HydrophobicContact CB-CE2 4.16Å; L946-Y1340 HydrophobicContact CD2-CD1 4.04Å; L946-Y1340 HydrophobicContact CD2-CE1 4.48Å; R947-Y1340 CarbonylContact C-O 3.38Å; R947-Y1340 VanDerWaalsContact CA-O 3.29Å; R947-Y1340 WeakPolarHBondContact CA-O 3.46Å; G948-Y1340 PolarHBondContact N-O 3.13Å; P1338-Y1340 VanDerWaalsContact C-N 3.26Å; P1338-Y1340 PolarHBondContact O-N 3.49Å
1341	V	84.2	Confident	79.7	Confident	10 Å²	10	32.9 Å²	32.9	6%	0.061	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	121.3	167.4	-177.8	0	0	0	0	107.7	Y859 T861 Q945 R947 P1338	Y859-V1341 HydrophobicContact CD1-CB 3.8Å; Y859-V1341 HydrophobicContact CD1-CG1 3.86Å; Y859-V1341 HydrophobicContact CD2-CB 4.48Å; Y859-V1341 HydrophobicContact CD2-CG1 3.63Å; Y859-V1341 HydrophobicContact CE1-CB 4.03Å; Y859-V1341 HydrophobicContact CE1-CG1 4.15Å; Y859-V1341 HydrophobicContact CE1-CG2 4.33Å; Y859-V1341 HydrophobicContact CE2-CG1 3.97Å; Y859-V1341 HydrophobicContact CG-CB 4.05Å; Y859-V1341 HydrophobicContact CG-CG1 3.59Å; T861-V1341 PolarHBondContact OG1-O 2.96Å; T861-V1341 VanDerWaalsContact OG1-O 3.04Å; Q945-V1341 HydrophobicContact CG-CG1 4.31Å; Q945-V1341 VanDerWaalsContact NE2-CG1 3.26Å; R947-V1341 HydrophobicContact CG-CG1 4.44Å; R947-V1341 HydrophobicContact CG-CG2 4.31Å; P1338-V1341 HydrophobicContact CB-CG2 3.91Å; P1338-V1341 HydrophobicContact CG-CG2 3.51Å
1342	S	84	Confident	79.9	Confident	0 Å²	0	33 Å²	33	0%	0	17%	0.174	C	C	.	.			trans	-71.6	155.1	179.4	80.6	0	0	0	0	111.6	Q945 L946	Q945-S1342 PolarHBondContact NE2-O 2.8Å; L946-S1342 PolarHBondContact N-OG 3.28Å; L946-S1342 PolarHBondContact O-N 3Å
1343	P	82.5	Confident	80.2	Confident	42 Å²	42	36 Å²	36	27%	0.273	19%	0.193	S	C	.	.			trans	-58.9	167.8	153.7	27.8	-34.5	0	0	0	110.5	Y859 T1345	Y859-P1343 VanDerWaalsContact O-CA 3.31Å; Y859-P1343 WeakPolarHBondContact O-CA 3.46Å; Y859-P1343 WeakPolarHBondContact O-CB 3.45Å; P1343-T1345 HydrophobicContact CG-CG2 4.27Å; P1343-T1345 PolarHBondContact O-N 3.24Å; P1343-T1345 VanDerWaalsContact O-N 3.08Å
1344	L	82.4	Confident	81.2	Confident	47 Å²	47	31.2 Å²	31.2	25%	0.246	17%	0.171	C	C	.	.			trans	-65.8	107.5	171.3	-65.7	171.2	0	0	0	109.5	F528 K853 I935 T943 Q945	F528-L1344 HydrophobicContact CB-CD1 3.67Å; F528-L1344 HydrophobicContact CD1-CD1 3.88Å; F528-L1344 HydrophobicContact CD1-CD2 4.37Å; F528-L1344 HydrophobicContact CG-CD1 3.81Å; K853-L1344 HydrophobicContact CD-CD1 4.42Å; I935-L1344 HydrophobicContact CD1-CD2 3.35Å; T943-L1344 HydrophobicContact CG2-CB 4.4Å; Q945-L1344 HydrophobicContact CB-CD2 4.46Å
1345	T	85.1	Confident	82.2	Confident	14 Å²	14	27.4 Å²	27.4	9%	0.086	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	124.2	-174.5	47.3	0	0	0	0	111.2	T895 T943 F944 P1343	T895-T1345 HydrophobicContact CG2-CG2 3.84Å; T943-T1345 WeakPolarHBondContact CA-O 3.3Å; T943-T1345 WeakPolarHBondContact CG2-O 3.49Å; F944-T1345 WeakPolarHBondContact CE2-OG1 3.3Å; F944-T1345 VanDerWaalsContact CZ-OG1 3.31Å; F944-T1345 WeakPolarHBondContact CZ-OG1 3.47Å; F944-T1345 PolarHBondContact N-O 3.08Å; F944-T1345 PolarHBondContact O-N 3.37Å; F944-T1345 PolarHBondContact O-OG1 3.4Å; P1343-T1345 HydrophobicContact CG-CG2 4.27Å; P1343-T1345 PolarHBondContact O-N 3.24Å; P1343-T1345 VanDerWaalsContact O-N 3.08Å
1346	T	86.8	Confident	82.6	Confident	28 Å²	28	29.1 Å²	29.1	17%	0.172	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	122.5	176.6	52.3	0	0	0	0	109.2	Q899 T943 Y1348	Q899-T1346 WeakPolarHBondContact CG-O 3.35Å; Q899-T1346 PolarHBondContact NE2-O 3.4Å; T943-T1346 HydrophobicContact CG2-CG2 3.81Å; T943-T1346 WeakPolarHBondContact OG1-CG2 3.3Å; T1346-Y1348 WeakPolarHBondContact CB-OH 3.48Å; T1346-Y1348 WeakPolarHBondContact OG1-CE2 3.25Å; T1346-Y1348 PolarHBondContact OG1-OH 2.84Å
1347	S	89.1	Confident	83	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	143.5	169.1	63.1	0	0	0	0	109.9	Q899 F941 V942	Q899-S1347 WeakPolarHBondContact O-CA 3.45Å; Q899-S1347 WeakPolarHBondContact O-CB 3.34Å; F941-S1347 VanDerWaalsContact CA-O 3.3Å; F941-S1347 WeakPolarHBondContact CA-O 3.31Å; V942-S1347 PolarHBondContact N-O 3.28Å; V942-S1347 PolarHBondContact O-N 3.3Å; V942-S1347 PolarHBondContact O-OG 3.29Å
1348	Y	87.6	Confident	83.2	Confident	24 Å²	24	29.2 Å²	29.2	9%	0.094	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	145.6	-176.9	-62.6	-77.3	0	0	0	109.9	T584 L625 F941 T1346 E1350 T1351	T584-Y1348 HydrophobicContact CG2-CE1 4.21Å; L625-Y1348 HydrophobicContact CD1-CE1 4.03Å; F941-Y1348 HydrophobicContact CB-CD1 3.75Å; F941-Y1348 HydrophobicContact CB-CE1 4Å; T1346-Y1348 WeakPolarHBondContact CB-OH 3.48Å; T1346-Y1348 WeakPolarHBondContact OG1-CE2 3.25Å; T1346-Y1348 PolarHBondContact OG1-OH 2.84Å; Y1348-E1350 PolarHBondContact O-N 3.22Å; Y1348-T1351 PolarHBondContact O-N 3.32Å; Y1348-T1351 PolarHBondContact O-OG1 3.36Å
1349	S	84.6	Confident	83	Confident	14 Å²	14	32.9 Å²	32.9	10%	0.098	19%	0.191	C	C	.	.	G	3₁₀ helix	trans	-57.9	-36.3	175.1	44.5	0	0	0	0	111.8	G940 T1351 H1352 I1355	G940-S1349 VanDerWaalsContact CA-OG 3.31Å; G940-S1349 WeakPolarHBondContact CA-OG 3.42Å; G940-S1349 PolarHBondContact O-N 3.1Å; G940-S1349 PolarHBondContact O-OG 3.35Å; G940-S1349 VanDerWaalsContact O-OG 3.11Å; S1349-T1351 PolarHBondContact O-N 2.76Å; S1349-H1352 PolarHBondContact O-N 3.48Å; S1349-H1352 VanDerWaalsContact O-N 3.16Å; S1349-I1355 WeakPolarHBondContact O-CG2 3.3Å
1350	E	80.5	Confident	82.7	Confident	42 Å²	42	33 Å²	33	20%	0.196	20%	0.199	C	C	.	.	G	3₁₀ helix	trans	-65.9	-17.2	-176.7	-63.4	86.4	167.1	0	0	114.2	R628 Y1348 V1362	R628-E1350 IonicContact CZ-OE1 2.78Å; R628-E1350 IonicContact CZ-OE2 3.67Å; R628-E1350 VanDerWaalsContact NH1-CD 3.31Å; R628-E1350 IonicContact NH1-OE1 3.64Å; R628-E1350 PolarHBondContact NH1-OE1 2.74Å; R628-E1350 IonicContact NH1-OE2 2.67Å; R628-E1350 PolarHBondContact NH1-OE2 3.09Å; Y1348-E1350 PolarHBondContact O-N 3.22Å; E1350-V1362 HydrophobicContact CB-CG1 3.9Å; E1350-V1362 HydrophobicContact CB-CG2 4.43Å; E1350-V1362 HydrophobicContact CG-CG1 4.15Å
1351	T	81.4	Confident	82	Confident	42 Å²	42	35.3 Å²	35.3	26%	0.258	22%	0.217	S	C	.	.	G	3₁₀ helix	trans	-84.2	-15.1	176.2	54.6	0	0	0	0	113.7	I624 Q900 Y1348 S1349 P1353	I624-T1351 HydrophobicContact CD1-CG2 4.18Å; Q900-T1351 CarbonylContact O-C 3.53Å; Q900-T1351 PolarHBondContact O-OG1 3.28Å; Y1348-T1351 PolarHBondContact O-N 3.32Å; Y1348-T1351 PolarHBondContact O-OG1 3.36Å; S1349-T1351 PolarHBondContact O-N 2.76Å; T1351-P1353 WeakPolarHBondContact O-CD 3.36Å
1352	H	85.3	Confident	81.2	Confident	3 Å²	3	38.2 Å²	38.2	1%	0.014	24%	0.235	C	C	.	.			trans	-78.4	118.7	-176.4	-178.1	-126	0	0	0	111.2	Q900 H901 D905 S1349 Q1354 I1355	Q900-H1352 PolarHBondContact O-N 2.9Å; H901-H1352 AromaticContact CD2-CD2 3.53Å; H901-H1352 AromaticContact CD2-NE2 3.9Å; D905-H1352 IonicContact OD1-CE1 3.12Å; D905-H1352 IonicContact OD1-NE2 2.96Å; S1349-H1352 PolarHBondContact O-N 3.48Å; S1349-H1352 VanDerWaalsContact O-N 3.16Å; H1352-Q1354 VanDerWaalsContact C-N 3.32Å; H1352-Q1354 PolarHBondContact O-N 3.37Å; H1352-I1355 HydrophobicContact CB-CB 4.41Å; H1352-I1355 HydrophobicContact CB-CG2 4.05Å; H1352-I1355 PolarHBondContact O-N 3.47Å
1353	P	81.5	Confident	80.6	Confident	70 Å²	70	40.1 Å²	40.1	46%	0.455	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-40	-170.9	20.1	-33.3	0	0	0	113.3	T1351 S1356	T1351-P1353 WeakPolarHBondContact O-CD 3.36Å; P1353-S1356 PolarHBondContact O-OG 3.34Å
1354	Q	85.7	Confident	80.2	Confident	31 Å²	31	41 Å²	41	15%	0.145	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75	-29.6	-174.7	-52.2	-175.2	-23.1	0	0	113.5	A709 V711 H1352 S1356 S1357	A709-Q1354 PolarHBondContact O-NE2 3.44Å; A709-Q1354 PolarHBondContact O-OE1 3.22Å; V711-Q1354 HydrophobicContact CG2-CB 4.09Å; V711-Q1354 HydrophobicContact CG2-CG 4.44Å; H1352-Q1354 VanDerWaalsContact C-N 3.32Å; H1352-Q1354 PolarHBondContact O-N 3.37Å; Q1354-S1356 VanDerWaalsContact C-N 3.3Å; Q1354-S1356 PolarHBondContact O-N 3.39Å; Q1354-S1357 WeakPolarHBondContact O-CB 3.44Å; Q1354-S1357 PolarHBondContact O-N 3.47Å; Q1354-S1357 VanDerWaalsContact O-N 3.11Å; Q1354-S1357 PolarHBondContact O-OG 3.01Å
1355	I	82.5	Confident	80	Confident	12 Å²	12	42.4 Å²	42.4	6%	0.062	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-71.4	-28	-169.5	-153.4	165.3	0	0	0	112.8	A907 S1349 H1352 S1357 I1358 L1359	A907-I1355 HydrophobicContact CB-CD1 3.68Å; S1349-I1355 WeakPolarHBondContact O-CG2 3.3Å; H1352-I1355 HydrophobicContact CB-CB 4.41Å; H1352-I1355 HydrophobicContact CB-CG2 4.05Å; H1352-I1355 PolarHBondContact O-N 3.47Å; I1355-S1357 PolarHBondContact O-N 3.31Å; I1355-S1357 VanDerWaalsContact O-N 3.16Å; I1355-I1358 PolarHBondContact O-N 3.24Å; I1355-L1359 HydrophobicContact CD1-CD1 3.75Å; I1355-L1359 HydrophobicContact CG1-CD1 3.53Å; I1355-L1359 PolarHBondContact O-N 3.13Å
1356	S	79.4	Confident	79.7	Confident	51 Å²	51	46.9 Å²	46.9	36%	0.357	27%	0.27	S	S	.	.	G	3₁₀ helix	trans	-57	-25.7	172.2	69.1	0	0	0	0	113.5	P1353 Q1354 G1360	P1353-S1356 PolarHBondContact O-OG 3.34Å; Q1354-S1356 VanDerWaalsContact C-N 3.3Å; Q1354-S1356 PolarHBondContact O-N 3.39Å; S1356-G1360 WeakPolarHBondContact CA-O 3.34Å; S1356-G1360 CarbonylContact O-C 3.32Å; S1356-G1360 VanDerWaalsContact O-C 3.31Å; S1356-G1360 WeakPolarHBondContact O-CA 3.42Å; S1356-G1360 PolarHBondContact O-N 3.25Å; S1356-G1360 VanDerWaalsContact O-O 3.04Å
1357	S	81.2	Confident	79.4	Confident	96 Å²	96	47.2 Å²	47.2	67%	0.671	28%	0.276	S	S	*	.	G	3₁₀ helix	trans	-83.8	-7.2	176.4	74.8	0	0	0	0	114.4	Q1354 I1355	Q1354-S1357 WeakPolarHBondContact O-CB 3.44Å; Q1354-S1357 PolarHBondContact O-N 3.47Å; Q1354-S1357 VanDerWaalsContact O-N 3.11Å; Q1354-S1357 PolarHBondContact O-OG 3.01Å; I1355-S1357 PolarHBondContact O-N 3.31Å; I1355-S1357 VanDerWaalsContact O-N 3.16Å
1358	I	81	Confident	79.1	Confident	20 Å²	20	49.9 Å²	49.9	10%	0.103	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-115	-49.6	-172.8	-55.9	167.3	0	0	0	110.8	V711 L908 I1355	V711-I1358 HydrophobicContact CG1-CD1 3.81Å; V711-I1358 HydrophobicContact CG2-CD1 4.29Å; L908-I1358 HydrophobicContact CD2-CD1 3.68Å; I1355-I1358 PolarHBondContact O-N 3.24Å
1359	L	75.8	Confident	78.8	Confident	89 Å²	89	50.3 Å²	50.3	47%	0.466	30%	0.298	S	S	.	.	S	Bend	trans	-99.4	-3.9	-178.7	-79.8	127.9	0	0	0	113.7	C723 I1355	C723-L1359 HydrophobicContact CB-CD2 4.31Å; I1355-L1359 HydrophobicContact CD1-CD1 3.75Å; I1355-L1359 HydrophobicContact CG1-CD1 3.53Å; I1355-L1359 PolarHBondContact O-N 3.13Å
1360	G	73.5	Confident	78.9	Confident	31 Å²	31	53.6 Å²	53.6	32%	0.32	32%	0.315	S	S	.	.			trans	104.2	-177.4	174.7	0	0	0	0	0	115	S1356	S1356-G1360 WeakPolarHBondContact CA-O 3.34Å; S1356-G1360 CarbonylContact O-C 3.32Å; S1356-G1360 VanDerWaalsContact O-C 3.31Å; S1356-G1360 WeakPolarHBondContact O-CA 3.42Å; S1356-G1360 PolarHBondContact O-N 3.25Å; S1356-G1360 VanDerWaalsContact O-O 3.04Å
1361	P	69.1	Low	79.2	Confident	75 Å²	75	59.1 Å²	59.1	49%	0.487	34%	0.338	S	S	.	.			trans	-68.7	138.3	-170.4	28.2	-35.2	0	0	0	112.6	D1363 A1367	P1361-D1363 VanDerWaalsContact C-N 3.28Å; P1361-D1363 PolarHBondContact O-N 2.86Å; P1361-A1367 HydrophobicContact CB-CB 4.39Å; P1361-A1367 HydrophobicContact CG-CB 3.82Å
1362	V	66.6	Low	79.4	Confident	71 Å²	71	61.2 Å²	61.2	43%	0.43	35%	0.351	S	S	.	.	S	Bend	trans	-56.8	-37.9	-178.6	171.3	0	0	0	0	113	N631 E1350 L1364	N631-V1362 PolarHBondContact ND2-O 2.62Å; E1350-V1362 HydrophobicContact CB-CG1 3.9Å; E1350-V1362 HydrophobicContact CB-CG2 4.43Å; E1350-V1362 HydrophobicContact CG-CG1 4.15Å; V1362-L1364 PolarHBondContact O-N 2.93Å
1363	D	70.2	Confident	79.6	Confident	40 Å²	40	65 Å²	65	21%	0.214	37%	0.37	C	S	.	.			trans	-100.8	66.2	179	-158.5	12.4	0	0	0	112.3	R630 N631 P1361 F1365 K1366 A1367	R630-D1363 IonicContact CZ-OD1 4Å; R630-D1363 IonicContact NH2-OD1 3.3Å; R630-D1363 PolarHBondContact NH2-OD1 3.32Å; R630-D1363 IonicContact NH2-OD2 3.99Å; R630-D1363 PolarHBondContact NH2-OD2 2.95Å; N631-D1363 PolarHBondContact ND2-OD1 2.83Å; N631-D1363 PolarHBondContact OD1-OD1 2.91Å; P1361-D1363 VanDerWaalsContact C-N 3.28Å; P1361-D1363 PolarHBondContact O-N 2.86Å; D1363-F1365 VanDerWaalsContact C-N 3.33Å; D1363-F1365 PolarHBondContact O-N 3.28Å; D1363-K1366 HydrophobicContact CB-CB 4.23Å; D1363-K1366 PolarHBondContact O-N 2.84Å; D1363-K1366 VanDerWaalsContact O-N 3.08Å; D1363-K1366 VanDerWaalsContact OD2-CB 3.28Å; D1363-K1366 WeakPolarHBondContact OD2-CB 3.16Å; D1363-A1367 PolarHBondContact O-N 3.09Å
1364	L	74.9	Confident	79.9	Confident	61 Å²	61	66.4 Å²	66.4	32%	0.319	37%	0.373	S	S	.	.	H	α-helix	trans	-56.4	-42.7	-173.9	-172.5	70.7	0	0	0	112.8	L635 V1362 K1366 A1367 V1368	L635-L1364 HydrophobicContact CD2-CD2 4.11Å; V1362-L1364 PolarHBondContact O-N 2.93Å; L1364-K1366 VanDerWaalsContact C-N 3.28Å; L1364-K1366 PolarHBondContact O-N 3.24Å; L1364-A1367 PolarHBondContact O-N 3.46Å; L1364-V1368 HydrophobicContact CD1-CG2 4.43Å; L1364-V1368 HydrophobicContact CG-CG2 4.41Å; L1364-V1368 WeakPolarHBondContact O-CB 3.39Å; L1364-V1368 WeakPolarHBondContact O-CG2 3.38Å; L1364-V1368 PolarHBondContact O-N 2.94Å
1365	F	77.8	Confident	80	Confident	76 Å²	76	70 Å²	70	33%	0.333	39%	0.393	S	S	.	.	H	α-helix	trans	-55.4	-45.8	176.4	173.5	-98.7	0	0	0	111.2	N631 F634 D1363 V1368 S1369	N631-F1365 WeakPolarHBondContact OD1-CB 3.3Å; N631-F1365 PolarHBondContact OD1-N 3.13Å; N631-F1365 VanDerWaalsContact OD1-N 3.11Å; F634-F1365 HydrophobicContact CB-CD2 4.16Å; F634-F1365 HydrophobicContact CD1-CB 4.41Å; F634-F1365 HydrophobicContact CD1-CD2 4.37Å; F634-F1365 AromaticContact CD2-CD2 3.73Å; F634-F1365 HydrophobicContact CD2-CD2 3.73Å; F634-F1365 HydrophobicContact CD2-CE2 4.22Å; F634-F1365 HydrophobicContact CE2-CD2 4.2Å; F634-F1365 HydrophobicContact CG-CB 4.49Å; F634-F1365 AromaticContact CG-CD2 3.82Å; F634-F1365 HydrophobicContact CG-CD2 3.82Å; D1363-F1365 VanDerWaalsContact C-N 3.33Å; D1363-F1365 PolarHBondContact O-N 3.28Å; F1365-V1368 PolarHBondContact O-N 3.38Å; F1365-S1369 WeakPolarHBondContact O-CB 3.08Å; F1365-S1369 PolarHBondContact O-N 3.04Å; F1365-S1369 PolarHBondContact O-OG 2.69Å
1366	K	79.6	Confident	80.2	Confident	108 Å²	108	77 Å²	77	47%	0.47	42%	0.418	S	S	.	.	H	α-helix	trans	-69.9	-43.3	179.7	-173.7	177.2	177.3	-174.2	0	111.9	D1363 L1364 V1368 S1369 D1370	D1363-K1366 HydrophobicContact CB-CB 4.23Å; D1363-K1366 PolarHBondContact O-N 2.84Å; D1363-K1366 VanDerWaalsContact O-N 3.08Å; D1363-K1366 VanDerWaalsContact OD2-CB 3.28Å; D1363-K1366 WeakPolarHBondContact OD2-CB 3.16Å; L1364-K1366 VanDerWaalsContact C-N 3.28Å; L1364-K1366 PolarHBondContact O-N 3.24Å; K1366-V1368 PolarHBondContact O-N 3.2Å; K1366-S1369 WeakPolarHBondContact CA-OG 3.11Å; K1366-S1369 PolarHBondContact O-N 3.36Å; K1366-S1369 PolarHBondContact O-OG 3.26Å; K1366-D1370 VanDerWaalsContact CE-OD2 3.26Å; K1366-D1370 WeakPolarHBondContact CE-OD2 3.43Å; K1366-D1370 WeakPolarHBondContact CG-OD2 3.47Å; K1366-D1370 WeakPolarHBondContact O-CB 3.49Å; K1366-D1370 PolarHBondContact O-N 3.35Å
1367	A	80.2	Confident	80.4	Confident	36 Å²	36	82.1 Å²	82.1	30%	0.298	43%	0.43	S	S	.	.	H	α-helix	trans	-61.2	-34	177.2	0	0	0	0	0	112.4	P1361 D1363 L1364 K1371	P1361-A1367 HydrophobicContact CB-CB 4.39Å; P1361-A1367 HydrophobicContact CG-CB 3.82Å; D1363-A1367 PolarHBondContact O-N 3.09Å; L1364-A1367 PolarHBondContact O-N 3.46Å; A1367-K1371 PolarHBondContact O-N 2.86Å
1368	V	82.3	Confident	80.5	Confident	55 Å²	55	84.3 Å²	84.3	33%	0.333	43%	0.425	S	S	.	.	H	α-helix	trans	-74.4	-46.3	172.1	174.2	0	0	0	0	111.1	F634 L1364 F1365 K1366 D1370 K1371 V1372	F634-V1368 HydrophobicContact CE1-CG2 4.5Å; F634-V1368 HydrophobicContact CZ-CG1 4.14Å; L1364-V1368 HydrophobicContact CD1-CG2 4.43Å; L1364-V1368 HydrophobicContact CG-CG2 4.41Å; L1364-V1368 WeakPolarHBondContact O-CB 3.39Å; L1364-V1368 WeakPolarHBondContact O-CG2 3.38Å; L1364-V1368 PolarHBondContact O-N 2.94Å; F1365-V1368 PolarHBondContact O-N 3.38Å; K1366-V1368 PolarHBondContact O-N 3.2Å; V1368-D1370 VanDerWaalsContact C-N 3.35Å; V1368-D1370 PolarHBondContact O-N 2.74Å; V1368-K1371 PolarHBondContact O-N 2.93Å; V1368-V1372 HydrophobicContact CG1-CG2 4.12Å; V1368-V1372 WeakPolarHBondContact O-CB 3.36Å; V1368-V1372 WeakPolarHBondContact O-CG2 3.27Å; V1368-V1372 PolarHBondContact O-N 2.71Å
1369	S	82.7	Confident	80.5	Confident	33 Å²	33	87.3 Å²	87.3	23%	0.231	44%	0.44	C	S	.	.	H	α-helix	trans	-61.1	-43	179.3	69.2	0	0	0	0	112.1	F1365 K1366 K1371 V1372 I1373	F1365-S1369 WeakPolarHBondContact O-CB 3.08Å; F1365-S1369 PolarHBondContact O-N 3.04Å; F1365-S1369 PolarHBondContact O-OG 2.69Å; K1366-S1369 WeakPolarHBondContact CA-OG 3.11Å; K1366-S1369 PolarHBondContact O-N 3.36Å; K1366-S1369 PolarHBondContact O-OG 3.26Å; S1369-K1371 VanDerWaalsContact C-N 3.32Å; S1369-K1371 PolarHBondContact O-N 3.11Å; S1369-V1372 PolarHBondContact O-N 3.41Å; S1369-I1373 WeakPolarHBondContact O-CB 3.43Å; S1369-I1373 WeakPolarHBondContact O-CD1 3.4Å; S1369-I1373 WeakPolarHBondContact O-CG1 3.43Å; S1369-I1373 PolarHBondContact O-N 3.08Å
1370	D	85.5	Confident	80.7	Confident	84 Å²	84	88.7 Å²	88.7	45%	0.449	44%	0.444	S	S	.	.	H	α-helix	trans	-64.6	-37.9	179.1	-67.3	-9.5	0	0	0	110.6	K1366 V1368 L1374	K1366-D1370 VanDerWaalsContact CE-OD2 3.26Å; K1366-D1370 WeakPolarHBondContact CE-OD2 3.43Å; K1366-D1370 WeakPolarHBondContact CG-OD2 3.47Å; K1366-D1370 WeakPolarHBondContact O-CB 3.49Å; K1366-D1370 PolarHBondContact O-N 3.35Å; V1368-D1370 VanDerWaalsContact C-N 3.35Å; V1368-D1370 PolarHBondContact O-N 2.74Å; D1370-L1374 VanDerWaalsContact O-CB 3.32Å; D1370-L1374 WeakPolarHBondContact O-CB 3.32Å; D1370-L1374 PolarHBondContact O-N 2.85Å
1371	K	87.3	Confident	80.7	Confident	158 Å²	158	93.6 Å²	93.6	69%	0.687	46%	0.463	S	S	*	.	H	α-helix	trans	-70.3	-38.1	172.1	-83.1	-169	173.8	-171.6	0	113.7	A1367 V1368 S1369 L1374 L1375	A1367-K1371 PolarHBondContact O-N 2.86Å; V1368-K1371 PolarHBondContact O-N 2.93Å; S1369-K1371 VanDerWaalsContact C-N 3.32Å; S1369-K1371 PolarHBondContact O-N 3.11Å; K1371-L1374 PolarHBondContact O-N 2.77Å; K1371-L1375 VanDerWaalsContact O-CB 3.3Å; K1371-L1375 WeakPolarHBondContact O-CB 3.25Å; K1371-L1375 PolarHBondContact O-N 2.87Å
1372	V	86.1	Confident	80.7	Confident	86 Å²	86	96.1 Å²	96.1	52%	0.521	47%	0.472	S	S	.	.	H	α-helix	trans	-68.2	-39.5	176.5	169.4	0	0	0	0	110.5	V1368 S1369 L1375 W1376	V1368-V1372 HydrophobicContact CG1-CG2 4.12Å; V1368-V1372 WeakPolarHBondContact O-CB 3.36Å; V1368-V1372 WeakPolarHBondContact O-CG2 3.27Å; V1368-V1372 PolarHBondContact O-N 2.71Å; S1369-V1372 PolarHBondContact O-N 3.41Å; V1372-L1375 PolarHBondContact O-N 3.45Å; V1372-W1376 VanDerWaalsContact O-CB 3.22Å; V1372-W1376 WeakPolarHBondContact O-CB 3.28Å; V1372-W1376 PolarHBondContact O-N 2.93Å
1373	I	88.4	Confident	80.5	Confident	81 Å²	81	97.8 Å²	97.8	42%	0.415	49%	0.486	S	S	.	.	H	α-helix	trans	-65.6	-39.6	173	-68.3	162.9	0	0	0	110.8	S1369 R1377	S1369-I1373 WeakPolarHBondContact O-CB 3.43Å; S1369-I1373 WeakPolarHBondContact O-CD1 3.4Å; S1369-I1373 WeakPolarHBondContact O-CG1 3.43Å; S1369-I1373 PolarHBondContact O-N 3.08Å; I1373-R1377 WeakPolarHBondContact O-CB 2.96Å; I1373-R1377 VanDerWaalsContact O-CG 3.28Å; I1373-R1377 WeakPolarHBondContact O-CG 3.27Å; I1373-R1377 PolarHBondContact O-N 2.76Å
1374	L	89	Confident	79.4	Confident	101 Å²	101	98.2 Å²	98.2	53%	0.529	50%	0.5	S	S	.	.	H	α-helix	trans	-64.6	-44.8	174.5	-170	74.4	0	0	0	111.8	D1370 K1371 R1377 Y1378	D1370-L1374 VanDerWaalsContact O-CB 3.32Å; D1370-L1374 WeakPolarHBondContact O-CB 3.32Å; D1370-L1374 PolarHBondContact O-N 2.85Å; K1371-L1374 PolarHBondContact O-N 2.77Å; L1374-R1377 PolarHBondContact O-N 2.74Å; L1374-Y1378 PolarHBondContact O-N 2.98Å
1375	L	87.7	Confident	78	Confident	107 Å²	107	103 Å²	103	56%	0.56	52%	0.523	S	S	*	.	H	α-helix	trans	-65	-41.8	176.8	-178.1	64.8	0	0	0	111.4	K1371 V1372 Y1378 L1379	K1371-L1375 VanDerWaalsContact O-CB 3.3Å; K1371-L1375 WeakPolarHBondContact O-CB 3.25Å; K1371-L1375 PolarHBondContact O-N 2.87Å; V1372-L1375 PolarHBondContact O-N 3.45Å; L1375-Y1378 WeakPolarHBondContact O-CB 3.27Å; L1375-Y1378 PolarHBondContact O-N 2.74Å; L1375-L1379 HydrophobicContact CG-CD1 4.16Å; L1375-L1379 WeakPolarHBondContact O-CB 3.49Å; L1375-L1379 WeakPolarHBondContact O-CG 3.34Å; L1375-L1379 PolarHBondContact O-N 3.11Å
1376	W	85.9	Confident	76	Confident	157 Å²	157	106.2 Å²	106.2	60%	0.595	55%	0.554	S	S	*	*	H	α-helix	trans	-62.6	-42	175	-176.4	-97.2	0	0	0	111.7	V1372 L1379 Q1380	V1372-W1376 VanDerWaalsContact O-CB 3.22Å; V1372-W1376 WeakPolarHBondContact O-CB 3.28Å; V1372-W1376 PolarHBondContact O-N 2.93Å; W1376-L1379 PolarHBondContact O-N 3.38Å; W1376-Q1380 WeakPolarHBondContact O-CB 3.38Å; W1376-Q1380 WeakPolarHBondContact O-CG 3.15Å; W1376-Q1380 PolarHBondContact O-N 3.05Å
1377	R	84.5	Confident	73.8	Confident	160 Å²	160	103.2 Å²	103.2	60%	0.604	55%	0.554	S	S	*	*	H	α-helix	trans	-63.2	-40.6	172.6	-74.6	171.6	178.9	-177.6	0.1	112.1	I1373 L1374 Q1380 L1381	I1373-R1377 WeakPolarHBondContact O-CB 2.96Å; I1373-R1377 VanDerWaalsContact O-CG 3.28Å; I1373-R1377 WeakPolarHBondContact O-CG 3.27Å; I1373-R1377 PolarHBondContact O-N 2.76Å; L1374-R1377 PolarHBondContact O-N 2.74Å; R1377-Q1380 PolarHBondContact O-N 3.37Å; R1377-L1381 WeakPolarHBondContact O-CB 3.46Å; R1377-L1381 VanDerWaalsContact O-CG 3.29Å; R1377-L1381 WeakPolarHBondContact O-CG 3.4Å; R1377-L1381 PolarHBondContact O-N 3.2Å
1378	Y	83	Confident	71.6	Confident	142 Å²	142	106.9 Å²	106.9	56%	0.557	58%	0.578	S	S	*	*	H	α-helix	trans	-62.8	-40.5	173.1	-107.2	-78.6	0	0	0	112.5	L1374 L1375 L1381 N1382	L1374-Y1378 PolarHBondContact O-N 2.98Å; L1375-Y1378 WeakPolarHBondContact O-CB 3.27Å; L1375-Y1378 PolarHBondContact O-N 2.74Å; Y1378-L1381 PolarHBondContact O-N 3.04Å; Y1378-N1382 WeakPolarHBondContact O-CB 3.25Å; Y1378-N1382 VanDerWaalsContact O-CG 3.3Å; Y1378-N1382 PolarHBondContact O-N 2.88Å
1379	L	79.5	Confident	69.2	Low	82 Å²	82	110.1 Å²	110.1	43%	0.429	60%	0.603	S	S	.	*	H	α-helix	trans	-68.5	-39.3	175.1	-74.5	165.5	0	0	0	111.9	L1375 W1376 L1381 N1382 C1383	L1375-L1379 HydrophobicContact CG-CD1 4.16Å; L1375-L1379 WeakPolarHBondContact O-CB 3.49Å; L1375-L1379 WeakPolarHBondContact O-CG 3.34Å; L1375-L1379 PolarHBondContact O-N 3.11Å; W1376-L1379 PolarHBondContact O-N 3.38Å; L1379-L1381 VanDerWaalsContact C-N 3.32Å; L1379-L1381 PolarHBondContact O-N 2.72Å; L1379-N1382 PolarHBondContact O-N 3.08Å; L1379-C1383 WeakPolarHBondContact O-CB 3.28Å; L1379-C1383 PolarHBondContact O-N 3.1Å; L1379-C1383 PolarHBondContact O-SG 2.87Å; L1379-C1383 VanDerWaalsContact O-SG 3.37Å
1380	Q	80.6	Confident	66.9	Low	118 Å²	118	113.6 Å²	113.6	55%	0.551	63%	0.634	S	S	*	*	H	α-helix	trans	-64.5	-36	173.5	-75	-175.1	-52.1	0	0	112.4	W1376 R1377 G1384	W1376-Q1380 WeakPolarHBondContact O-CB 3.38Å; W1376-Q1380 WeakPolarHBondContact O-CG 3.15Å; W1376-Q1380 PolarHBondContact O-N 3.05Å; R1377-Q1380 PolarHBondContact O-N 3.37Å; Q1380-G1384 PolarHBondContact O-N 2.98Å
1381	L	73.4	Confident	64.6	Low	134 Å²	134	117 Å²	117	70%	0.702	65%	0.65	S	S	*	*	H	α-helix	trans	-70.1	-40.7	173.9	-73.2	165	0	0	0	112.2	R1377 Y1378 L1379	R1377-L1381 WeakPolarHBondContact O-CB 3.46Å; R1377-L1381 VanDerWaalsContact O-CG 3.29Å; R1377-L1381 WeakPolarHBondContact O-CG 3.4Å; R1377-L1381 PolarHBondContact O-N 3.2Å; Y1378-L1381 PolarHBondContact O-N 3.04Å; L1379-L1381 VanDerWaalsContact C-N 3.32Å; L1379-L1381 PolarHBondContact O-N 2.72Å
1382	N	69.2	Low	62	Low	128 Å²	128	116.2 Å²	116.2	68%	0.684	65%	0.653	S	S	*	*	H	α-helix	trans	-84.8	-21.5	-176.3	-69.9	1.5	0	0	0	114.3	Y1378 L1379	Y1378-N1382 WeakPolarHBondContact O-CB 3.25Å; Y1378-N1382 VanDerWaalsContact O-CG 3.3Å; Y1378-N1382 PolarHBondContact O-N 2.88Å; L1379-N1382 PolarHBondContact O-N 3.08Å
1383	C	62.3	Low	59.7	Low	106 Å²	106	118.6 Å²	118.6	72%	0.716	67%	0.669	S	S	*	*	S	Bend	trans	-96.1	3.9	173	-61.4	0	0	0	0	112.6	L1379 M1385	L1379-C1383 WeakPolarHBondContact O-CB 3.28Å; L1379-C1383 PolarHBondContact O-N 3.1Å; L1379-C1383 PolarHBondContact O-SG 2.87Å; L1379-C1383 VanDerWaalsContact O-SG 3.37Å; C1383-M1385 PolarHBondContact O-N 2.9Å
1384	G	47.5	Very low	57.1	Low	50 Å²	50	120.9 Å²	120.9	52%	0.515	69%	0.686	S	S	.	*	S	Bend	trans	-80.4	95.7	179.2	0	0	0	0	0	113	Q1380	Q1380-G1384 PolarHBondContact O-N 2.98Å
1385	M	44.9	Very low	54.3	Low	161 Å²	161	122.1 Å²	122.1	79%	0.793	69%	0.693	S	S	*	*			trans	59.3	96.1	165.5	-67.2	175.6	59.1	0	0	117.8	C1383 G1387	C1383-M1385 PolarHBondContact O-N 2.9Å; M1385-G1387 VanDerWaalsContact C-N 3.33Å; M1385-G1387 PolarHBondContact O-N 2.92Å; M1385-G1387 VanDerWaalsContact O-N 3.08Å
1386	S	35.6	Very low	51.5	Low	143 Å²	143	125.7 Å²	125.7	100%	1	71%	0.707	S	S	*	*			trans	-65.1	95	138.9	-61.3	0	0	0	0	108.6
1387	G	35	Very low	48.7	Very low	45 Å²	45	121.5 Å²	121.5	46%	0.464	71%	0.712	S	S	.	*			trans	-171.2	78.7	-172.6	0	0	0	0	0	115.9	M1385	M1385-G1387 VanDerWaalsContact C-N 3.33Å; M1385-G1387 PolarHBondContact O-N 2.92Å; M1385-G1387 VanDerWaalsContact O-N 3.08Å
1388	S	32.5	Very low	45.8	Very low	114 Å²	114	124.1 Å²	124.1	80%	0.797	73%	0.729	S	S	*	*			trans	38.1	107.3	152.4	-55.2	0	0	0	0	121.1
1389	S	32.9	Very low	43.2	Very low	122 Å²	122	122.8 Å²	122.8	85%	0.853	74%	0.739	S	S	*	*			trans	53.4	99.8	133.3	63.4	0	0	0	0	120.6
1390	A	34.4	Very low	40.8	Very low	107 Å²	107	126.7 Å²	126.7	88%	0.884	76%	0.755	S	S	*	*			trans	-145.8	147.6	136.1	0	0	0	0	0	109.4
1391	I	37.8	Very low	38.1	Very low	155 Å²	155	133.2 Å²	133.2	80%	0.795	77%	0.774	S	S	*	*			trans	-104.9	151.1	-179.4	-91.6	172.8	0	0	0	110.2
1392	N	32.3	Very low	35.8	Very low	141 Å²	141	131.9 Å²	131.9	75%	0.754	78%	0.776	S	S	*	*			trans	2.2	129.5	161.5	-47.1	-21.6	0	0	0	116.1
1393	T	37	Very low	33.8	Very low	137 Å²	137	131.5 Å²	131.5	84%	0.84	78%	0.782	S	S	*	*				-159.2	158.7	65.8	39.4	0	0	0	0	115.6
1394	V	33.9	Very low	31.9	Very low	128 Å²	128	133.2 Å²	133.2	78%	0.776	79%	0.789	S	S	*	*			trans	-40.8	132.3	158.7	173.1	0	0	0	0	113
1395	D	31.2	Very low	30.9	Very low	128 Å²	128	138.3 Å²	138.3	68%	0.684	80%	0.804	S	S	*	*				-162.3	173.3	100.3	-133.1	-24.6	0	0	0	116.3
1396	Q	28.6	Very low	30	Very low	181 Å²	181	135.9 Å²	135.9	85%	0.846	80%	0.8	S	S	*	*			trans	-69.4	139.7	-161.1	-66.3	149.4	74.2	0	0	116.6
1397	G	25.9	Very low	29.4	Very low	69 Å²	69	134.1 Å²	134.1	71%	0.711	80%	0.795	S	S	*	*			trans	179.7	138.4	162.9	0	0	0	0	0	113.9
1398	F	24.9	Very low	28.9	Very low	216 Å²	216	137.3 Å²	137.3	95%	0.947	81%	0.805	S	S	*	*			trans	58.7	82	169.2	-81.8	-93.2	0	0	0	119.4
1399	C	27.9	Very low	28.5	Very low	114 Å²	114	135.1 Å²	135.1	77%	0.77	79%	0.794	S	S	*	*			trans	-131	139.6	142.8	-99.4	0	0	0	0	108.5
1400	Q	29.6	Very low	28.2	Very low	164 Å²	164	137.3 Å²	137.3	77%	0.766	79%	0.794	S	S	*	*			cis	-158.2	135.8	-9.5	-136	172.1	22.5	0	0	108.5	S1402	Q1400-S1402 PolarHBondContact O-N 2.89Å; Q1400-S1402 VanDerWaalsContact O-N 3.08Å
1401	R	22.6	Very low	27.7	Very low	255 Å²	255	141.1 Å²	141.1	96%	0.962	79%	0.794	S	S	*	*			trans	-77	89.5	168	-88.3	-178.1	170	162.1	-3.7	109.1
1402	S	26.7	Very low	27.1	Very low	106 Å²	106	142.1 Å²	142.1	74%	0.741	80%	0.799	S	S	*	*			trans	-79.9	123.4	174.1	42	0	0	0	0	111	Q1400	Q1400-S1402 PolarHBondContact O-N 2.89Å; Q1400-S1402 VanDerWaalsContact O-N 3.08Å
1403	C	26.3	Very low	26.6	Very low	120 Å²	120	143.9 Å²	143.9	81%	0.811	80%	0.803	S	S	*	*			trans	-67.7	134.6	-174.6	-61.2	0	0	0	0	112.8	L1405	C1403-L1405 PolarHBondContact O-N 3.21Å
1404	T	23.1	Very low	26	Very low	141 Å²	141	146.3 Å²	146.3	87%	0.865	81%	0.805	S	S	*	*			trans	-72.3	108.6	172.5	50.3	0	0	0	0	111.6
1405	L	25.2	Very low	25.6	Very low	157 Å²	157	148.8 Å²	148.8	82%	0.822	81%	0.812	S	S	*	*			trans	-139.1	146.4	159.5	-94.5	130.1	0	0	0	109.5	C1403	C1403-L1405 PolarHBondContact O-N 3.21Å
1406	P	26.1	Very low	25.3	Very low	110 Å²	110	152.2 Å²	152.2	71%	0.714	82%	0.82	S	S	*	*			trans	-87.3	133.6	-153.1	32.1	-35.3	0	0	0	114.3	V1408	P1406-V1408 PolarHBondContact O-N 3.11Å
1407	A	24.6	Very low	25	Very low	107 Å²	107	147.2 Å²	147.2	88%	0.884	82%	0.818	S	S	*	*			trans	-75	100.7	174	0	0	0	0	0	111.9
1408	V	24	Very low	24.9	Very low	112 Å²	112	155 Å²	155	68%	0.679	83%	0.826	S	S	*	*			trans	-132.8	57.4	167.8	-166.6	0	0	0	0	111.1	R623 P1406	R623-V1408 PolarHBondContact NH1-O 2.73Å; R623-V1408 PolarHBondContact NH2-O 3.34Å; P1406-V1408 PolarHBondContact O-N 3.11Å
1409	A	24.3	Very low	24.8	Very low	68 Å²	68	150.1 Å²	150.1	56%	0.562	81%	0.814	S	S	*	*			trans	175.8	106.6	150.7	0	0	0	0	0	110.3
1410	I	26.7	Very low	24.7	Very low	167 Å²	167	151.2 Å²	151.2	86%	0.856	82%	0.819	S	S	*	*			trans	-171.1	105.1	140.2	-90.9	145	0	0	0	105.5
1411	E	23.3	Very low	24.4	Very low	188 Å²	188	149 Å²	149	88%	0.879	82%	0.817	S	S	*	*			trans	-153.8	75	168.3	-174.9	175	-129.8	0	0	106.9
1412	L	24.4	Very low	24.5	Very low	175 Å²	175	146 Å²	146	92%	0.916	81%	0.814	S	S	*	*	S	Bend	trans	179.7	48.5	167	-106.1	166.3	0	0	0	111.6
1413	Q	23.4	Very low	24.3	Very low	178 Å²	178	147.6 Å²	147.6	83%	0.832	82%	0.823	S	S	*	*	S	Bend	trans	-151.8	36.8	174.5	-136.6	173.3	34.7	0	0	116.7
1414	H	24.3	Very low	24.2	Very low	189 Å²	189	147 Å²	147	88%	0.875	82%	0.82	S	S	*	*			trans	-152.2	64.1	166.4	-112.3	-76.1	0	0	0	114.5
1415	I	25.2	Very low	24.3	Very low	179 Å²	179	145.8 Å²	145.8	92%	0.918	81%	0.813	S	S	*	*			trans	-122.7	91.8	155.8	-56.5	-178.1	0	0	0	108.4
1416	K	24	Very low	24.3	Very low	200 Å²	200	147 Å²	147	87%	0.87	82%	0.82	S	S	*	*			trans	-127.9	107.5	164	-151.9	179	-170.1	-178.6	0	105.5	R1418	K1416-R1418 PolarHBondContact O-N 3.29Å
1417	G	22.4	Very low	24.2	Very low	77 Å²	77	152.3 Å²	152.3	79%	0.794	83%	0.825	S	S	*	*			trans	-60.5	130.8	-162.6	0	0	0	0	0	113.8
1418	R	24.8	Very low	24.2	Very low	233 Å²	233	158.5 Å²	158.5	88%	0.879	83%	0.826	S	S	*	*			trans	-147.4	111.6	158.5	-113	-179.7	178.9	174.8	-1.8	109.8	K1416	K1416-R1418 PolarHBondContact O-N 3.29Å
1419	T	22.6	Very low	24.3	Very low	113 Å²	113	157.7 Å²	157.7	69%	0.693	83%	0.825	S	S	*	*			trans	2.1	111.8	146	50.9	0	0	0	0	116.2	T1421	T1419-T1421 PolarHBondContact O-N 2.9Å; T1419-T1421 VanDerWaalsContact O-N 3.11Å
1420	P	24.8	Very low	24.4	Very low	136 Å²	136	160.9 Å²	160.9	88%	0.883	83%	0.833	S	S	*	*			trans	-81.2	83.1	169.6	33.3	-32.7	0	0	0	110.4	E1422	P1420-E1422 PolarHBondContact O-N 3.34Å
1421	T	23.6	Very low	24.5	Very low	118 Å²	118	159.5 Å²	159.5	72%	0.724	83%	0.826	S	S	*	*			trans	-79.1	112.2	160.1	48.3	0	0	0	0	108.7	T1419	T1419-T1421 PolarHBondContact O-N 2.9Å; T1419-T1421 VanDerWaalsContact O-N 3.11Å
1422	E	24.2	Very low	24.7	Very low	193 Å²	193	155 Å²	155	90%	0.902	82%	0.816	S	S	*	*			trans	59.9	105.3	160.8	-60.7	177	174.9	0	0	117.3	P1420	P1420-E1422 PolarHBondContact O-N 3.34Å
1423	C	22.7	Very low	24.7	Very low	138 Å²	138	153.9 Å²	153.9	93%	0.932	81%	0.81	S	S	*	*			trans	-119.4	106	170.7	-173.5	0	0	0	0	110.4
1424	S	24.4	Very low	25.1	Very low	107 Å²	107	150.8 Å²	150.8	75%	0.748	81%	0.805	S	S	*	*			trans	-170	135.2	-178.4	147.1	0	0	0	0	107.9
1425	T	24.8	Very low	25.2	Very low	117 Å²	117	148.3 Å²	148.3	72%	0.718	80%	0.795	S	S	*	*			cis	-147	168.1	-13.9	41	0	0	0	0	108.4
1426	L	24.9	Very low	25.4	Very low	183 Å²	183	146.7 Å²	146.7	96%	0.958	79%	0.787	S	S	*	*			trans	-139.3	129.9	151.4	-127.1	166.2	0	0	0	108.9
1427	R	24.4	Very low	25.5	Very low	220 Å²	220	144 Å²	144	83%	0.83	78%	0.778	S	S	*	*			trans	-145.2	129.8	-155.1	-178.1	-169.3	-169.1	-165.7	6.6	111.5
1428	R	24.3	Very low	25.8	Very low	238 Å²	238	149.4 Å²	149.4	90%	0.898	78%	0.783	S	S	*	*			trans	-175.7	154.9	149.5	-104	155.8	-175	-177.9	1.8	108.4
1429	S	27.8	Very low	26	Very low	94 Å²	94	142 Å²	142	66%	0.657	78%	0.779	S	S	*	*			cis	-146.5	140.9	21.1	52.6	0	0	0	0	114.5
1430	N	26.5	Very low	26.1	Very low	135 Å²	135	148.5 Å²	148.5	72%	0.722	79%	0.79	S	S	*	*			trans	64.5	149.9	135.8	-56	3.2	0	0	0	118.9
1431	L	27.7	Very low	26.1	Very low	138 Å²	138	146.2 Å²	146.2	72%	0.723	78%	0.778	S	S	*	*			cis	-151.1	151.4	4.9	-158	74.7	0	0	0	111.6
1432	S	26.8	Very low	26.4	Very low	94 Å²	94	146.6 Å²	146.6	66%	0.657	78%	0.78	S	S	*	*			trans	61.1	149.7	149.6	49	0	0	0	0	121.5
1433	L	25.3	Very low	26.4	Very low	152 Å²	152	141.7 Å²	141.7	80%	0.796	77%	0.772	S	S	*	*			cis	-168.3	169.3	-18.1	-105.8	173.3	0	0	0	106
1434	P	32.3	Very low	26.6	Very low	112 Å²	112	140.2 Å²	140.2	73%	0.727	76%	0.764	S	S	*	*			cis	-123.4	-89.5	30.2	19.2	7.2	0	0	0	117.8
1435	M	26.3	Very low	26.6	Very low	137 Å²	137	139.7 Å²	139.7	68%	0.675	76%	0.76	S	S	*	*			trans	-138.9	172.3	-147.6	-71.1	-150.3	74.3	0	0	111.2	E1437	M1435-E1437 HydrophobicContact CE-CG 4.15Å
1436	I	29.1	Very low	26.6	Very low	146 Å²	146	141.5 Å²	141.5	75%	0.749	76%	0.764	S	S	*	*			cis	-131.2	163.5	30.6	-72.6	172.2	0	0	0	113
1437	E	26.4	Very low	26.6	Very low	144 Å²	144	139.2 Å²	139.2	67%	0.673	75%	0.753	S	S	*	*			trans	-34.8	162.1	174.1	-66.6	142	159.1	0	0	117.1	M1435	M1435-E1437 HydrophobicContact CE-CG 4.15Å
1438	E	27.9	Very low	26.6	Very low	190 Å²	190	136.2 Å²	136.2	89%	0.888	75%	0.748	S	S	*	*			cis	-159.2	176.9	12.7	-138.6	175.5	-169	0	0	111.4
1439	G	28.3	Very low	26.5	Very low	78 Å²	78	135.9 Å²	135.9	80%	0.804	75%	0.746	S	S	*	*			trans	126.8	117	155	0	0	0	0	0	120
1440	R	26.3	Very low	26.4	Very low	248 Å²	248	137.4 Å²	137.4	94%	0.936	76%	0.757	S	S	*	*			trans	-89.7	170.8	171.5	-86.8	174.9	170.5	150.5	-6.1	111.9
1441	S	24.4	Very low	26.2	Very low	88 Å²	88	136 Å²	136	62%	0.615	76%	0.758	S	S	*	*			cis	-175.4	-174.7	-13.7	54.1	0	0	0	0	111.1
1442	T	28.6	Very low	26.2	Very low	127 Å²	127	136.6 Å²	136.6	78%	0.779	77%	0.767	S	S	*	*			trans	68.5	120.5	160.4	43.2	0	0	0	0	118.1
1443	A	25.9	Very low	26	Very low	89 Å²	89	140.6 Å²	140.6	74%	0.736	78%	0.776	S	S	*	*				81.8	150.7	65.9	0	0	0	0	0	113.1
1444	S	26.7	Very low	26.2	Very low	108 Å²	108	138.9 Å²	138.9	76%	0.755	77%	0.774	S	S	*	*			cis	178.2	159.1	-12.8	47.5	0	0	0	0	109
1445	S	24.1	Very low	25.9	Very low	95 Å²	95	140.1 Å²	140.1	66%	0.664	78%	0.778	S	S	*	*			cis	177.6	160	-20.5	56.9	0	0	0	0	109.9
1446	L	25.1	Very low	25.7	Very low	155 Å²	155	140.5 Å²	140.5	81%	0.812	78%	0.783	S	S	*	*			trans	70.9	159.5	170.5	-49.6	166.4	0	0	0	115
1447	L	23.3	Very low	25.5	Very low	135 Å²	135	144.7 Å²	144.7	71%	0.707	79%	0.79	S	S	*	*			cis	-162.1	176	-17.1	-120.3	174.3	0	0	0	111.6
1448	H	25.6	Very low	25.4	Very low	158 Å²	158	142.3 Å²	142.3	73%	0.731	79%	0.789	S	S	*	*			trans	80.7	114	152.7	-89.6	-73.7	0	0	0	124.4
1449	R	22.1	Very low	25.2	Very low	230 Å²	230	140.7 Å²	140.7	87%	0.868	79%	0.785	S	S	*	*			trans	-23.7	144.4	156.8	-62.8	169.7	168.8	170.6	-4.3	119.6
1450	S	24.9	Very low	24.8	Very low	127 Å²	127	142.2 Å²	142.2	89%	0.888	78%	0.783	S	S	*	*				-151.6	-179.8	121.9	71.7	0	0	0	0	110.7
1451	S	23.1	Very low	24.7	Very low	106 Å²	106	134.5 Å²	134.5	74%	0.741	77%	0.772	S	S	*	*			trans	-147.3	141.2	-167.7	58.9	0	0	0	0	114.3
1452	T	26.7	Very low	24.6	Very low	149 Å²	149	136.8 Å²	136.8	91%	0.914	77%	0.773	S	S	*	*			trans	-166.5	148	147.2	18.5	0	0	0	0	112.1
1453	H	23.5	Very low	24.3	Very low	179 Å²	179	135.2 Å²	135.2	83%	0.829	76%	0.758	S	S	*	*			trans	-86.6	170.1	165.1	-77.3	-89	0	0	0	110.9
1454	P	29.9	Very low	24.2	Very low	116 Å²	116	134.5 Å²	134.5	75%	0.753	74%	0.742	S	S	*	*				-147.9	142.8	101.7	34.2	-16.5	0	0	0	118
1455	V	26.4	Very low	24.2	Very low	137 Å²	137	136.1 Å²	136.1	83%	0.83	74%	0.741	S	S	*	*			trans	70.8	138.5	136	178.5	0	0	0	0	121.9
1456	D	22.1	Very low	24.1	Very low	145 Å²	145	137.3 Å²	137.3	78%	0.775	73%	0.73	S	S	*	*			trans	-86.7	163.4	179.2	-37.2	-105.8	0	0	0	115
1457	R	25.1	Very low	24	Very low	234 Å²	234	133.8 Å²	133.8	88%	0.883	72%	0.718	S	S	*	*				178.9	127.6	106.8	-98.1	179	-174.4	-170.1	2.2	117.1
1458	S	22.6	Very low	24.4	Very low	94 Å²	94	132.7 Å²	132.7	66%	0.657	72%	0.722	S	S	*	*			trans	62.1	124.9	133.7	69.5	0	0	0	0	124.8
1459	I	23.8	Very low	24.4	Very low	156 Å²	156	129.8 Å²	129.8	80%	0.8	71%	0.709	S	S	*	*			trans	88.2	121.8	135.7	-66.4	163.8	0	0	0	120.5
1460	S	21.3	Very low	24.6	Very low	111 Å²	111	125 Å²	125	78%	0.776	70%	0.704	S	S	*	*			trans	13.6	150.5	143.5	-47.9	0	0	0	0	122.6
1461	A	22.6	Very low	24.7	Very low	85 Å²	85	124.6 Å²	124.6	70%	0.702	70%	0.697	S	S	*	*			cis	-174.2	174.6	-13.7	0	0	0	0	0	110.5
1462	Q	23.5	Very low	24.8	Very low	136 Å²	136	126.4 Å²	126.4	64%	0.636	70%	0.704	S	S	*	*			trans	81.2	110.1	165.1	-47.7	-170.8	-3.7	0	0	120.4	I1479	Q1462-I1479 HydrophobicContact CB-CD1 3.96Å; Q1462-I1479 VanDerWaalsContact CD-CD1 3.47Å; Q1462-I1479 HydrophobicContact CG-CD1 3.58Å
1463	M	22.2	Very low	24.8	Very low	94 Å²	94	121.8 Å²	121.8	46%	0.463	69%	0.685	S	S	.	*				52.9	153.5	122.7	-67.3	-147.8	-172.4	0	0	124.7	C1478 I1479	M1463-C1478 HydrophobicContact CE-CB 3.73Å; M1463-C1478 WeakPolarHBondContact CE-SG 3.24Å; M1463-C1478 HydrophobicContact SD-CB 3.88Å; M1463-I1479 HydrophobicContact CB-CD1 4.44Å; M1463-I1479 HydrophobicContact CE-CB 4.05Å; M1463-I1479 HydrophobicContact CE-CD1 3.71Å; M1463-I1479 HydrophobicContact CE-CG1 3.55Å; M1463-I1479 HydrophobicContact CG-CD1 3.83Å; M1463-I1479 HydrophobicContact SD-CB 3.68Å; M1463-I1479 HydrophobicContact SD-CD1 3.66Å; M1463-I1479 HydrophobicContact SD-CG1 3.72Å
1464	L	23.8	Very low	24.9	Very low	74 Å²	74	119.3 Å²	119.3	39%	0.387	69%	0.686	S	S	.	*			cis	-174.3	76.1	-32	-122.9	179.4	0	0	0	112.5	R1476 Q1477	L1464-R1476 VanDerWaalsContact CD2-CZ 3.41Å; L1464-R1476 PolarHBondContact O-NH1 3.32Å; L1464-Q1477 HydrophobicContact CB-CG 4.12Å; L1464-Q1477 PolarHBondContact O-OE1 3.26Å
1465	I	25.8	Very low	24.5	Very low	143 Å²	143	116.5 Å²	116.5	73%	0.733	67%	0.669	S	S	*	*			trans	-130.2	146.9	167.2	-23.2	-175.4	0	0	0	108.3	R1476	I1465-R1476 VanDerWaalsContact N-NH1 3.13Å; I1465-R1476 PolarHBondContact O-NH1 3.37Å
1466	R	22.5	Very low	24.3	Very low	120 Å²	120	115.1 Å²	115.1	45%	0.453	65%	0.649	S	S	.	*			cis	80.4	145.1	20.7	-111.4	-157.2	160.8	100.1	8	115	H1469 C1475	R1466-H1469 PolarHBondContact NE-NE2 2.81Å; R1466-H1469 PolarHBondContact NH2-CE1 2.71Å; R1466-H1469 VanDerWaalsContact NH2-CE1 3.3Å; R1466-C1475 PolarHBondContact NH1-SG 3.47Å; R1466-C1475 PolarHBondContact NH2-SG 2.88Å; R1466-C1475 VanDerWaalsContact NH2-SG 3.4Å
1467	S	24.2	Very low	24.4	Very low	80 Å²	80	113.5 Å²	113.5	56%	0.559	64%	0.637	S	S	*	*			cis	-140.9	172.5	-0.9	74.2	0	0	0	0	111.5
1468	S	30.5	Very low	24.4	Very low	112 Å²	112	107.1 Å²	107.1	78%	0.783	63%	0.627	S	S	*	*				-168.2	144.6	84.9	39	0	0	0	0	109.7
1469	H	25.5	Very low	24.4	Very low	98 Å²	98	106.8 Å²	106.8	45%	0.454	62%	0.617	S	S	.	*			cis	86	107.7	28.8	-77.5	-45.8	0	0	0	116.6	R1466 G1473 C1475	R1466-H1469 PolarHBondContact NE-NE2 2.81Å; R1466-H1469 PolarHBondContact NH2-CE1 2.71Å; R1466-H1469 VanDerWaalsContact NH2-CE1 3.3Å; H1469-G1473 PolarHBondContact CE1-O 2.97Å; H1469-C1475 PolarHBondContact CE1-SG 3.41Å; H1469-C1475 PolarHBondContact NE2-SG 3.2Å
1470	V	25.9	Very low	24.3	Very low	128 Å²	128	105.7 Å²	105.7	78%	0.776	61%	0.612	S	S	*	*			trans	-132.7	115	133.4	-172.3	0	0	0	0	107.3
1471	T	27.1	Very low	24.3	Very low	119 Å²	119	104.8 Å²	104.8	73%	0.73	61%	0.606	S	S	*	*	S	Bend	trans	53.2	131.1	157.3	59.3	0	0	0	0	121
1472	V	26	Very low	24.3	Very low	145 Å²	145	107.3 Å²	107.3	88%	0.879	61%	0.612	S	S	*	*	S	Bend	cis	-140	141.4	-3	-174	0	0	0	0	108.8
1473	G	25.7	Very low	24.4	Very low	51 Å²	51	104.6 Å²	104.6	53%	0.526	61%	0.613	S	S	.	*			trans	119.9	118.6	169.3	0	0	0	0	0	114.8	H1469 C1475	H1469-G1473 PolarHBondContact CE1-O 2.97Å; G1473-C1475 PolarHBondContact O-SG 3.2Å; G1473-C1475 VanDerWaalsContact O-SG 3.36Å
1474	C	25.4	Very low	24.4	Very low	127 Å²	127	107.3 Å²	107.3	86%	0.858	63%	0.628	S	S	*	*			trans	-88.4	170.8	179.6	-72	0	0	0	0	113
1475	C	22.2	Very low	24.5	Very low	57 Å²	57	112.6 Å²	112.6	39%	0.385	65%	0.651	S	S	.	*			cis	154.3	101.3	-47.3	-84.9	0	0	0	0	113	R1466 H1469 G1473	R1466-C1475 PolarHBondContact NH1-SG 3.47Å; R1466-C1475 PolarHBondContact NH2-SG 2.88Å; R1466-C1475 VanDerWaalsContact NH2-SG 3.4Å; H1469-C1475 PolarHBondContact CE1-SG 3.41Å; H1469-C1475 PolarHBondContact NE2-SG 3.2Å; G1473-C1475 PolarHBondContact O-SG 3.2Å; G1473-C1475 VanDerWaalsContact O-SG 3.36Å
1476	R	22.6	Very low	24.4	Very low	108 Å²	108	112.9 Å²	112.9	41%	0.408	65%	0.654	S	S	.	*			trans	84.3	155.8	145.1	-135.9	-176.2	-124.5	-147.1	1.6	120.9	L1464 I1465	L1464-R1476 VanDerWaalsContact CD2-CZ 3.41Å; L1464-R1476 PolarHBondContact O-NH1 3.32Å; I1465-R1476 VanDerWaalsContact N-NH1 3.13Å; I1465-R1476 PolarHBondContact O-NH1 3.37Å
1477	Q	25	Very low	24.7	Very low	111 Å²	111	118.6 Å²	118.6	52%	0.519	68%	0.675	S	S	.	*			trans	63.6	126.3	169	-69.9	139.4	-98.3	0	0	116.6	L1464	L1464-Q1477 HydrophobicContact CB-CG 4.12Å; L1464-Q1477 PolarHBondContact O-OE1 3.26Å
1478	C	23.3	Very low	24.8	Very low	101 Å²	101	122 Å²	122	68%	0.682	69%	0.687	S	S	*	*			cis	88.2	133.7	6.1	-131	0	0	0	0	117.9	M1463	M1463-C1478 HydrophobicContact CE-CB 3.73Å; M1463-C1478 WeakPolarHBondContact CE-SG 3.24Å; M1463-C1478 HydrophobicContact SD-CB 3.88Å
1479	I	23.1	Very low	24.7	Very low	87 Å²	87	122.3 Å²	122.3	45%	0.446	69%	0.69	S	S	.	*			trans	90.4	109.1	179.6	-98.4	178.9	0	0	0	121	Q1462 M1463	Q1462-I1479 HydrophobicContact CB-CD1 3.96Å; Q1462-I1479 VanDerWaalsContact CD-CD1 3.47Å; Q1462-I1479 HydrophobicContact CG-CD1 3.58Å; M1463-I1479 HydrophobicContact CB-CD1 4.44Å; M1463-I1479 HydrophobicContact CE-CB 4.05Å; M1463-I1479 HydrophobicContact CE-CD1 3.71Å; M1463-I1479 HydrophobicContact CE-CG1 3.55Å; M1463-I1479 HydrophobicContact CG-CD1 3.83Å; M1463-I1479 HydrophobicContact SD-CB 3.68Å; M1463-I1479 HydrophobicContact SD-CD1 3.66Å; M1463-I1479 HydrophobicContact SD-CG1 3.72Å
1480	L	22.2	Very low	24.6	Very low	133 Å²	133	123.9 Å²	123.9	70%	0.696	71%	0.71	S	S	*	*				58.7	106.6	126.9	-145.5	76	0	0	0	124
1481	S	21.5	Very low	24.8	Very low	92 Å²	92	122.7 Å²	122.7	64%	0.643	71%	0.714	S	S	*	*			trans	74.7	158.9	136.1	73	0	0	0	0	122.3
1482	T	22.8	Very low	24.6	Very low	137 Å²	137	125.9 Å²	125.9	84%	0.84	72%	0.72	S	S	*	*			trans	69.9	132.1	-179.9	68.8	0	0	0	0	115.2
1483	A	24.7	Very low	24.5	Very low	79 Å²	79	123.9 Å²	123.9	65%	0.653	71%	0.712	S	S	*	*			cis	-156.6	149.9	-11.4	0	0	0	0	0	112.7
1484	I	23.1	Very low	24.5	Very low	151 Å²	151	129.9 Å²	129.9	77%	0.774	73%	0.731	S	S	*	*			trans	38.1	107.5	135.4	-54.6	164.8	0	0	0	117.6
1485	Q	25.9	Very low	24.4	Very low	185 Å²	185	129.1 Å²	129.1	86%	0.864	73%	0.726	S	S	*	*				-174.4	159	103.9	-124.9	152.5	30.2	0	0	114.3
1486	N	23.8	Very low	24.5	Very low	149 Å²	149	130.9 Å²	130.9	80%	0.797	74%	0.739	S	S	*	*			trans	-82.2	149.5	-176.1	-53.4	-42.6	0	0	0	113.2
1487	R	28.5	Very low	24.5	Very low	241 Å²	241	134.7 Å²	134.7	91%	0.909	76%	0.759	S	S	*	*				-178.9	144.9	109.3	-100.4	172.3	176.6	179.6	-0.4	116.1
1488	N	25.1	Very low	24.5	Very low	151 Å²	151	138.3 Å²	138.3	81%	0.807	78%	0.776	S	S	*	*			trans	-41.5	154.9	168.1	-38.2	-3.3	0	0	0	113.4
1489	S	28.7	Very low	24.6	Very low	119 Å²	119	138.8 Å²	138.8	83%	0.832	78%	0.779	S	S	*	*				-169.7	175.4	74.6	52	0	0	0	0	114.8
1490	C	25.1	Very low	24.5	Very low	130 Å²	130	140.6 Å²	140.6	88%	0.878	80%	0.798	S	S	*	*			trans	-90.2	155.1	-166.8	-43.4	0	0	0	0	115.4
1491	A	28.8	Very low	24.7	Very low	104 Å²	104	140.4 Å²	140.4	86%	0.86	80%	0.802	S	S	*	*			trans	-147.6	147.4	146.7	0	0	0	0	0	109.5
1492	H	23.4	Very low	25	Very low	185 Å²	185	145.7 Å²	145.7	86%	0.856	81%	0.814	S	S	*	*			trans	-128.9	153.4	-176.1	-139.1	-99.2	0	0	0	110.1
1493	S	23.1	Very low	25	Very low	103 Å²	103	144.5 Å²	144.5	72%	0.72	81%	0.811	S	S	*	*			trans	62.1	126.7	172.3	71.6	0	0	0	0	118.6
1494	L	27.1	Very low	25	Very low	177 Å²	177	145.9 Å²	145.9	93%	0.927	82%	0.816	S	S	*	*				-155.9	171.5	103.5	-108.1	166.8	0	0	0	109.6
1495	C	22.8	Very low	25	Very low	112 Å²	112	143.3 Å²	143.3	76%	0.757	82%	0.818	S	S	*	*			trans	-120.2	150.9	-160	-170.3	0	0	0	0	113.8
1496	S	23	Very low	25.2	Very low	94 Å²	94	141 Å²	141	66%	0.657	82%	0.815	S	S	*	*			trans	82.2	140.8	156.1	85.4	0	0	0	0	119.4
1497	K	23.6	Very low	25.2	Very low	187 Å²	187	140 Å²	140	81%	0.813	82%	0.815	S	S	*	*			trans	57.2	104.6	153.7	-61.9	171.9	-179.7	179.4	0	118.2
1498	Q	25.3	Very low	25.1	Very low	187 Å²	187	143.8 Å²	143.8	87%	0.874	83%	0.829	S	S	*	*				-177	168.7	97.8	-103.4	174.2	-38.2	0	0	113.7
1499	C	26	Very low	25.1	Very low	111 Å²	111	143.4 Å²	143.4	75%	0.75	83%	0.831	S	S	*	*			trans	62	96.5	163	-64.7	0	0	0	0	119.4
1500	C	20.3	Very low	24.9	Very low	126 Å²	126	144.7 Å²	144.7	85%	0.851	83%	0.83	S	S	*	*			trans	-66.2	133.4	131.3	-61.6	0	0	0	0	108.8
1501	T	26.1	Very low	24.9	Very low	128 Å²	128	145.5 Å²	145.5	79%	0.785	83%	0.828	S	S	*	*			trans	177	149.1	135.1	23.4	0	0	0	0	112.3
1502	K	27.3	Very low	24.6	Very low	204 Å²	204	147.9 Å²	147.9	89%	0.887	83%	0.826	S	S	*	*			trans	75.5	113.9	172.4	-62.8	-173.7	176.8	-177	0	117.5
1503	S	23.4	Very low	24.7	Very low	112 Å²	112	145.6 Å²	145.6	78%	0.783	82%	0.824	S	S	*	*			trans	-58.4	158.1	163.9	49.7	0	0	0	0	112.1
1504	S	24.6	Very low	24.8	Very low	107 Å²	107	148.5 Å²	148.5	75%	0.748	83%	0.831	S	S	*	*				175.7	147.5	70.8	43.3	0	0	0	0	111.2
1505	A	23.9	Very low	24.7	Very low	98 Å²	98	146.4 Å²	146.4	81%	0.81	82%	0.824	S	S	*	*			trans	54.6	136.3	168.3	0	0	0	0	0	117
1506	V	29	Very low	24.8	Very low	135 Å²	135	149.1 Å²	149.1	82%	0.818	83%	0.829	S	S	*	*			cis	-143.5	151.4	38	165.5	0	0	0	0	110.4
1507	T	24	Very low	25	Very low	129 Å²	129	153.7 Å²	153.7	79%	0.791	84%	0.844	S	S	*	*			trans	-61.5	150.8	177.6	46.1	0	0	0	0	115.1
1508	W	26	Very low	25.1	Very low	320 Å²	320	150.6 Å²	150.6	100%	1.212	85%	0.846	S	S	*	*			trans	-145	0	157.9	-111.2	91.8	0	0	0	109.6

Retrieved 1,508 of 1,508 residues in 871.5 ms (Link to these results)

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