A0A3Q0KNA9_SCHMA Loading...

PDZ domain-containing protein

AlphaFold DB , UniProt , Accession A0A3Q0KNA9, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,431 aa.

						>A0A3Q0KNA9_SCHMA|A0A3Q0KNA9
MDFVILKVNGQDLRNATHEQAIHAFQTAKEPIIVEVARRDPNVELLQKSAPNSNSGPVNSLDNQNKCSVAIQTDPSTAEATLAAMAAAALTTEDIRTALGIRHPGLPTSLECIYHPEFPDLVDIVEEDDDDEDDDDEDDDDDIDEDDDVDIDGDDDEVDEQDNNNNNNHNDGIKDPITSSNMNCDPRSVNCPCFSNDNIEYDEISDIQNKSITFKEENDSIIWDMGFHESENILIKEVTLCRKKPDEKFGLTLCYRQGDTSNTSCNVYVGELELNSLAEKSGQIYNGDQILSINGNRIKSREHVIDLFQQSQLKVCLLIAREKINKNDNNNQLMNKNLMINTNKSMKIINNQSNYLIENSNSINKNCSDYPVYKRPDQDSGMGRTTDESARTEESSEQEIDNDQHHHHHQYQQQQRTNFIHGLAQITKLTCENGQFNNNSSGNSLTQDATSLDQKLAFPSDVFSDYDPIDPIDQELVQLGRLMQSLAVHCRQLVQAKMHYNRIQYPLPIIDNCTSQYGGNDSIVQPQTVPTKVITSTTTSVINSSSIPTATTTTSSSSSLSSKISNQLTENCYYSTGNNNLQNTKCIINKSNEGISNGSPLLSTKDNNHNMLTRLPRMGTRMEPSIMGSMSSNDSSGSFHDKNLKMSAITTTGKLSHSRFPSNIKDRPVSSERHESQTQQQQQTTYCPDSNSKLIEPNSIYPDHLEQCRLNGSGDTSAYCTSESRKSQNDSSVNNNSNSIINNDHNTSNGSITDQRFHCITTDGNNNNSNTQYPPVTTLSNSDYPTRTISNLHYNGNSVGEGITASLSDLGGSLLSLSAVIPDPHHYHHHRHHSRPQYNSSEVNSTNHQITPNDSFSPSSNWSIDGNSQYTTHSNNNHNNNQYIHPDPNNNNNNNYTESYYTSIRQFNSPEPSTSTSSSFISGRNYNNKSSNEQLPSTSDNNNNNNHNYNNPSPSNEHKRNMNSTKDLSIRSNMKFQKSDFRHQHHQHHHPKLHNSNLITEHNPQKFVKEDKSSSPSSIHPNKTKNLQKYSQLHNHPLYPLPPLYCNECYYPIKDISPMKCNTSNINEQLSIINTSIPSIINKNLHSYEFYDNFYCSLTNKTIMTTNNEKEQSILNQSFKQFNKLINIDKTNIINEEPTLSDIYETPYASVTIHDEPIGDQYPMKCISKDPCNSISGLSMNRTEDCSNLLPKPNYWPSVQINDNNNNNNNNSNNNNNSSYTPCIANHAELIKMKVENPSHPRLFNPCLSSIGYPLVYPHPMYTSATCHSKRYQNTAVSASVITGAVSSSSSTAATSTITTTGMPPSGQVYPMDNWNMMEWVVKKRPDGTRYITRRPIRNRILKERAKRLAEERSGITTDDDAISELKTGRYWNRSERKKQLEKAKADRKRKQLNIITQQNSHKNLVLTTTNSSPINKSDGNNTTLVTMTTV
					

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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	45.6	Very low	81.5	Confident	155 Å²	155	70.3 Å²	70.3	76%	0.764	38%	0.379	S	S	*	.				0	90.9	0	-103.7	-76.8	-124.2	0	0	105.4	F3 R38	M1-F3 HydrophobicContact CB-CD2 4.4Å; M1-F3 HydrophobicContact CB-CE2 3.99Å; M1-F3 HydrophobicContact CE-CE2 4.25Å; M1-F3 HydrophobicContact CE-CZ 4.12Å; M1-F3 HydrophobicContact CG-CE2 4.42Å; M1-F3 WeakPolarHBondContact O-CD2 2.84Å; M1-F3 PolarHBondContact O-N 3.11Å; M1-F3 HydrophobicContact SD-CE2 3.85Å; M1-F3 HydrophobicContact SD-CZ 3.93Å; M1-R38 PolarHBondContact SD-NH2 2.96Å; M1-R38 VanDerWaalsContact SD-NH2 3.42Å
2	D	70.8	Confident	82.2	Confident	93 Å²	93	70.3 Å²	70.3	50%	0.497	38%	0.378	S	S	.	.			trans	-103.5	85.5	-149.1	-62.9	31.7	0	0	0	107.8	R39	D2-R39 HydrophobicContact CB-CB 4.3Å; D2-R39 WeakPolarHBondContact O-CB 3.39Å; D2-R39 WeakPolarHBondContact O-CG 3.28Å; D2-R39 PolarHBondContact O-N 3.32Å
3	F	81.7	Confident	82.7	Confident	88 Å²	88	65.8 Å²	65.8	39%	0.386	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	143	-177.4	-65.6	-82.3	0	0	0	111.4	M1 V36 A37 R38	M1-F3 HydrophobicContact CB-CD2 4.4Å; M1-F3 HydrophobicContact CB-CE2 3.99Å; M1-F3 HydrophobicContact CE-CE2 4.25Å; M1-F3 HydrophobicContact CE-CZ 4.12Å; M1-F3 HydrophobicContact CG-CE2 4.42Å; M1-F3 WeakPolarHBondContact O-CD2 2.84Å; M1-F3 PolarHBondContact O-N 3.11Å; M1-F3 HydrophobicContact SD-CE2 3.85Å; M1-F3 HydrophobicContact SD-CZ 3.93Å; F3-V36 HydrophobicContact CB-CB 4.24Å; F3-V36 HydrophobicContact CD1-CB 4.17Å; F3-V36 HydrophobicContact CD1-CG2 3.81Å; F3-V36 HydrophobicContact CE1-CG2 4.26Å; F3-V36 HydrophobicContact CG-CG2 4.41Å; F3-A37 CarbonylContact C-O 3.51Å; F3-A37 VanDerWaalsContact CA-O 3.27Å; F3-A37 WeakPolarHBondContact CA-O 3.48Å; F3-R38 HydrophobicContact CD1-CG 3.87Å; F3-R38 HydrophobicContact CE1-CG 3.52Å; F3-R38 HydrophobicContact CZ-CG 4.26Å
4	V	83.3	Confident	83	Confident	51 Å²	51	72.5 Å²	72.5	31%	0.309	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	127.8	165.3	-172.2	0	0	0	0	107.7	L6 V36 A37 R39	V4-L6 HydrophobicContact CG1-CD2 4.38Å; V4-L6 PolarHBondContact O-N 3.33Å; V4-V36 CarbonylContact O-C 3.59Å; V4-V36 VanDerWaalsContact O-CA 3.29Å; V4-V36 WeakPolarHBondContact O-CA 3.3Å; V4-A37 PolarHBondContact N-O 3.5Å; V4-A37 PolarHBondContact O-N 3.17Å; V4-R39 HydrophobicContact CG2-CG 3.49Å; V4-R39 VanDerWaalsContact CG2-CG 3.49Å
5	I	87.2	Confident	83.2	Confident	67 Å²	67	78.3 Å²	78.3	34%	0.344	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	115.8	170.6	-62.9	159	0	0	0	107.4	V8 L13 F25 V34 V36	I5-V8 HydrophobicContact CG2-CG2 3.99Å; I5-L13 HydrophobicContact CG2-CD1 4.03Å; I5-F25 HydrophobicContact CD1-CE2 3.94Å; I5-F25 HydrophobicContact CD1-CZ 3.92Å; I5-F25 HydrophobicContact CG2-CZ 4.47Å; I5-V34 HydrophobicContact CG1-CG1 4.14Å; I5-V34 HydrophobicContact CG2-CG1 3.78Å; I5-V36 HydrophobicContact CG1-CG1 4.07Å
6	L	88.4	Confident	83.3	Confident	41 Å²	41	75.4 Å²	75.4	22%	0.215	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	-44.8	176.9	-57.5	-174.4	0	0	0	110.9	V4 L13 R14 E35 A37	V4-L6 HydrophobicContact CG1-CD2 4.38Å; V4-L6 PolarHBondContact O-N 3.33Å; L6-L13 PolarHBondContact O-N 3.47Å; L6-R14 HydrophobicContact CB-CG 4.19Å; L6-R14 HydrophobicContact CD2-CG 3.79Å; L6-R14 PolarHBondContact O-N 3.22Å; L6-E35 HydrophobicContact CB-CB 4.43Å; L6-E35 PolarHBondContact N-O 3.43Å; L6-A37 HydrophobicContact CD1-CB 3.87Å; L6-A37 HydrophobicContact CD2-CB 4.15Å; L6-A37 HydrophobicContact CG-CB 4.06Å
7	K	90.1	Very high	83.6	Confident	61 Å²	61	74.9 Å²	74.9	27%	0.265	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145	155.3	179.7	-48.6	-153.8	-161.2	83.9	0	112.9	G10 Q11 E35	K7-G10 WeakPolarHBondContact CD-O 3.27Å; K7-Q11 CarbonylContact C-O 3.59Å; K7-Q11 WeakPolarHBondContact CA-O 3.45Å; K7-Q11 VanDerWaalsContact CB-O 3.28Å; K7-Q11 WeakPolarHBondContact CB-O 3.35Å; K7-E35 HydrophobicContact CB-CB 4.12Å; K7-E35 HydrophobicContact CB-CG 4.36Å; K7-E35 HydrophobicContact CG-CB 4.46Å; K7-E35 PolarHBondContact N-O 2.91Å; K7-E35 IonicContact NZ-OE1 3.33Å; K7-E35 IonicContact NZ-OE2 3.75Å; K7-E35 PolarHBondContact NZ-OE2 3.33Å; K7-E35 PolarHBondContact O-N 3.39Å
8	V	88.6	Confident	83.6	Confident	2 Å²	2	79.2 Å²	79.2	1%	0.012	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	124.4	166.5	173.7	0	0	0	0	108.3	I5 G10 Q11 L13 F25 A28 I32 I33 V34	I5-V8 HydrophobicContact CG2-CG2 3.99Å; V8-G10 PolarHBondContact O-N 3.43Å; V8-Q11 PolarHBondContact N-O 3.2Å; V8-Q11 WeakPolarHBondContact O-CB 3.23Å; V8-Q11 PolarHBondContact O-N 2.87Å; V8-L13 HydrophobicContact CB-CD1 4.09Å; V8-L13 HydrophobicContact CG2-CD1 3.54Å; V8-F25 HydrophobicContact CG1-CD1 4.15Å; V8-F25 HydrophobicContact CG1-CE1 4.26Å; V8-F25 HydrophobicContact CG2-CD1 4.12Å; V8-F25 HydrophobicContact CG2-CD2 4.19Å; V8-F25 HydrophobicContact CG2-CE1 3.61Å; V8-F25 HydrophobicContact CG2-CE2 3.68Å; V8-F25 HydrophobicContact CG2-CG 4.39Å; V8-F25 HydrophobicContact CG2-CZ 3.36Å; V8-A28 HydrophobicContact CG1-CB 3.89Å; V8-I32 HydrophobicContact CG1-CG2 3.98Å; V8-I33 CarbonylContact C-O 3.56Å; V8-I33 WeakPolarHBondContact CA-O 3.49Å; V8-V34 HydrophobicContact CG2-CG1 4.37Å
9	N	87.8	Confident	83.9	Confident	62 Å²	62	83.1 Å²	83.1	33%	0.332	43%	0.429	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.3	34.3	-176	-74.1	14.3	0	0	0	114.5	Q11 K29 I33	N9-Q11 VanDerWaalsContact C-N 3.28Å; N9-Q11 PolarHBondContact O-N 2.91Å; N9-K29 PolarHBondContact ND2-N 3.23Å; N9-K29 PolarHBondContact ND2-O 2.99Å; N9-I33 PolarHBondContact N-O 3.45Å; N9-I33 PolarHBondContact OD1-N 2.92Å
10	G	85.2	Confident	84.1	Confident	58 Å²	58	84.2 Å²	84.2	60%	0.598	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.8	-13.5	-177.1	0	0	0	0	0	115.4	K7 V8 D12	K7-G10 WeakPolarHBondContact CD-O 3.27Å; V8-G10 PolarHBondContact O-N 3.43Å; G10-D12 PolarHBondContact O-N 2.94Å
11	Q	87.5	Confident	84.3	Confident	95 Å²	95	81.3 Å²	81.3	44%	0.444	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	124.6	170.2	-177.5	176.4	-13.3	0	0	109.8	K7 V8 N9 L13	K7-Q11 CarbonylContact C-O 3.59Å; K7-Q11 WeakPolarHBondContact CA-O 3.45Å; K7-Q11 VanDerWaalsContact CB-O 3.28Å; K7-Q11 WeakPolarHBondContact CB-O 3.35Å; V8-Q11 PolarHBondContact N-O 3.2Å; V8-Q11 WeakPolarHBondContact O-CB 3.23Å; V8-Q11 PolarHBondContact O-N 2.87Å; N9-Q11 VanDerWaalsContact C-N 3.28Å; N9-Q11 PolarHBondContact O-N 2.91Å; Q11-L13 HydrophobicContact CG-CD2 4.38Å
12	D	90.1	Very high	86.4	Confident	70 Å²	70	77.1 Å²	77.1	37%	0.374	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	124.3	-178.6	-166.7	-10.1	0	0	0	111.3	G10 R14	G10-D12 PolarHBondContact O-N 2.94Å; D12-R14 VanDerWaalsContact OD1-CB 3.32Å; D12-R14 WeakPolarHBondContact OD1-CB 3.22Å; D12-R14 WeakPolarHBondContact OD1-CG 3.2Å; D12-R14 IonicContact OD1-CZ 3.86Å; D12-R14 PolarHBondContact OD1-N 3.37Å; D12-R14 IonicContact OD1-NE 2.64Å; D12-R14 PolarHBondContact OD1-NE 3.45Å; D12-R14 IonicContact OD2-CZ 2.63Å; D12-R14 VanDerWaalsContact OD2-CZ 3.25Å; D12-R14 IonicContact OD2-NE 2.78Å; D12-R14 PolarHBondContact OD2-NE 3.41Å; D12-R14 IonicContact OD2-NH2 3.25Å; D12-R14 PolarHBondContact OD2-NH2 3.02Å
13	L	89	Confident	87.2	Confident	13 Å²	13	78 Å²	78	7%	0.068	40%	0.401	C	S	.	.			trans	-111.5	2.2	-179.5	-60.4	-171.6	0	0	0	113.3	I5 L6 V8 Q11 N15 A16 A21 A24 F25	I5-L13 HydrophobicContact CG2-CD1 4.03Å; L6-L13 PolarHBondContact O-N 3.47Å; V8-L13 HydrophobicContact CB-CD1 4.09Å; V8-L13 HydrophobicContact CG2-CD1 3.54Å; Q11-L13 HydrophobicContact CG-CD2 4.38Å; L13-N15 PolarHBondContact O-N 3.16Å; L13-A16 HydrophobicContact CB-CB 4.14Å; L13-A16 HydrophobicContact CD2-CB 3.82Å; L13-A16 PolarHBondContact O-N 3.15Å; L13-A21 HydrophobicContact CD1-CB 4.09Å; L13-A24 HydrophobicContact CD1-CB 4.24Å; L13-A24 HydrophobicContact CD2-CB 3.73Å; L13-F25 HydrophobicContact CD1-CE2 4.48Å
14	R	87.1	Confident	87.5	Confident	159 Å²	159	73.9 Å²	73.9	60%	0.6	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.2	-31.8	-177.5	-70.6	179.4	-67	164	0.2	114.1	L6 D12	L6-R14 HydrophobicContact CB-CG 4.19Å; L6-R14 HydrophobicContact CD2-CG 3.79Å; L6-R14 PolarHBondContact O-N 3.22Å; D12-R14 VanDerWaalsContact OD1-CB 3.32Å; D12-R14 WeakPolarHBondContact OD1-CB 3.22Å; D12-R14 WeakPolarHBondContact OD1-CG 3.2Å; D12-R14 IonicContact OD1-CZ 3.86Å; D12-R14 PolarHBondContact OD1-N 3.37Å; D12-R14 IonicContact OD1-NE 2.64Å; D12-R14 PolarHBondContact OD1-NE 3.45Å; D12-R14 IonicContact OD2-CZ 2.63Å; D12-R14 VanDerWaalsContact OD2-CZ 3.25Å; D12-R14 IonicContact OD2-NE 2.78Å; D12-R14 PolarHBondContact OD2-NE 3.41Å; D12-R14 IonicContact OD2-NH2 3.25Å; D12-R14 PolarHBondContact OD2-NH2 3.02Å
15	N	85.5	Confident	87.9	Confident	160 Å²	160	74.9 Å²	74.9	86%	0.856	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118	13	179.5	-62.3	-4.4	0	0	0	112.7	L13	L13-N15 PolarHBondContact O-N 3.16Å
16	A	84.8	Confident	88	Confident	31 Å²	31	78.8 Å²	78.8	26%	0.256	40%	0.401	S	S	.	.			trans	-77.6	146.7	-176.2	0	0	0	0	0	111.9	L13 Q20	L13-A16 HydrophobicContact CB-CB 4.14Å; L13-A16 HydrophobicContact CD2-CB 3.82Å; L13-A16 PolarHBondContact O-N 3.15Å; A16-Q20 HydrophobicContact CB-CB 3.97Å
17	T	88.2	Confident	87.9	Confident	67 Å²	67	80.6 Å²	80.6	41%	0.411	41%	0.414	S	S	.	.			trans	-67.4	162.7	167.1	72.1	0	0	0	0	110.7	E19 Q20 A21	T17-E19 PolarHBondContact O-N 2.8Å; T17-Q20 PolarHBondContact O-N 3.19Å; T17-Q20 VanDerWaalsContact O-N 3.15Å; T17-Q20 VanDerWaalsContact OG1-CG 3.31Å; T17-Q20 WeakPolarHBondContact OG1-CG 3.21Å; T17-Q20 PolarHBondContact OG1-N 2.84Å; T17-Q20 VanDerWaalsContact OG1-N 3.15Å; T17-A21 PolarHBondContact O-N 3.38Å
18	H	83.9	Confident	87.6	Confident	153 Å²	153	78.6 Å²	78.6	71%	0.708	41%	0.409	S	S	*	.	H	α-helix	trans	-55.5	-41.7	176	-176.6	47.9	0	0	0	112.1	A21 I22	H18-A21 PolarHBondContact O-N 3.05Å; H18-I22 WeakPolarHBondContact O-CG1 3.48Å; H18-I22 PolarHBondContact O-N 3.19Å
19	E	88.5	Confident	87.3	Confident	153 Å²	153	86.9 Å²	86.9	72%	0.715	45%	0.445	S	S	*	.	H	α-helix	trans	-64.4	-44.3	175.8	-62.7	162.2	176.7	0	0	112.2	T17 A21 I22 H23	T17-E19 PolarHBondContact O-N 2.8Å; E19-A21 VanDerWaalsContact C-N 3.33Å; E19-A21 PolarHBondContact O-N 3.44Å; E19-I22 PolarHBondContact O-N 3.31Å; E19-H23 WeakPolarHBondContact O-CB 3.47Å; E19-H23 PolarHBondContact O-N 2.95Å
20	Q	88.5	Confident	86.9	Confident	105 Å²	105	87.2 Å²	87.2	49%	0.491	44%	0.444	S	S	.	.	H	α-helix	trans	-64.8	-37.5	176.7	-73.8	170	-10.2	0	0	112	A16 T17 A24	A16-Q20 HydrophobicContact CB-CB 3.97Å; T17-Q20 PolarHBondContact O-N 3.19Å; T17-Q20 VanDerWaalsContact O-N 3.15Å; T17-Q20 VanDerWaalsContact OG1-CG 3.31Å; T17-Q20 WeakPolarHBondContact OG1-CG 3.21Å; T17-Q20 PolarHBondContact OG1-N 2.84Å; T17-Q20 VanDerWaalsContact OG1-N 3.15Å; Q20-A24 WeakPolarHBondContact O-CB 3.46Å; Q20-A24 PolarHBondContact O-N 3.39Å
21	A	88.6	Confident	86.4	Confident	23 Å²	23	86.2 Å²	86.2	19%	0.19	43%	0.427	C	S	.	.	H	α-helix	trans	-65.7	-45.7	173.8	0	0	0	0	0	111.5	L13 T17 H18 E19 H23 A24 F25	L13-A21 HydrophobicContact CD1-CB 4.09Å; T17-A21 PolarHBondContact O-N 3.38Å; H18-A21 PolarHBondContact O-N 3.05Å; E19-A21 VanDerWaalsContact C-N 3.33Å; E19-A21 PolarHBondContact O-N 3.44Å; A21-H23 PolarHBondContact O-N 3.06Å; A21-A24 PolarHBondContact O-N 2.76Å; A21-F25 VanDerWaalsContact O-CD2 3.29Å; A21-F25 WeakPolarHBondContact O-CD2 3.15Å; A21-F25 PolarHBondContact O-N 3.41Å
22	I	88.9	Confident	86.2	Confident	68 Å²	68	82.3 Å²	82.3	35%	0.349	41%	0.409	S	S	.	.	H	α-helix	trans	-58.6	-47.3	174	-72.3	166	0	0	0	110.7	H18 E19 A24 F25 Q26	H18-I22 WeakPolarHBondContact O-CG1 3.48Å; H18-I22 PolarHBondContact O-N 3.19Å; E19-I22 PolarHBondContact O-N 3.31Å; I22-A24 VanDerWaalsContact C-N 3.32Å; I22-A24 PolarHBondContact O-N 3.23Å; I22-F25 PolarHBondContact O-N 3.44Å; I22-F25 VanDerWaalsContact O-N 3.16Å; I22-Q26 HydrophobicContact CG2-CG 4.24Å; I22-Q26 WeakPolarHBondContact O-CG 3.25Å; I22-Q26 PolarHBondContact O-N 3.09Å
23	H	88.8	Confident	85.9	Confident	110 Å²	110	80.9 Å²	80.9	51%	0.509	40%	0.401	S	S	.	.	H	α-helix	trans	-61.8	-38.3	178.1	-176.4	-81.8	0	0	0	112.1	E19 A21 Q26 T27	E19-H23 WeakPolarHBondContact O-CB 3.47Å; E19-H23 PolarHBondContact O-N 2.95Å; A21-H23 PolarHBondContact O-N 3.06Å; H23-Q26 PolarHBondContact O-N 3.23Å; H23-T27 WeakPolarHBondContact O-CB 3.21Å; H23-T27 PolarHBondContact O-N 3.32Å; H23-T27 PolarHBondContact O-OG1 3.24Å
24	A	88.6	Confident	85.8	Confident	2 Å²	2	80.9 Å²	80.9	2%	0.017	40%	0.402	C	S	.	.	H	α-helix	trans	-64.8	-37.7	174.9	0	0	0	0	0	112.5	L13 Q20 A21 I22 A28	L13-A24 HydrophobicContact CD1-CB 4.24Å; L13-A24 HydrophobicContact CD2-CB 3.73Å; Q20-A24 WeakPolarHBondContact O-CB 3.46Å; Q20-A24 PolarHBondContact O-N 3.39Å; A21-A24 PolarHBondContact O-N 2.76Å; I22-A24 VanDerWaalsContact C-N 3.32Å; I22-A24 PolarHBondContact O-N 3.23Å; A24-A28 WeakPolarHBondContact O-CB 3.49Å; A24-A28 PolarHBondContact O-N 3.11Å; A24-A28 VanDerWaalsContact O-N 3.09Å
25	F	90.7	Very high	85.8	Confident	73 Å²	73	75.6 Å²	75.6	32%	0.32	38%	0.384	S	S	.	.	H	α-helix	trans	-67.8	-43.2	170.7	-82.9	-73	0	0	0	112.5	I5 V8 L13 A21 I22 T27 A28 I32 V34	I5-F25 HydrophobicContact CD1-CE2 3.94Å; I5-F25 HydrophobicContact CD1-CZ 3.92Å; I5-F25 HydrophobicContact CG2-CZ 4.47Å; V8-F25 HydrophobicContact CG1-CD1 4.15Å; V8-F25 HydrophobicContact CG1-CE1 4.26Å; V8-F25 HydrophobicContact CG2-CD1 4.12Å; V8-F25 HydrophobicContact CG2-CD2 4.19Å; V8-F25 HydrophobicContact CG2-CE1 3.61Å; V8-F25 HydrophobicContact CG2-CE2 3.68Å; V8-F25 HydrophobicContact CG2-CG 4.39Å; V8-F25 HydrophobicContact CG2-CZ 3.36Å; L13-F25 HydrophobicContact CD1-CE2 4.48Å; A21-F25 VanDerWaalsContact O-CD2 3.29Å; A21-F25 WeakPolarHBondContact O-CD2 3.15Å; A21-F25 PolarHBondContact O-N 3.41Å; I22-F25 PolarHBondContact O-N 3.44Å; I22-F25 VanDerWaalsContact O-N 3.16Å; F25-T27 VanDerWaalsContact C-N 3.29Å; F25-T27 PolarHBondContact O-N 3.43Å; F25-A28 WeakPolarHBondContact O-CB 3.41Å; F25-A28 PolarHBondContact O-N 3.23Å; F25-I32 HydrophobicContact CD1-CG2 4.24Å; F25-I32 HydrophobicContact CE1-CG2 4.32Å; F25-V34 HydrophobicContact CE1-CG2 3.86Å; F25-V34 HydrophobicContact CZ-CG1 4.34Å; F25-V34 HydrophobicContact CZ-CG2 4.27Å
26	Q	89.1	Confident	85.9	Confident	149 Å²	149	69 Å²	69	70%	0.696	35%	0.35	S	S	*	.	H	α-helix	trans	-66.4	-27.3	179.2	-72.8	174.9	-13.4	0	0	113.7	I22 H23	I22-Q26 HydrophobicContact CG2-CG 4.24Å; I22-Q26 WeakPolarHBondContact O-CG 3.25Å; I22-Q26 PolarHBondContact O-N 3.09Å; H23-Q26 PolarHBondContact O-N 3.23Å
27	T	87.4	Confident	85.7	Confident	79 Å²	79	68.8 Å²	68.8	49%	0.485	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.7	-0.3	178.1	55.8	0	0	0	0	113.8	H23 F25 K29	H23-T27 WeakPolarHBondContact O-CB 3.21Å; H23-T27 PolarHBondContact O-N 3.32Å; H23-T27 PolarHBondContact O-OG1 3.24Å; F25-T27 VanDerWaalsContact C-N 3.29Å; F25-T27 PolarHBondContact O-N 3.43Å; T27-K29 PolarHBondContact O-N 3.25Å
28	A	83.8	Confident	85.3	Confident	19 Å²	19	72 Å²	72	16%	0.157	35%	0.352	C	S	.	.	P	Polyproline II helix	trans	-67.9	121.1	174.8	0	0	0	0	0	110.9	V8 A24 F25 I32	V8-A28 HydrophobicContact CG1-CB 3.89Å; A24-A28 WeakPolarHBondContact O-CB 3.49Å; A24-A28 PolarHBondContact O-N 3.11Å; A24-A28 VanDerWaalsContact O-N 3.09Å; F25-A28 WeakPolarHBondContact O-CB 3.41Å; F25-A28 PolarHBondContact O-N 3.23Å; A28-I32 HydrophobicContact CB-CD1 4.11Å; A28-I32 HydrophobicContact CB-CG1 3.97Å; A28-I32 HydrophobicContact CB-CG2 4.04Å
29	K	81.7	Confident	84.9	Confident	176 Å²	176	71.9 Å²	71.9	77%	0.765	35%	0.345	S	S	*	.	P	Polyproline II helix	trans	-72	144.5	169.7	-62.8	-178.7	-179.2	179.4	0	110.3	N9 T27 P31	N9-K29 PolarHBondContact ND2-N 3.23Å; N9-K29 PolarHBondContact ND2-O 2.99Å; T27-K29 PolarHBondContact O-N 3.25Å; K29-P31 CarbonylContact O-C 3.59Å
30	E	79.5	Confident	83.9	Confident	69 Å²	69	69.7 Å²	69.7	32%	0.322	34%	0.339	S	S	.	.	S	Bend	trans	-71.1	147.6	176.1	-58.8	-145.5	123.8	0	0	112.8	Q72 T73 K248	E30-Q72 VanDerWaalsContact OE1-C 3.24Å; E30-Q72 WeakPolarHBondContact OE1-CA 3.41Å; E30-Q72 WeakPolarHBondContact OE1-CG 3.37Å; E30-Q72 WeakPolarHBondContact OE2-CG 3.33Å; E30-Q72 PolarHBondContact OE2-NE2 3.22Å; E30-T73 PolarHBondContact OE1-N 2.97Å; E30-K248 VanDerWaalsContact CD-NZ 3.33Å; E30-K248 IonicContact OE1-NZ 3.15Å; E30-K248 PolarHBondContact OE1-NZ 2.97Å; E30-K248 VanDerWaalsContact OE2-CE 3.32Å; E30-K248 WeakPolarHBondContact OE2-CE 3.13Å; E30-K248 IonicContact OE2-NZ 3.42Å; E30-K248 PolarHBondContact OE2-NZ 3.39Å
31	P	75.1	Confident	82.4	Confident	37 Å²	37	69.4 Å²	69.4	24%	0.24	35%	0.346	C	S	.	.	S	Bend	cis	-72.1	144.3	-6.8	31.2	-35.1	0	0	0	111.9	K29 I33 I305	K29-P31 CarbonylContact O-C 3.59Å; P31-I33 PolarHBondContact O-N 3.11Å; P31-I305 HydrophobicContact CG-CG2 4.08Å
32	I	82.7	Confident	80.8	Confident	12 Å²	12	73.8 Å²	73.8	6%	0.062	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	115	-179	-55.4	-178.4	0	0	0	108.9	V8 F25 A28 V34 A70 I71	V8-I32 HydrophobicContact CG1-CG2 3.98Å; F25-I32 HydrophobicContact CD1-CG2 4.24Å; F25-I32 HydrophobicContact CE1-CG2 4.32Å; A28-I32 HydrophobicContact CB-CD1 4.11Å; A28-I32 HydrophobicContact CB-CG1 3.97Å; A28-I32 HydrophobicContact CB-CG2 4.04Å; I32-V34 HydrophobicContact CG2-CG2 4.17Å; I32-A70 WeakPolarHBondContact O-CA 3.15Å; I32-I71 PolarHBondContact N-O 3.19Å; I32-I71 PolarHBondContact O-N 3.38Å
33	I	82.8	Confident	79.3	Confident	41 Å²	41	74.6 Å²	74.6	21%	0.21	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	115.7	-177.8	-57.6	157.5	0	0	0	108.3	V8 N9 P31 I305	V8-I33 CarbonylContact C-O 3.56Å; V8-I33 WeakPolarHBondContact CA-O 3.49Å; N9-I33 PolarHBondContact N-O 3.45Å; N9-I33 PolarHBondContact OD1-N 2.92Å; P31-I33 PolarHBondContact O-N 3.11Å; I33-I305 HydrophobicContact CD1-CD1 3.71Å; I33-I305 HydrophobicContact CD1-CG1 4.46Å; I33-I305 HydrophobicContact CD1-CG2 4.31Å; I33-I305 HydrophobicContact CG1-CD1 4.06Å
34	V	88.6	Confident	77.3	Confident	13 Å²	13	77.4 Å²	77.4	8%	0.079	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	120	179.4	-165.4	0	0	0	0	110	I5 V8 F25 I32 V36 S68 V69	I5-V34 HydrophobicContact CG1-CG1 4.14Å; I5-V34 HydrophobicContact CG2-CG1 3.78Å; V8-V34 HydrophobicContact CG2-CG1 4.37Å; F25-V34 HydrophobicContact CE1-CG2 3.86Å; F25-V34 HydrophobicContact CZ-CG1 4.34Å; F25-V34 HydrophobicContact CZ-CG2 4.27Å; I32-V34 HydrophobicContact CG2-CG2 4.17Å; V34-V36 HydrophobicContact CG1-CG1 3.86Å; V34-S68 WeakPolarHBondContact O-CA 3.39Å; V34-V69 PolarHBondContact N-O 2.77Å; V34-V69 PolarHBondContact O-N 3.2Å; V34-V69 VanDerWaalsContact O-N 3.09Å
35	E	86.7	Confident	75.2	Confident	48 Å²	48	83.3 Å²	83.3	22%	0.224	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	118.8	168.4	-65.7	-167.6	162.7	0	0	109	L6 K7 R301	L6-E35 HydrophobicContact CB-CB 4.43Å; L6-E35 PolarHBondContact N-O 3.43Å; K7-E35 HydrophobicContact CB-CB 4.12Å; K7-E35 HydrophobicContact CB-CG 4.36Å; K7-E35 HydrophobicContact CG-CB 4.46Å; K7-E35 PolarHBondContact N-O 2.91Å; K7-E35 IonicContact NZ-OE1 3.33Å; K7-E35 IonicContact NZ-OE2 3.75Å; K7-E35 PolarHBondContact NZ-OE2 3.33Å; K7-E35 PolarHBondContact O-N 3.39Å; E35-R301 IonicContact OE1-CZ 3.41Å; E35-R301 IonicContact OE1-NH1 3.7Å; E35-R301 PolarHBondContact OE1-NH1 3.23Å; E35-R301 IonicContact OE1-NH2 3.99Å
36	V	87.6	Confident	73.1	Confident	22 Å²	22	86.4 Å²	86.4	13%	0.133	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	148.3	176.1	-61.6	0	0	0	0	111.6	F3 V4 I5 V34 C67	F3-V36 HydrophobicContact CB-CB 4.24Å; F3-V36 HydrophobicContact CD1-CB 4.17Å; F3-V36 HydrophobicContact CD1-CG2 3.81Å; F3-V36 HydrophobicContact CE1-CG2 4.26Å; F3-V36 HydrophobicContact CG-CG2 4.41Å; V4-V36 CarbonylContact O-C 3.59Å; V4-V36 VanDerWaalsContact O-CA 3.29Å; V4-V36 WeakPolarHBondContact O-CA 3.3Å; I5-V36 HydrophobicContact CG1-CG1 4.07Å; V34-V36 HydrophobicContact CG1-CG1 3.86Å; V36-C67 WeakPolarHBondContact CG2-O 3.36Å
37	A	80.2	Confident	71	Confident	25 Å²	25	87.2 Å²	87.2	21%	0.207	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	147.5	164.2	0	0	0	0	0	109.6	F3 V4 L6	F3-A37 CarbonylContact C-O 3.51Å; F3-A37 VanDerWaalsContact CA-O 3.27Å; F3-A37 WeakPolarHBondContact CA-O 3.48Å; V4-A37 PolarHBondContact N-O 3.5Å; V4-A37 PolarHBondContact O-N 3.17Å; L6-A37 HydrophobicContact CD1-CB 3.87Å; L6-A37 HydrophobicContact CD2-CB 4.15Å; L6-A37 HydrophobicContact CG-CB 4.06Å
38	R	78.8	Confident	69	Low	134 Å²	134	92.7 Å²	92.7	51%	0.506	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	140.3	164.3	-75.9	177.5	152.6	179.4	-7.8	109	M1 F3 D40	M1-R38 PolarHBondContact SD-NH2 2.96Å; M1-R38 VanDerWaalsContact SD-NH2 3.42Å; F3-R38 HydrophobicContact CD1-CG 3.87Å; F3-R38 HydrophobicContact CE1-CG 3.52Å; F3-R38 HydrophobicContact CZ-CG 4.26Å; R38-D40 PolarHBondContact O-N 2.81Å
39	R	75.9	Confident	66.7	Low	151 Å²	151	96.6 Å²	96.6	57%	0.57	48%	0.484	S	S	*	.	P	Polyproline II helix	trans	-69.8	121.5	157.8	-67.4	-172.2	176.9	133.8	2.4	107.9	D2 V4 P41	D2-R39 HydrophobicContact CB-CB 4.3Å; D2-R39 WeakPolarHBondContact O-CB 3.39Å; D2-R39 WeakPolarHBondContact O-CG 3.28Å; D2-R39 PolarHBondContact O-N 3.32Å; V4-R39 HydrophobicContact CG2-CG 3.49Å; V4-R39 VanDerWaalsContact CG2-CG 3.49Å; R39-P41 WeakPolarHBondContact O-CD 3.38Å
40	D	67.1	Low	64.5	Low	108 Å²	108	92.4 Å²	92.4	58%	0.578	48%	0.482	S	S	*	.	P	Polyproline II helix	trans	-71.8	120.4	166.3	-74.2	-59.9	0	0	0	109.1	R38 N42 V43	R38-D40 PolarHBondContact O-N 2.81Å; D40-N42 PolarHBondContact O-N 3.28Å; D40-V43 HydrophobicContact CB-CG2 3.93Å; D40-V43 PolarHBondContact O-N 3.21Å
41	P	58.6	Low	62.4	Low	99 Å²	99	95 Å²	95	64%	0.643	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69	1.5	-169.6	28.4	-36.5	0	0	0	114.5	R39	R39-P41 WeakPolarHBondContact O-CD 3.38Å
42	N	54.6	Low	60.3	Low	115 Å²	115	101.5 Å²	101.5	62%	0.615	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.1	-10.6	180	-67.9	-12.5	0	0	0	113.7	D40 L45	D40-N42 PolarHBondContact O-N 3.28Å; N42-L45 PolarHBondContact O-N 3.05Å
43	V	56.5	Low	58.1	Low	84 Å²	84	106.5 Å²	106.5	51%	0.509	57%	0.574	S	S	.	*	G	3₁₀ helix	trans	-73	-38	-172.1	177.8	0	0	0	0	112.7	D40 L45 L46	D40-V43 HydrophobicContact CB-CG2 3.93Å; D40-V43 PolarHBondContact O-N 3.21Å; V43-L45 PolarHBondContact O-N 3.26Å; V43-L46 PolarHBondContact O-N 3.4Å
44	E	46.8	Very low	55.8	Low	169 Å²	169	112.3 Å²	112.3	79%	0.79	61%	0.605	S	S	*	*	G	3₁₀ helix	trans	-68.1	-15.4	176.8	-71.7	-172.6	116.3	0	0	113.6
45	L	44.5	Very low	53.3	Low	126 Å²	126	117.7 Å²	117.7	66%	0.66	64%	0.643	S	S	*	*	G	3₁₀ helix	trans	-82.2	-18.6	-179.2	-94.8	160.5	0	0	0	114	N42 V43	N42-L45 PolarHBondContact O-N 3.05Å; V43-L45 PolarHBondContact O-N 3.26Å
46	L	47.4	Very low	50.8	Low	138 Å²	138	118.5 Å²	118.5	72%	0.723	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.4	-17.7	178.3	-84	75.9	0	0	0	113.7	V43 K48	V43-L46 PolarHBondContact O-N 3.4Å; L46-K48 PolarHBondContact O-N 3.38Å
47	Q	45.3	Very low	48.1	Very low	166 Å²	166	123.7 Å²	123.7	78%	0.776	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.3	1.2	-176	-67.6	-172	-11.2	0	0	114.6
48	K	44.8	Very low	45.9	Very low	195 Å²	195	129.2 Å²	129.2	85%	0.848	73%	0.73	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.5	12.6	-175.3	-156.7	158.3	-174.4	164.9	0	114.8	L46	L46-K48 PolarHBondContact O-N 3.38Å
49	S	35.8	Very low	43.7	Very low	100 Å²	100	130.4 Å²	130.4	70%	0.699	75%	0.746	S	S	*	*	S	Bend	trans	-143.2	48.5	-173.1	59.9	0	0	0	0	114.3
50	A	34.5	Very low	41.7	Very low	88 Å²	88	128.2 Å²	128.2	73%	0.727	75%	0.754	S	S	*	*			trans	-150.6	131.7	165	0	0	0	0	0	111.2
51	P	35.4	Very low	40.2	Very low	125 Å²	125	130.3 Å²	130.3	81%	0.812	77%	0.765	S	S	*	*			trans	-81.5	157	169.9	33.5	-33.6	0	0	0	112	S53	P51-S53 PolarHBondContact O-N 2.93Å
52	N	31.3	Very low	39.1	Very low	172 Å²	172	132.7 Å²	132.7	92%	0.92	77%	0.772	S	S	*	*			trans	-48.3	128	-172.5	-62.1	-19.3	0	0	0	115.5
53	S	37.8	Very low	38.1	Very low	118 Å²	118	133.6 Å²	133.6	83%	0.825	78%	0.777	S	S	*	*			trans	-150.7	141.3	147	53.2	0	0	0	0	110.2	P51	P51-S53 PolarHBondContact O-N 2.93Å
54	N	34.4	Very low	37.5	Very low	162 Å²	162	136.4 Å²	136.4	87%	0.866	78%	0.784	S	S	*	*			trans	-91.7	135.5	-174.1	-66.9	-36.1	0	0	0	111.6
55	S	35.8	Very low	37.2	Very low	126 Å²	126	134.1 Å²	134.1	88%	0.881	78%	0.777	S	S	*	*			trans	166.1	151.4	130.3	47.8	0	0	0	0	113.7
56	G	32.8	Very low	37.2	Very low	66 Å²	66	134.2 Å²	134.2	68%	0.68	77%	0.773	S	S	*	*			trans	90.5	114.3	157.2	0	0	0	0	0	117.4
57	P	32.5	Very low	36.8	Very low	130 Å²	130	131.1 Å²	131.1	84%	0.844	76%	0.762	S	S	*	*			trans	-84	130.8	164.7	33.1	-30.5	0	0	0	110.8
58	V	34.5	Very low	37	Very low	141 Å²	141	123.9 Å²	123.9	86%	0.855	73%	0.729	S	S	*	*			trans	-127.7	135.9	171.7	-71	0	0	0	0	110.7
59	N	31.5	Very low	37.2	Very low	160 Å²	160	116.6 Å²	116.6	86%	0.856	70%	0.701	S	S	*	*			trans	-101.9	162.9	-175.5	-75.4	-45.7	0	0	0	112
60	S	33.5	Very low	37.9	Very low	105 Å²	105	112.4 Å²	112.4	73%	0.734	67%	0.672	S	S	*	*			trans	72.6	86.7	155.6	-175.6	0	0	0	0	118.5
61	L	35.9	Very low	38.6	Very low	152 Å²	152	111.1 Å²	111.1	80%	0.796	65%	0.653	S	S	*	*				-161.2	144.4	104.7	-133.5	65.6	0	0	0	110.7
62	D	35.2	Very low	39.2	Very low	149 Å²	149	106.8 Å²	106.8	80%	0.797	62%	0.622	S	S	*	*			trans	176.1	124.1	133	-97.2	-25.8	0	0	0	111.5
63	N	34	Very low	39.8	Very low	133 Å²	133	102.2 Å²	102.2	71%	0.711	60%	0.6	S	S	*	*			trans	-139.3	81.1	-170.5	-138.6	20.9	0	0	0	111.1
64	Q	44.4	Very low	40.1	Very low	144 Å²	144	101.9 Å²	101.9	67%	0.673	59%	0.589	S	S	*	*	S	Bend	trans	-161.5	160	168.5	-104.9	142.9	80.4	0	0	110.1	K66	Q64-K66 PolarHBondContact O-N 2.83Å
65	N	39.4	Very low	40.5	Very low	120 Å²	120	99.3 Å²	99.3	64%	0.642	58%	0.581	S	S	*	*			trans	60.3	38.2	165.6	-56.3	-35.4	0	0	0	119
66	K	44.7	Very low	40.8	Very low	129 Å²	129	96 Å²	96	56%	0.561	56%	0.558	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-94.7	122.2	168.4	-68.8	167	-172.3	154.8	0	110.9	Q64	Q64-K66 PolarHBondContact O-N 2.83Å
67	C	39.8	Very low	41.8	Very low	73 Å²	73	98.2 Å²	98.2	49%	0.493	56%	0.559	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-118.6	127.8	167.5	-64.2	0	0	0	0	108.5	V36	V36-C67 WeakPolarHBondContact CG2-O 3.36Å
68	S	48.7	Very low	42.8	Very low	14 Å²	14	95.2 Å²	95.2	10%	0.098	55%	0.545	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	147	165.9	53.5	0	0	0	0	110.2	V34 Y255 R301	V34-S68 WeakPolarHBondContact O-CA 3.39Å; S68-Y255 WeakPolarHBondContact O-CD2 2.97Å; S68-R301 VanDerWaalsContact OG-CD 3.29Å; S68-R301 WeakPolarHBondContact OG-CD 3.13Å; S68-R301 PolarHBondContact OG-NH1 2.83Å
69	V	49.5	Very low	43.7	Very low	41 Å²	41	95.1 Å²	95.1	25%	0.248	54%	0.535	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	138.6	176.5	-173.9	0	0	0	0	108.3	V34 I71 T252	V34-V69 PolarHBondContact N-O 2.77Å; V34-V69 PolarHBondContact O-N 3.2Å; V34-V69 VanDerWaalsContact O-N 3.09Å; V69-I71 HydrophobicContact CG1-CD1 4.21Å; V69-I71 HydrophobicContact CG1-CG1 3.84Å; V69-T252 HydrophobicContact CG1-CG2 3.63Å
70	A	51.2	Low	44.9	Very low	12 Å²	12	89.9 Å²	89.9	10%	0.099	51%	0.514	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	132.8	170.5	0	0	0	0	0	109.1	I32 Y255	I32-A70 WeakPolarHBondContact O-CA 3.15Å; A70-Y255 HydrophobicContact CB-CE2 4.33Å
71	I	47.9	Very low	46.3	Very low	61 Å²	61	88 Å²	88	31%	0.313	50%	0.498	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	152.4	-176.2	-40.9	179.2	0	0	0	108.7	I32 V69 T73	I32-I71 PolarHBondContact N-O 3.19Å; I32-I71 PolarHBondContact O-N 3.38Å; V69-I71 HydrophobicContact CG1-CD1 4.21Å; V69-I71 HydrophobicContact CG1-CG1 3.84Å; I71-T73 HydrophobicContact CB-CG2 4.47Å; I71-T73 HydrophobicContact CG2-CG2 3.7Å
72	Q	49.1	Very low	47.3	Very low	35 Å²	35	86.4 Å²	86.4	16%	0.164	49%	0.49	C	S	.	.			trans	-124.8	76.6	-176.3	-157.7	-166.2	-11.6	0	0	110.9	E30 K248	E30-Q72 VanDerWaalsContact OE1-C 3.24Å; E30-Q72 WeakPolarHBondContact OE1-CA 3.41Å; E30-Q72 WeakPolarHBondContact OE1-CG 3.37Å; E30-Q72 WeakPolarHBondContact OE2-CG 3.33Å; E30-Q72 PolarHBondContact OE2-NE2 3.22Å; Q72-K248 VanDerWaalsContact C-NZ 3.29Å; Q72-K248 HydrophobicContact CB-CD 4.09Å; Q72-K248 HydrophobicContact CG-CD 3.69Å; Q72-K248 HydrophobicContact CG-CG 4.37Å; Q72-K248 WeakPolarHBondContact O-CD 3.4Å; Q72-K248 PolarHBondContact O-NZ 3.11Å
73	T	43.6	Very low	48.4	Very low	76 Å²	76	82.1 Å²	82.1	47%	0.466	48%	0.475	S	S	.	.			trans	-96.3	126.8	-168.4	55.7	0	0	0	0	114.4	E30 I71	E30-T73 PolarHBondContact OE1-N 2.97Å; I71-T73 HydrophobicContact CB-CG2 4.47Å; I71-T73 HydrophobicContact CG2-CG2 3.7Å
74	D	43.2	Very low	49.6	Very low	110 Å²	110	78.5 Å²	78.5	59%	0.588	46%	0.464	S	S	*	.			trans	-90.1	125	175.3	-77.8	-39.1	0	0	0	113.4	S76 K248	D74-S76 PolarHBondContact O-N 3.38Å; D74-K248 WeakPolarHBondContact OD1-CE 3.39Å; D74-K248 IonicContact OD1-NZ 2.65Å; D74-K248 PolarHBondContact OD1-NZ 3.04Å; D74-K248 WeakPolarHBondContact OD2-CD 3.29Å; D74-K248 WeakPolarHBondContact OD2-CE 3.44Å; D74-K248 IonicContact OD2-NZ 3.93Å; D74-K248 PolarHBondContact OD2-NZ 3.38Å
75	P	42.6	Very low	50.1	Low	109 Å²	109	77 Å²	77	71%	0.708	46%	0.458	S	S	*	.			trans	-79.6	92.7	157.6	32.4	-29.7	0	0	0	108.9	T77	P75-T77 PolarHBondContact O-N 3Å
76	S	43	Very low	50.9	Low	56 Å²	56	74.5 Å²	74.5	39%	0.392	45%	0.454	S	S	.	.			trans	-54.4	122.9	173	172.4	0	0	0	0	110.1	D74 A78 E79 A80	D74-S76 PolarHBondContact O-N 3.38Å; S76-A78 PolarHBondContact O-N 3.17Å; S76-A78 VanDerWaalsContact O-N 3.12Å; S76-E79 PolarHBondContact O-N 2.88Å; S76-A80 PolarHBondContact O-N 3.3Å
77	T	54.4	Low	51.2	Low	113 Å²	113	72 Å²	72	69%	0.693	46%	0.457	S	S	*	.	H	α-helix	trans	-57.9	-31.1	-179.8	-41.1	0	0	0	0	111.9	P75 T81	P75-T77 PolarHBondContact O-N 3Å; T77-T81 VanDerWaalsContact O-CB 3.26Å; T77-T81 WeakPolarHBondContact O-CB 3.38Å; T77-T81 PolarHBondContact O-N 2.81Å; T77-T81 PolarHBondContact O-OG1 2.63Å
78	A	52.9	Low	51.8	Low	67 Å²	67	72.5 Å²	72.5	55%	0.554	47%	0.466	S	S	*	.	H	α-helix	trans	-66.3	-39.9	174.7	0	0	0	0	0	112	S76 L82	S76-A78 PolarHBondContact O-N 3.17Å; S76-A78 VanDerWaalsContact O-N 3.12Å; A78-L82 WeakPolarHBondContact O-CB 3.39Å; A78-L82 PolarHBondContact O-N 2.88Å
79	E	54.3	Low	51.6	Low	138 Å²	138	75.3 Å²	75.3	65%	0.645	49%	0.491	S	S	*	.	H	α-helix	trans	-78.9	-39.9	179.6	-171.5	170.6	-163.1	0	0	112.1	S76 T81 L82 A83	S76-E79 PolarHBondContact O-N 2.88Å; E79-T81 VanDerWaalsContact C-N 3.3Å; E79-T81 PolarHBondContact O-N 2.81Å; E79-L82 PolarHBondContact O-N 3.09Å; E79-A83 WeakPolarHBondContact O-CB 3.36Å; E79-A83 PolarHBondContact O-N 2.93Å
80	A	54.9	Low	51.4	Low	51 Å²	51	78.3 Å²	78.3	42%	0.421	51%	0.505	S	S	.	.	H	α-helix	trans	-61.7	-38.7	171.7	0	0	0	0	0	111.5	S76 A84	S76-A80 PolarHBondContact O-N 3.3Å; A80-A84 VanDerWaalsContact O-CB 3.3Å; A80-A84 WeakPolarHBondContact O-CB 3.49Å; A80-A84 PolarHBondContact O-N 3.33Å
81	T	63.7	Low	51.2	Low	64 Å²	64	81.7 Å²	81.7	39%	0.393	53%	0.525	S	S	.	.	H	α-helix	trans	-76.9	-30.1	173.9	-41.6	0	0	0	0	111.8	T77 E79 M85	T77-T81 VanDerWaalsContact O-CB 3.26Å; T77-T81 WeakPolarHBondContact O-CB 3.38Å; T77-T81 PolarHBondContact O-N 2.81Å; T77-T81 PolarHBondContact O-OG1 2.63Å; E79-T81 VanDerWaalsContact C-N 3.3Å; E79-T81 PolarHBondContact O-N 2.81Å; T81-M85 HydrophobicContact CG2-CE 3.55Å; T81-M85 VanDerWaalsContact O-CB 3.23Å; T81-M85 WeakPolarHBondContact O-CB 3.29Å; T81-M85 VanDerWaalsContact O-CG 3.26Å; T81-M85 WeakPolarHBondContact O-CG 3.04Å; T81-M85 PolarHBondContact O-N 2.65Å
82	L	57.5	Low	51.1	Low	119 Å²	119	84.2 Å²	84.2	62%	0.623	54%	0.543	S	S	*	.	H	α-helix	trans	-66.1	-39.8	170.2	-123.5	83	0	0	0	111.8	A78 E79 M85 A86	A78-L82 WeakPolarHBondContact O-CB 3.39Å; A78-L82 PolarHBondContact O-N 2.88Å; E79-L82 PolarHBondContact O-N 3.09Å; L82-M85 PolarHBondContact O-N 3.07Å; L82-A86 VanDerWaalsContact O-CB 3.23Å; L82-A86 WeakPolarHBondContact O-CB 3.45Å; L82-A86 PolarHBondContact O-N 2.79Å
83	A	57.5	Low	51.2	Low	60 Å²	60	87.5 Å²	87.5	50%	0.496	56%	0.558	S	S	.	*	H	α-helix	trans	-69	-40.9	176.3	0	0	0	0	0	111.3	E79 A86 A87	E79-A83 WeakPolarHBondContact O-CB 3.36Å; E79-A83 PolarHBondContact O-N 2.93Å; A83-A86 PolarHBondContact O-N 3.04Å; A83-A87 VanDerWaalsContact O-CB 3.27Å; A83-A87 WeakPolarHBondContact O-CB 3.33Å; A83-A87 PolarHBondContact O-N 2.96Å
84	A	60.3	Low	51.1	Low	57 Å²	57	88.6 Å²	88.6	47%	0.471	56%	0.561	S	S	.	*	H	α-helix	trans	-65.1	-40.6	171.7	0	0	0	0	0	112.1	A80 A87 A88	A80-A84 VanDerWaalsContact O-CB 3.3Å; A80-A84 WeakPolarHBondContact O-CB 3.49Å; A80-A84 PolarHBondContact O-N 3.33Å; A84-A87 PolarHBondContact O-N 3.23Å; A84-A88 WeakPolarHBondContact O-CB 3.37Å; A84-A88 PolarHBondContact O-N 2.78Å
85	M	54.9	Low	51.3	Low	113 Å²	113	87.9 Å²	87.9	56%	0.557	56%	0.556	S	S	*	*	H	α-helix	trans	-65.8	-41	173.1	-79.4	-171.8	-111.4	0	0	111.8	T81 L82 A88 A89	T81-M85 HydrophobicContact CG2-CE 3.55Å; T81-M85 VanDerWaalsContact O-CB 3.23Å; T81-M85 WeakPolarHBondContact O-CB 3.29Å; T81-M85 VanDerWaalsContact O-CG 3.26Å; T81-M85 WeakPolarHBondContact O-CG 3.04Å; T81-M85 PolarHBondContact O-N 2.65Å; L82-M85 PolarHBondContact O-N 3.07Å; M85-A88 CarbonylContact O-C 3.55Å; M85-A88 PolarHBondContact O-N 3.05Å; M85-A89 WeakPolarHBondContact O-CA 3.41Å; M85-A89 WeakPolarHBondContact O-CB 3.37Å; M85-A89 PolarHBondContact O-N 3.06Å
86	A	55.2	Low	51.4	Low	67 Å²	67	90.3 Å²	90.3	55%	0.554	55%	0.551	S	S	*	*	H	α-helix	trans	-67.8	-36.4	177.1	0	0	0	0	0	112.2	L82 A83	L82-A86 VanDerWaalsContact O-CB 3.23Å; L82-A86 WeakPolarHBondContact O-CB 3.45Å; L82-A86 PolarHBondContact O-N 2.79Å; A83-A86 PolarHBondContact O-N 3.04Å
87	A	50.7	Low	51.9	Low	76 Å²	76	93.7 Å²	93.7	63%	0.628	57%	0.57	S	S	*	*	H	α-helix	trans	-71	-31.8	172.8	0	0	0	0	0	112.8	A83 A84	A83-A87 VanDerWaalsContact O-CB 3.27Å; A83-A87 WeakPolarHBondContact O-CB 3.33Å; A83-A87 PolarHBondContact O-N 2.96Å; A84-A87 PolarHBondContact O-N 3.23Å
88	A	53.7	Low	51.3	Low	83 Å²	83	92.3 Å²	92.3	69%	0.686	57%	0.57	S	S	*	*	H	α-helix	trans	-88.3	-13.4	177	0	0	0	0	0	114.3	A84 M85 L90	A84-A88 WeakPolarHBondContact O-CB 3.37Å; A84-A88 PolarHBondContact O-N 2.78Å; M85-A88 CarbonylContact O-C 3.55Å; M85-A88 PolarHBondContact O-N 3.05Å; A88-L90 VanDerWaalsContact C-N 3.34Å
89	A	44.6	Very low	50.7	Low	74 Å²	74	94.7 Å²	94.7	61%	0.612	57%	0.573	S	S	*	*	S	Bend	trans	-83.5	-7.7	178.4	0	0	0	0	0	113.4	M85 T91	M85-A89 WeakPolarHBondContact O-CA 3.41Å; M85-A89 WeakPolarHBondContact O-CB 3.37Å; M85-A89 PolarHBondContact O-N 3.06Å; A89-T91 PolarHBondContact O-N 2.86Å
90	L	44.4	Very low	49.8	Very low	104 Å²	104	92.1 Å²	92.1	55%	0.545	58%	0.583	S	S	.	*	S	Bend	trans	-75.8	107.9	162.9	-73.7	176.3	0	0	0	108.7	A88	A88-L90 VanDerWaalsContact C-N 3.34Å
91	T	47.6	Very low	49	Very low	83 Å²	83	96.8 Å²	96.8	51%	0.509	60%	0.599	S	S	.	*			trans	-62.9	158.7	-178.4	66.3	0	0	0	0	111.8	A89 E93 D94	A89-T91 PolarHBondContact O-N 2.86Å; T91-E93 PolarHBondContact O-N 3.46Å; T91-D94 PolarHBondContact O-N 2.88Å
92	T	45.9	Very low	47.7	Very low	114 Å²	114	104.8 Å²	104.8	70%	0.699	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66	13.3	-176.2	40.5	0	0	0	0	116	R96	T92-R96 PolarHBondContact O-NH1 3.03Å; T92-R96 PolarHBondContact O-NH2 3.3Å
93	E	49.8	Very low	46.8	Very low	104 Å²	104	108 Å²	108	49%	0.486	63%	0.634	S	S	.	*	T	Hydrogen-bonded Turn	trans	-114.2	-38	-176.2	-135.2	52.5	-130.4	0	0	112.4	T91 R96	T91-E93 PolarHBondContact O-N 3.46Å; E93-R96 WeakPolarHBondContact O-CB 3.36Å; E93-R96 PolarHBondContact O-N 2.83Å; E93-R96 IonicContact OE1-CZ 3.3Å; E93-R96 IonicContact OE1-NH1 3.8Å; E93-R96 PolarHBondContact OE1-NH1 2.82Å; E93-R96 IonicContact OE2-CZ 2.96Å; E93-R96 IonicContact OE2-NH1 3.4Å; E93-R96 PolarHBondContact OE2-NH1 3.44Å
94	D	41.3	Very low	45.8	Very low	98 Å²	98	111.3 Å²	111.3	52%	0.524	65%	0.65	S	S	.	*	T	Hydrogen-bonded Turn	trans	-70.4	-37.2	-179.5	-67.1	-43	0	0	0	112.4	T91 R96 T97	T91-D94 PolarHBondContact O-N 2.88Å; D94-R96 PolarHBondContact O-N 3.39Å; D94-T97 PolarHBondContact O-N 3.4Å
95	I	47.6	Very low	44.5	Very low	95 Å²	95	111.7 Å²	111.7	49%	0.487	66%	0.66	S	S	.	*	H	α-helix	trans	-63.4	-28.1	176.3	-59.7	176.8	0	0	0	111.2	T97 L99	I95-T97 VanDerWaalsContact C-N 3.27Å; I95-T97 PolarHBondContact O-N 3.09Å; I95-L99 HydrophobicContact CG2-CD1 4.36Å
96	R	45.2	Very low	43.4	Very low	161 Å²	161	114 Å²	114	61%	0.608	67%	0.674	S	S	*	*	H	α-helix	trans	-71.8	-19	-179.8	-170.4	172.4	-72.2	131.2	8.7	113.1	T92 E93 D94	T92-R96 PolarHBondContact O-NH1 3.03Å; T92-R96 PolarHBondContact O-NH2 3.3Å; E93-R96 WeakPolarHBondContact O-CB 3.36Å; E93-R96 PolarHBondContact O-N 2.83Å; E93-R96 IonicContact OE1-CZ 3.3Å; E93-R96 IonicContact OE1-NH1 3.8Å; E93-R96 PolarHBondContact OE1-NH1 2.82Å; E93-R96 IonicContact OE2-CZ 2.96Å; E93-R96 IonicContact OE2-NH1 3.4Å; E93-R96 PolarHBondContact OE2-NH1 3.44Å; D94-R96 PolarHBondContact O-N 3.39Å
97	T	53.7	Low	42.5	Very low	126 Å²	126	115.7 Å²	115.7	77%	0.773	68%	0.679	S	S	*	*	H	α-helix	trans	-98.5	-27.3	-176.6	-54.5	0	0	0	0	113	D94 I95	D94-T97 PolarHBondContact O-N 3.4Å; I95-T97 VanDerWaalsContact C-N 3.27Å; I95-T97 PolarHBondContact O-N 3.09Å
98	A	42.1	Very low	41.5	Very low	85 Å²	85	117.9 Å²	117.9	70%	0.702	69%	0.685	S	S	*	*	H	α-helix	trans	-89.6	-18.2	-175.4	0	0	0	0	0	115.2
99	L	39	Very low	40.4	Very low	116 Å²	116	118.9 Å²	118.9	61%	0.607	69%	0.687	S	S	*	*			trans	-117.3	89.3	-176.6	-68.7	175.7	0	0	0	111.4	I95 I101	I95-L99 HydrophobicContact CG2-CD1 4.36Å; L99-I101 PolarHBondContact O-N 3.34Å
100	G	36.1	Very low	39.8	Very low	84 Å²	84	121.9 Å²	121.9	87%	0.866	69%	0.692	S	S	*	*			trans	-70.8	51.3	-177.4	0	0	0	0	0	116
101	I	38.1	Very low	39.1	Very low	149 Å²	149	124.6 Å²	124.6	76%	0.764	70%	0.702	S	S	*	*			trans	-93.5	112.3	174.8	-58.1	179.9	0	0	0	108.7	L99	L99-I101 PolarHBondContact O-N 3.34Å
102	R	36.3	Very low	38.3	Very low	232 Å²	232	125 Å²	125	88%	0.875	71%	0.707	S	S	*	*	P	Polyproline II helix	trans	-69.1	138.6	-176.4	-62.7	-179.3	179	-169.2	-1.6	111.8
103	H	39.6	Very low	37.7	Very low	187 Å²	187	126.3 Å²	126.3	87%	0.866	71%	0.708	S	S	*	*	P	Polyproline II helix	trans	-63	137.3	164.4	-72.1	-86.8	0	0	0	111.3
104	P	35.7	Very low	37	Very low	129 Å²	129	130.8 Å²	130.8	84%	0.838	72%	0.722	S	S	*	*	P	Polyproline II helix	trans	-88.6	125.1	163.3	32.6	-29.2	0	0	0	111.1
105	G	33.6	Very low	36.7	Very low	65 Å²	65	133.7 Å²	133.7	67%	0.67	73%	0.732	S	S	*	*			trans	126.6	77	154.8	0	0	0	0	0	119.9
106	L	32.3	Very low	36.2	Very low	162 Å²	162	133.3 Å²	133.3	85%	0.848	74%	0.736	S	S	*	*			trans	62.8	170.9	142.5	-92.8	75.3	0	0	0	119
107	P	35.4	Very low	35.7	Very low	102 Å²	102	133.1 Å²	133.1	66%	0.662	74%	0.742	S	S	*	*			cis	-127	151.9	5.5	41.5	-26.7	0	0	0	117.7
108	T	28.9	Very low	34.8	Very low	122 Å²	122	135.9 Å²	135.9	75%	0.748	74%	0.744	S	S	*	*			trans	46.9	149	140.7	60.9	0	0	0	0	123.7
109	S	30.4	Very low	34.9	Very low	105 Å²	105	136.5 Å²	136.5	73%	0.734	74%	0.74	S	S	*	*			trans	76.3	122.4	163.5	-178.7	0	0	0	0	115.6
110	L	33.5	Very low	34.4	Very low	137 Å²	137	137.6 Å²	137.6	72%	0.717	75%	0.747	S	S	*	*			cis	-151.2	163.9	-1.1	-145.6	69.3	0	0	0	110.5
111	E	29.7	Very low	34.1	Very low	160 Å²	160	141.1 Å²	141.1	75%	0.748	75%	0.745	S	S	*	*			trans	7.8	144.8	145.4	-69.7	176.7	144.7	0	0	120
112	C	30.4	Very low	33.9	Very low	92 Å²	92	139.2 Å²	139.2	62%	0.622	74%	0.74	S	S	*	*			cis	-171.8	168.9	19.1	-128.9	0	0	0	0	114.2
113	I	33	Very low	33.6	Very low	141 Å²	141	134.4 Å²	134.4	72%	0.723	73%	0.732	S	S	*	*			trans	67	137.8	146	-68.2	159.9	0	0	0	118.8
114	Y	36.3	Very low	33.5	Very low	198 Å²	198	133 Å²	133	78%	0.776	73%	0.729	S	S	*	*			cis	-153.1	138.9	-12.3	-118.7	-147.5	0	0	0	105.8
115	H	34.8	Very low	33.4	Very low	159 Å²	159	131.3 Å²	131.3	74%	0.736	72%	0.716	S	S	*	*				84.1	172.1	82.8	-116.1	-37.4	0	0	0	114.3
116	P	37.1	Very low	34	Very low	88 Å²	88	136.7 Å²	136.7	57%	0.571	72%	0.724	S	S	*	*				-133.2	-178.3	-111.8	48	-34	0	0	0	118.8
117	E	33.9	Very low	34.7	Very low	156 Å²	156	136.6 Å²	136.6	73%	0.729	72%	0.719	S	S	*	*			trans	64.6	128	137.7	-83.1	168.4	174.3	0	0	124.7
118	F	35.7	Very low	34.8	Very low	185 Å²	185	137.9 Å²	137.9	81%	0.811	72%	0.72	S	S	*	*			trans	62.7	176.2	151.1	-67.2	-66.2	0	0	0	117.3
119	P	43.5	Very low	35.7	Very low	97 Å²	97	139.9 Å²	139.9	63%	0.63	73%	0.726	S	S	*	*				-130.2	-165.5	-83.9	39.5	-20.8	0	0	0	113.7
120	D	28.2	Very low	36.2	Very low	140 Å²	140	141.6 Å²	141.6	75%	0.749	73%	0.727	S	S	*	*			trans	73.5	158.2	162.7	-58.6	-28.6	0	0	0	119.4
121	L	29.7	Very low	36.8	Very low	158 Å²	158	142 Å²	142	83%	0.827	73%	0.73	S	S	*	*			trans	81.3	125.6	154.9	-71.4	152.8	0	0	0	121.5
122	V	34	Very low	37.3	Very low	108 Å²	108	142.3 Å²	142.3	66%	0.655	73%	0.731	S	S	*	*			trans	68.5	103.8	148.2	-57.4	0	0	0	0	121.4
123	D	29.2	Very low	37.8	Very low	132 Å²	132	144.8 Å²	144.8	71%	0.706	74%	0.739	S	S	*	*				44.6	100.3	106.7	-38.9	-27.1	0	0	0	117.7
124	I	37.3	Very low	38.4	Very low	157 Å²	157	145.3 Å²	145.3	81%	0.805	74%	0.743	S	S	*	*				-119.7	108.3	124.9	-62.2	-178.2	0	0	0	106.3	E126	I124-E126 HydrophobicContact CG2-CG 4.35Å
125	V	35.2	Very low	38.7	Very low	93 Å²	93	143.4 Å²	143.4	56%	0.564	75%	0.746	S	S	*	*			trans	-88.3	122.6	164.7	-158.7	0	0	0	0	105.6
126	E	45.9	Very low	39.1	Very low	179 Å²	179	143 Å²	143	84%	0.836	75%	0.75	S	S	*	*			trans	-118.1	79.7	152.5	-74.6	-178.4	-170.6	0	0	103	I124	I124-E126 HydrophobicContact CG2-CG 4.35Å
127	E	46.3	Very low	39.5	Very low	160 Å²	160	147 Å²	147	75%	0.748	76%	0.761	S	S	*	*				99.5	93.5	80.4	-90.6	-179.9	-175.7	0	0	107.1
128	D	37.5	Very low	40.1	Very low	129 Å²	129	147.6 Å²	147.6	69%	0.69	77%	0.769	S	S	*	*			trans	-17	127.2	154.9	-35.8	-39	0	0	0	114.5
129	D	48.5	Very low	40.7	Very low	164 Å²	164	143.8 Å²	143.8	88%	0.877	76%	0.757	S	S	*	*			trans	-134.5	119.9	139.9	-87.1	-42.2	0	0	0	104.2
130	D	40.2	Very low	41.1	Very low	140 Å²	140	147.4 Å²	147.4	75%	0.749	77%	0.771	S	S	*	*			trans	-88.1	-115.5	-178.2	-73.3	-68.7	0	0	0	110.2
131	D	46.3	Very low	42	Very low	146 Å²	146	146.2 Å²	146.2	78%	0.781	77%	0.765	S	S	*	*			trans	59.2	84.3	-178.6	-54	-12.3	0	0	0	112.5
132	E	40.5	Very low	43	Very low	166 Å²	166	146.2 Å²	146.2	78%	0.776	77%	0.765	S	S	*	*				60.9	108.4	69.5	-55.1	-163.7	147.9	0	0	112.6
133	D	40	Very low	43.6	Very low	145 Å²	145	146.8 Å²	146.8	78%	0.775	76%	0.764	S	S	*	*			trans	63.3	174.4	150.6	-52.2	-24.4	0	0	0	115.8
134	D	46.3	Very low	44.5	Very low	152 Å²	152	147.4 Å²	147.4	81%	0.813	77%	0.767	S	S	*	*			cis	-125.4	162.8	12	-60.5	-68.9	0	0	0	113.6
135	D	41.7	Very low	45.2	Very low	157 Å²	157	147.9 Å²	147.9	84%	0.84	77%	0.765	S	S	*	*			trans	-75.1	155.8	155.1	-71.3	-64.6	0	0	0	109.4
136	D	45	Very low	46.1	Very low	152 Å²	152	150.3 Å²	150.3	81%	0.813	78%	0.776	S	S	*	*			trans	-166.9	139.1	142.5	-105.4	-22	0	0	0	111.9
137	E	44.1	Very low	46.5	Very low	172 Å²	172	148.7 Å²	148.7	80%	0.804	77%	0.773	S	S	*	*			trans	-101.1	146.3	167.8	-60.4	-175.7	135.2	0	0	108.1
138	D	47.1	Very low	46.7	Very low	168 Å²	168	147.8 Å²	147.8	90%	0.898	77%	0.773	S	S	*	*			trans	-153.7	129.5	156.8	-117.1	-18.7	0	0	0	110.9
139	D	48.4	Very low	47.7	Very low	104 Å²	104	148.7 Å²	148.7	56%	0.556	78%	0.783	S	S	*	*			trans	-96.2	158.3	175	-76	-41.5	0	0	0	109.7	H408	D139-H408 IonicContact OD1-ND1 2.68Å; D139-H408 IonicContact OD2-CG 2.96Å; D139-H408 IonicContact OD2-ND1 3.24Å
140	D	51.5	Low	47.7	Very low	174 Å²	174	147.5 Å²	147.5	93%	0.93	78%	0.776	S	S	*	*			trans	-154.7	97.3	159.4	-118.1	-15.4	0	0	0	109.1
141	D	47	Very low	48.4	Very low	115 Å²	115	148.8 Å²	148.8	62%	0.615	78%	0.782	S	S	*	*			trans	-97.5	130.2	175.7	-88.3	-45.7	0	0	0	110.6	H408	D141-H408 IonicContact OD2-CE1 2.69Å
142	D	50.2	Low	48.4	Very low	157 Å²	157	149.2 Å²	149.2	84%	0.84	78%	0.784	S	S	*	*			trans	-152.3	110.6	162.3	-94.9	-29.2	0	0	0	104.9
143	I	47.3	Very low	48.9	Very low	121 Å²	121	144.3 Å²	144.3	62%	0.621	78%	0.778	S	S	*	*				61.2	128	52	-41.1	173.1	0	0	0	109
144	D	49	Very low	49.6	Very low	145 Å²	145	144.6 Å²	144.6	78%	0.775	78%	0.779	S	S	*	*			cis	-118.8	148.9	30.1	-50.7	-66.1	0	0	0	112.4
145	E	51	Low	49.9	Very low	166 Å²	166	144.4 Å²	144.4	78%	0.776	78%	0.779	S	S	*	*				74.2	163.2	68.8	-57.7	-159.1	144.8	0	0	116.6
146	D	54.6	Low	50.6	Low	145 Å²	145	145 Å²	145	78%	0.775	78%	0.781	S	S	*	*			trans	69.8	137.2	176.8	-59.9	-8.5	0	0	0	118.5
147	D	53.2	Low	50.6	Low	145 Å²	145	146.5 Å²	146.5	78%	0.775	78%	0.784	S	S	*	*			cis	-161.8	164.3	-8.8	-137.5	-10.9	0	0	0	111.1
148	D	51.7	Low	51.2	Low	141 Å²	141	144.4 Å²	144.4	75%	0.754	78%	0.782	S	S	*	*			trans	-77.9	162.9	-177.4	-64	-52.9	0	0	0	115.5
149	V	59.2	Low	51.4	Low	148 Å²	148	143.3 Å²	143.3	90%	0.897	78%	0.777	S	S	*	*			trans	-162.9	113.4	141.2	-99.7	0	0	0	0	112.7
150	D	48.4	Very low	50.8	Low	138 Å²	138	146 Å²	146	74%	0.738	79%	0.786	S	S	*	*			trans	-77.2	154.2	165.4	-59.5	-66.7	0	0	0	112.7
151	I	55	Low	50.2	Low	168 Å²	168	144.8 Å²	144.8	86%	0.862	77%	0.774	S	S	*	*			trans	-137.5	96	156.9	-59.4	-176.6	0	0	0	108.7
152	D	45.9	Very low	49.8	Very low	154 Å²	154	145.2 Å²	145.2	82%	0.824	78%	0.777	S	S	*	*			trans	-66.1	155.8	160	-63.9	-57.1	0	0	0	110.7
153	G	50.3	Low	49.1	Very low	64 Å²	64	143 Å²	143	66%	0.66	77%	0.765	S	S	*	*			trans	-176.7	97	175.2	0	0	0	0	0	114.7
154	D	54.1	Low	48.5	Very low	150 Å²	150	143.2 Å²	143.2	80%	0.802	77%	0.767	S	S	*	*			trans	56.1	104.4	147.1	-47.3	-11	0	0	0	116.9
155	D	54.6	Low	47.9	Very low	149 Å²	149	142.5 Å²	142.5	80%	0.797	76%	0.764	S	S	*	*				72.7	109	78.5	-75.1	-18.5	0	0	0	113.9
156	D	54.5	Low	47.2	Very low	168 Å²	168	140.5 Å²	140.5	90%	0.898	76%	0.758	S	S	*	*				-177	109	126.6	-99.7	-20.2	0	0	0	110
157	E	46.2	Very low	46.5	Very low	184 Å²	184	140.5 Å²	140.5	86%	0.86	76%	0.758	S	S	*	*			trans	-69.8	145.8	159.2	-59	177	118.8	0	0	109.3
158	V	55.4	Low	45.7	Very low	128 Å²	128	139.4 Å²	139.4	78%	0.776	75%	0.753	S	S	*	*				-174.3	133	122.2	-93.4	0	0	0	0	113.3
159	D	51.4	Low	45.3	Very low	146 Å²	146	141.3 Å²	141.3	78%	0.781	76%	0.757	S	S	*	*			trans	51.6	97.3	132.5	-52.8	-13.4	0	0	0	120.8
160	E	36	Very low	44.1	Very low	160 Å²	160	140.7 Å²	140.7	75%	0.748	75%	0.748	S	S	*	*				14.6	141.2	123.1	-68.5	-147.3	100.7	0	0	122.2
161	Q	38.5	Very low	43.4	Very low	148 Å²	148	142 Å²	142	69%	0.692	76%	0.755	S	S	*	*			trans	87.8	146.6	136.9	-78.3	166.2	36.4	0	0	122.3
162	D	38.7	Very low	42.3	Very low	124 Å²	124	137.1 Å²	137.1	66%	0.663	75%	0.746	S	S	*	*			trans	79.3	92.5	146.7	-83.2	35.6	0	0	0	123.5
163	N	36	Very low	41.6	Very low	112 Å²	112	136.7 Å²	136.7	60%	0.599	74%	0.742	S	S	*	*				81.7	105.3	114.9	-84.3	-49.4	0	0	0	119.7
164	N	35.3	Very low	40.9	Very low	124 Å²	124	141.8 Å²	141.8	66%	0.663	75%	0.747	S	S	*	*				42.3	107.7	115.5	-67.1	-45.2	0	0	0	117.6
165	N	36.5	Very low	39.9	Very low	131 Å²	131	141.5 Å²	141.5	70%	0.701	75%	0.745	S	S	*	*				-179.1	149.2	88.7	-95.3	-65.2	0	0	0	113.9
166	N	36.3	Very low	39.2	Very low	123 Å²	123	139.2 Å²	139.2	66%	0.658	74%	0.738	S	S	*	*			trans	26.8	128.9	139.2	-48.6	-30.4	0	0	0	119.2
167	N	40.5	Very low	37.9	Very low	145 Å²	145	138.4 Å²	138.4	78%	0.775	73%	0.732	S	S	*	*				-165.4	149.7	92.4	-105.7	-67.6	0	0	0	116.4
168	N	35.5	Very low	37.3	Very low	123 Å²	123	135.2 Å²	135.2	66%	0.658	73%	0.725	S	S	*	*			trans	-44.4	143.5	169.4	-50.7	-83.3	0	0	0	115.2
169	H	43.6	Very low	36.1	Very low	181 Å²	181	133.9 Å²	133.9	84%	0.838	72%	0.722	S	S	*	*				-163.6	124.2	124.3	-95.9	43.8	0	0	0	105.4
170	N	32.9	Very low	35.5	Very low	135 Å²	135	132 Å²	132	72%	0.722	72%	0.721	S	S	*	*				66.6	138.6	61.1	-75.9	-10	0	0	0	115.2
171	D	34.8	Very low	35.3	Very low	164 Å²	164	131.4 Å²	131.4	88%	0.877	72%	0.722	S	S	*	*			trans	64.4	125.2	175.9	-54.5	-34.5	0	0	0	117.5
172	G	31.4	Very low	35.4	Very low	66 Å²	66	131.7 Å²	131.7	68%	0.68	73%	0.726	S	S	*	*			cis	163.3	-158.3	-6.3	0	0	0	0	0	113.3
173	I	31.1	Very low	35.3	Very low	145 Å²	145	132.4 Å²	132.4	74%	0.744	73%	0.729	S	S	*	*			trans	83.4	94.8	156.5	-52	-177.8	0	0	0	118.8
174	K	35.9	Very low	35.3	Very low	172 Å²	172	128.9 Å²	128.9	75%	0.748	71%	0.713	S	S	*	*			trans	74.5	114	136.2	-63.2	172.8	-166.7	165.3	0	120.2
175	D	32.3	Very low	36	Very low	144 Å²	144	126.9 Å²	126.9	77%	0.77	70%	0.702	S	S	*	*				77.3	153	67.5	-70.2	-35.5	0	0	0	114.8
176	P	40.9	Very low	36.4	Very low	101 Å²	101	124.3 Å²	124.3	66%	0.656	69%	0.693	S	S	*	*			cis	-142.9	-154.1	-33.5	36.1	-14.5	0	0	0	113.2
177	I	27.5	Very low	36.8	Very low	151 Å²	151	126 Å²	126	77%	0.774	69%	0.69	S	S	*	*			trans	69	127.4	165.7	-12.9	-178	0	0	0	114.5
178	T	31.9	Very low	37.2	Very low	116 Å²	116	121.1 Å²	121.1	71%	0.712	67%	0.667	S	S	*	*			cis	-158.2	135.1	43.1	-45.6	0	0	0	0	114.1
179	S	32.1	Very low	37.5	Very low	101 Å²	101	122.4 Å²	122.4	71%	0.706	68%	0.679	S	S	*	*			trans	22.9	142.2	155.1	65.6	0	0	0	0	122.2
180	S	37.5	Very low	37.8	Very low	107 Å²	107	121.2 Å²	121.2	75%	0.748	68%	0.679	S	S	*	*			cis	-168.9	128	-5	43.9	0	0	0	0	111.7
181	N	32.8	Very low	37.8	Very low	146 Å²	146	115.8 Å²	115.8	78%	0.781	65%	0.651	S	S	*	*			trans	-66.2	137.9	162.5	-73.9	-27.9	0	0	0	111.6
182	M	39.6	Very low	38.3	Very low	155 Å²	155	110.7 Å²	110.7	76%	0.764	63%	0.627	S	S	*	*			trans	-148.4	99.3	138.7	-65.8	-59	164.4	0	0	104.1
183	N	37.7	Very low	38.5	Very low	139 Å²	139	111 Å²	111	74%	0.743	62%	0.618	S	S	*	*				63.1	121.3	57.2	-154.8	39.2	0	0	0	112.3
184	C	34.5	Very low	38.7	Very low	37 Å²	37	110.2 Å²	110.2	25%	0.25	61%	0.61	C	S	.	*			trans	-154.2	127.5	-143.8	-66.2	0	0	0	0	107.4	P186 N1116 Q1117	C184-P186 WeakPolarHBondContact O-CD 3.45Å; C184-N1116 CarbonylContact C-O 3.59Å; C184-N1116 WeakPolarHBondContact CA-O 3.3Å; C184-Q1117 HydrophobicContact CB-CB 3.92Å; C184-Q1117 WeakPolarHBondContact SG-CB 3.47Å; C184-Q1117 PolarHBondContact SG-O 3.33Å
185	D	49.9	Very low	38.8	Very low	82 Å²	82	107.5 Å²	107.5	44%	0.439	61%	0.612	S	S	.	*			trans	-119.8	111.5	-136.7	-177	87.1	0	0	0	114.8	R187 S188 I1114 L1115 N1116	D185-R187 VanDerWaalsContact C-N 3.26Å; D185-R187 PolarHBondContact O-N 2.71Å; D185-S188 PolarHBondContact O-N 3.33Å; D185-S188 VanDerWaalsContact O-N 3.11Å; D185-I1114 CarbonylContact C-O 3.58Å; D185-I1114 HydrophobicContact CB-CG2 3.91Å; D185-I1114 WeakPolarHBondContact OD1-CG2 3.18Å; D185-I1114 WeakPolarHBondContact OD2-CG2 3.23Å; D185-L1115 CarbonylContact O-C 3.56Å; D185-L1115 VanDerWaalsContact O-O 3.11Å; D185-N1116 PolarHBondContact N-O 3.34Å
186	P	46.7	Very low	38.9	Very low	78 Å²	78	106.8 Å²	106.8	51%	0.506	61%	0.608	S	S	.	*	T	Hydrogen-bonded Turn	trans	-70.7	37.1	-171.8	-1.3	3.3	0	0	0	116	C184 I1114	C184-P186 WeakPolarHBondContact O-CD 3.45Å; P186-I1114 VanDerWaalsContact CA-CB 3.49Å; P186-I1114 WeakPolarHBondContact CA-O 3.28Å; P186-I1114 HydrophobicContact CB-CB 3.93Å; P186-I1114 WeakPolarHBondContact CB-O 3.26Å; P186-I1114 VanDerWaalsContact CD-N 3.3Å; P186-I1114 WeakPolarHBondContact CD-O 3.49Å; P186-I1114 HydrophobicContact CG-CB 3.6Å; P186-I1114 WeakPolarHBondContact CG-O 3.25Å; P186-I1114 WeakPolarHBondContact O-CA 3.17Å
187	R	43.9	Very low	38.7	Very low	157 Å²	157	108.8 Å²	108.8	59%	0.592	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-137.1	-2.5	170.4	-75.8	-170.9	161.7	97.2	9.8	114.3	D185 V189 S1113 I1114	D185-R187 VanDerWaalsContact C-N 3.26Å; D185-R187 PolarHBondContact O-N 2.71Å; R187-V189 WeakPolarHBondContact O-CG2 3.2Å; R187-V189 PolarHBondContact O-N 2.92Å; R187-S1113 VanDerWaalsContact CZ-CB 3.48Å; R187-S1113 VanDerWaalsContact CZ-OG 3.3Å; R187-S1113 PolarHBondContact NH1-OG 2.61Å; R187-S1113 PolarHBondContact NH2-OG 3.43Å; R187-I1114 HydrophobicContact CG-CG1 3.9Å
188	S	47.7	Very low	39	Very low	43 Å²	43	107.4 Å²	107.4	30%	0.301	61%	0.608	S	S	.	*			trans	-79.8	97.1	176.3	-169.8	0	0	0	0	112.5	D185 N190	D185-S188 PolarHBondContact O-N 3.33Å; D185-S188 VanDerWaalsContact O-N 3.11Å; S188-N190 PolarHBondContact O-N 2.78Å
189	V	43.7	Very low	39	Very low	150 Å²	150	106.1 Å²	106.1	91%	0.909	60%	0.596	S	S	*	*	S	Bend	trans	-70.8	20.6	-174.5	-153.2	0	0	0	0	114.3	R187	R187-V189 WeakPolarHBondContact O-CG2 3.2Å; R187-V189 PolarHBondContact O-N 2.92Å
190	N	48.3	Very low	38.9	Very low	156 Å²	156	109.8 Å²	109.8	83%	0.834	60%	0.601	S	S	*	*	S	Bend	trans	-155.2	42.6	-166.8	-151.3	-6.3	0	0	0	113.7	S188	S188-N190 PolarHBondContact O-N 2.78Å
191	C	34.6	Very low	38.6	Very low	21 Å²	21	114.6 Å²	114.6	14%	0.142	61%	0.605	C	S	.	*			trans	-139.5	140.6	-170	-162.5	0	0	0	0	113	C193 N1116 Q1117	C191-C193 PolarHBondContact O-N 3.38Å; C191-C193 VanDerWaalsContact O-N 3.17Å; C191-N1116 HydrophobicContact CB-CB 3.34Å; C191-N1116 VanDerWaalsContact SG-CB 3.55Å; C191-Q1117 WeakPolarHBondContact SG-CG 3.43Å
192	P	43.9	Very low	38.6	Very low	57 Å²	57	114.8 Å²	114.8	37%	0.37	61%	0.606	S	S	.	*	T	Hydrogen-bonded Turn	trans	-94.7	22.8	-141.8	-10.6	31.5	0	0	0	116.9	F194 K1120	P192-F194 VanDerWaalsContact C-N 3.28Å; P192-K1120 HydrophobicContact CB-CB 4.11Å; P192-K1120 HydrophobicContact CB-CD 3.84Å; P192-K1120 HydrophobicContact CB-CG 4.25Å; P192-K1120 HydrophobicContact CG-CB 3.78Å; P192-K1120 HydrophobicContact CG-CD 3.64Å; P192-K1120 HydrophobicContact CG-CG 4.17Å
193	C	35.6	Very low	38.4	Very low	72 Å²	72	116 Å²	116	49%	0.486	61%	0.609	S	S	.	*	T	Hydrogen-bonded Turn	trans	-83.3	-7	177.9	-48.9	0	0	0	0	112.7	C191 N1116	C191-C193 PolarHBondContact O-N 3.38Å; C191-C193 VanDerWaalsContact O-N 3.17Å; C193-N1116 VanDerWaalsContact CB-OD1 3.29Å; C193-N1116 WeakPolarHBondContact CB-OD1 3.28Å
194	F	35.7	Very low	38.3	Very low	130 Å²	130	116.1 Å²	116.1	57%	0.57	61%	0.609	S	S	*	*			trans	-133.1	112.9	-179.7	-99.1	-100.8	0	0	0	111.3	P192 L1115	P192-F194 VanDerWaalsContact C-N 3.28Å; F194-L1115 HydrophobicContact CD2-CD1 3.99Å; F194-L1115 HydrophobicContact CE2-CD1 3.58Å; F194-L1115 HydrophobicContact CE2-CD2 4.21Å; F194-L1115 HydrophobicContact CZ-CD1 4.14Å
195	S	37.3	Very low	38.2	Very low	114 Å²	114	118 Å²	118	80%	0.797	62%	0.622	S	S	*	*			trans	-175	79.7	166.7	-69.1	0	0	0	0	105.3
196	N	34.3	Very low	37.2	Very low	130 Å²	130	120.6 Å²	120.6	70%	0.695	64%	0.636	S	S	*	*				44	113.3	89.5	-76.7	26.1	0	0	0	113.9
197	D	37.6	Very low	36.7	Very low	143 Å²	143	121.9 Å²	121.9	77%	0.765	64%	0.638	S	S	*	*				-162.6	95.7	124	-96.4	-29.3	0	0	0	111.7
198	N	33.2	Very low	36.1	Very low	122 Å²	122	122.4 Å²	122.4	65%	0.652	65%	0.647	S	S	*	*			trans	56.9	100.9	138.1	-37	-44.9	0	0	0	121.2	S1280	N198-S1280 PolarHBondContact O-OG 2.87Å; N198-S1280 VanDerWaalsContact O-OG 3.13Å
199	I	31.9	Very low	35.3	Very low	89 Å²	89	128.2 Å²	128.2	46%	0.456	67%	0.674	S	S	.	*				-128.2	135.9	124.3	-62.6	-170.2	0	0	0	109.3	Y201 A1279 S1280	I199-Y201 HydrophobicContact CG2-CD2 3.93Å; I199-Y201 HydrophobicContact CG2-CE2 4.03Å; I199-Y201 PolarHBondContact O-N 2.72Å; I199-A1279 HydrophobicContact CD1-CB 3.47Å; I199-A1279 VanDerWaalsContact CD1-CB 3.47Å; I199-A1279 HydrophobicContact CG1-CB 4.48Å; I199-S1280 WeakPolarHBondContact CD1-OG 3.46Å; I199-S1280 WeakPolarHBondContact CG1-OG 3.32Å
200	E	31.1	Very low	34.9	Very low	177 Å²	177	127.5 Å²	127.5	83%	0.827	66%	0.659	S	S	*	*			trans	-67.6	111.7	169.9	-175.9	172.3	-146.6	0	0	111.8
201	Y	31.4	Very low	34.2	Very low	209 Å²	209	124.9 Å²	124.9	82%	0.82	65%	0.653	S	S	*	*			trans	-133.2	121.7	161.9	-91.2	-87.5	0	0	0	107.6	I199 E203	I199-Y201 HydrophobicContact CG2-CD2 3.93Å; I199-Y201 HydrophobicContact CG2-CE2 4.03Å; I199-Y201 PolarHBondContact O-N 2.72Å; Y201-E203 PolarHBondContact O-N 2.99Å
202	D	31.7	Very low	34.4	Very low	150 Å²	150	128.3 Å²	128.3	80%	0.802	67%	0.669	S	S	*	*			trans	-72	94.6	179	-73.7	-50.2	0	0	0	111.5	I204	D202-I204 PolarHBondContact O-N 3.01Å
203	E	35.6	Very low	33.7	Very low	179 Å²	179	130.4 Å²	130.4	84%	0.836	68%	0.681	S	S	*	*			trans	-68	95.1	163.3	-79.1	-165.3	131	0	0	110	Y201 S205	Y201-E203 PolarHBondContact O-N 2.99Å; E203-S205 VanDerWaalsContact C-N 3.27Å; E203-S205 PolarHBondContact O-N 3.02Å
204	I	34.7	Very low	33.5	Very low	142 Å²	142	131.9 Å²	131.9	73%	0.728	68%	0.679	S	S	*	*			trans	-74.4	88.2	162.1	-58.4	-177.9	0	0	0	108.2	D202 I207	D202-I204 PolarHBondContact O-N 3.01Å; I204-I207 HydrophobicContact CG2-CD1 4.47Å
205	S	32.5	Very low	33.4	Very low	77 Å²	77	135.3 Å²	135.3	54%	0.538	69%	0.694	S	S	.	*			trans	-59.8	153.4	168.7	-43.7	0	0	0	0	111.8	E203	E203-S205 VanDerWaalsContact C-N 3.27Å; E203-S205 PolarHBondContact O-N 3.02Å
206	D	29	Very low	33.3	Very low	136 Å²	136	133.9 Å²	133.9	73%	0.727	68%	0.675	S	S	*	*			trans	50.9	75	155.9	-54.9	-30	0	0	0	116.9
207	I	35.9	Very low	33.4	Very low	106 Å²	106	136.3 Å²	136.3	54%	0.544	68%	0.682	S	S	.	*			trans	-108.6	62.1	148.7	-51.4	-177.1	0	0	0	109.4	I204 K210	I204-I207 HydrophobicContact CG2-CD1 4.47Å; I207-K210 HydrophobicContact CD1-CD 4.16Å; I207-K210 HydrophobicContact CG1-CD 4.09Å; I207-K210 HydrophobicContact CG2-CB 3.69Å; I207-K210 HydrophobicContact CG2-CD 3.99Å; I207-K210 HydrophobicContact CG2-CG 3.92Å
208	Q	33	Very low	33.2	Very low	167 Å²	167	136.9 Å²	136.9	78%	0.78	69%	0.685	S	S	*	*	S	Bend	trans	-76.5	124.9	146.5	-65.6	-175.4	-4.6	0	0	107
209	N	31	Very low	33.5	Very low	165 Å²	165	137 Å²	137	88%	0.882	69%	0.686	S	S	*	*	S	Bend	trans	60.9	44	167.1	-53.9	-11.3	0	0	0	118
210	K	35	Very low	33.5	Very low	135 Å²	135	138.3 Å²	138.3	59%	0.587	70%	0.702	S	S	*	*			trans	-90	118.5	155.5	-70.4	178	-177.1	159.1	0	110.7	I207 I212	I207-K210 HydrophobicContact CD1-CD 4.16Å; I207-K210 HydrophobicContact CG1-CD 4.09Å; I207-K210 HydrophobicContact CG2-CB 3.69Å; I207-K210 HydrophobicContact CG2-CD 3.99Å; I207-K210 HydrophobicContact CG2-CG 3.92Å; K210-I212 PolarHBondContact O-N 3.49Å
211	S	32.1	Very low	33.8	Very low	102 Å²	102	135 Å²	135	71%	0.713	69%	0.689	S	S	*	*			trans	-65.5	108.1	164	42.5	0	0	0	0	110.1	T213	S211-T213 PolarHBondContact O-N 2.81Å; S211-T213 PolarHBondContact O-OG1 2.84Å
212	I	39.1	Very low	33.7	Very low	92 Å²	92	131.2 Å²	131.2	47%	0.472	68%	0.682	S	S	.	*			trans	-69.1	93	-179.1	-55.9	178.7	0	0	0	109.1	K210 F214 I235 L318	K210-I212 PolarHBondContact O-N 3.49Å; I212-F214 HydrophobicContact CG2-CD2 3.93Å; I212-F214 HydrophobicContact CG2-CE2 3.46Å; I212-F214 VanDerWaalsContact CG2-CE2 3.46Å; I212-F214 HydrophobicContact CG2-CZ 3.82Å; I212-F214 PolarHBondContact O-N 2.82Å; I212-I235 HydrophobicContact CD1-CG2 4.49Å; I212-L318 HydrophobicContact CD1-CD1 4.49Å
213	T	29.9	Very low	33.8	Very low	101 Å²	101	130.7 Å²	130.7	62%	0.62	67%	0.669	S	S	*	*			trans	-92.4	91.6	-179.4	-52.5	0	0	0	0	109.9	S211 K215	S211-T213 PolarHBondContact O-N 2.81Å; S211-T213 PolarHBondContact O-OG1 2.84Å; T213-K215 PolarHBondContact O-N 3.48Å
214	F	31.2	Very low	33.6	Very low	104 Å²	104	129.2 Å²	129.2	46%	0.456	67%	0.667	S	S	.	*			trans	-66.4	129.1	168.9	-69.9	-81.2	0	0	0	109.9	I212 E216 L318	I212-F214 HydrophobicContact CG2-CD2 3.93Å; I212-F214 HydrophobicContact CG2-CE2 3.46Å; I212-F214 VanDerWaalsContact CG2-CE2 3.46Å; I212-F214 HydrophobicContact CG2-CZ 3.82Å; I212-F214 PolarHBondContact O-N 2.82Å; F214-E216 PolarHBondContact O-N 3.13Å; F214-L318 HydrophobicContact CE2-CD2 4.31Å; F214-L318 HydrophobicContact CZ-CD2 4.33Å
215	K	33.6	Very low	33.7	Very low	201 Å²	201	126.7 Å²	126.7	87%	0.874	65%	0.653	S	S	*	*			trans	-92.8	70.6	170.6	-68	-173.8	178.2	-177.3	0	110.1	T213	T213-K215 PolarHBondContact O-N 3.48Å
216	E	35.1	Very low	33.5	Very low	84 Å²	84	126.5 Å²	126.5	39%	0.393	66%	0.663	S	S	.	*			trans	-74.2	119.5	156.7	-79.8	-176.6	-145.1	0	0	107.3	F214 N218 K299	F214-E216 PolarHBondContact O-N 3.13Å; E216-N218 PolarHBondContact O-N 2.86Å; E216-K299 IonicContact OE2-NZ 3.94Å; E216-K299 PolarHBondContact OE2-NZ 3.2Å
217	E	35.6	Very low	33.7	Very low	181 Å²	181	124.1 Å²	124.1	85%	0.846	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.3	114.8	174.3	-66.7	-173.5	147	0	0	108.9
218	N	34.3	Very low	33.7	Very low	155 Å²	155	127.5 Å²	127.5	83%	0.829	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	80.7	42.5	179.3	-40.8	-77.5	0	0	0	117.4	E216	E216-N218 PolarHBondContact O-N 2.86Å
219	D	39.4	Very low	33.9	Very low	126 Å²	126	128 Å²	128	67%	0.674	66%	0.662	S	S	*	*			trans	-161.4	93	136.7	-111.5	-19	0	0	0	111.5	I221	D219-I221 PolarHBondContact O-N 2.85Å
220	S	31.1	Very low	34.3	Very low	115 Å²	115	122.8 Å²	122.8	80%	0.804	64%	0.639	S	S	*	*			trans	-80.2	61.9	-175.2	65.2	0	0	0	0	112.9	I222	S220-I222 PolarHBondContact O-N 2.81Å
221	I	37.8	Very low	35.3	Very low	108 Å²	108	123.6 Å²	123.6	55%	0.554	64%	0.644	S	S	*	*			trans	-71.4	86.5	161.4	-57.1	178.4	0	0	0	107	D219 W223	D219-I221 PolarHBondContact O-N 2.85Å; I221-W223 PolarHBondContact O-N 2.92Å; I221-W223 VanDerWaalsContact O-N 3.16Å
222	I	30.7	Very low	37.2	Very low	130 Å²	130	121.8 Å²	121.8	67%	0.667	63%	0.627	S	S	*	*			trans	-59.1	119.5	161.1	-55.9	177.3	0	0	0	105.3	S220 D224	S220-I222 PolarHBondContact O-N 2.81Å; I222-D224 HydrophobicContact CG2-CB 4.22Å; I222-D224 PolarHBondContact O-N 2.85Å
223	W	33.6	Very low	39.2	Very low	138 Å²	138	120.7 Å²	120.7	52%	0.523	62%	0.621	S	S	.	*			trans	-71.1	69	163	-74.4	109.5	0	0	0	108.4	I221 M225	I221-W223 PolarHBondContact O-N 2.92Å; I221-W223 VanDerWaalsContact O-N 3.16Å; W223-M225 HydrophobicContact CB-CG 4.23Å; W223-M225 HydrophobicContact CE3-CG 3.94Å; W223-M225 HydrophobicContact CE3-SD 3.59Å; W223-M225 VanDerWaalsContact CE3-SD 3.59Å; W223-M225 HydrophobicContact CZ3-SD 3.81Å; W223-M225 PolarHBondContact O-N 2.93Å
224	D	31.1	Very low	42	Very low	148 Å²	148	120.3 Å²	120.3	79%	0.791	62%	0.615	S	S	*	*			trans	-72.9	66	158.9	-162.8	23.7	0	0	0	106.4	I222 G226	I222-D224 HydrophobicContact CG2-CB 4.22Å; I222-D224 PolarHBondContact O-N 2.85Å; D224-G226 VanDerWaalsContact C-N 3.29Å; D224-G226 PolarHBondContact O-N 2.95Å
225	M	37.4	Very low	44.8	Very low	89 Å²	89	119.2 Å²	119.2	44%	0.438	61%	0.613	S	S	.	*			trans	-62.7	102.7	168.1	-73.5	-69.3	-73.9	0	0	104.9	W223 F227	W223-M225 HydrophobicContact CB-CG 4.23Å; W223-M225 HydrophobicContact CE3-CG 3.94Å; W223-M225 HydrophobicContact CE3-SD 3.59Å; W223-M225 VanDerWaalsContact CE3-SD 3.59Å; W223-M225 HydrophobicContact CZ3-SD 3.81Å; W223-M225 PolarHBondContact O-N 2.93Å; M225-F227 HydrophobicContact CB-CD2 3.49Å; M225-F227 VanDerWaalsContact CB-CD2 3.49Å; M225-F227 HydrophobicContact CB-CE2 3.72Å; M225-F227 HydrophobicContact CB-CG 4.16Å; M225-F227 HydrophobicContact CE-CD1 4.32Å; M225-F227 HydrophobicContact CE-CD2 4.32Å; M225-F227 HydrophobicContact CE-CE1 3.67Å; M225-F227 HydrophobicContact CE-CE2 3.68Å; M225-F227 HydrophobicContact CE-CZ 3.32Å; M225-F227 HydrophobicContact CG-CD2 4.26Å; M225-F227 HydrophobicContact CG-CE2 3.96Å; M225-F227 PolarHBondContact O-N 3.09Å
226	G	27.3	Very low	47.5	Very low	73 Å²	73	114.2 Å²	114.2	75%	0.753	59%	0.591	S	S	*	*			trans	-62.5	54.9	157.1	0	0	0	0	0	110.9	D224 H228	D224-G226 VanDerWaalsContact C-N 3.29Å; D224-G226 PolarHBondContact O-N 2.95Å; G226-H228 PolarHBondContact O-N 2.95Å
227	F	34.4	Very low	50.3	Low	87 Å²	87	116 Å²	116	38%	0.382	60%	0.599	S	S	.	*			trans	-58.7	90.6	151.3	-74.9	-54.1	0	0	0	105.9	M225 E229 I233	M225-F227 HydrophobicContact CB-CD2 3.49Å; M225-F227 VanDerWaalsContact CB-CD2 3.49Å; M225-F227 HydrophobicContact CB-CE2 3.72Å; M225-F227 HydrophobicContact CB-CG 4.16Å; M225-F227 HydrophobicContact CE-CD1 4.32Å; M225-F227 HydrophobicContact CE-CD2 4.32Å; M225-F227 HydrophobicContact CE-CE1 3.67Å; M225-F227 HydrophobicContact CE-CE2 3.68Å; M225-F227 HydrophobicContact CE-CZ 3.32Å; M225-F227 HydrophobicContact CG-CD2 4.26Å; M225-F227 HydrophobicContact CG-CE2 3.96Å; M225-F227 PolarHBondContact O-N 3.09Å; F227-E229 PolarHBondContact O-N 3.05Å; F227-I233 HydrophobicContact CE1-CD1 3.81Å; F227-I233 HydrophobicContact CZ-CD1 4.08Å
228	H	34.7	Very low	53.1	Low	176 Å²	176	107.4 Å²	107.4	82%	0.815	56%	0.56	S	S	*	*			trans	-64.4	86.9	166.2	-141.1	-59.8	0	0	0	106.4	G226 S230	G226-H228 PolarHBondContact O-N 2.95Å; H228-S230 PolarHBondContact O-N 2.82Å; H228-S230 PolarHBondContact O-OG 3.06Å
229	E	36.7	Very low	56	Low	178 Å²	178	102.9 Å²	102.9	83%	0.832	54%	0.537	S	S	*	.	S	Bend	trans	34.3	45.6	-179.4	-68.7	171.1	140.2	0	0	114.3	F227 E231	F227-E229 PolarHBondContact O-N 3.05Å; E229-E231 PolarHBondContact O-N 3.48Å
230	S	40.2	Very low	58.5	Low	56 Å²	56	97 Å²	97	39%	0.392	51%	0.506	S	S	.	.			trans	-80.2	74.9	177.3	-43.2	0	0	0	0	108.3	H228 N232	H228-S230 PolarHBondContact O-N 2.82Å; H228-S230 PolarHBondContact O-OG 3.06Å; S230-N232 PolarHBondContact O-N 3.35Å
231	E	55.8	Low	61.4	Low	151 Å²	151	95 Å²	95	71%	0.706	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	-6.1	178.9	-67.1	-155.7	131.2	0	0	113.3	E229 I233 K323	E229-E231 PolarHBondContact O-N 3.48Å; E231-I233 PolarHBondContact O-N 2.78Å; E231-K323 WeakPolarHBondContact O-CD 3.4Å; E231-K323 WeakPolarHBondContact O-CE 3.34Å; E231-K323 PolarHBondContact O-NZ 3.27Å
232	N	71.8	Confident	63.9	Low	65 Å²	65	91.6 Å²	91.6	35%	0.348	47%	0.471	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.7	10	-168.5	-57.5	-3.4	0	0	0	115.5	S230 E322 K323 N325	S230-N232 PolarHBondContact O-N 3.35Å; N232-E322 CarbonylContact O-C 3.56Å; N232-E322 WeakPolarHBondContact O-CA 3.28Å; N232-E322 WeakPolarHBondContact O-CG 3.5Å; N232-K323 PolarHBondContact O-N 2.74Å; N232-N325 PolarHBondContact OD1-ND2 2.98Å
233	I	82.6	Confident	66.6	Low	68 Å²	68	94.6 Å²	94.6	35%	0.349	48%	0.479	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	136.3	175	-57.8	-172.5	0	0	0	111.6	F227 E231 I235 A320	F227-I233 HydrophobicContact CE1-CD1 3.81Å; F227-I233 HydrophobicContact CZ-CD1 4.08Å; E231-I233 PolarHBondContact O-N 2.78Å; I233-I235 HydrophobicContact CG2-CG1 4.37Å; I233-A320 HydrophobicContact CG2-CB 4.34Å
234	L	86.8	Confident	69	Low	93 Å²	93	93.9 Å²	93.9	49%	0.487	48%	0.48	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	132.6	165.2	-83.4	160.4	0	0	0	109	A320 R321 K323	L234-A320 CarbonylContact O-C 3.58Å; L234-A320 WeakPolarHBondContact O-CA 3.02Å; L234-R321 PolarHBondContact N-O 3.23Å; L234-R321 PolarHBondContact O-N 3.46Å; L234-K323 HydrophobicContact CB-CG 4.36Å; L234-K323 HydrophobicContact CD1-CG 3.65Å; L234-K323 HydrophobicContact CG-CD 4.1Å; L234-K323 HydrophobicContact CG-CG 3.55Å
235	I	91.3	Very high	71.4	Confident	82 Å²	82	91.1 Å²	91.1	42%	0.421	47%	0.47	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	133.1	165.3	-60.4	177.6	0	0	0	107.5	I212 I233 L291 L318 I319 A320	I212-I235 HydrophobicContact CD1-CG2 4.49Å; I233-I235 HydrophobicContact CG2-CG1 4.37Å; I235-L291 HydrophobicContact CD1-CD1 4.44Å; I235-L318 HydrophobicContact CG2-CD1 3.66Å; I235-L318 HydrophobicContact CG2-CD2 4.4Å; I235-L318 HydrophobicContact CG2-CG 3.97Å; I235-I319 CarbonylContact C-O 3.59Å; I235-I319 VanDerWaalsContact CA-O 3.29Å; I235-I319 WeakPolarHBondContact CA-O 3.4Å; I235-A320 HydrophobicContact CG1-CB 4.29Å
236	K	90.2	Very high	73.5	Confident	95 Å²	95	91.5 Å²	91.5	41%	0.413	47%	0.474	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	136.7	-177.5	176.7	167.9	179.7	170.1	0	111.1	V238 I319	K236-V238 HydrophobicContact CD-CG2 4.33Å; K236-V238 HydrophobicContact CG-CG2 4.14Å; K236-I319 PolarHBondContact N-O 3.11Å; K236-I319 PolarHBondContact O-N 3.17Å
237	E	94.5	Very high	76.4	Confident	121 Å²	121	90.2 Å²	90.2	57%	0.565	45%	0.448	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.5	137.5	166.6	-169.5	174.3	178.9	0	0	110.6	L317 L318	E237-L317 CarbonylContact C-O 3.55Å; E237-L317 WeakPolarHBondContact CA-O 3.32Å; E237-L318 HydrophobicContact CB-CD1 4.24Å
238	V	93.9	Very high	78.9	Confident	2 Å²	2	86.9 Å²	86.9	1%	0.012	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	127	176.5	-175.1	0	0	0	0	109.5	K236 L240 Q283 I284 L317 I319	K236-V238 HydrophobicContact CD-CG2 4.33Å; K236-V238 HydrophobicContact CG-CG2 4.14Å; V238-L240 HydrophobicContact CG1-CD2 4.26Å; V238-Q283 HydrophobicContact CG1-CB 3.95Å; V238-Q283 HydrophobicContact CG2-CB 3.92Å; V238-I284 HydrophobicContact CB-CG1 4.27Å; V238-I284 HydrophobicContact CG1-CD1 4.12Å; V238-I284 HydrophobicContact CG1-CG1 3.86Å; V238-I284 HydrophobicContact CG2-CG1 4.37Å; V238-L317 PolarHBondContact N-O 3.47Å; V238-L317 PolarHBondContact O-N 2.83Å; V238-I319 HydrophobicContact CB-CD1 4.44Å; V238-I319 HydrophobicContact CG2-CD1 4.09Å
239	T	94.1	Very high	81.6	Confident	59 Å²	59	78.8 Å²	78.8	36%	0.362	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	129.5	173.9	-68	0	0	0	0	110.4	K314 V315 C316	T239-K314 HydrophobicContact CG2-CD 3.97Å; T239-K314 HydrophobicContact CG2-CG 3.89Å; T239-V315 WeakPolarHBondContact CA-O 3.21Å; T239-C316 PolarHBondContact OG1-SG 3.01Å
240	L	94	Very high	84.2	Confident	4 Å²	4	70.4 Å²	70.4	2%	0.021	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	133.4	167.6	-51.1	179.9	0	0	0	109.6	V238 F249 L251 A278 I284 K314 V315 L317	V238-L240 HydrophobicContact CG1-CD2 4.26Å; L240-F249 HydrophobicContact CB-CD1 4Å; L240-F249 HydrophobicContact CB-CE1 4.23Å; L240-F249 HydrophobicContact CD1-CB 4.25Å; L240-F249 HydrophobicContact CD1-CD1 4.12Å; L240-F249 HydrophobicContact CD1-CG 4.46Å; L240-L251 HydrophobicContact CD1-CD1 4Å; L240-A278 HydrophobicContact CD1-CB 3.94Å; L240-I284 HydrophobicContact CD1-CD1 3.89Å; L240-I284 HydrophobicContact CD2-CD1 3.99Å; L240-I284 HydrophobicContact CG-CD1 4.16Å; L240-K314 WeakPolarHBondContact O-CA 3.2Å; L240-V315 HydrophobicContact CB-CG1 3.89Å; L240-V315 HydrophobicContact CD1-CG1 4.32Å; L240-V315 HydrophobicContact CG-CG1 4.33Å; L240-V315 PolarHBondContact N-O 2.87Å; L240-V315 PolarHBondContact O-N 2.92Å; L240-L317 HydrophobicContact CD1-CD1 4.46Å
241	C	91.5	Very high	86.8	Confident	71 Å²	71	68.8 Å²	68.8	48%	0.48	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	124.2	179.2	-66.8	0	0	0	0	110.3	L277 L313	C241-L277 WeakPolarHBondContact O-CD2 3.37Å; C241-L313 CarbonylContact C-O 3.59Å; C241-L313 WeakPolarHBondContact CA-O 3.43Å
242	R	90.8	Very high	88.5	Confident	38 Å²	38	62.2 Å²	62.2	14%	0.143	31%	0.314	C	S	.	.			trans	-81.3	137.2	173.7	-60	174.9	177.9	-144.9	-1.5	110.2	K244 P245 E247 F249 L277 Q312 L313	R242-K244 WeakPolarHBondContact CB-O 3.37Å; R242-P245 PolarHBondContact NH1-O 2.71Å; R242-E247 HydrophobicContact CB-CB 4.31Å; R242-E247 WeakPolarHBondContact CD-O 3.48Å; R242-E247 WeakPolarHBondContact CG-O 3.37Å; R242-E247 PolarHBondContact NE-O 2.89Å; R242-E247 PolarHBondContact NH1-O 3.31Å; R242-E247 VanDerWaalsContact NH1-O 3.09Å; R242-F249 HydrophobicContact CG-CD1 4.18Å; R242-F249 HydrophobicContact CG-CE1 3.65Å; R242-F249 HydrophobicContact CG-CZ 4.2Å; R242-L277 HydrophobicContact CB-CD1 4.03Å; R242-L277 HydrophobicContact CG-CD1 3.51Å; R242-Q312 WeakPolarHBondContact CD-O 3.25Å; R242-L313 PolarHBondContact N-O 2.97Å
243	K	86.6	Confident	89.5	Confident	192 Å²	192	59.6 Å²	59.6	84%	0.835	30%	0.3	S	S	*	.	S	Bend	trans	-79.9	-21.8	172	-66.1	-176.5	179.7	-179.4	0	112.7	E247	K243-E247 WeakPolarHBondContact CB-OE2 2.99Å; K243-E247 PolarHBondContact N-OE2 2.73Å
244	K	84.3	Confident	89.8	Confident	123 Å²	123	58.7 Å²	58.7	54%	0.535	30%	0.299	S	S	.	.	S	Bend	trans	-144.1	153.7	175.5	-43.4	175.7	-178	175.2	0	109.6	R242 D246 E247	R242-K244 WeakPolarHBondContact CB-O 3.37Å; K244-D246 WeakPolarHBondContact CB-OD1 3.48Å; K244-D246 WeakPolarHBondContact CD-OD1 3.45Å; K244-D246 WeakPolarHBondContact CD-OD2 3.27Å; K244-D246 IonicContact NZ-OD2 2.7Å; K244-D246 PolarHBondContact NZ-OD2 3.16Å; K244-D246 PolarHBondContact O-N 3.06Å; K244-E247 WeakPolarHBondContact O-CB 3.38Å; K244-E247 PolarHBondContact O-N 3.03Å
245	P	80.7	Confident	90	Very high	90 Å²	90	55 Å²	55	58%	0.584	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-28.5	179.4	26.2	-35.1	0	0	0	113.6	R242 E247	R242-P245 PolarHBondContact NH1-O 2.71Å; P245-E247 VanDerWaalsContact C-N 3.35Å
246	D	82.1	Confident	89.5	Confident	98 Å²	98	59.5 Å²	59.5	52%	0.524	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71	-18.8	173.9	49.3	-60.2	0	0	0	114.5	K244	K244-D246 WeakPolarHBondContact CB-OD1 3.48Å; K244-D246 WeakPolarHBondContact CD-OD1 3.45Å; K244-D246 WeakPolarHBondContact CD-OD2 3.27Å; K244-D246 IonicContact NZ-OD2 2.7Å; K244-D246 PolarHBondContact NZ-OD2 3.16Å; K244-D246 PolarHBondContact O-N 3.06Å
247	E	87.6	Confident	88.6	Confident	45 Å²	45	61.3 Å²	61.3	21%	0.21	30%	0.301	C	S	.	.			trans	-72.9	132.1	-179.9	-169.4	175.6	-154.4	0	0	111.2	R242 K243 K244 P245 L277 K280	R242-E247 HydrophobicContact CB-CB 4.31Å; R242-E247 WeakPolarHBondContact CD-O 3.48Å; R242-E247 WeakPolarHBondContact CG-O 3.37Å; R242-E247 PolarHBondContact NE-O 2.89Å; R242-E247 PolarHBondContact NH1-O 3.31Å; R242-E247 VanDerWaalsContact NH1-O 3.09Å; K243-E247 WeakPolarHBondContact CB-OE2 2.99Å; K243-E247 PolarHBondContact N-OE2 2.73Å; K244-E247 WeakPolarHBondContact O-CB 3.38Å; K244-E247 PolarHBondContact O-N 3.03Å; P245-E247 VanDerWaalsContact C-N 3.35Å; E247-L277 HydrophobicContact CG-CD1 3.95Å; E247-L277 HydrophobicContact CG-CD2 4.4Å; E247-L277 HydrophobicContact CG-CG 4.06Å; E247-K280 IonicContact OE1-NZ 3.34Å
248	K	86.7	Confident	86.9	Confident	17 Å²	17	56.5 Å²	56.5	7%	0.074	28%	0.284	C	S	.	.			trans	-89.6	150.2	-172.9	-57.1	-162.3	166.3	179.1	0	113.1	E30 Q72 D74 G250 L277	E30-K248 VanDerWaalsContact CD-NZ 3.33Å; E30-K248 IonicContact OE1-NZ 3.15Å; E30-K248 PolarHBondContact OE1-NZ 2.97Å; E30-K248 VanDerWaalsContact OE2-CE 3.32Å; E30-K248 WeakPolarHBondContact OE2-CE 3.13Å; E30-K248 IonicContact OE2-NZ 3.42Å; E30-K248 PolarHBondContact OE2-NZ 3.39Å; Q72-K248 VanDerWaalsContact C-NZ 3.29Å; Q72-K248 HydrophobicContact CB-CD 4.09Å; Q72-K248 HydrophobicContact CG-CD 3.69Å; Q72-K248 HydrophobicContact CG-CG 4.37Å; Q72-K248 WeakPolarHBondContact O-CD 3.4Å; Q72-K248 PolarHBondContact O-NZ 3.11Å; D74-K248 WeakPolarHBondContact OD1-CE 3.39Å; D74-K248 IonicContact OD1-NZ 2.65Å; D74-K248 PolarHBondContact OD1-NZ 3.04Å; D74-K248 WeakPolarHBondContact OD2-CD 3.29Å; D74-K248 WeakPolarHBondContact OD2-CE 3.44Å; D74-K248 IonicContact OD2-NZ 3.93Å; D74-K248 PolarHBondContact OD2-NZ 3.38Å; K248-G250 VanDerWaalsContact C-N 3.35Å; K248-L277 WeakPolarHBondContact O-CD1 3.13Å; K248-L277 WeakPolarHBondContact O-CG 3.15Å
249	F	91.8	Very high	84.9	Confident	7 Å²	7	64.7 Å²	64.7	3%	0.031	33%	0.327	C	S	.	.			trans	-71	-34.5	171.5	-63.5	-50.7	0	0	0	111.5	L240 R242 L251 L277 A278 F308 V315	L240-F249 HydrophobicContact CB-CD1 4Å; L240-F249 HydrophobicContact CB-CE1 4.23Å; L240-F249 HydrophobicContact CD1-CB 4.25Å; L240-F249 HydrophobicContact CD1-CD1 4.12Å; L240-F249 HydrophobicContact CD1-CG 4.46Å; R242-F249 HydrophobicContact CG-CD1 4.18Å; R242-F249 HydrophobicContact CG-CE1 3.65Å; R242-F249 HydrophobicContact CG-CZ 4.2Å; F249-L251 HydrophobicContact CB-CD1 4.36Å; F249-L277 HydrophobicContact CD1-CD1 4.11Å; F249-A278 WeakPolarHBondContact O-CB 3.31Å; F249-A278 PolarHBondContact O-N 2.9Å; F249-F308 AromaticContact CD2-CD1 3.96Å; F249-F308 HydrophobicContact CD2-CD1 3.96Å; F249-F308 HydrophobicContact CD2-CE1 4.16Å; F249-F308 HydrophobicContact CE2-CD1 4.06Å; F249-V315 HydrophobicContact CD1-CG1 3.87Å; F249-V315 HydrophobicContact CD2-CG1 4.25Å; F249-V315 HydrophobicContact CE1-CB 4.21Å; F249-V315 HydrophobicContact CE1-CG1 3.48Å; F249-V315 VanDerWaalsContact CE1-CG1 3.48Å; F249-V315 HydrophobicContact CE2-CB 4.19Å; F249-V315 HydrophobicContact CE2-CG1 3.9Å; F249-V315 HydrophobicContact CG-CG1 4.25Å; F249-V315 HydrophobicContact CZ-CB 3.79Å; F249-V315 HydrophobicContact CZ-CG1 3.51Å
250	G	92.1	Very high	82.7	Confident	1 Å²	1	65.6 Å²	65.6	1%	0.01	33%	0.333	C	S	.	.			trans	66.3	49.4	178.9	0	0	0	0	0	114.4	K248 E273	K248-G250 VanDerWaalsContact C-N 3.35Å; G250-E273 WeakPolarHBondContact CA-OE2 3.14Å; G250-E273 PolarHBondContact O-N 2.89Å; G250-E273 VanDerWaalsContact O-N 3.09Å
251	L	93.3	Very high	80.7	Confident	23 Å²	23	71.1 Å²	71.1	12%	0.12	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	115	177.1	-72.5	164.4	0	0	0	109.4	L240 F249 L253 V269 L272 A278 I284 F308 L317	L240-L251 HydrophobicContact CD1-CD1 4Å; F249-L251 HydrophobicContact CB-CD1 4.36Å; L251-L253 HydrophobicContact CB-CD2 4.24Å; L251-V269 HydrophobicContact CD2-CG1 3.87Å; L251-V269 HydrophobicContact CD2-CG2 4.12Å; L251-L272 HydrophobicContact CD2-CD2 3.61Å; L251-A278 HydrophobicContact CD1-CB 4.32Å; L251-A278 HydrophobicContact CD2-CB 3.63Å; L251-A278 HydrophobicContact CG-CB 3.67Å; L251-I284 HydrophobicContact CD1-CD1 4.41Å; L251-I284 HydrophobicContact CD2-CD1 4.24Å; L251-I284 HydrophobicContact CD2-CG2 3.91Å; L251-F308 HydrophobicContact CD1-CE1 4.49Å; L251-F308 HydrophobicContact CD1-CZ 4.43Å; L251-L317 HydrophobicContact CD1-CD1 3.77Å
252	T	92.3	Very high	78.8	Confident	12 Å²	12	74.6 Å²	74.6	7%	0.074	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	120.5	167	-60.7	0	0	0	0	108.6	V69 G270 E271	V69-T252 HydrophobicContact CG1-CG2 3.63Å; T252-G270 PolarHBondContact O-N 2.93Å; T252-E271 PolarHBondContact N-O 3.18Å
253	L	92.9	Very high	77.2	Confident	10 Å²	10	75.7 Å²	75.7	5%	0.052	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	124.4	-175.6	-60.4	-178.9	0	0	0	112.3	L251 Y255 V267 I290 V304 F308	L251-L253 HydrophobicContact CB-CD2 4.24Å; L253-Y255 HydrophobicContact CB-CE2 3.91Å; L253-V267 HydrophobicContact CB-CG1 4.28Å; L253-V267 HydrophobicContact CD1-CG1 4.47Å; L253-V267 HydrophobicContact CD2-CG1 4.18Å; L253-I290 HydrophobicContact CD2-CD1 3.72Å; L253-V304 HydrophobicContact CD1-CG1 4.02Å; L253-F308 HydrophobicContact CD1-CD2 4Å; L253-F308 HydrophobicContact CD1-CE2 3.51Å; L253-F308 HydrophobicContact CD1-CZ 4.2Å
254	C	89.2	Confident	76.3	Confident	49 Å²	49	68.4 Å²	68.4	33%	0.331	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	117.8	176.5	-73.7	0	0	0	0	110.3	Y268	C254-Y268 PolarHBondContact N-O 3.15Å; C254-Y268 PolarHBondContact O-N 3.4Å
255	Y	89.9	Confident	76.1	Confident	15 Å²	15	62.9 Å²	62.9	6%	0.059	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	122.9	-180	-60.4	-91.9	0	0	0	110.7	S68 A70 L253 V267 R301 V304	S68-Y255 WeakPolarHBondContact O-CD2 2.97Å; A70-Y255 HydrophobicContact CB-CE2 4.33Å; L253-Y255 HydrophobicContact CB-CE2 3.91Å; Y255-V267 HydrophobicContact CD1-CG2 3.74Å; Y255-V267 HydrophobicContact CE1-CG1 4.38Å; Y255-V267 HydrophobicContact CE1-CG2 3.77Å; Y255-R301 HydrophobicContact CD1-CB 3.9Å; Y255-R301 HydrophobicContact CD1-CG 3.76Å; Y255-R301 HydrophobicContact CD2-CG 4.43Å; Y255-R301 HydrophobicContact CE1-CB 4.06Å; Y255-R301 HydrophobicContact CE1-CG 3.72Å; Y255-R301 HydrophobicContact CE2-CG 4.4Å; Y255-R301 HydrophobicContact CG-CG 4.13Å; Y255-V304 HydrophobicContact CE1-CB 4.04Å; Y255-V304 HydrophobicContact CE1-CG1 3.93Å; Y255-V304 HydrophobicContact CE1-CG2 4.25Å; Y255-V304 WeakPolarHBondContact OH-CG1 3.34Å
256	R	82.1	Confident	76.4	Confident	178 Å²	178	61 Å²	61	67%	0.672	33%	0.332	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.4	103.3	171.1	-169.5	171.8	-178.9	173.3	-1.5	109.1	N266 Y268	R256-N266 HydrophobicContact CB-CB 4.5Å; R256-N266 PolarHBondContact N-O 2.95Å; R256-N266 PolarHBondContact O-N 3.48Å; R256-Y268 HydrophobicContact CB-CD2 4.49Å; R256-Y268 HydrophobicContact CB-CE2 4.09Å
257	Q	69.9	Low	76.9	Confident	133 Å²	133	56.3 Å²	56.3	62%	0.621	31%	0.307	S	S	*	.			trans	-61.1	134.2	167.3	-155.6	87.5	27	0	0	108.5
258	G	59.8	Low	77.2	Confident	20 Å²	20	57 Å²	57	21%	0.206	31%	0.308	C	S	.	.			trans	-84.7	164.3	168.5	0	0	0	0	0	111.9	T260	G258-T260 PolarHBondContact O-N 2.93Å
259	D	50.6	Low	77.6	Confident	173 Å²	173	56.2 Å²	56.2	93%	0.925	30%	0.304	S	S	*	.	S	Bend	trans	-72.7	5.7	-166	-50.2	-67.9	0	0	0	115.7
260	T	48.3	Very low	77.6	Confident	79 Å²	79	57 Å²	57	49%	0.485	32%	0.315	S	S	.	.	S	Bend	trans	-134.5	156.3	176.9	87	0	0	0	0	111.5	G258 N262 T263	G258-T260 PolarHBondContact O-N 2.93Å; T260-N262 PolarHBondContact O-N 3.15Å; T260-N262 PolarHBondContact OG1-N 3.29Å; T260-T263 PolarHBondContact N-OG1 3.49Å; T260-T263 PolarHBondContact O-N 3.39Å; T260-T263 VanDerWaalsContact O-N 3.11Å; T260-T263 PolarHBondContact OG1-N 3.25Å; T260-T263 PolarHBondContact OG1-OG1 2.85Å
261	S	52.1	Low	77.6	Confident	119 Å²	119	62.9 Å²	62.9	83%	0.832	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-18	174.4	55.8	0	0	0	0	114.4
262	N	52.8	Low	77.5	Confident	145 Å²	145	63.8 Å²	63.8	78%	0.775	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.7	-3	-175.7	-59.3	12.5	0	0	0	111.9	T260	T260-N262 PolarHBondContact O-N 3.15Å; T260-N262 PolarHBondContact OG1-N 3.29Å
263	T	55.9	Low	77.5	Confident	60 Å²	60	66.1 Å²	66.1	37%	0.368	36%	0.357	S	S	.	.	S	Bend	trans	-78.4	123.8	178.7	-47.2	0	0	0	0	109.5	T260	T260-T263 PolarHBondContact N-OG1 3.49Å; T260-T263 PolarHBondContact O-N 3.39Å; T260-T263 VanDerWaalsContact O-N 3.11Å; T260-T263 PolarHBondContact OG1-N 3.25Å; T260-T263 PolarHBondContact OG1-OG1 2.85Å
264	S	67.7	Low	77.3	Confident	39 Å²	39	72.1 Å²	72.1	27%	0.273	39%	0.388	S	S	.	.			trans	-55.4	141	179.5	51.9	0	0	0	0	111.9	N266	S264-N266 PolarHBondContact O-N 2.86Å; S264-N266 PolarHBondContact O-OD1 3.32Å
265	C	79.6	Confident	77.2	Confident	8 Å²	8	75.1 Å²	75.1	5%	0.054	40%	0.401	C	S	.	.			trans	-68.2	112.9	176.6	-166.4	0	0	0	0	110	I298	C265-I298 WeakPolarHBondContact O-CG2 3.46Å
266	N	88.4	Confident	77.3	Confident	50 Å²	50	74.9 Å²	74.9	27%	0.267	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	124.2	177.5	-71	-1.8	0	0	0	109.2	R256 S264 Y268	R256-N266 HydrophobicContact CB-CB 4.5Å; R256-N266 PolarHBondContact N-O 2.95Å; R256-N266 PolarHBondContact O-N 3.48Å; S264-N266 PolarHBondContact O-N 2.86Å; S264-N266 PolarHBondContact O-OD1 3.32Å; N266-Y268 HydrophobicContact CB-CE2 3.64Å; N266-Y268 PolarHBondContact ND2-OH 3.19Å
267	V	92.2	Very high	77.7	Confident	0 Å²	0	67.3 Å²	67.3	0%	0	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	129.8	-177.9	-177.4	0	0	0	0	109.5	L253 Y255 Q289 I290 I298 V304	L253-V267 HydrophobicContact CB-CG1 4.28Å; L253-V267 HydrophobicContact CD1-CG1 4.47Å; L253-V267 HydrophobicContact CD2-CG1 4.18Å; Y255-V267 HydrophobicContact CD1-CG2 3.74Å; Y255-V267 HydrophobicContact CE1-CG1 4.38Å; Y255-V267 HydrophobicContact CE1-CG2 3.77Å; V267-Q289 CarbonylContact O-C 3.55Å; V267-Q289 WeakPolarHBondContact O-CA 3.49Å; V267-I290 HydrophobicContact CB-CB 4.45Å; V267-I290 HydrophobicContact CG1-CB 4.49Å; V267-I290 HydrophobicContact CG1-CD1 4.23Å; V267-I290 PolarHBondContact O-N 2.98Å; V267-I298 HydrophobicContact CB-CD1 4.15Å; V267-I298 HydrophobicContact CG2-CD1 4.05Å; V267-I298 HydrophobicContact CG2-CG2 4.11Å; V267-V304 HydrophobicContact CG2-CG2 3.8Å
268	Y	94.2	Very high	78.8	Confident	58 Å²	58	61 Å²	61	23%	0.227	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	146	177.9	-58.3	-90.6	0	0	0	110.5	C254 R256 N266 G270 D288 Q289	C254-Y268 PolarHBondContact N-O 3.15Å; C254-Y268 PolarHBondContact O-N 3.4Å; R256-Y268 HydrophobicContact CB-CD2 4.49Å; R256-Y268 HydrophobicContact CB-CE2 4.09Å; N266-Y268 HydrophobicContact CB-CE2 3.64Å; N266-Y268 PolarHBondContact ND2-OH 3.19Å; Y268-G270 PolarHBondContact O-N 3.22Å; Y268-D288 CarbonylContact C-O 3.53Å; Y268-D288 VanDerWaalsContact CA-O 3.26Å; Y268-D288 WeakPolarHBondContact CA-O 3.35Å; Y268-Q289 HydrophobicContact CD1-CB 3.73Å; Y268-Q289 HydrophobicContact CD1-CG 4.01Å; Y268-Q289 HydrophobicContact CE1-CB 3.55Å; Y268-Q289 HydrophobicContact CE1-CG 3.6Å; Y268-Q289 VanDerWaalsContact CE1-OE1 3.3Å; Y268-Q289 PolarHBondContact OH-OE1 3.03Å
269	V	93.7	Very high	80.4	Confident	1 Å²	1	63.8 Å²	63.8	1%	0.006	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	112.3	167.7	-178.7	0	0	0	0	107.8	L251 L272 I284 G287 D288 I290	L251-V269 HydrophobicContact CD2-CG1 3.87Å; L251-V269 HydrophobicContact CD2-CG2 4.12Å; V269-L272 HydrophobicContact CG1-CD2 4.29Å; V269-L272 HydrophobicContact CG1-CG 4.22Å; V269-I284 HydrophobicContact CB-CG2 4.43Å; V269-I284 HydrophobicContact CG1-CG2 4.17Å; V269-I284 HydrophobicContact CG2-CG2 3.76Å; V269-G287 PolarHBondContact O-N 2.64Å; V269-D288 HydrophobicContact CB-CB 4.24Å; V269-D288 HydrophobicContact CG2-CB 3.97Å; V269-D288 PolarHBondContact N-O 2.8Å; V269-I290 HydrophobicContact CG2-CD1 4.19Å; V269-I290 HydrophobicContact CG2-CG1 4.25Å
270	G	91.9	Very high	82.3	Confident	24 Å²	24	61.7 Å²	61.7	25%	0.247	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	-54.3	177.3	0	0	0	0	0	111.7	T252 Y268 N286	T252-G270 PolarHBondContact O-N 2.93Å; Y268-G270 PolarHBondContact O-N 3.22Å; G270-N286 WeakPolarHBondContact O-CB 3.37Å; G270-N286 VanDerWaalsContact O-CG 3.27Å; G270-N286 PolarHBondContact O-ND2 2.9Å
271	E	92.2	Very high	84.3	Confident	124 Å²	124	59.1 Å²	59.1	58%	0.579	32%	0.32	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-142.7	157.2	-174.6	-61.3	171.8	174.4	0	0	110.3	T252	T252-E271 PolarHBondContact N-O 3.18Å
272	L	92.9	Very high	86.2	Confident	42 Å²	42	55.8 Å²	55.8	22%	0.22	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	130.5	177.4	-72.6	160.9	0	0	0	108.4	L251 V269 A278 I284 N286	L251-L272 HydrophobicContact CD2-CD2 3.61Å; V269-L272 HydrophobicContact CG1-CD2 4.29Å; V269-L272 HydrophobicContact CG1-CG 4.22Å; L272-A278 HydrophobicContact CD2-CB 3.43Å; L272-A278 VanDerWaalsContact CD2-CB 3.43Å; L272-I284 WeakPolarHBondContact CD1-O 3.38Å; L272-I284 HydrophobicContact CD2-CB 4.41Å; L272-I284 HydrophobicContact CD2-CG2 4.27Å; L272-N286 WeakPolarHBondContact CD1-OD1 3.26Å; L272-N286 WeakPolarHBondContact CG-OD1 3.31Å; L272-N286 PolarHBondContact N-OD1 3.12Å
273	E	91.9	Very high	88	Confident	61 Å²	61	52.4 Å²	52.4	29%	0.285	28%	0.284	S	S	.	.			trans	-78.9	136.2	179.7	-68.4	176.5	164.2	0	0	111.1	G250 N275 S276	G250-E273 WeakPolarHBondContact CA-OE2 3.14Å; G250-E273 PolarHBondContact O-N 2.89Å; G250-E273 VanDerWaalsContact O-N 3.09Å; E273-N275 PolarHBondContact O-N 2.79Å; E273-S276 WeakPolarHBondContact O-CB 3.44Å; E273-S276 PolarHBondContact O-N 3.15Å; E273-S276 PolarHBondContact O-OG 2.82Å
274	L	89.1	Confident	89.8	Confident	137 Å²	137	49.9 Å²	49.9	72%	0.717	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	132.8	179.3	-173.6	73.3	0	0	0	111	S276 E279	L274-S276 PolarHBondContact O-N 2.82Å; L274-E279 WeakPolarHBondContact CD1-OE1 3.06Å
275	N	86.7	Confident	91	Very high	111 Å²	111	54 Å²	54	59%	0.594	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.3	14	-171.2	-57.3	-77.4	0	0	0	115.6	E273 E279 K280	E273-N275 PolarHBondContact O-N 2.79Å; N275-E279 PolarHBondContact N-OE2 2.98Å; N275-K280 WeakPolarHBondContact O-CE 3.43Å; N275-K280 PolarHBondContact O-NZ 2.89Å
276	S	91.1	Very high	91.6	Very high	10 Å²	10	58.2 Å²	58.2	7%	0.07	30%	0.3	C	S	.	.			trans	-72.3	169.3	174.5	66.9	0	0	0	0	113.6	E273 L274 A278 E279 K280	E273-S276 WeakPolarHBondContact O-CB 3.44Å; E273-S276 PolarHBondContact O-N 3.15Å; E273-S276 PolarHBondContact O-OG 2.82Å; L274-S276 PolarHBondContact O-N 2.82Å; S276-A278 VanDerWaalsContact C-N 3.31Å; S276-A278 PolarHBondContact O-N 2.88Å; S276-E279 PolarHBondContact OG-N 2.95Å; S276-E279 VanDerWaalsContact OG-N 3.09Å; S276-K280 WeakPolarHBondContact O-CB 3.48Å; S276-K280 VanDerWaalsContact O-CD 3.3Å; S276-K280 WeakPolarHBondContact O-CD 3.19Å; S276-K280 WeakPolarHBondContact O-CG 3.43Å; S276-K280 PolarHBondContact O-N 3.43Å
277	L	91.6	Very high	91.7	Very high	19 Å²	19	58.3 Å²	58.3	10%	0.099	31%	0.314	C	S	.	.	H	α-helix	trans	-63.4	-36.3	171.8	-69.2	170.9	0	0	0	112.7	C241 R242 E247 K248 F249 S281	C241-L277 WeakPolarHBondContact O-CD2 3.37Å; R242-L277 HydrophobicContact CB-CD1 4.03Å; R242-L277 HydrophobicContact CG-CD1 3.51Å; E247-L277 HydrophobicContact CG-CD1 3.95Å; E247-L277 HydrophobicContact CG-CD2 4.4Å; E247-L277 HydrophobicContact CG-CG 4.06Å; K248-L277 WeakPolarHBondContact O-CD1 3.13Å; K248-L277 WeakPolarHBondContact O-CG 3.15Å; F249-L277 HydrophobicContact CD1-CD1 4.11Å; L277-S281 WeakPolarHBondContact O-CB 3.07Å; L277-S281 PolarHBondContact O-N 2.85Å
278	A	93	Very high	91.9	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-69	-42.3	178.6	0	0	0	0	0	112.1	L240 F249 L251 L272 S276 S281 I284	L240-A278 HydrophobicContact CD1-CB 3.94Å; F249-A278 WeakPolarHBondContact O-CB 3.31Å; F249-A278 PolarHBondContact O-N 2.9Å; L251-A278 HydrophobicContact CD1-CB 4.32Å; L251-A278 HydrophobicContact CD2-CB 3.63Å; L251-A278 HydrophobicContact CG-CB 3.67Å; L272-A278 HydrophobicContact CD2-CB 3.43Å; L272-A278 VanDerWaalsContact CD2-CB 3.43Å; S276-A278 VanDerWaalsContact C-N 3.31Å; S276-A278 PolarHBondContact O-N 2.88Å; A278-S281 WeakPolarHBondContact O-CB 3.03Å; A278-S281 PolarHBondContact O-N 2.81Å; A278-S281 PolarHBondContact O-OG 2.68Å; A278-I284 HydrophobicContact CB-CD1 4.19Å
279	E	91.9	Very high	91.8	Very high	79 Å²	79	58 Å²	58	37%	0.369	31%	0.314	S	S	.	.	H	α-helix	trans	-65.4	-49.6	172.9	-171.3	-171.2	-120.1	0	0	111.2	L274 N275 S276 S281 G282	L274-E279 WeakPolarHBondContact CD1-OE1 3.06Å; N275-E279 PolarHBondContact N-OE2 2.98Å; S276-E279 PolarHBondContact OG-N 2.95Å; S276-E279 VanDerWaalsContact OG-N 3.09Å; E279-S281 PolarHBondContact O-N 2.74Å; E279-G282 PolarHBondContact O-N 2.96Å
280	K	90.9	Very high	91.9	Very high	130 Å²	130	58.1 Å²	58.1	57%	0.565	32%	0.315	S	S	*	.	H	α-helix	trans	-56.5	-22	175.4	-73.9	165	178.5	149.7	0	113.4	E247 N275 S276 G282	E247-K280 IonicContact OE1-NZ 3.34Å; N275-K280 WeakPolarHBondContact O-CE 3.43Å; N275-K280 PolarHBondContact O-NZ 2.89Å; S276-K280 WeakPolarHBondContact O-CB 3.48Å; S276-K280 VanDerWaalsContact O-CD 3.3Å; S276-K280 WeakPolarHBondContact O-CD 3.19Å; S276-K280 WeakPolarHBondContact O-CG 3.43Å; S276-K280 PolarHBondContact O-N 3.43Å; K280-G282 VanDerWaalsContact C-N 3.26Å; K280-G282 PolarHBondContact O-N 3.11Å
281	S	91.2	Very high	91.9	Very high	25 Å²	25	59.3 Å²	59.3	18%	0.175	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-26.3	176.2	83	0	0	0	0	113.3	L277 A278 E279 Q283	L277-S281 WeakPolarHBondContact O-CB 3.07Å; L277-S281 PolarHBondContact O-N 2.85Å; A278-S281 WeakPolarHBondContact O-CB 3.03Å; A278-S281 PolarHBondContact O-N 2.81Å; A278-S281 PolarHBondContact O-OG 2.68Å; E279-S281 PolarHBondContact O-N 2.74Å; S281-Q283 VanDerWaalsContact O-CG 3.26Å; S281-Q283 WeakPolarHBondContact O-CG 3.29Å; S281-Q283 PolarHBondContact O-N 3Å; S281-Q283 VanDerWaalsContact O-N 3.12Å; S281-Q283 PolarHBondContact O-NE2 3.2Å; S281-Q283 PolarHBondContact OG-N 2.99Å
282	G	91	Very high	92	Very high	48 Å²	48	53.7 Å²	53.7	50%	0.495	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.7	9.5	-174.2	0	0	0	0	0	115.3	E279 K280	E279-G282 PolarHBondContact O-N 2.96Å; K280-G282 VanDerWaalsContact C-N 3.26Å; K280-G282 PolarHBondContact O-N 3.11Å
283	Q	90.8	Very high	92.1	Very high	75 Å²	75	51.7 Å²	51.7	35%	0.35	28%	0.279	S	S	.	.			trans	-121.2	-24.7	-166	-72.2	170.4	88.5	0	0	114	V238 S281 Y285 R321	V238-Q283 HydrophobicContact CG1-CB 3.95Å; V238-Q283 HydrophobicContact CG2-CB 3.92Å; S281-Q283 VanDerWaalsContact O-CG 3.26Å; S281-Q283 WeakPolarHBondContact O-CG 3.29Å; S281-Q283 PolarHBondContact O-N 3Å; S281-Q283 VanDerWaalsContact O-N 3.12Å; S281-Q283 PolarHBondContact O-NE2 3.2Å; S281-Q283 PolarHBondContact OG-N 2.99Å; Q283-Y285 WeakPolarHBondContact O-CD2 3.5Å; Q283-R321 PolarHBondContact O-NH2 3.07Å
284	I	93.7	Very high	92.1	Very high	7 Å²	7	51.4 Å²	51.4	4%	0.036	28%	0.279	C	S	.	.			trans	-96	139.9	174.5	-47.5	-179.1	0	0	0	108.9	V238 L240 L251 V269 L272 A278 D288 L317 I319	V238-I284 HydrophobicContact CB-CG1 4.27Å; V238-I284 HydrophobicContact CG1-CD1 4.12Å; V238-I284 HydrophobicContact CG1-CG1 3.86Å; V238-I284 HydrophobicContact CG2-CG1 4.37Å; L240-I284 HydrophobicContact CD1-CD1 3.89Å; L240-I284 HydrophobicContact CD2-CD1 3.99Å; L240-I284 HydrophobicContact CG-CD1 4.16Å; L251-I284 HydrophobicContact CD1-CD1 4.41Å; L251-I284 HydrophobicContact CD2-CD1 4.24Å; L251-I284 HydrophobicContact CD2-CG2 3.91Å; V269-I284 HydrophobicContact CB-CG2 4.43Å; V269-I284 HydrophobicContact CG1-CG2 4.17Å; V269-I284 HydrophobicContact CG2-CG2 3.76Å; L272-I284 WeakPolarHBondContact CD1-O 3.38Å; L272-I284 HydrophobicContact CD2-CB 4.41Å; L272-I284 HydrophobicContact CD2-CG2 4.27Å; A278-I284 HydrophobicContact CB-CD1 4.19Å; I284-D288 WeakPolarHBondContact CA-OD2 3.26Å; I284-L317 HydrophobicContact CD1-CD1 3.84Å; I284-I319 HydrophobicContact CB-CD1 4.36Å; I284-I319 HydrophobicContact CD1-CD1 4.29Å; I284-I319 HydrophobicContact CG1-CD1 3.84Å; I284-I319 HydrophobicContact CG2-CD1 4.01Å
285	Y	92.9	Very high	92.2	Very high	125 Å²	125	46.1 Å²	46.1	49%	0.49	26%	0.259	S	S	.	.			trans	-138	149.8	-175.3	-67.7	-112.6	0	0	0	110.1	Q283 G287 D288 R321	Q283-Y285 WeakPolarHBondContact O-CD2 3.5Å; Y285-G287 PolarHBondContact O-N 3.29Å; Y285-D288 PolarHBondContact N-OD2 3.45Å; Y285-D288 VanDerWaalsContact O-CB 3.24Å; Y285-D288 WeakPolarHBondContact O-CB 3.48Å; Y285-D288 PolarHBondContact O-N 2.83Å; Y285-D288 VanDerWaalsContact O-N 3.11Å; Y285-R321 VanDerWaalsContact CE2-NH1 3.34Å
286	N	92.5	Very high	92.5	Very high	96 Å²	96	44 Å²	44	51%	0.513	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.5	131.9	174.6	-59.8	3.7	0	0	0	110.3	G270 L272	G270-N286 WeakPolarHBondContact O-CB 3.37Å; G270-N286 VanDerWaalsContact O-CG 3.27Å; G270-N286 PolarHBondContact O-ND2 2.9Å; L272-N286 WeakPolarHBondContact CD1-OD1 3.26Å; L272-N286 WeakPolarHBondContact CG-OD1 3.31Å; L272-N286 PolarHBondContact N-OD1 3.12Å
287	G	90.8	Very high	92.5	Very high	53 Å²	53	47 Å²	47	55%	0.546	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	98.3	-12.5	-173.3	0	0	0	0	0	115	V269 Y285 Q289	V269-G287 PolarHBondContact O-N 2.64Å; Y285-G287 PolarHBondContact O-N 3.29Å; G287-Q289 PolarHBondContact O-N 3.33Å
288	D	94.9	Very high	92.5	Very high	2 Å²	2	46.5 Å²	46.5	1%	0.011	25%	0.254	C	S	.	.	P	Polyproline II helix	trans	-59	129.3	176.8	-83.4	-16.8	0	0	0	112.4	Y268 V269 I284 Y285 I319 R321	Y268-D288 CarbonylContact C-O 3.53Å; Y268-D288 VanDerWaalsContact CA-O 3.26Å; Y268-D288 WeakPolarHBondContact CA-O 3.35Å; V269-D288 HydrophobicContact CB-CB 4.24Å; V269-D288 HydrophobicContact CG2-CB 3.97Å; V269-D288 PolarHBondContact N-O 2.8Å; I284-D288 WeakPolarHBondContact CA-OD2 3.26Å; Y285-D288 PolarHBondContact N-OD2 3.45Å; Y285-D288 VanDerWaalsContact O-CB 3.24Å; Y285-D288 WeakPolarHBondContact O-CB 3.48Å; Y285-D288 PolarHBondContact O-N 2.83Å; Y285-D288 VanDerWaalsContact O-N 3.11Å; D288-I319 HydrophobicContact CB-CG2 3.63Å; D288-I319 VanDerWaalsContact CG-CG2 3.43Å; D288-R321 VanDerWaalsContact CG-NH2 3.26Å; D288-R321 IonicContact OD1-CZ 2.79Å; D288-R321 VanDerWaalsContact OD1-CZ 3.24Å; D288-R321 IonicContact OD1-NE 3.14Å; D288-R321 PolarHBondContact OD1-NE 2.86Å; D288-R321 IonicContact OD1-NH2 2.73Å; D288-R321 PolarHBondContact OD1-NH2 2.96Å; D288-R321 IonicContact OD2-CZ 2.71Å; D288-R321 IonicContact OD2-NE 2.74Å; D288-R321 IonicContact OD2-NH2 2.7Å; D288-R321 PolarHBondContact OD2-NH2 2.62Å
289	Q	93.5	Very high	92.2	Very high	48 Å²	48	52.2 Å²	52.2	22%	0.224	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	122.8	174.4	-171.4	173.1	-27.6	0	0	110.6	V267 Y268 G287 L291 I319 A320	V267-Q289 CarbonylContact O-C 3.55Å; V267-Q289 WeakPolarHBondContact O-CA 3.49Å; Y268-Q289 HydrophobicContact CD1-CB 3.73Å; Y268-Q289 HydrophobicContact CD1-CG 4.01Å; Y268-Q289 HydrophobicContact CE1-CB 3.55Å; Y268-Q289 HydrophobicContact CE1-CG 3.6Å; Y268-Q289 VanDerWaalsContact CE1-OE1 3.3Å; Y268-Q289 PolarHBondContact OH-OE1 3.03Å; G287-Q289 PolarHBondContact O-N 3.33Å; Q289-L291 HydrophobicContact CG-CD2 4.26Å; Q289-I319 CarbonylContact O-C 3.53Å; Q289-I319 VanDerWaalsContact O-CA 3.31Å; Q289-I319 WeakPolarHBondContact O-CA 2.81Å; Q289-A320 PolarHBondContact N-O 3.13Å; Q289-A320 PolarHBondContact O-N 2.98Å
290	I	94.6	Very high	92	Very high	4 Å²	4	50.5 Å²	50.5	2%	0.021	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	130.8	174.3	-47.3	-179	0	0	0	108.9	L253 V267 V269 I293 I298 L317	L253-I290 HydrophobicContact CD2-CD1 3.72Å; V267-I290 HydrophobicContact CB-CB 4.45Å; V267-I290 HydrophobicContact CG1-CB 4.49Å; V267-I290 HydrophobicContact CG1-CD1 4.23Å; V267-I290 PolarHBondContact O-N 2.98Å; V269-I290 HydrophobicContact CG2-CD1 4.19Å; V269-I290 HydrophobicContact CG2-CG1 4.25Å; I290-I293 HydrophobicContact CG2-CG1 3.96Å; I290-I298 HydrophobicContact CB-CD1 3.97Å; I290-I298 HydrophobicContact CG2-CD1 3.73Å; I290-L317 HydrophobicContact CG2-CD2 4.34Å
291	L	92.5	Very high	91.8	Very high	49 Å²	49	46.9 Å²	46.9	26%	0.257	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	-40.6	-179	-57.5	-176.3	0	0	0	112.7	I235 Q289 I298 L318 A320	I235-L291 HydrophobicContact CD1-CD1 4.44Å; Q289-L291 HydrophobicContact CG-CD2 4.26Å; L291-I298 PolarHBondContact O-N 3.47Å; L291-I298 VanDerWaalsContact O-N 3.09Å; L291-L318 HydrophobicContact CB-CB 4.46Å; L291-L318 HydrophobicContact CB-CD2 4.28Å; L291-L318 HydrophobicContact CB-CG 4.42Å; L291-L318 HydrophobicContact CD1-CD2 4.35Å; L291-L318 HydrophobicContact CD1-CG 4.48Å; L291-L318 PolarHBondContact N-O 3.43Å; L291-A320 HydrophobicContact CD1-CB 4.05Å; L291-A320 HydrophobicContact CD2-CB 4.4Å; L291-A320 HydrophobicContact CG-CB 4.27Å
292	S	94.3	Very high	91.7	Very high	6 Å²	6	49.7 Å²	49.7	4%	0.042	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	153.7	177.3	63.6	0	0	0	0	111.6	N296 L318	S292-N296 CarbonylContact C-O 3.6Å; S292-N296 VanDerWaalsContact CA-O 3.25Å; S292-N296 WeakPolarHBondContact CA-O 3.32Å; S292-N296 WeakPolarHBondContact CB-O 3.34Å; S292-L318 PolarHBondContact O-N 2.7Å; S292-L318 WeakPolarHBondContact OG-CB 3.42Å
293	I	94.6	Very high	91.7	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	124.4	179.7	-57.3	159.2	0	0	0	107.1	I290 G295 N296 I298 V304 L307 F308 V315 C316 L317	I290-I293 HydrophobicContact CG2-CG1 3.96Å; I293-G295 PolarHBondContact O-N 2.97Å; I293-N296 PolarHBondContact N-O 2.93Å; I293-N296 WeakPolarHBondContact O-CB 3.26Å; I293-N296 PolarHBondContact O-N 3.5Å; I293-I298 HydrophobicContact CD1-CD1 3.91Å; I293-I298 HydrophobicContact CD1-CG1 4.03Å; I293-I298 HydrophobicContact CG1-CD1 4.17Å; I293-I298 HydrophobicContact CG1-CG1 4.31Å; I293-V304 HydrophobicContact CD1-CB 4.26Å; I293-V304 HydrophobicContact CD1-CG1 3.79Å; I293-V304 HydrophobicContact CD1-CG2 4.25Å; I293-L307 HydrophobicContact CB-CB 4.03Å; I293-L307 HydrophobicContact CB-CD1 3.99Å; I293-L307 HydrophobicContact CD1-CB 4.42Å; I293-L307 HydrophobicContact CD1-CD1 4.46Å; I293-L307 HydrophobicContact CG2-CB 3.85Å; I293-F308 HydrophobicContact CD1-CD2 3.86Å; I293-F308 HydrophobicContact CD1-CE2 3.52Å; I293-F308 HydrophobicContact CD1-CZ 4.34Å; I293-F308 HydrophobicContact CG1-CE2 4.23Å; I293-V315 HydrophobicContact CG2-CG2 3.61Å; I293-C316 CarbonylContact C-O 3.5Å; I293-C316 WeakPolarHBondContact CA-O 3.44Å; I293-L317 HydrophobicContact CB-CD2 4.31Å; I293-L317 HydrophobicContact CG1-CD2 3.82Å; I293-L317 HydrophobicContact CG2-CD2 4.02Å
294	N	93.7	Very high	91.7	Very high	55 Å²	55	45.9 Å²	45.9	29%	0.294	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.2	36.6	-174.3	-53.5	-37.9	0	0	0	113	N296 L307 V315 C316	N294-N296 PolarHBondContact O-N 2.8Å; N294-L307 PolarHBondContact ND2-O 3.09Å; N294-V315 VanDerWaalsContact OD1-CA 3.3Å; N294-V315 WeakPolarHBondContact OD1-CA 3.24Å; N294-V315 WeakPolarHBondContact OD1-CG2 3.39Å; N294-C316 PolarHBondContact N-O 2.65Å; N294-C316 PolarHBondContact OD1-N 3.09Å
295	G	91.2	Very high	91.5	Very high	27 Å²	27	46.7 Å²	46.7	28%	0.278	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	82.5	-29.2	-173.7	0	0	0	0	0	114.3	I293 R297	I293-G295 PolarHBondContact O-N 2.97Å; G295-R297 PolarHBondContact O-N 2.93Å
296	N	92.5	Very high	91.4	Very high	65 Å²	65	44.3 Å²	44.3	35%	0.348	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	121.9	-177.1	-62.6	-24	0	0	0	111.1	S292 I293 N294 L307	S292-N296 CarbonylContact C-O 3.6Å; S292-N296 VanDerWaalsContact CA-O 3.25Å; S292-N296 WeakPolarHBondContact CA-O 3.32Å; S292-N296 WeakPolarHBondContact CB-O 3.34Å; I293-N296 PolarHBondContact N-O 2.93Å; I293-N296 WeakPolarHBondContact O-CB 3.26Å; I293-N296 PolarHBondContact O-N 3.5Å; N294-N296 PolarHBondContact O-N 2.8Å; N296-L307 HydrophobicContact CB-CD1 3.94Å; N296-L307 HydrophobicContact CB-CD2 3.72Å; N296-L307 WeakPolarHBondContact ND2-CD2 3.49Å
297	R	91.5	Very high	91.4	Very high	74 Å²	74	39.8 Å²	39.8	28%	0.279	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.9	137.6	177.9	-172.6	-169.5	161.4	-176.5	-1	110.8	G295 K299 H303	G295-R297 PolarHBondContact O-N 2.93Å; R297-K299 PolarHBondContact O-N 3.04Å; R297-H303 PolarHBondContact O-CE1 2.78Å; R297-H303 PolarHBondContact O-ND1 2.91Å
298	I	90.8	Very high	91.4	Very high	8 Å²	8	38.7 Å²	38.7	4%	0.041	19%	0.194	C	C	.	.	P	Polyproline II helix	trans	-62.9	131.4	172.7	-68.4	172.7	0	0	0	110.2	C265 V267 I290 L291 I293 V304	C265-I298 WeakPolarHBondContact O-CG2 3.46Å; V267-I298 HydrophobicContact CB-CD1 4.15Å; V267-I298 HydrophobicContact CG2-CD1 4.05Å; V267-I298 HydrophobicContact CG2-CG2 4.11Å; I290-I298 HydrophobicContact CB-CD1 3.97Å; I290-I298 HydrophobicContact CG2-CD1 3.73Å; L291-I298 PolarHBondContact O-N 3.47Å; L291-I298 VanDerWaalsContact O-N 3.09Å; I293-I298 HydrophobicContact CD1-CD1 3.91Å; I293-I298 HydrophobicContact CD1-CG1 4.03Å; I293-I298 HydrophobicContact CG1-CD1 4.17Å; I293-I298 HydrophobicContact CG1-CG1 4.31Å; I298-V304 HydrophobicContact CB-CG2 4.23Å; I298-V304 HydrophobicContact CD1-CG2 3.93Å; I298-V304 HydrophobicContact CG1-CG2 3.79Å; I298-V304 HydrophobicContact CG2-CG2 3.54Å
299	K	87.4	Confident	91.1	Very high	120 Å²	120	44.5 Å²	44.5	52%	0.522	22%	0.221	S	C	.	.			trans	-119.6	-57.6	-176.4	-66.3	172.8	-173	178.9	0	109.9	E216 R297	E216-K299 IonicContact OE2-NZ 3.94Å; E216-K299 PolarHBondContact OE2-NZ 3.2Å; R297-K299 PolarHBondContact O-N 3.04Å
300	S	87.4	Confident	90.8	Very high	43 Å²	43	48.3 Å²	48.3	30%	0.301	24%	0.239	S	C	.	.	S	Bend	trans	-128.1	173.8	171.5	68.1	0	0	0	0	112.3	E302 H303 V304	S300-E302 VanDerWaalsContact C-N 3.28Å; S300-E302 WeakPolarHBondContact CB-OE2 3.19Å; S300-E302 PolarHBondContact OG-N 3.35Å; S300-E302 PolarHBondContact OG-OE2 2.69Å; S300-H303 PolarHBondContact O-N 3.18Å; S300-H303 PolarHBondContact OG-N 2.84Å; S300-H303 VanDerWaalsContact OG-N 3.11Å; S300-V304 WeakPolarHBondContact O-CG2 3.21Å; S300-V304 PolarHBondContact O-N 3.48Å
301	R	87.2	Confident	90.4	Very high	54 Å²	54	48.5 Å²	48.5	20%	0.204	24%	0.24	C	C	.	.	H	α-helix	trans	-60.4	-39.7	170.8	172.6	-176	67.5	162.6	6.1	111.4	E35 S68 Y255 V304 I305	E35-R301 IonicContact OE1-CZ 3.41Å; E35-R301 IonicContact OE1-NH1 3.7Å; E35-R301 PolarHBondContact OE1-NH1 3.23Å; E35-R301 IonicContact OE1-NH2 3.99Å; S68-R301 VanDerWaalsContact OG-CD 3.29Å; S68-R301 WeakPolarHBondContact OG-CD 3.13Å; S68-R301 PolarHBondContact OG-NH1 2.83Å; Y255-R301 HydrophobicContact CD1-CB 3.9Å; Y255-R301 HydrophobicContact CD1-CG 3.76Å; Y255-R301 HydrophobicContact CD2-CG 4.43Å; Y255-R301 HydrophobicContact CE1-CB 4.06Å; Y255-R301 HydrophobicContact CE1-CG 3.72Å; Y255-R301 HydrophobicContact CE2-CG 4.4Å; Y255-R301 HydrophobicContact CG-CG 4.13Å; R301-V304 WeakPolarHBondContact O-CB 3.19Å; R301-V304 PolarHBondContact O-N 2.88Å; R301-I305 HydrophobicContact CG-CD1 4.12Å; R301-I305 WeakPolarHBondContact O-CD1 3.33Å; R301-I305 WeakPolarHBondContact O-CG1 3.3Å; R301-I305 PolarHBondContact O-N 3.08Å; R301-I305 VanDerWaalsContact O-N 3.17Å
302	E	88.7	Confident	89.9	Confident	85 Å²	85	53 Å²	53	40%	0.397	26%	0.26	S	S	.	.	H	α-helix	trans	-65.4	-44.6	179.6	-63.7	64.5	-142.9	0	0	110	S300 V304 I305 D306	S300-E302 VanDerWaalsContact C-N 3.28Å; S300-E302 WeakPolarHBondContact CB-OE2 3.19Å; S300-E302 PolarHBondContact OG-N 3.35Å; S300-E302 PolarHBondContact OG-OE2 2.69Å; E302-V304 VanDerWaalsContact C-N 3.26Å; E302-V304 PolarHBondContact O-N 2.78Å; E302-I305 WeakPolarHBondContact O-CB 3.27Å; E302-I305 PolarHBondContact O-N 2.91Å; E302-I305 VanDerWaalsContact O-N 3.11Å; E302-D306 VanDerWaalsContact O-CG 3.31Å; E302-D306 PolarHBondContact O-N 3.12Å
303	H	90.1	Very high	89.5	Confident	42 Å²	42	57.4 Å²	57.4	19%	0.194	28%	0.283	C	S	.	.	H	α-helix	trans	-59	-35	174	-171.1	-148.6	0	0	0	112.5	R297 S300 L307	R297-H303 PolarHBondContact O-CE1 2.78Å; R297-H303 PolarHBondContact O-ND1 2.91Å; S300-H303 PolarHBondContact O-N 3.18Å; S300-H303 PolarHBondContact OG-N 2.84Å; S300-H303 VanDerWaalsContact OG-N 3.11Å; H303-L307 WeakPolarHBondContact O-CB 3.29Å; H303-L307 WeakPolarHBondContact O-CD1 3.36Å; H303-L307 WeakPolarHBondContact O-CG 3.08Å; H303-L307 PolarHBondContact O-N 3.43Å
304	V	91.2	Very high	89.3	Confident	0 Å²	0	63 Å²	63	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-65.3	-45.6	175.8	171.7	0	0	0	0	111	L253 Y255 V267 I293 I298 S300 R301 E302 L307 F308	L253-V304 HydrophobicContact CD1-CG1 4.02Å; Y255-V304 HydrophobicContact CE1-CB 4.04Å; Y255-V304 HydrophobicContact CE1-CG1 3.93Å; Y255-V304 HydrophobicContact CE1-CG2 4.25Å; Y255-V304 WeakPolarHBondContact OH-CG1 3.34Å; V267-V304 HydrophobicContact CG2-CG2 3.8Å; I293-V304 HydrophobicContact CD1-CB 4.26Å; I293-V304 HydrophobicContact CD1-CG1 3.79Å; I293-V304 HydrophobicContact CD1-CG2 4.25Å; I298-V304 HydrophobicContact CB-CG2 4.23Å; I298-V304 HydrophobicContact CD1-CG2 3.93Å; I298-V304 HydrophobicContact CG1-CG2 3.79Å; I298-V304 HydrophobicContact CG2-CG2 3.54Å; S300-V304 WeakPolarHBondContact O-CG2 3.21Å; S300-V304 PolarHBondContact O-N 3.48Å; R301-V304 WeakPolarHBondContact O-CB 3.19Å; R301-V304 PolarHBondContact O-N 2.88Å; E302-V304 VanDerWaalsContact C-N 3.26Å; E302-V304 PolarHBondContact O-N 2.78Å; V304-L307 PolarHBondContact O-N 3.15Å; V304-F308 HydrophobicContact CG1-CD2 3.91Å; V304-F308 HydrophobicContact CG1-CE2 4.04Å; V304-F308 WeakPolarHBondContact O-CD2 3.04Å; V304-F308 PolarHBondContact O-N 3.26Å
305	I	89.6	Confident	89.3	Confident	25 Å²	25	60.3 Å²	60.3	13%	0.128	29%	0.293	C	S	.	.	H	α-helix	trans	-61.6	-46.9	177.5	-66	156.2	0	0	0	110.1	P31 I33 R301 E302 L307 F308 Q309	P31-I305 HydrophobicContact CG-CG2 4.08Å; I33-I305 HydrophobicContact CD1-CD1 3.71Å; I33-I305 HydrophobicContact CD1-CG1 4.46Å; I33-I305 HydrophobicContact CD1-CG2 4.31Å; I33-I305 HydrophobicContact CG1-CD1 4.06Å; R301-I305 HydrophobicContact CG-CD1 4.12Å; R301-I305 WeakPolarHBondContact O-CD1 3.33Å; R301-I305 WeakPolarHBondContact O-CG1 3.3Å; R301-I305 PolarHBondContact O-N 3.08Å; R301-I305 VanDerWaalsContact O-N 3.17Å; E302-I305 WeakPolarHBondContact O-CB 3.27Å; E302-I305 PolarHBondContact O-N 2.91Å; E302-I305 VanDerWaalsContact O-N 3.11Å; I305-L307 PolarHBondContact O-N 3.3Å; I305-F308 PolarHBondContact O-N 2.77Å; I305-Q309 WeakPolarHBondContact O-CB 3.3Å; I305-Q309 PolarHBondContact O-N 2.96Å
306	D	90.2	Very high	89.5	Confident	74 Å²	74	59.8 Å²	59.8	40%	0.396	29%	0.285	S	S	.	.	H	α-helix	trans	-59	-45.2	177.7	-66.4	-29.2	0	0	0	111.8	E302 Q309 Q310	E302-D306 VanDerWaalsContact O-CG 3.31Å; E302-D306 PolarHBondContact O-N 3.12Å; D306-Q309 PolarHBondContact O-N 3.13Å; D306-Q310 WeakPolarHBondContact O-CB 3.26Å; D306-Q310 WeakPolarHBondContact O-CG 3.23Å; D306-Q310 PolarHBondContact O-N 3.05Å; D306-Q310 PolarHBondContact O-NE2 3.41Å; D306-Q310 VanDerWaalsContact O-NE2 3.15Å
307	L	92.6	Very high	89.7	Confident	1 Å²	1	56.7 Å²	56.7	1%	0.005	27%	0.268	C	S	.	.	H	α-helix	trans	-65.8	-39.3	179.8	-70.7	170.2	0	0	0	112.4	I293 N294 N296 H303 V304 I305 S311	I293-L307 HydrophobicContact CB-CB 4.03Å; I293-L307 HydrophobicContact CB-CD1 3.99Å; I293-L307 HydrophobicContact CD1-CB 4.42Å; I293-L307 HydrophobicContact CD1-CD1 4.46Å; I293-L307 HydrophobicContact CG2-CB 3.85Å; N294-L307 PolarHBondContact ND2-O 3.09Å; N296-L307 HydrophobicContact CB-CD1 3.94Å; N296-L307 HydrophobicContact CB-CD2 3.72Å; N296-L307 WeakPolarHBondContact ND2-CD2 3.49Å; H303-L307 WeakPolarHBondContact O-CB 3.29Å; H303-L307 WeakPolarHBondContact O-CD1 3.36Å; H303-L307 WeakPolarHBondContact O-CG 3.08Å; H303-L307 PolarHBondContact O-N 3.43Å; V304-L307 PolarHBondContact O-N 3.15Å; I305-L307 PolarHBondContact O-N 3.3Å; L307-S311 PolarHBondContact O-N 3.17Å; L307-S311 PolarHBondContact O-OG 2.94Å
308	F	91.1	Very high	89.9	Confident	31 Å²	31	54.1 Å²	54.1	14%	0.136	26%	0.26	C	S	.	.	H	α-helix	trans	-68.9	-37.5	174.1	-88.2	-70.4	0	0	0	112.5	F249 L251 L253 I293 V304 I305 Q310 S311 V315 L317	F249-F308 AromaticContact CD2-CD1 3.96Å; F249-F308 HydrophobicContact CD2-CD1 3.96Å; F249-F308 HydrophobicContact CD2-CE1 4.16Å; F249-F308 HydrophobicContact CE2-CD1 4.06Å; L251-F308 HydrophobicContact CD1-CE1 4.49Å; L251-F308 HydrophobicContact CD1-CZ 4.43Å; L253-F308 HydrophobicContact CD1-CD2 4Å; L253-F308 HydrophobicContact CD1-CE2 3.51Å; L253-F308 HydrophobicContact CD1-CZ 4.2Å; I293-F308 HydrophobicContact CD1-CD2 3.86Å; I293-F308 HydrophobicContact CD1-CE2 3.52Å; I293-F308 HydrophobicContact CD1-CZ 4.34Å; I293-F308 HydrophobicContact CG1-CE2 4.23Å; V304-F308 HydrophobicContact CG1-CD2 3.91Å; V304-F308 HydrophobicContact CG1-CE2 4.04Å; V304-F308 WeakPolarHBondContact O-CD2 3.04Å; V304-F308 PolarHBondContact O-N 3.26Å; I305-F308 PolarHBondContact O-N 2.77Å; F308-Q310 VanDerWaalsContact C-N 3.32Å; F308-Q310 PolarHBondContact O-N 2.75Å; F308-S311 WeakPolarHBondContact CA-OG 3.17Å; F308-S311 PolarHBondContact O-N 2.82Å; F308-S311 PolarHBondContact O-OG 2.61Å; F308-V315 HydrophobicContact CD1-CG2 4.18Å; F308-V315 HydrophobicContact CE1-CG1 4.39Å; F308-V315 HydrophobicContact CE1-CG2 3.93Å; F308-L317 HydrophobicContact CE1-CD2 4.14Å; F308-L317 HydrophobicContact CZ-CD2 3.71Å
309	Q	87.6	Confident	90.1	Very high	123 Å²	123	53.9 Å²	53.9	58%	0.575	26%	0.258	S	S	*	.	H	α-helix	trans	-69.3	-29.1	177	-168.9	172.7	56.9	0	0	112.6	I305 D306	I305-Q309 WeakPolarHBondContact O-CB 3.3Å; I305-Q309 PolarHBondContact O-N 2.96Å; D306-Q309 PolarHBondContact O-N 3.13Å
310	Q	87.3	Confident	90.4	Very high	129 Å²	129	48.9 Å²	48.9	60%	0.603	24%	0.24	S	C	*	.	H	α-helix	trans	-71.8	-32.4	172.2	-71.7	164.1	48.5	0	0	112.7	D306 F308 Q312	D306-Q310 WeakPolarHBondContact O-CB 3.26Å; D306-Q310 WeakPolarHBondContact O-CG 3.23Å; D306-Q310 PolarHBondContact O-N 3.05Å; D306-Q310 PolarHBondContact O-NE2 3.41Å; D306-Q310 VanDerWaalsContact O-NE2 3.15Å; F308-Q310 VanDerWaalsContact C-N 3.32Å; F308-Q310 PolarHBondContact O-N 2.75Å; Q310-Q312 PolarHBondContact O-N 3.11Å
311	S	86.5	Confident	90.5	Very high	7 Å²	7	50.9 Å²	50.9	5%	0.049	24%	0.241	C	C	.	.			trans	-78.1	78.1	177.6	45.5	0	0	0	0	114.1	L307 F308 K314	L307-S311 PolarHBondContact O-N 3.17Å; L307-S311 PolarHBondContact O-OG 2.94Å; F308-S311 WeakPolarHBondContact CA-OG 3.17Å; F308-S311 PolarHBondContact O-N 2.82Å; F308-S311 PolarHBondContact O-OG 2.61Å; S311-K314 WeakPolarHBondContact CB-O 3.03Å
312	Q	81.6	Confident	90.3	Very high	143 Å²	143	55.1 Å²	55.1	67%	0.668	26%	0.263	S	S	*	.	S	Bend	trans	-68.7	-32.5	-179	-66.8	-173.6	-9	0	0	115.4	R242 Q310	R242-Q312 WeakPolarHBondContact CD-O 3.25Å; Q310-Q312 PolarHBondContact O-N 3.11Å
313	L	86.6	Confident	89.5	Confident	99 Å²	99	54.8 Å²	54.8	52%	0.518	26%	0.26	S	S	.	.	S	Bend	trans	-130.3	-26.8	-174.5	-68.9	176.8	0	0	0	114.3	C241 R242	C241-L313 CarbonylContact C-O 3.59Å; C241-L313 WeakPolarHBondContact CA-O 3.43Å; R242-L313 PolarHBondContact N-O 2.97Å
314	K	91.2	Very high	88.1	Confident	117 Å²	117	60 Å²	60	51%	0.509	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	135.4	-179.2	170.9	173.1	166.2	169.8	0	109.1	T239 L240 S311 C316	T239-K314 HydrophobicContact CG2-CD 3.97Å; T239-K314 HydrophobicContact CG2-CG 3.89Å; L240-K314 WeakPolarHBondContact O-CA 3.2Å; S311-K314 WeakPolarHBondContact CB-O 3.03Å; K314-C316 WeakPolarHBondContact CE-SG 3.32Å
315	V	93.7	Very high	86.1	Confident	0 Å²	0	63.1 Å²	63.1	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	136.8	169.6	68	0	0	0	0	110.1	T239 L240 F249 I293 N294 F308 L317	T239-V315 WeakPolarHBondContact CA-O 3.21Å; L240-V315 HydrophobicContact CB-CG1 3.89Å; L240-V315 HydrophobicContact CD1-CG1 4.32Å; L240-V315 HydrophobicContact CG-CG1 4.33Å; L240-V315 PolarHBondContact N-O 2.87Å; L240-V315 PolarHBondContact O-N 2.92Å; F249-V315 HydrophobicContact CD1-CG1 3.87Å; F249-V315 HydrophobicContact CD2-CG1 4.25Å; F249-V315 HydrophobicContact CE1-CB 4.21Å; F249-V315 HydrophobicContact CE1-CG1 3.48Å; F249-V315 VanDerWaalsContact CE1-CG1 3.48Å; F249-V315 HydrophobicContact CE2-CB 4.19Å; F249-V315 HydrophobicContact CE2-CG1 3.9Å; F249-V315 HydrophobicContact CG-CG1 4.25Å; F249-V315 HydrophobicContact CZ-CB 3.79Å; F249-V315 HydrophobicContact CZ-CG1 3.51Å; I293-V315 HydrophobicContact CG2-CG2 3.61Å; N294-V315 VanDerWaalsContact OD1-CA 3.3Å; N294-V315 WeakPolarHBondContact OD1-CA 3.24Å; N294-V315 WeakPolarHBondContact OD1-CG2 3.39Å; F308-V315 HydrophobicContact CD1-CG2 4.18Å; F308-V315 HydrophobicContact CE1-CG1 4.39Å; F308-V315 HydrophobicContact CE1-CG2 3.93Å; V315-L317 HydrophobicContact CG2-CD2 3.81Å; V315-L317 HydrophobicContact CG2-CG 4.35Å
316	C	94.6	Very high	84.3	Confident	16 Å²	16	70 Å²	70	11%	0.108	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	121.2	175.8	-62.3	0	0	0	0	109.2	T239 I293 N294 K314	T239-C316 PolarHBondContact OG1-SG 3.01Å; I293-C316 CarbonylContact C-O 3.5Å; I293-C316 WeakPolarHBondContact CA-O 3.44Å; N294-C316 PolarHBondContact N-O 2.65Å; N294-C316 PolarHBondContact OD1-N 3.09Å; K314-C316 WeakPolarHBondContact CE-SG 3.32Å
317	L	95.8	Very high	82	Confident	0 Å²	0	73.9 Å²	73.9	0%	0	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	122.4	-174.8	-57.7	176.6	0	0	0	109.5	E237 V238 L240 L251 I284 I290 I293 F308 V315 I319	E237-L317 CarbonylContact C-O 3.55Å; E237-L317 WeakPolarHBondContact CA-O 3.32Å; V238-L317 PolarHBondContact N-O 3.47Å; V238-L317 PolarHBondContact O-N 2.83Å; L240-L317 HydrophobicContact CD1-CD1 4.46Å; L251-L317 HydrophobicContact CD1-CD1 3.77Å; I284-L317 HydrophobicContact CD1-CD1 3.84Å; I290-L317 HydrophobicContact CG2-CD2 4.34Å; I293-L317 HydrophobicContact CB-CD2 4.31Å; I293-L317 HydrophobicContact CG1-CD2 3.82Å; I293-L317 HydrophobicContact CG2-CD2 4.02Å; F308-L317 HydrophobicContact CE1-CD2 4.14Å; F308-L317 HydrophobicContact CZ-CD2 3.71Å; V315-L317 HydrophobicContact CG2-CD2 3.81Å; V315-L317 HydrophobicContact CG2-CG 4.35Å; L317-I319 HydrophobicContact CB-CD1 4.34Å; L317-I319 HydrophobicContact CB-CG1 4.37Å
318	L	95.9	Very high	79.6	Confident	20 Å²	20	77.9 Å²	77.9	11%	0.105	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	117.7	167.6	-170.3	67.6	0	0	0	108.7	I212 F214 I235 E237 L291 S292	I212-L318 HydrophobicContact CD1-CD1 4.49Å; F214-L318 HydrophobicContact CE2-CD2 4.31Å; F214-L318 HydrophobicContact CZ-CD2 4.33Å; I235-L318 HydrophobicContact CG2-CD1 3.66Å; I235-L318 HydrophobicContact CG2-CD2 4.4Å; I235-L318 HydrophobicContact CG2-CG 3.97Å; E237-L318 HydrophobicContact CB-CD1 4.24Å; L291-L318 HydrophobicContact CB-CB 4.46Å; L291-L318 HydrophobicContact CB-CD2 4.28Å; L291-L318 HydrophobicContact CB-CG 4.42Å; L291-L318 HydrophobicContact CD1-CD2 4.35Å; L291-L318 HydrophobicContact CD1-CG 4.48Å; L291-L318 PolarHBondContact N-O 3.43Å; S292-L318 PolarHBondContact O-N 2.7Å; S292-L318 WeakPolarHBondContact OG-CB 3.42Å
319	I	95	Very high	77.1	Confident	2 Å²	2	80.6 Å²	80.6	1%	0.01	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	140.2	-173.3	-74.8	166.5	0	0	0	110	I235 K236 V238 I284 D288 Q289 L317	I235-I319 CarbonylContact C-O 3.59Å; I235-I319 VanDerWaalsContact CA-O 3.29Å; I235-I319 WeakPolarHBondContact CA-O 3.4Å; K236-I319 PolarHBondContact N-O 3.11Å; K236-I319 PolarHBondContact O-N 3.17Å; V238-I319 HydrophobicContact CB-CD1 4.44Å; V238-I319 HydrophobicContact CG2-CD1 4.09Å; I284-I319 HydrophobicContact CB-CD1 4.36Å; I284-I319 HydrophobicContact CD1-CD1 4.29Å; I284-I319 HydrophobicContact CG1-CD1 3.84Å; I284-I319 HydrophobicContact CG2-CD1 4.01Å; D288-I319 HydrophobicContact CB-CG2 3.63Å; D288-I319 VanDerWaalsContact CG-CG2 3.43Å; Q289-I319 CarbonylContact O-C 3.53Å; Q289-I319 VanDerWaalsContact O-CA 3.31Å; Q289-I319 WeakPolarHBondContact O-CA 2.81Å; L317-I319 HydrophobicContact CB-CD1 4.34Å; L317-I319 HydrophobicContact CB-CG1 4.37Å
320	A	93.6	Very high	74.8	Confident	16 Å²	16	82.3 Å²	82.3	13%	0.132	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	137.3	164.6	0	0	0	0	0	111	I233 L234 I235 Q289 L291	I233-A320 HydrophobicContact CG2-CB 4.34Å; L234-A320 CarbonylContact O-C 3.58Å; L234-A320 WeakPolarHBondContact O-CA 3.02Å; I235-A320 HydrophobicContact CG1-CB 4.29Å; Q289-A320 PolarHBondContact N-O 3.13Å; Q289-A320 PolarHBondContact O-N 2.98Å; L291-A320 HydrophobicContact CD1-CB 4.05Å; L291-A320 HydrophobicContact CD2-CB 4.4Å; L291-A320 HydrophobicContact CG-CB 4.27Å
321	R	90.4	Very high	72.6	Confident	84 Å²	84	83.3 Å²	83.3	32%	0.317	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	138.8	177.4	-173.3	-176.4	-57.5	152.3	18.9	110.1	L234 Q283 Y285 D288	L234-R321 PolarHBondContact N-O 3.23Å; L234-R321 PolarHBondContact O-N 3.46Å; Q283-R321 PolarHBondContact O-NH2 3.07Å; Y285-R321 VanDerWaalsContact CE2-NH1 3.34Å; D288-R321 VanDerWaalsContact CG-NH2 3.26Å; D288-R321 IonicContact OD1-CZ 2.79Å; D288-R321 VanDerWaalsContact OD1-CZ 3.24Å; D288-R321 IonicContact OD1-NE 3.14Å; D288-R321 PolarHBondContact OD1-NE 2.86Å; D288-R321 IonicContact OD1-NH2 2.73Å; D288-R321 PolarHBondContact OD1-NH2 2.96Å; D288-R321 IonicContact OD2-CZ 2.71Å; D288-R321 IonicContact OD2-NE 2.74Å; D288-R321 IonicContact OD2-NH2 2.7Å; D288-R321 PolarHBondContact OD2-NH2 2.62Å
322	E	83	Confident	70.3	Confident	143 Å²	143	90.1 Å²	90.1	67%	0.668	45%	0.445	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.8	129.6	171.3	-164.1	169	-159.8	0	0	110.6	N232 I324	N232-E322 CarbonylContact O-C 3.56Å; N232-E322 WeakPolarHBondContact O-CA 3.28Å; N232-E322 WeakPolarHBondContact O-CG 3.5Å; E322-I324 PolarHBondContact O-N 3.06Å
323	K	70.8	Confident	68.1	Low	79 Å²	79	88 Å²	88	34%	0.343	44%	0.438	S	S	.	.			trans	-72.4	114.9	171.1	-74	161	170.6	-175.7	0	108.4	E231 N232 L234 N325	E231-K323 WeakPolarHBondContact O-CD 3.4Å; E231-K323 WeakPolarHBondContact O-CE 3.34Å; E231-K323 PolarHBondContact O-NZ 3.27Å; N232-K323 PolarHBondContact O-N 2.74Å; L234-K323 HydrophobicContact CB-CG 4.36Å; L234-K323 HydrophobicContact CD1-CG 3.65Å; L234-K323 HydrophobicContact CG-CD 4.1Å; L234-K323 HydrophobicContact CG-CG 3.55Å; K323-N325 PolarHBondContact O-N 3.49Å
324	I	61.3	Low	65.5	Low	150 Å²	150	89.9 Å²	89.9	77%	0.769	45%	0.446	S	S	*	.			trans	-69	99.5	165.6	-56.2	170	0	0	0	107.3	E322 K326	E322-I324 PolarHBondContact O-N 3.06Å; I324-K326 PolarHBondContact O-N 2.81Å; I324-K326 VanDerWaalsContact O-N 3.08Å
325	N	50.1	Low	62.9	Low	66 Å²	66	91.8 Å²	91.8	35%	0.353	46%	0.462	S	S	.	.			trans	-65.3	107.9	178.6	-78.2	-16.9	0	0	0	110.1	N232 K323 N327 D328	N232-N325 PolarHBondContact OD1-ND2 2.98Å; K323-N325 PolarHBondContact O-N 3.49Å; N325-N327 PolarHBondContact O-N 3.32Å; N325-D328 PolarHBondContact O-N 3.42Å
326	K	50.7	Low	60.4	Low	171 Å²	171	101.3 Å²	101.3	74%	0.743	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.8	17.5	-178.4	-62.9	-175.8	178.7	178.5	0	114.5	I324 N329	I324-K326 PolarHBondContact O-N 2.81Å; I324-K326 VanDerWaalsContact O-N 3.08Å; K326-N329 PolarHBondContact O-ND2 2.84Å; K326-N329 PolarHBondContact O-OD1 3.27Å
327	N	42.5	Very low	57.5	Low	155 Å²	155	105.5 Å²	105.5	83%	0.829	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106	-12.7	176.1	-74.8	2.5	0	0	0	113	N325 N329	N325-N327 PolarHBondContact O-N 3.32Å; N327-N329 PolarHBondContact O-N 3.36Å
328	D	41.4	Very low	54.8	Low	84 Å²	84	111.4 Å²	111.4	45%	0.449	56%	0.555	S	S	.	*			trans	-77.2	27.7	172.4	-71	-49.1	0	0	0	113.5	N325 N330 N331 Q332	N325-D328 PolarHBondContact O-N 3.42Å; D328-N330 PolarHBondContact O-N 2.69Å; D328-N331 PolarHBondContact O-N 3.38Å; D328-Q332 PolarHBondContact O-N 2.74Å
329	N	39.2	Very low	51.7	Low	89 Å²	89	118.4 Å²	118.4	48%	0.476	59%	0.589	S	S	.	*	T	Hydrogen-bonded Turn	trans	-64.3	-10.2	-174.8	-69.4	-28.1	0	0	0	114.2	K326 N327 L333	K326-N329 PolarHBondContact O-ND2 2.84Å; K326-N329 PolarHBondContact O-OD1 3.27Å; N327-N329 PolarHBondContact O-N 3.36Å; N329-L333 VanDerWaalsContact O-CB 3.29Å; N329-L333 WeakPolarHBondContact O-CB 3.04Å
330	N	40.1	Very low	48.8	Very low	158 Å²	158	123.2 Å²	123.2	85%	0.845	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.1	-9.6	176.1	-70.5	-0.4	0	0	0	114.1	D328	D328-N330 PolarHBondContact O-N 2.69Å
331	N	40.9	Very low	45.8	Very low	151 Å²	151	127.6 Å²	127.6	81%	0.807	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-135.3	-12.6	-176.3	-89.7	-35.6	0	0	0	116.4	D328	D328-N331 PolarHBondContact O-N 3.38Å
332	Q	38.3	Very low	43	Very low	150 Å²	150	128.8 Å²	128.8	70%	0.701	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.3	-6.1	165.9	-68.3	-160.9	18.7	0	0	114.1	D328 M334	D328-Q332 PolarHBondContact O-N 2.74Å; Q332-M334 PolarHBondContact O-N 3.46Å
333	L	34.7	Very low	40.5	Very low	97 Å²	97	129.3 Å²	129.3	51%	0.508	66%	0.659	S	S	.	*	T	Hydrogen-bonded Turn	trans	-78	29.3	179.9	-152	79.5	0	0	0	114.2	N329 N337	N329-L333 VanDerWaalsContact O-CB 3.29Å; N329-L333 WeakPolarHBondContact O-CB 3.04Å; L333-N337 PolarHBondContact O-ND2 2.78Å
334	M	31.2	Very low	38.6	Very low	139 Å²	139	134.6 Å²	134.6	69%	0.685	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-122.9	4.3	180	-139	169.6	-164.9	0	0	114.8	Q332 L482	Q332-M334 PolarHBondContact O-N 3.46Å; M334-L482 HydrophobicContact CE-CD1 4.24Å; M334-L482 HydrophobicContact SD-CD1 4.31Å
335	N	38.5	Very low	37.1	Very low	158 Å²	158	133 Å²	133	85%	0.845	68%	0.684	S	S	*	*	S	Bend	trans	-117.4	2.8	171	-83.9	-58.7	0	0	0	114.4
336	K	39.8	Very low	36.2	Very low	200 Å²	200	137.8 Å²	137.8	87%	0.87	71%	0.707	S	S	*	*	S	Bend	trans	-138.1	32.8	169.9	-76.2	-166	176.1	176.6	0	114.2
337	N	34.7	Very low	35.2	Very low	104 Å²	104	139.7 Å²	139.7	56%	0.556	72%	0.715	S	S	*	*			trans	-104.4	146	149.7	-73.4	-45.9	0	0	0	106.6	L333	L333-N337 PolarHBondContact O-ND2 2.78Å
338	L	38.6	Very low	34.6	Very low	124 Å²	124	139 Å²	139	65%	0.649	71%	0.71	S	S	*	*			cis	-138.4	107.2	13.4	-179.7	67.2	0	0	0	110.6	N341	L338-N341 HydrophobicContact CD2-CB 4.01Å; L338-N341 HydrophobicContact CG-CB 4.41Å
339	M	31.7	Very low	34.1	Very low	166 Å²	166	142.2 Å²	142.2	82%	0.818	73%	0.726	S	S	*	*	S	Bend	trans	-101.2	145.2	156.7	-155.9	174.5	91	0	0	107.7
340	I	32.7	Very low	33.5	Very low	104 Å²	104	145.8 Å²	145.8	53%	0.533	74%	0.744	S	S	.	*			trans	69.9	63	176.1	-40	-178.4	0	0	0	114.4	T342	I340-T342 WeakPolarHBondContact CG2-OG1 3.32Å; I340-T342 PolarHBondContact O-N 3.46Å; I340-T342 VanDerWaalsContact O-N 3.08Å
341	N	30.2	Very low	33	Very low	107 Å²	107	145.3 Å²	145.3	57%	0.572	74%	0.742	S	S	*	*			trans	-80.6	51.6	157.2	-151.2	2.6	0	0	0	111	L338	L338-N341 HydrophobicContact CD2-CB 4.01Å; L338-N341 HydrophobicContact CG-CB 4.41Å
342	T	32.5	Very low	32.6	Very low	110 Å²	110	147.8 Å²	147.8	68%	0.675	75%	0.749	S	S	*	*			trans	-126	41.1	-177	69.3	0	0	0	0	112.5	I340	I340-T342 WeakPolarHBondContact CG2-OG1 3.32Å; I340-T342 PolarHBondContact O-N 3.46Å; I340-T342 VanDerWaalsContact O-N 3.08Å
343	N	30.3	Very low	32.1	Very low	153 Å²	153	145.2 Å²	145.2	82%	0.818	75%	0.747	S	S	*	*	S	Bend	trans	-131.9	20.5	175.5	-87.3	-52.6	0	0	0	113.6
344	K	32	Very low	31.7	Very low	190 Å²	190	144.7 Å²	144.7	83%	0.826	75%	0.745	S	S	*	*	S	Bend	trans	-121.4	21.6	-177	-144.3	176.4	-178.9	-176.3	0	115.3
345	S	28.3	Very low	31.5	Very low	116 Å²	116	143.2 Å²	143.2	81%	0.811	73%	0.733	S	S	*	*	S	Bend	trans	-151.5	67.1	171.3	-80.1	0	0	0	0	113.8
346	M	31.6	Very low	31.1	Very low	167 Å²	167	139.6 Å²	139.6	82%	0.823	71%	0.713	S	S	*	*			trans	-151.6	45	158.1	-96.6	-52.2	-84.1	0	0	111.5
347	K	29.5	Very low	30.6	Very low	211 Å²	211	134.5 Å²	134.5	92%	0.917	69%	0.694	S	S	*	*			trans	-109.8	33.4	171.4	-98.9	-167.3	176	-174.3	0	112.7
348	I	31.1	Very low	30.3	Very low	140 Å²	140	136.1 Å²	136.1	72%	0.718	70%	0.698	S	S	*	*	S	Bend	trans	-133.5	150.2	168	-49.4	-179	0	0	0	107
349	I	29.6	Very low	29.8	Very low	153 Å²	153	135.9 Å²	135.9	79%	0.785	70%	0.698	S	S	*	*			trans	64.9	70.7	-176.4	-37.7	-177.2	0	0	0	113.8
350	N	26.8	Very low	29.7	Very low	163 Å²	163	132 Å²	132	87%	0.872	69%	0.687	S	S	*	*			trans	-127.5	68.2	154.4	-157.4	4	0	0	0	108.7
351	N	28.9	Very low	29.4	Very low	149 Å²	149	134.4 Å²	134.4	80%	0.797	70%	0.701	S	S	*	*			trans	-163.5	47.7	-175	-123.4	-5.3	0	0	0	114.3
352	Q	33.4	Very low	29.3	Very low	203 Å²	203	134.8 Å²	134.8	95%	0.949	71%	0.712	S	S	*	*			trans	-167.4	93	160.5	-115	161.8	69	0	0	111.6
353	S	27.4	Very low	29.1	Very low	96 Å²	96	137 Å²	137	67%	0.671	72%	0.718	S	S	*	*			trans	-118.4	123.6	170.7	56	0	0	0	0	109.3
354	N	27.2	Very low	28.9	Very low	85 Å²	85	135.5 Å²	135.5	46%	0.455	71%	0.71	S	S	.	*			trans	169.8	156.8	146.9	-83.6	-20.9	0	0	0	111.5	T1429	N354-T1429 WeakPolarHBondContact OD1-CA 3.03Å; N354-T1429 VanDerWaalsContact OD1-CB 3.3Å; N354-T1429 WeakPolarHBondContact OD1-CB 3.5Å; N354-T1429 WeakPolarHBondContact OD1-CG2 3.45Å; N354-T1429 PolarHBondContact OD1-N 3.41Å; N354-T1429 PolarHBondContact OD1-OG1 3.22Å
355	Y	27.5	Very low	28.8	Very low	109 Å²	109	134.8 Å²	134.8	43%	0.427	71%	0.707	S	S	.	*			trans	64.3	130.8	179.5	-51.7	-89.1	0	0	0	116.1	Y1039 T1427 M1428	Y355-Y1039 WeakPolarHBondContact O-CE1 3.42Å; Y355-Y1039 WeakPolarHBondContact O-CE2 2.45Å; Y355-Y1039 PolarHBondContact O-OH 2.76Å; Y355-T1427 PolarHBondContact OH-O 3.49Å; Y355-M1428 WeakPolarHBondContact CA-O 3.44Å; Y355-M1428 HydrophobicContact CD1-CB 4.11Å; Y355-M1428 WeakPolarHBondContact CD1-O 3.44Å; Y355-M1428 WeakPolarHBondContact CD2-O 3.3Å; Y355-M1428 HydrophobicContact CE1-CB 3.77Å; Y355-M1428 WeakPolarHBondContact CE1-O 3.28Å; Y355-M1428 PolarHBondContact N-O 2.99Å; Y355-M1428 PolarHBondContact OH-N 3.05Å
356	L	29.8	Very low	28.7	Very low	82 Å²	82	136.8 Å²	136.8	43%	0.429	71%	0.709	S	S	.	*			cis	-164.6	148.3	-13.4	-123.2	-178.9	0	0	0	111.8	Y1039 T1430	L356-Y1039 VanDerWaalsContact O-CD2 3.31Å; L356-Y1039 WeakPolarHBondContact O-CD2 2.87Å; L356-T1430 CarbonylContact C-O 3.41Å; L356-T1430 VanDerWaalsContact C-O 3.29Å
357	I	29.3	Very low	28.4	Very low	92 Å²	92	134.8 Å²	134.8	47%	0.472	71%	0.71	S	S	.	*			trans	-82.5	173.5	170.2	-93.4	158.2	0	0	0	109.3	T1430 V1431	I357-T1430 WeakPolarHBondContact CA-O 3.31Å; I357-T1430 WeakPolarHBondContact CB-O 3.49Å; I357-T1430 VanDerWaalsContact CD1-O 3.25Å; I357-T1430 WeakPolarHBondContact CD1-O 3.46Å; I357-T1430 WeakPolarHBondContact CG1-O 3.37Å; I357-T1430 PolarHBondContact N-O 3.45Å; I357-V1431 HydrophobicContact CB-CG2 4.35Å; I357-V1431 HydrophobicContact CD1-CG1 4.36Å; I357-V1431 HydrophobicContact CG1-CB 3.92Å; I357-V1431 HydrophobicContact CG1-CG1 3.94Å; I357-V1431 HydrophobicContact CG1-CG2 3.59Å
358	E	28.7	Very low	28.4	Very low	138 Å²	138	129.4 Å²	129.4	65%	0.645	70%	0.699	S	S	*	*			trans	109.1	132.5	163.2	-60.6	-159.1	-157.2	0	0	115.3
359	N	28.4	Very low	28.2	Very low	119 Å²	119	129.8 Å²	129.8	64%	0.636	70%	0.702	S	S	*	*			cis	-159.1	155	-6.3	-126	-35	0	0	0	114.9
360	S	27.6	Very low	28.2	Very low	85 Å²	85	132.7 Å²	132.7	59%	0.594	70%	0.704	S	S	*	*			trans	49.2	117.2	146.7	68.2	0	0	0	0	124.7
361	N	26.9	Very low	28.3	Very low	155 Å²	155	129 Å²	129	83%	0.829	69%	0.69	S	S	*	*				55.4	109.2	118.7	-53.3	-17.5	0	0	0	123.5
362	S	28.9	Very low	28.5	Very low	115 Å²	115	127.1 Å²	127.1	80%	0.804	68%	0.683	S	S	*	*			trans	-178.5	122.2	130.7	24.8	0	0	0	0	108.9
363	I	27.8	Very low	28.3	Very low	155 Å²	155	125 Å²	125	80%	0.795	67%	0.668	S	S	*	*				74.1	125.6	70.2	-64.9	174.8	0	0	0	114.4
364	N	27.1	Very low	28.4	Very low	123 Å²	123	128.7 Å²	128.7	66%	0.658	67%	0.672	S	S	*	*			trans	79.6	111.3	169.1	-81.8	-43.1	0	0	0	121
365	K	28.2	Very low	29.2	Very low	175 Å²	175	134.4 Å²	134.4	76%	0.761	69%	0.687	S	S	*	*				68.6	140.6	124.8	-66.2	174.5	-177.2	178.9	0	121.6
366	N	26.7	Very low	29.6	Very low	158 Å²	158	135 Å²	135	85%	0.845	70%	0.704	S	S	*	*			trans	81.4	147.2	156.1	-68.9	12.9	0	0	0	120.1
367	C	25.7	Very low	29.8	Very low	125 Å²	125	135.2 Å²	135.2	85%	0.845	71%	0.706	S	S	*	*			trans	-50.5	153	177.8	-171.4	0	0	0	0	116.4
368	S	29.1	Very low	30.5	Very low	98 Å²	98	138.8 Å²	138.8	69%	0.685	72%	0.72	S	S	*	*			trans	84.7	158.4	157.5	-141.4	0	0	0	0	119.8
369	D	28	Very low	30.8	Very low	147 Å²	147	138.9 Å²	138.9	79%	0.786	73%	0.725	S	S	*	*			trans	80.4	116.5	159.3	-60.8	0.2	0	0	0	120.2
370	Y	28.5	Very low	31.5	Very low	214 Å²	214	137.5 Å²	137.5	84%	0.839	73%	0.725	S	S	*	*			trans	-74.6	153.3	169.9	-77.4	-103.5	0	0	0	112.6
371	P	28.8	Very low	31.8	Very low	87 Å²	87	136 Å²	136	57%	0.565	72%	0.722	S	S	*	*			trans	-96.3	93	150.9	35	-29.9	0	0	0	111.8	L1033	P371-L1033 HydrophobicContact CB-CD1 3.63Å; P371-L1033 HydrophobicContact CB-CD2 3.55Å; P371-L1033 HydrophobicContact CB-CG 4.24Å
372	V	34.7	Very low	32.4	Very low	109 Å²	109	136.1 Å²	136.1	66%	0.661	72%	0.72	S	S	*	*			trans	-83.4	117.7	170.3	173.5	0	0	0	0	110.4
373	Y	27.6	Very low	32.7	Very low	159 Å²	159	133.9 Å²	133.9	62%	0.624	72%	0.716	S	S	*	*			trans	-135.6	91.7	159.5	-92.9	-75.1	0	0	0	113.9	L1033 H1034	Y373-L1033 HydrophobicContact CE2-CD1 4.33Å; Y373-H1034 AromaticContact CD2-NE2 3.99Å
374	K	29.9	Very low	33.4	Very low	173 Å²	173	135.3 Å²	135.3	75%	0.752	71%	0.711	S	S	*	*			trans	65.8	92.8	148.1	-63	-169.8	175.8	-170.9	0	120.2
375	R	43.8	Very low	33.9	Very low	205 Å²	205	136.1 Å²	136.1	77%	0.774	72%	0.721	S	S	*	*				7	139.2	105.3	-78.7	172.3	178.5	-114.4	8.8	115.9	D377	R375-D377 WeakPolarHBondContact CD-OD1 3.38Å; R375-D377 WeakPolarHBondContact CG-OD1 3.48Å; R375-D377 IonicContact CZ-OD1 2.99Å; R375-D377 IonicContact NE-OD1 3.93Å; R375-D377 IonicContact NH1-OD1 3.63Å; R375-D377 PolarHBondContact NH1-OD1 3.42Å
376	P	36.2	Very low	34.3	Very low	121 Å²	121	133.2 Å²	133.2	79%	0.786	72%	0.718	S	S	*	*				-115.1	118.9	60	2.8	18.6	0	0	0	113.3
377	D	34.1	Very low	34.6	Very low	87 Å²	87	132.5 Å²	132.5	47%	0.465	71%	0.714	S	S	.	*				89.8	149.5	77.9	-70.5	-40.8	0	0	0	113.5	R375	R375-D377 WeakPolarHBondContact CD-OD1 3.38Å; R375-D377 WeakPolarHBondContact CG-OD1 3.48Å; R375-D377 IonicContact CZ-OD1 2.99Å; R375-D377 IonicContact NE-OD1 3.93Å; R375-D377 IonicContact NH1-OD1 3.63Å; R375-D377 PolarHBondContact NH1-OD1 3.42Å
378	Q	43.8	Very low	35.1	Very low	167 Å²	167	134.9 Å²	134.9	78%	0.78	71%	0.712	S	S	*	*			trans	78.1	112.3	-176.6	-43.2	-61.7	-100.8	0	0	113.5
379	D	35.3	Very low	35.4	Very low	139 Å²	139	135.5 Å²	135.5	74%	0.743	72%	0.717	S	S	*	*			cis	70.8	128.6	45.1	-161.4	55.9	0	0	0	111.6
380	S	43.4	Very low	35.7	Very low	90 Å²	90	131.8 Å²	131.8	63%	0.629	71%	0.707	S	S	*	*			cis	-146.3	-176.9	-2.1	-130.3	0	0	0	0	107.6
381	G	34.3	Very low	36.2	Very low	53 Å²	53	129.4 Å²	129.4	55%	0.546	70%	0.696	S	S	.	*			cis	133.1	135.2	10.1	0	0	0	0	0	111
382	M	39.1	Very low	36.5	Very low	158 Å²	158	129.9 Å²	129.9	78%	0.778	70%	0.698	S	S	*	*			trans	60.6	157.4	158.6	-68.9	69.8	78.4	0	0	121.5
383	G	35.1	Very low	37	Very low	69 Å²	69	132.2 Å²	132.2	71%	0.711	70%	0.701	S	S	*	*			trans	74.1	130.4	162.7	0	0	0	0	0	117.3
384	R	42	Very low	37.5	Very low	185 Å²	185	131.8 Å²	131.8	70%	0.698	71%	0.705	S	S	*	*			cis	51.3	91.9	4.8	-86.3	-160	177.9	119.2	1.5	116.7
385	T	37.2	Very low	37.9	Very low	140 Å²	140	129 Å²	129	86%	0.859	71%	0.707	S	S	*	*				-160.6	165.7	128.8	11	0	0	0	0	112
386	T	36.4	Very low	37.9	Very low	114 Å²	114	124.4 Å²	124.4	70%	0.699	71%	0.706	S	S	*	*			trans	-53.5	178	172.2	55.3	0	0	0	0	114.4
387	D	33.6	Very low	37.8	Very low	143 Å²	143	125.7 Å²	125.7	77%	0.765	70%	0.702	S	S	*	*			cis	-151.3	-175.1	7	15.4	68.1	0	0	0	111.7
388	E	35.6	Very low	38.1	Very low	174 Å²	174	130.6 Å²	130.6	81%	0.813	72%	0.722	S	S	*	*			trans	-71.4	143.8	163.2	-55.2	164.6	123.5	0	0	111.5
389	S	36.7	Very low	37.8	Very low	112 Å²	112	130.6 Å²	130.6	78%	0.783	72%	0.722	S	S	*	*				153	140.3	126.4	-70.7	0	0	0	0	116.5
390	A	33.7	Very low	38	Very low	69 Å²	69	132 Å²	132	57%	0.57	73%	0.728	S	S	*	*			trans	54.3	113.4	147.3	0	0	0	0	0	121.3
391	R	38.4	Very low	37.5	Very low	164 Å²	164	134.4 Å²	134.4	62%	0.619	73%	0.734	S	S	*	*				-173.6	141	106.3	-90.1	145.5	-169.3	102.1	-3.7	110
392	T	35.6	Very low	37.5	Very low	97 Å²	97	138.4 Å²	138.4	60%	0.595	74%	0.743	S	S	*	*			cis	69.1	87.6	32.9	78.6	0	0	0	0	113.4	E394	T392-E394 WeakPolarHBondContact CA-OE1 3.48Å; T392-E394 WeakPolarHBondContact CB-OE1 3.29Å
393	E	46	Very low	37.2	Very low	158 Å²	158	137.2 Å²	137.2	74%	0.738	74%	0.739	S	S	*	*			trans	-140.4	101.5	161.9	-65.2	-172.8	-163.1	0	0	105.5
394	E	36.6	Very low	37.1	Very low	150 Å²	150	141.4 Å²	141.4	70%	0.701	74%	0.74	S	S	*	*			trans	-98.4	-169.3	-174.8	-62.6	92.6	-131.8	0	0	113.6	T392	T392-E394 WeakPolarHBondContact CA-OE1 3.48Å; T392-E394 WeakPolarHBondContact CB-OE1 3.29Å
395	S	38.3	Very low	36.7	Very low	114 Å²	114	139.9 Å²	139.9	80%	0.797	74%	0.741	S	S	*	*			trans	78.4	142.1	178.6	-49.5	0	0	0	0	116
396	S	44.2	Very low	36.4	Very low	108 Å²	108	141.2 Å²	141.2	76%	0.755	74%	0.737	S	S	*	*			cis	-139.4	157.7	16.6	-65.4	0	0	0	0	113.8
397	E	35.5	Very low	36.3	Very low	149 Å²	149	143.2 Å²	143.2	70%	0.696	74%	0.738	S	S	*	*			trans	-66.7	162	-176.5	-29.4	77.6	-108.8	0	0	116.5
398	Q	40	Very low	36.2	Very low	189 Å²	189	140.9 Å²	140.9	88%	0.883	72%	0.723	S	S	*	*				-168.2	124	118.2	-108.3	163.7	31.5	0	0	115.2
399	E	36	Very low	36	Very low	168 Å²	168	139.4 Å²	139.4	79%	0.785	72%	0.715	S	S	*	*			trans	-62.1	163	-179.7	-45.9	155.3	101.2	0	0	115.2
400	I	41	Very low	35.9	Very low	168 Å²	168	139.1 Å²	139.1	86%	0.862	70%	0.702	S	S	*	*				-174.3	125.4	121.8	-93.5	151.5	0	0	0	111.9
401	D	32.8	Very low	35.8	Very low	140 Å²	140	143.2 Å²	143.2	75%	0.749	70%	0.703	S	S	*	*			trans	-57.4	141.5	173.9	-74	-65.6	0	0	0	114.8
402	N	33.5	Very low	35.9	Very low	138 Å²	138	143.3 Å²	143.3	74%	0.738	71%	0.711	S	S	*	*				161.2	136.3	103.6	-90.1	-82.1	0	0	0	114.3
403	D	32.2	Very low	36.1	Very low	132 Å²	132	144 Å²	144	71%	0.706	71%	0.707	S	S	*	*			trans	51.6	95.6	145.8	-90	-14	0	0	0	120.4
404	Q	33.5	Very low	35.7	Very low	158 Å²	158	138.9 Å²	138.9	74%	0.738	68%	0.683	S	S	*	*				146	144.4	113.4	-80.2	161.9	47.8	0	0	117.4
405	H	34	Very low	35.7	Very low	153 Å²	153	139.1 Å²	139.1	71%	0.708	68%	0.684	S	S	*	*			trans	73	95.2	153.1	-75.5	-58.6	0	0	0	122.1
406	H	30.6	Very low	35.5	Very low	168 Å²	168	143 Å²	143	78%	0.778	68%	0.682	S	S	*	*				39.2	101.6	123	-73	22.3	0	0	0	118.3
407	H	34.5	Very low	35.2	Very low	156 Å²	156	140.8 Å²	140.8	72%	0.722	66%	0.663	S	S	*	*				-168.6	-31.4	117.6	-112.5	-66.8	0	0	0	116.8	H409	H407-H409 PolarHBondContact O-N 2.87Å
408	H	32.3	Very low	35.3	Very low	94 Å²	94	138.5 Å²	138.5	44%	0.435	66%	0.656	S	S	.	*	G	3₁₀ helix	trans	-64	-32.4	-159.7	-153.6	108	0	0	0	115.5	D139 D141 Q410 Y411	D139-H408 IonicContact OD1-ND1 2.68Å; D139-H408 IonicContact OD2-CG 2.96Å; D139-H408 IonicContact OD2-ND1 3.24Å; D141-H408 IonicContact OD2-CE1 2.69Å; H408-Q410 PolarHBondContact O-N 3.4Å; H408-Y411 PolarHBondContact O-N 2.77Å; H408-Y411 VanDerWaalsContact O-N 3.12Å
409	H	31.4	Very low	35.2	Very low	142 Å²	142	136.9 Å²	136.9	66%	0.657	65%	0.646	S	S	*	*	G	3₁₀ helix	trans	-62.6	-0.1	-173.9	-144	90.2	0	0	0	115.4	H407 Q413	H407-H409 PolarHBondContact O-N 2.87Å; H409-Q413 PolarHBondContact CD2-NE2 3.4Å
410	Q	33.8	Very low	35.6	Very low	107 Å²	107	133.7 Å²	133.7	50%	0.5	63%	0.634	S	S	.	*	G	3₁₀ helix	trans	-84.4	-26.7	174.2	-138.3	177.5	-14.7	0	0	114.2	H408 Q413 Q414	H408-Q410 PolarHBondContact O-N 3.4Å; Q410-Q413 CarbonylContact O-C 3.6Å; Q410-Q414 WeakPolarHBondContact O-CB 2.91Å; Q410-Q414 WeakPolarHBondContact O-CG 3.31Å; Q410-Q414 PolarHBondContact O-N 3.4Å
411	Y	31.8	Very low	35.4	Very low	154 Å²	154	130.8 Å²	130.8	60%	0.604	62%	0.616	S	S	*	*	H	α-helix	trans	-79.1	-44.4	-167.6	-97	-97.5	0	0	0	115.7	H408 Q413 Q414 Q415	H408-Y411 PolarHBondContact O-N 2.77Å; H408-Y411 VanDerWaalsContact O-N 3.12Å; Y411-Q413 VanDerWaalsContact C-N 3.29Å; Y411-Q413 PolarHBondContact O-N 3.29Å; Y411-Q414 WeakPolarHBondContact O-CA 3.33Å; Y411-Q414 WeakPolarHBondContact O-CB 3.33Å; Y411-Q414 PolarHBondContact O-N 3.24Å; Y411-Q414 VanDerWaalsContact O-N 3.07Å; Y411-Q415 PolarHBondContact O-N 3.17Å
412	Q	39.6	Very low	35.7	Very low	167 Å²	167	125.7 Å²	125.7	78%	0.78	60%	0.597	S	S	*	*	H	α-helix	trans	-68.3	-31.3	171.6	-71.9	-162	25	0	0	112.2	Q414 Q415 R416	Q412-Q414 VanDerWaalsContact C-N 3.33Å; Q412-Q415 PolarHBondContact O-N 3.04Å; Q412-R416 PolarHBondContact O-N 3.34Å
413	Q	39.9	Very low	36	Very low	110 Å²	110	123.5 Å²	123.5	51%	0.514	59%	0.585	S	S	.	*	H	α-helix	trans	-67.6	-33.6	168.6	-65.2	-156.4	31.5	0	0	111.5	H409 Q410 Y411 R416 T417	H409-Q413 PolarHBondContact CD2-NE2 3.4Å; Q410-Q413 CarbonylContact O-C 3.6Å; Y411-Q413 VanDerWaalsContact C-N 3.29Å; Y411-Q413 PolarHBondContact O-N 3.29Å; Q413-R416 CarbonylContact O-C 3.57Å; Q413-R416 PolarHBondContact O-N 2.82Å; Q413-T417 WeakPolarHBondContact O-CB 3.46Å; Q413-T417 WeakPolarHBondContact O-CG2 3.43Å; Q413-T417 PolarHBondContact O-N 3.3Å; Q413-T417 PolarHBondContact O-OG1 3.08Å
414	Q	37.3	Very low	36.3	Very low	52 Å²	52	119.4 Å²	119.4	24%	0.243	57%	0.569	C	S	.	*	H	α-helix	trans	-66.3	-36.9	173.2	-81.8	171.3	23.1	0	0	113.4	Q410 Y411 Q412 R416 T417 N418	Q410-Q414 WeakPolarHBondContact O-CB 2.91Å; Q410-Q414 WeakPolarHBondContact O-CG 3.31Å; Q410-Q414 PolarHBondContact O-N 3.4Å; Y411-Q414 WeakPolarHBondContact O-CA 3.33Å; Y411-Q414 WeakPolarHBondContact O-CB 3.33Å; Y411-Q414 PolarHBondContact O-N 3.24Å; Y411-Q414 VanDerWaalsContact O-N 3.07Å; Q412-Q414 VanDerWaalsContact C-N 3.33Å; Q414-R416 VanDerWaalsContact C-N 3.31Å; Q414-R416 PolarHBondContact O-N 3.48Å; Q414-T417 WeakPolarHBondContact CA-OG1 3.36Å; Q414-T417 PolarHBondContact O-N 3Å; Q414-N418 WeakPolarHBondContact O-CB 3.49Å; Q414-N418 PolarHBondContact O-N 3.33Å; Q414-N418 PolarHBondContact O-ND2 3.47Å
415	Q	36.7	Very low	36.5	Very low	154 Å²	154	117.5 Å²	117.5	72%	0.72	56%	0.56	S	S	*	*	H	α-helix	trans	-63.9	-38.5	173.2	-65.8	-162	25	0	0	111.9	Y411 Q412 F419	Y411-Q415 PolarHBondContact O-N 3.17Å; Q412-Q415 PolarHBondContact O-N 3.04Å; Q415-F419 PolarHBondContact O-N 2.88Å
416	R	34.7	Very low	36.7	Very low	196 Å²	196	113.9 Å²	113.9	74%	0.74	55%	0.545	S	S	*	.	H	α-helix	trans	-70.2	-42.2	171.4	-85.1	-172.1	165.6	-148.8	-0.6	113.3	Q412 Q413 Q414 I420	Q412-R416 PolarHBondContact O-N 3.34Å; Q413-R416 CarbonylContact O-C 3.57Å; Q413-R416 PolarHBondContact O-N 2.82Å; Q414-R416 VanDerWaalsContact C-N 3.31Å; Q414-R416 PolarHBondContact O-N 3.48Å; R416-I420 WeakPolarHBondContact O-CB 3.44Å; R416-I420 VanDerWaalsContact O-CG1 3.23Å; R416-I420 WeakPolarHBondContact O-CG1 3.45Å; R416-I420 PolarHBondContact O-N 3.46Å
417	T	38.9	Very low	37.1	Very low	61 Å²	61	111.2 Å²	111.2	37%	0.374	54%	0.541	S	S	.	.	H	α-helix	trans	-79.2	-17.5	-178	59.5	0	0	0	0	113.1	Q413 Q414 I420 H421	Q413-T417 WeakPolarHBondContact O-CB 3.46Å; Q413-T417 WeakPolarHBondContact O-CG2 3.43Å; Q413-T417 PolarHBondContact O-N 3.3Å; Q413-T417 PolarHBondContact O-OG1 3.08Å; Q414-T417 WeakPolarHBondContact CA-OG1 3.36Å; Q414-T417 PolarHBondContact O-N 3Å; T417-I420 CarbonylContact O-C 3.29Å; T417-H421 WeakPolarHBondContact O-CA 3.42Å; T417-H421 WeakPolarHBondContact O-CB 3.41Å; T417-H421 PolarHBondContact O-N 3.49Å
418	N	36.4	Very low	37.1	Very low	101 Å²	101	111.2 Å²	111.2	54%	0.54	54%	0.539	S	S	.	.	H	α-helix	trans	-78.1	-41.4	168.8	-72.1	-17.4	0	0	0	111.2	Q414 I420 H421 G422	Q414-N418 WeakPolarHBondContact O-CB 3.49Å; Q414-N418 PolarHBondContact O-N 3.33Å; Q414-N418 PolarHBondContact O-ND2 3.47Å; N418-I420 VanDerWaalsContact C-N 3.29Å; N418-I420 PolarHBondContact O-N 2.97Å; N418-H421 PolarHBondContact O-N 3.42Å; N418-G422 PolarHBondContact O-N 3.21Å
419	F	37.8	Very low	37.1	Very low	155 Å²	155	113.1 Å²	113.1	68%	0.68	55%	0.552	S	S	*	*	H	α-helix	trans	-62.8	-38.9	169.7	-162.1	-97.4	0	0	0	111.3	Q415 L423	Q415-F419 PolarHBondContact O-N 2.88Å; F419-L423 HydrophobicContact CD1-CD1 4.02Å; F419-L423 HydrophobicContact CE1-CD1 3.88Å; F419-L423 WeakPolarHBondContact O-CG 3.43Å; F419-L423 PolarHBondContact O-N 3.38Å
420	I	44.4	Very low	37	Very low	101 Å²	101	112.5 Å²	112.5	52%	0.518	56%	0.558	S	S	.	*	H	α-helix	trans	-75	-29.4	173.9	-67.5	167.4	0	0	0	112.1	R416 T417 N418 L423 A424	R416-I420 WeakPolarHBondContact O-CB 3.44Å; R416-I420 VanDerWaalsContact O-CG1 3.23Å; R416-I420 WeakPolarHBondContact O-CG1 3.45Å; R416-I420 PolarHBondContact O-N 3.46Å; T417-I420 CarbonylContact O-C 3.29Å; N418-I420 VanDerWaalsContact C-N 3.29Å; N418-I420 PolarHBondContact O-N 2.97Å; I420-L423 PolarHBondContact O-N 2.9Å; I420-A424 WeakPolarHBondContact O-CA 3.33Å; I420-A424 WeakPolarHBondContact O-CB 3.48Å; I420-A424 PolarHBondContact O-N 3.5Å
421	H	38.1	Very low	36.6	Very low	107 Å²	107	113.2 Å²	113.2	50%	0.495	57%	0.573	S	S	.	*	H	α-helix	trans	-71.5	-41.5	174.1	-111.3	-126.4	0	0	0	111.5	T417 N418 L423 A424 Q425	T417-H421 WeakPolarHBondContact O-CA 3.42Å; T417-H421 WeakPolarHBondContact O-CB 3.41Å; T417-H421 PolarHBondContact O-N 3.49Å; N418-H421 PolarHBondContact O-N 3.42Å; H421-L423 VanDerWaalsContact C-N 3.31Å; H421-L423 PolarHBondContact O-N 3.28Å; H421-A424 PolarHBondContact O-N 3.44Å; H421-Q425 WeakPolarHBondContact O-CB 3.47Å; H421-Q425 WeakPolarHBondContact O-CG 3.49Å; H421-Q425 PolarHBondContact O-N 3.22Å
422	G	37.6	Very low	36.5	Very low	33 Å²	33	114 Å²	114	34%	0.34	58%	0.582	S	S	.	*	H	α-helix	trans	-56.3	-48.4	172	0	0	0	0	0	110.8	N418 I426	N418-G422 PolarHBondContact O-N 3.21Å; G422-I426 VanDerWaalsContact O-CB 3.32Å; G422-I426 WeakPolarHBondContact O-CB 3.41Å; G422-I426 WeakPolarHBondContact O-CD1 3.23Å; G422-I426 WeakPolarHBondContact O-CG1 3.43Å; G422-I426 PolarHBondContact O-N 3.28Å; G422-I426 VanDerWaalsContact O-N 3.1Å
423	L	41.4	Very low	36	Very low	93 Å²	93	114.3 Å²	114.3	49%	0.487	59%	0.589	S	S	.	*	H	α-helix	trans	-68.1	-34.7	175.8	-67.5	173.3	0	0	0	113.5	F419 I420 H421 T427	F419-L423 HydrophobicContact CD1-CD1 4.02Å; F419-L423 HydrophobicContact CE1-CD1 3.88Å; F419-L423 WeakPolarHBondContact O-CG 3.43Å; F419-L423 PolarHBondContact O-N 3.38Å; I420-L423 PolarHBondContact O-N 2.9Å; H421-L423 VanDerWaalsContact C-N 3.31Å; H421-L423 PolarHBondContact O-N 3.28Å; L423-T427 WeakPolarHBondContact O-CB 3.08Å; L423-T427 PolarHBondContact O-N 2.8Å; L423-T427 VanDerWaalsContact O-N 3.11Å; L423-T427 PolarHBondContact O-OG1 3.26Å
424	A	38.5	Very low	35.5	Very low	45 Å²	45	112.1 Å²	112.1	37%	0.372	60%	0.597	S	S	.	*	H	α-helix	trans	-73.8	-40.3	179.2	0	0	0	0	0	112.3	I420 H421 T427 K428	I420-A424 WeakPolarHBondContact O-CA 3.33Å; I420-A424 WeakPolarHBondContact O-CB 3.48Å; I420-A424 PolarHBondContact O-N 3.5Å; H421-A424 PolarHBondContact O-N 3.44Å; A424-T427 CarbonylContact O-C 3.46Å; A424-T427 WeakPolarHBondContact O-CA 3.27Å; A424-T427 PolarHBondContact O-N 3.39Å; A424-K428 VanDerWaalsContact O-CB 3.26Å; A424-K428 WeakPolarHBondContact O-CB 3.49Å; A424-K428 PolarHBondContact O-N 3.24Å
425	Q	37.7	Very low	35.2	Very low	119 Å²	119	117.5 Å²	117.5	56%	0.556	62%	0.622	S	S	*	*	H	α-helix	trans	-65.5	-41.7	174	-71.4	178.9	-4.3	0	0	110.8	H421 T427 K428 L429	H421-Q425 WeakPolarHBondContact O-CB 3.47Å; H421-Q425 WeakPolarHBondContact O-CG 3.49Å; H421-Q425 PolarHBondContact O-N 3.22Å; Q425-T427 PolarHBondContact O-N 3.2Å; Q425-T427 VanDerWaalsContact O-N 3.14Å; Q425-K428 PolarHBondContact O-N 3.42Å; Q425-L429 PolarHBondContact O-N 2.81Å
426	I	37.1	Very low	34.9	Very low	77 Å²	77	117.3 Å²	117.3	40%	0.395	62%	0.619	S	S	.	*	H	α-helix	trans	-62.2	-17.5	170.5	-69.4	169.5	0	0	0	112.6	G422	G422-I426 VanDerWaalsContact O-CB 3.32Å; G422-I426 WeakPolarHBondContact O-CB 3.41Å; G422-I426 WeakPolarHBondContact O-CD1 3.23Å; G422-I426 WeakPolarHBondContact O-CG1 3.43Å; G422-I426 PolarHBondContact O-N 3.28Å; G422-I426 VanDerWaalsContact O-N 3.1Å
427	T	39.2	Very low	34.7	Very low	112 Å²	112	113.3 Å²	113.3	69%	0.687	61%	0.612	S	S	*	*	H	α-helix	trans	-105.5	-11.9	178	-52.6	0	0	0	0	113.6	L423 A424 Q425	L423-T427 WeakPolarHBondContact O-CB 3.08Å; L423-T427 PolarHBondContact O-N 2.8Å; L423-T427 VanDerWaalsContact O-N 3.11Å; L423-T427 PolarHBondContact O-OG1 3.26Å; A424-T427 CarbonylContact O-C 3.46Å; A424-T427 WeakPolarHBondContact O-CA 3.27Å; A424-T427 PolarHBondContact O-N 3.39Å; Q425-T427 PolarHBondContact O-N 3.2Å; Q425-T427 VanDerWaalsContact O-N 3.14Å
428	K	35.5	Very low	34.2	Very low	156 Å²	156	116.6 Å²	116.6	68%	0.678	63%	0.628	S	S	*	*	H	α-helix	trans	-101.4	-10.6	-177	-158.4	176.2	-179.2	-170.6	0	113.6	A424 Q425	A424-K428 VanDerWaalsContact O-CB 3.26Å; A424-K428 WeakPolarHBondContact O-CB 3.49Å; A424-K428 PolarHBondContact O-N 3.24Å; Q425-K428 PolarHBondContact O-N 3.42Å
429	L	30.4	Very low	33.8	Very low	134 Å²	134	119.2 Å²	119.2	70%	0.702	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.8	144.1	165.6	-60.9	175	0	0	0	109.9	Q425	Q425-L429 PolarHBondContact O-N 2.81Å
430	T	29.8	Very low	33.6	Very low	129 Å²	129	116.9 Å²	116.9	79%	0.791	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	79	28.9	-173.4	73	0	0	0	0	118.2
431	C	25.8	Very low	33	Very low	122 Å²	122	117.5 Å²	117.5	82%	0.824	66%	0.657	S	S	*	*			trans	-140.8	26.6	168	-109.1	0	0	0	0	116.1
432	E	29.7	Very low	32.7	Very low	169 Å²	169	116.1 Å²	116.1	79%	0.79	67%	0.673	S	S	*	*			trans	-120.1	120.9	170.2	-68.5	-175.2	-172.3	0	0	109.7
433	N	29.7	Very low	32.2	Very low	174 Å²	174	122.9 Å²	122.9	93%	0.93	70%	0.701	S	S	*	*			trans	-151.4	132.9	-175.1	-140.7	-6.9	0	0	0	110.4
434	G	29.3	Very low	31.7	Very low	65 Å²	65	123.2 Å²	123.2	67%	0.67	71%	0.711	S	S	*	*			trans	89.9	114.8	-161.7	0	0	0	0	0	109.8
435	Q	30.4	Very low	31.2	Very low	164 Å²	164	128 Å²	128	77%	0.766	73%	0.73	S	S	*	*				-154.2	165.2	53.4	-81.1	168.9	8.3	0	0	109.9
436	F	29.7	Very low	30.9	Very low	151 Å²	151	127.4 Å²	127.4	66%	0.662	73%	0.734	S	S	*	*			cis	-158.8	153.2	1.4	-110.9	-41.3	0	0	0	110.5
437	N	31.3	Very low	30.6	Very low	111 Å²	111	131.1 Å²	131.1	59%	0.594	75%	0.75	S	S	*	*			trans	54.5	106.4	140.8	-57.9	-22.9	0	0	0	123.9
438	N	27.8	Very low	30.2	Very low	131 Å²	131	132.3 Å²	132.3	70%	0.701	75%	0.752	S	S	*	*				66.8	134.5	108.7	-53.8	-19.8	0	0	0	124
439	N	28.6	Very low	30.1	Very low	156 Å²	156	129 Å²	129	83%	0.834	75%	0.754	S	S	*	*			trans	87.8	157.3	143.3	-62.6	-16.5	0	0	0	121.1
440	S	34.3	Very low	30.1	Very low	105 Å²	105	129.1 Å²	129.1	73%	0.734	76%	0.76	S	S	*	*			trans	68.9	97.6	-174.2	-160.7	0	0	0	0	114.3
441	S	31.4	Very low	30	Very low	114 Å²	114	128.2 Å²	128.2	80%	0.797	76%	0.759	S	S	*	*				64.6	113.2	60	87.4	0	0	0	0	114.1
442	G	32.3	Very low	30.4	Very low	79 Å²	79	129.8 Å²	129.8	81%	0.814	76%	0.758	S	S	*	*			trans	162.2	99.8	174.9	0	0	0	0	0	112.5
443	N	27.1	Very low	30.4	Very low	174 Å²	174	128.5 Å²	128.5	93%	0.93	76%	0.757	S	S	*	*			trans	-71.8	144.4	162.8	-68.3	-16.4	0	0	0	109.1
444	S	30	Very low	30.7	Very low	100 Å²	100	128.6 Å²	128.6	70%	0.699	75%	0.752	S	S	*	*			trans	157.4	145.1	138.6	-173.7	0	0	0	0	111.1
445	L	29	Very low	31.1	Very low	146 Å²	146	133.8 Å²	133.8	76%	0.764	76%	0.756	S	S	*	*			trans	22.5	139.4	146.9	-81.3	49	0	0	0	120.1
446	T	30.3	Very low	31.2	Very low	106 Å²	106	133.1 Å²	133.1	65%	0.65	76%	0.757	S	S	*	*			cis	-173.6	157.6	-7.4	8.2	0	0	0	0	107.2
447	Q	32.3	Very low	31.4	Very low	156 Å²	156	130.3 Å²	130.3	73%	0.729	76%	0.762	S	S	*	*			trans	68	127.5	149	-78.4	-178	-93.2	0	0	120.6
448	D	30.5	Very low	31.9	Very low	137 Å²	137	132.9 Å²	132.9	73%	0.733	77%	0.768	S	S	*	*			trans	79.6	162.7	138.4	-51.2	-16.6	0	0	0	120.5
449	A	32.1	Very low	33	Very low	87 Å²	87	129.1 Å²	129.1	72%	0.719	75%	0.751	S	S	*	*			trans	73.1	89.7	174.6	0	0	0	0	0	119.4
450	T	31	Very low	34.3	Very low	136 Å²	136	127 Å²	127	83%	0.834	75%	0.748	S	S	*	*				54.6	140.9	123.1	55.6	0	0	0	0	123.3
451	S	28.4	Very low	35.9	Very low	110 Å²	110	123.7 Å²	123.7	77%	0.769	72%	0.722	S	S	*	*			trans	49.7	99.6	143.5	-161.8	0	0	0	0	118.7
452	L	34	Very low	38.1	Very low	154 Å²	154	123.8 Å²	123.8	81%	0.806	72%	0.718	S	S	*	*			trans	-142.7	95	144.1	-165.4	65.1	0	0	0	110.8	Q454	L452-Q454 PolarHBondContact O-N 2.78Å
453	D	29.8	Very low	40.6	Very low	142 Å²	142	122.8 Å²	122.8	76%	0.759	69%	0.691	S	S	*	*			trans	-54.4	111.6	159.2	-97.6	-44.6	0	0	0	108.5	K455	D453-K455 PolarHBondContact O-N 2.82Å
454	Q	35.6	Very low	42.8	Very low	177 Å²	177	118 Å²	118	83%	0.827	67%	0.671	S	S	*	*			trans	-74.2	71.7	159.2	-71.7	-163.5	3.5	0	0	108.4	L452 L456	L452-Q454 PolarHBondContact O-N 2.78Å; Q454-L456 PolarHBondContact O-N 2.64Å
455	K	37.2	Very low	45.2	Very low	174 Å²	174	121.1 Å²	121.1	76%	0.757	68%	0.68	S	S	*	*			trans	-58.7	85	170.7	-175.7	-179.6	-178.7	179.9	0	108.1	D453 A457	D453-K455 PolarHBondContact O-N 2.82Å; K455-A457 PolarHBondContact O-N 3.33Å
456	L	32.9	Very low	47.8	Very low	150 Å²	150	119.6 Å²	119.6	79%	0.785	67%	0.665	S	S	*	*			trans	-45.7	110.1	161.8	-112.7	162.7	0	0	0	105.9	Q454 F458	Q454-L456 PolarHBondContact O-N 2.64Å; L456-F458 VanDerWaalsContact C-N 3.3Å; L456-F458 WeakPolarHBondContact O-CD2 3.4Å; L456-F458 PolarHBondContact O-N 3.32Å
457	A	33.9	Very low	50.2	Low	92 Å²	92	121.5 Å²	121.5	76%	0.76	67%	0.671	S	S	*	*			trans	-67.4	93.2	-168.1	0	0	0	0	0	109	K455	K455-A457 PolarHBondContact O-N 3.33Å
458	F	40.9	Very low	52.5	Low	164 Å²	164	115.3 Å²	115.3	72%	0.719	65%	0.645	S	S	*	*	P	Polyproline II helix	trans	-52.7	129.2	166.1	-68.6	-83	0	0	0	106.8	L456 S460	L456-F458 VanDerWaalsContact C-N 3.3Å; L456-F458 WeakPolarHBondContact O-CD2 3.4Å; L456-F458 PolarHBondContact O-N 3.32Å; F458-S460 PolarHBondContact O-N 2.87Å
459	P	51.4	Low	54.9	Low	53 Å²	53	116.3 Å²	116.3	34%	0.344	65%	0.648	S	S	.	*	P	Polyproline II helix	trans	-55.9	130.3	173.4	25.6	-33.2	0	0	0	107.2	D461 V488	P459-D461 PolarHBondContact O-N 2.98Å; P459-V488 HydrophobicContact CG-CG2 4.42Å
460	S	56.8	Low	57.3	Low	111 Å²	111	116.8 Å²	116.8	78%	0.776	64%	0.639	S	S	*	*	P	Polyproline II helix	trans	-47.3	130.8	-174.6	-52.2	0	0	0	0	110.1	F458 V462	F458-S460 PolarHBondContact O-N 2.87Å; S460-V462 PolarHBondContact O-N 2.78Å
461	D	67.5	Low	59.8	Low	36 Å²	36	114.5 Å²	114.5	19%	0.193	63%	0.626	C	S	.	*			trans	-64.1	115.6	179.7	171.6	26.4	0	0	0	108.8	P459 F463 S464 R481 Q484	P459-D461 PolarHBondContact O-N 2.98Å; D461-F463 PolarHBondContact O-N 3.25Å; D461-F463 WeakPolarHBondContact OD1-CD2 3.15Å; D461-F463 PolarHBondContact OD1-N 3.39Å; D461-S464 VanDerWaalsContact O-CB 3.3Å; D461-S464 WeakPolarHBondContact O-CB 3.49Å; D461-S464 PolarHBondContact O-N 3.44Å; D461-S464 PolarHBondContact O-OG 2.85Å; D461-S464 VanDerWaalsContact O-OG 3.13Å; D461-R481 IonicContact OD1-NE 2.61Å; D461-R481 IonicContact OD2-CZ 3.53Å; D461-R481 IonicContact OD2-NE 3.68Å; D461-R481 PolarHBondContact OD2-NE 2.88Å; D461-R481 IonicContact OD2-NH2 2.68Å; D461-R481 PolarHBondContact OD2-NH2 2.81Å; D461-Q484 PolarHBondContact OD1-NE2 2.93Å; D461-Q484 PolarHBondContact OD1-OE1 3.27Å
462	V	78.2	Confident	62.4	Low	116 Å²	116	114.6 Å²	114.6	70%	0.703	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.4	-11.6	-177.7	-171.6	0	0	0	0	111.9	S460	S460-V462 PolarHBondContact O-N 2.78Å
463	F	83.4	Confident	64.8	Low	58 Å²	58	108.9 Å²	108.9	25%	0.254	59%	0.587	S	S	.	*	T	Hydrogen-bonded Turn	trans	-109.6	19.8	175.5	-48.5	-80.2	0	0	0	113.1	D461 V477 G480 R481	D461-F463 PolarHBondContact O-N 3.25Å; D461-F463 WeakPolarHBondContact OD1-CD2 3.15Å; D461-F463 PolarHBondContact OD1-N 3.39Å; F463-V477 HydrophobicContact CB-CG1 3.83Å; F463-V477 HydrophobicContact CB-CG2 4.27Å; F463-V477 HydrophobicContact CD1-CG2 4.12Å; F463-V477 HydrophobicContact CG-CG1 4.35Å; F463-V477 HydrophobicContact CG-CG2 4.41Å; F463-G480 VanDerWaalsContact CE2-CA 3.4Å; F463-R481 HydrophobicContact CD2-CG 4.32Å; F463-R481 PolarHBondContact O-NH2 2.88Å
464	S	74.7	Confident	67.4	Low	74 Å²	74	106.6 Å²	106.6	52%	0.517	57%	0.572	S	S	.	*	S	Bend	trans	-61.5	-45.9	172.8	-80.2	0	0	0	0	112.2	D461	D461-S464 VanDerWaalsContact O-CB 3.3Å; D461-S464 WeakPolarHBondContact O-CB 3.49Å; D461-S464 PolarHBondContact O-N 3.44Å; D461-S464 PolarHBondContact O-OG 2.85Å; D461-S464 VanDerWaalsContact O-OG 3.13Å
465	D	79.2	Confident	69.9	Low	165 Å²	165	104.3 Å²	104.3	88%	0.882	56%	0.561	S	S	*	*	S	Bend	trans	-98	9.4	-170.2	-43.4	-46.5	0	0	0	112.6
466	Y	83.8	Confident	72.3	Confident	114 Å²	114	100.7 Å²	100.7	45%	0.447	55%	0.549	S	S	.	.			trans	-107.2	108.2	-177.6	-174.9	-86.2	0	0	0	110.2	P468 D473 V477	Y466-P468 HydrophobicContact CD1-CB 4.49Å; Y466-P468 HydrophobicContact CE1-CB 4.16Å; Y466-P468 WeakPolarHBondContact O-CD 3.2Å; Y466-D473 HydrophobicContact CE1-CB 4.15Å; Y466-V477 HydrophobicContact CD1-CG2 3.54Å; Y466-V477 HydrophobicContact CE1-CG2 3.91Å
467	D	80.4	Confident	74.9	Confident	145 Å²	145	93.8 Å²	93.8	78%	0.775	51%	0.514	S	S	*	.			trans	-92	109.1	179.2	-164.7	16.3	0	0	0	110.9	I469	D467-I469 PolarHBondContact O-N 3.33Å
468	P	80.1	Confident	77.4	Confident	27 Å²	27	95.4 Å²	95.4	18%	0.175	51%	0.506	C	S	.	.			trans	-81.1	107.5	-167.6	31.3	-35.9	0	0	0	113	Y466 D473 Q474 V477	Y466-P468 HydrophobicContact CD1-CB 4.49Å; Y466-P468 HydrophobicContact CE1-CB 4.16Å; Y466-P468 WeakPolarHBondContact O-CD 3.2Å; P468-D473 HydrophobicContact CB-CB 3.59Å; P468-Q474 HydrophobicContact CB-CB 4.5Å; P468-Q474 HydrophobicContact CB-CG 3.69Å; P468-Q474 HydrophobicContact CG-CG 3.56Å; P468-V477 HydrophobicContact CB-CG2 4.38Å
469	I	81	Confident	79.8	Confident	158 Å²	158	92 Å²	92	81%	0.81	49%	0.494	S	S	*	.			trans	-68.8	-47.3	-176.5	-57.3	175.8	0	0	0	111.6	D467	D467-I469 PolarHBondContact O-N 3.33Å
470	D	83.3	Confident	81.6	Confident	97 Å²	97	90 Å²	90	52%	0.519	48%	0.484	S	S	.	.	S	Bend	trans	-97.6	155.7	-178.9	-99.8	-33.9	0	0	0	112.5	I472 D473 Q474	D470-I472 PolarHBondContact O-N 2.92Å; D470-D473 PolarHBondContact N-OD2 3.27Å; D470-D473 WeakPolarHBondContact O-CB 3.49Å; D470-D473 PolarHBondContact O-N 3.03Å; D470-Q474 PolarHBondContact O-N 3.05Å; D470-Q474 VanDerWaalsContact O-N 3.16Å
471	P	82.9	Confident	83.2	Confident	87 Å²	87	90 Å²	90	57%	0.565	47%	0.467	S	S	*	.	H	α-helix	trans	-64.6	-21.2	176.9	27.4	-34.9	0	0	0	112.9	E475	P471-E475 PolarHBondContact O-N 2.87Å
472	I	82.7	Confident	84.3	Confident	112 Å²	112	92 Å²	92	57%	0.574	48%	0.477	S	S	*	.	H	α-helix	trans	-69.1	-43.3	172.6	-61.1	176	0	0	0	109.7	D470 Q474 E475 L476	D470-I472 PolarHBondContact O-N 2.92Å; I472-Q474 VanDerWaalsContact C-N 3.27Å; I472-Q474 PolarHBondContact O-N 3.19Å; I472-E475 PolarHBondContact O-N 3.06Å; I472-E475 VanDerWaalsContact O-N 3.12Å; I472-L476 HydrophobicContact CG2-CD1 4.11Å; I472-L476 HydrophobicContact CG2-CG 4.41Å; I472-L476 WeakPolarHBondContact O-CG 3.39Å; I472-L476 PolarHBondContact O-N 3.26Å
473	D	84.6	Confident	84.7	Confident	35 Å²	35	92.3 Å²	92.3	19%	0.187	47%	0.472	C	S	.	.	H	α-helix	trans	-63.5	-36.5	177.4	-57.5	-22.4	0	0	0	111	Y466 P468 D470 E475 L476 V477	Y466-D473 HydrophobicContact CE1-CB 4.15Å; P468-D473 HydrophobicContact CB-CB 3.59Å; D470-D473 PolarHBondContact N-OD2 3.27Å; D470-D473 WeakPolarHBondContact O-CB 3.49Å; D470-D473 PolarHBondContact O-N 3.03Å; D473-E475 PolarHBondContact O-N 3.01Å; D473-L476 PolarHBondContact O-N 3.34Å; D473-V477 WeakPolarHBondContact O-CB 3.41Å; D473-V477 WeakPolarHBondContact O-CG2 3.47Å; D473-V477 PolarHBondContact O-N 3.46Å
474	Q	84.9	Confident	84.8	Confident	94 Å²	94	91.8 Å²	91.8	44%	0.439	47%	0.47	S	S	.	.	H	α-helix	trans	-62.7	-40.2	173.1	-67.3	-175.6	8.6	0	0	112.5	P468 D470 I472 Q478	P468-Q474 HydrophobicContact CB-CB 4.5Å; P468-Q474 HydrophobicContact CB-CG 3.69Å; P468-Q474 HydrophobicContact CG-CG 3.56Å; D470-Q474 PolarHBondContact O-N 3.05Å; D470-Q474 VanDerWaalsContact O-N 3.16Å; I472-Q474 VanDerWaalsContact C-N 3.27Å; I472-Q474 PolarHBondContact O-N 3.19Å; Q474-Q478 WeakPolarHBondContact O-CB 3.37Å; Q474-Q478 WeakPolarHBondContact O-CG 3.33Å; Q474-Q478 PolarHBondContact O-N 2.95Å; Q474-Q478 VanDerWaalsContact O-N 3.11Å; Q474-Q478 PolarHBondContact O-NE2 3.04Å
475	E	87.5	Confident	85.4	Confident	128 Å²	128	91.8 Å²	91.8	60%	0.598	47%	0.471	S	S	*	.	H	α-helix	trans	-69.9	-35.9	173.9	-71.3	-171.2	174	0	0	111.9	P471 I472 D473 Q478 L479	P471-E475 PolarHBondContact O-N 2.87Å; I472-E475 PolarHBondContact O-N 3.06Å; I472-E475 VanDerWaalsContact O-N 3.12Å; D473-E475 PolarHBondContact O-N 3.01Å; E475-Q478 PolarHBondContact O-N 3.38Å; E475-L479 VanDerWaalsContact O-CB 3.29Å; E475-L479 WeakPolarHBondContact O-CB 3.5Å; E475-L479 PolarHBondContact O-N 2.92Å
476	L	87.5	Confident	85.9	Confident	98 Å²	98	88.8 Å²	88.8	51%	0.513	45%	0.454	S	S	.	.	H	α-helix	trans	-67.3	-44.2	175.9	-70.9	172.9	0	0	0	112.6	I472 D473 L479 G480	I472-L476 HydrophobicContact CG2-CD1 4.11Å; I472-L476 HydrophobicContact CG2-CG 4.41Å; I472-L476 WeakPolarHBondContact O-CG 3.39Å; I472-L476 PolarHBondContact O-N 3.26Å; D473-L476 PolarHBondContact O-N 3.34Å; L476-L479 PolarHBondContact O-N 3.25Å; L476-G480 PolarHBondContact O-N 3.02Å
477	V	88.4	Confident	85.9	Confident	6 Å²	6	85.3 Å²	85.3	4%	0.036	45%	0.449	C	S	.	.	H	α-helix	trans	-62	-43.2	174	166.5	0	0	0	0	111.1	F463 Y466 P468 D473 G480 R481	F463-V477 HydrophobicContact CB-CG1 3.83Å; F463-V477 HydrophobicContact CB-CG2 4.27Å; F463-V477 HydrophobicContact CD1-CG2 4.12Å; F463-V477 HydrophobicContact CG-CG1 4.35Å; F463-V477 HydrophobicContact CG-CG2 4.41Å; Y466-V477 HydrophobicContact CD1-CG2 3.54Å; Y466-V477 HydrophobicContact CE1-CG2 3.91Å; P468-V477 HydrophobicContact CB-CG2 4.38Å; D473-V477 WeakPolarHBondContact O-CB 3.41Å; D473-V477 WeakPolarHBondContact O-CG2 3.47Å; D473-V477 PolarHBondContact O-N 3.46Å; V477-G480 PolarHBondContact O-N 3.47Å; V477-R481 VanDerWaalsContact CG1-NH1 3.29Å; V477-R481 WeakPolarHBondContact O-CB 3.43Å; V477-R481 WeakPolarHBondContact O-CG 3.47Å; V477-R481 PolarHBondContact O-N 3.41Å
478	Q	86	Confident	86.2	Confident	126 Å²	126	79.9 Å²	79.9	59%	0.589	42%	0.421	S	S	*	.	H	α-helix	trans	-64.3	-41.7	176	-74.8	172.6	47.4	0	0	112.2	Q474 E475 L482	Q474-Q478 WeakPolarHBondContact O-CB 3.37Å; Q474-Q478 WeakPolarHBondContact O-CG 3.33Å; Q474-Q478 PolarHBondContact O-N 2.95Å; Q474-Q478 VanDerWaalsContact O-N 3.11Å; Q474-Q478 PolarHBondContact O-NE2 3.04Å; E475-Q478 PolarHBondContact O-N 3.38Å; Q478-L482 WeakPolarHBondContact O-CB 3.34Å; Q478-L482 PolarHBondContact O-N 2.89Å
479	L	91.7	Very high	86.4	Confident	91 Å²	91	84 Å²	84	48%	0.476	44%	0.437	S	S	.	.	H	α-helix	trans	-63.3	-42.2	174.4	178.8	60.5	0	0	0	111.6	E475 L476 L482 M483	E475-L479 VanDerWaalsContact O-CB 3.29Å; E475-L479 WeakPolarHBondContact O-CB 3.5Å; E475-L479 PolarHBondContact O-N 2.92Å; L476-L479 PolarHBondContact O-N 3.25Å; L479-L482 PolarHBondContact O-N 2.95Å; L479-M483 HydrophobicContact CD1-CG 4.48Å; L479-M483 HydrophobicContact CG-SD 4.44Å; L479-M483 WeakPolarHBondContact O-CG 3.35Å; L479-M483 PolarHBondContact O-N 3.39Å
480	G	90.1	Very high	86.7	Confident	12 Å²	12	79.6 Å²	79.6	12%	0.124	42%	0.42	C	S	.	.	H	α-helix	trans	-60.9	-49.6	176.2	0	0	0	0	0	112.7	F463 L476 V477 L482 M483 Q484	F463-G480 VanDerWaalsContact CE2-CA 3.4Å; L476-G480 PolarHBondContact O-N 3.02Å; V477-G480 PolarHBondContact O-N 3.47Å; G480-L482 VanDerWaalsContact C-N 3.33Å; G480-L482 PolarHBondContact O-N 3.45Å; G480-M483 PolarHBondContact O-N 3.4Å; G480-Q484 WeakPolarHBondContact O-CG 3.26Å; G480-Q484 PolarHBondContact O-N 2.91Å
481	R	89	Confident	86.8	Confident	111 Å²	111	79.7 Å²	79.7	42%	0.419	41%	0.413	S	S	.	.	H	α-helix	trans	-58.1	-42.5	173.5	-74.4	172.2	165.2	144.8	9.1	112.1	D461 F463 V477 M483 Q484 S485	D461-R481 IonicContact OD1-NE 2.61Å; D461-R481 IonicContact OD2-CZ 3.53Å; D461-R481 IonicContact OD2-NE 3.68Å; D461-R481 PolarHBondContact OD2-NE 2.88Å; D461-R481 IonicContact OD2-NH2 2.68Å; D461-R481 PolarHBondContact OD2-NH2 2.81Å; F463-R481 HydrophobicContact CD2-CG 4.32Å; F463-R481 PolarHBondContact O-NH2 2.88Å; V477-R481 VanDerWaalsContact CG1-NH1 3.29Å; V477-R481 WeakPolarHBondContact O-CB 3.43Å; V477-R481 WeakPolarHBondContact O-CG 3.47Å; V477-R481 PolarHBondContact O-N 3.41Å; R481-M483 PolarHBondContact O-N 3.19Å; R481-Q484 PolarHBondContact O-N 2.83Å; R481-S485 PolarHBondContact O-N 3.16Å
482	L	91.8	Very high	87.1	Confident	78 Å²	78	80.5 Å²	80.5	41%	0.408	41%	0.409	S	S	.	.	H	α-helix	trans	-63.2	-40.3	175.5	-178	62.7	0	0	0	112.2	M334 Q478 L479 G480 S485 L486	M334-L482 HydrophobicContact CE-CD1 4.24Å; M334-L482 HydrophobicContact SD-CD1 4.31Å; Q478-L482 WeakPolarHBondContact O-CB 3.34Å; Q478-L482 PolarHBondContact O-N 2.89Å; L479-L482 PolarHBondContact O-N 2.95Å; G480-L482 VanDerWaalsContact C-N 3.33Å; G480-L482 PolarHBondContact O-N 3.45Å; L482-S485 PolarHBondContact O-N 3.42Å; L482-L486 WeakPolarHBondContact O-CB 3.45Å; L482-L486 PolarHBondContact O-N 2.7Å
483	M	86.8	Confident	87.2	Confident	123 Å²	123	80.6 Å²	80.6	61%	0.606	41%	0.41	S	S	*	.	H	α-helix	trans	-67.3	-38.7	176.3	-75.2	-177.5	63.4	0	0	112.8	L479 G480 R481 L486 A487	L479-M483 HydrophobicContact CD1-CG 4.48Å; L479-M483 HydrophobicContact CG-SD 4.44Å; L479-M483 WeakPolarHBondContact O-CG 3.35Å; L479-M483 PolarHBondContact O-N 3.39Å; G480-M483 PolarHBondContact O-N 3.4Å; R481-M483 PolarHBondContact O-N 3.19Å; M483-L486 PolarHBondContact O-N 3.34Å; M483-A487 WeakPolarHBondContact O-CB 3.23Å; M483-A487 PolarHBondContact O-N 2.76Å
484	Q	85.7	Confident	87.3	Confident	46 Å²	46	83.5 Å²	83.5	22%	0.215	43%	0.429	C	S	.	.	H	α-helix	trans	-60.3	-48	172.3	-67.7	175.3	27.9	0	0	111.2	D461 G480 R481 A487 V488	D461-Q484 PolarHBondContact OD1-NE2 2.93Å; D461-Q484 PolarHBondContact OD1-OE1 3.27Å; G480-Q484 WeakPolarHBondContact O-CG 3.26Å; G480-Q484 PolarHBondContact O-N 2.91Å; R481-Q484 PolarHBondContact O-N 2.83Å; Q484-A487 WeakPolarHBondContact O-CB 3.3Å; Q484-A487 PolarHBondContact O-N 3.45Å; Q484-V488 PolarHBondContact O-N 3.11Å
485	S	86.5	Confident	87.2	Confident	75 Å²	75	84.4 Å²	84.4	52%	0.524	43%	0.433	S	S	.	.	H	α-helix	trans	-59.7	-46.9	177.5	-179.6	0	0	0	0	112.1	R481 L482 A487 V488 H489	R481-S485 PolarHBondContact O-N 3.16Å; L482-S485 PolarHBondContact O-N 3.42Å; S485-A487 VanDerWaalsContact C-N 3.3Å; S485-A487 PolarHBondContact O-N 2.96Å; S485-V488 PolarHBondContact O-N 3.4Å; S485-V488 VanDerWaalsContact O-N 3.16Å; S485-H489 PolarHBondContact O-N 3.16Å
486	L	89.2	Confident	86.9	Confident	102 Å²	102	81 Å²	81	53%	0.534	43%	0.427	S	S	.	.	H	α-helix	trans	-60.6	-37.7	175.8	-177.5	60.5	0	0	0	112.1	L482 M483 H489 C490	L482-L486 WeakPolarHBondContact O-CB 3.45Å; L482-L486 PolarHBondContact O-N 2.7Å; M483-L486 PolarHBondContact O-N 3.34Å; L486-H489 PolarHBondContact O-N 3.35Å; L486-C490 WeakPolarHBondContact O-CB 3.49Å; L486-C490 PolarHBondContact O-N 3.2Å; L486-C490 PolarHBondContact O-SG 3.06Å
487	A	85.2	Confident	86.7	Confident	40 Å²	40	83 Å²	83	33%	0.331	43%	0.431	S	S	.	.	H	α-helix	trans	-66.7	-38.4	175.7	0	0	0	0	0	112.7	M483 Q484 S485 R491	M483-A487 WeakPolarHBondContact O-CB 3.23Å; M483-A487 PolarHBondContact O-N 2.76Å; Q484-A487 WeakPolarHBondContact O-CB 3.3Å; Q484-A487 PolarHBondContact O-N 3.45Å; S485-A487 VanDerWaalsContact C-N 3.3Å; S485-A487 PolarHBondContact O-N 2.96Å; A487-R491 WeakPolarHBondContact O-CG 3.29Å; A487-R491 PolarHBondContact O-N 2.97Å
488	V	85.3	Confident	86.1	Confident	31 Å²	31	88.9 Å²	88.9	19%	0.188	46%	0.46	C	S	.	.	H	α-helix	trans	-62.9	-49.1	172.5	173.3	0	0	0	0	110.7	P459 Q484 S485 C490 R491 Q492	P459-V488 HydrophobicContact CG-CG2 4.42Å; Q484-V488 PolarHBondContact O-N 3.11Å; S485-V488 PolarHBondContact O-N 3.4Å; S485-V488 VanDerWaalsContact O-N 3.16Å; V488-C490 VanDerWaalsContact C-N 3.33Å; V488-C490 PolarHBondContact O-N 3.06Å; V488-R491 WeakPolarHBondContact O-CB 3.43Å; V488-R491 PolarHBondContact O-N 3.03Å; V488-R491 VanDerWaalsContact O-N 3.11Å; V488-Q492 WeakPolarHBondContact O-CG 3.38Å; V488-Q492 PolarHBondContact O-N 3.49Å
489	H	85.5	Confident	85.6	Confident	114 Å²	114	88.9 Å²	88.9	53%	0.528	46%	0.46	S	S	.	.	H	α-helix	trans	-64.4	-36.6	-179.8	-169.3	-120	0	0	0	112.2	S485 L486 Q492 L493	S485-H489 PolarHBondContact O-N 3.16Å; L486-H489 PolarHBondContact O-N 3.35Å; H489-Q492 PolarHBondContact O-N 2.92Å; H489-L493 WeakPolarHBondContact O-CB 3.38Å; H489-L493 PolarHBondContact O-N 3.36Å
490	C	86.9	Confident	84.8	Confident	65 Å²	65	91 Å²	91	44%	0.439	46%	0.463	S	S	.	.	H	α-helix	trans	-62.6	-41	171.4	-75.8	0	0	0	0	112.7	L486 V488 L493 V494	L486-C490 WeakPolarHBondContact O-CB 3.49Å; L486-C490 PolarHBondContact O-N 3.2Å; L486-C490 PolarHBondContact O-SG 3.06Å; V488-C490 VanDerWaalsContact C-N 3.33Å; V488-C490 PolarHBondContact O-N 3.06Å; C490-L493 PolarHBondContact O-N 2.84Å; C490-V494 WeakPolarHBondContact O-CG2 3.45Å; C490-V494 PolarHBondContact O-N 2.87Å
491	R	85.6	Confident	83.7	Confident	100 Å²	100	93.8 Å²	93.8	38%	0.377	48%	0.475	S	S	.	.	H	α-helix	trans	-63.2	-45.3	173.9	-75.8	-174.3	-70.6	-107.6	2	111.6	A487 V488 L493 V494 Q495	A487-R491 WeakPolarHBondContact O-CG 3.29Å; A487-R491 PolarHBondContact O-N 2.97Å; V488-R491 WeakPolarHBondContact O-CB 3.43Å; V488-R491 PolarHBondContact O-N 3.03Å; V488-R491 VanDerWaalsContact O-N 3.11Å; R491-L493 PolarHBondContact O-N 3.23Å; R491-V494 PolarHBondContact O-N 2.99Å; R491-Q495 WeakPolarHBondContact O-CG 3.44Å; R491-Q495 PolarHBondContact O-N 3.06Å
492	Q	87.8	Confident	82.7	Confident	104 Å²	104	97.4 Å²	97.4	49%	0.486	49%	0.488	S	S	.	.	H	α-helix	trans	-60.2	-42.7	175.5	-71.2	173.2	-16.3	0	0	111.9	V488 H489 V494 Q495 A496	V488-Q492 WeakPolarHBondContact O-CG 3.38Å; V488-Q492 PolarHBondContact O-N 3.49Å; H489-Q492 PolarHBondContact O-N 2.92Å; Q492-V494 VanDerWaalsContact C-N 3.35Å; Q492-V494 PolarHBondContact O-N 2.85Å; Q492-Q495 PolarHBondContact O-N 2.79Å; Q492-A496 WeakPolarHBondContact O-CB 3.48Å; Q492-A496 PolarHBondContact O-N 3.15Å
493	L	86.3	Confident	81.6	Confident	114 Å²	114	99.4 Å²	99.4	60%	0.597	50%	0.498	S	S	*	.	H	α-helix	trans	-64.8	-37	177.2	-168.6	70.9	0	0	0	112.2	H489 C490 R491 K497	H489-L493 WeakPolarHBondContact O-CB 3.38Å; H489-L493 PolarHBondContact O-N 3.36Å; C490-L493 PolarHBondContact O-N 2.84Å; R491-L493 PolarHBondContact O-N 3.23Å; L493-K497 VanDerWaalsContact O-CB 3.23Å; L493-K497 WeakPolarHBondContact O-CB 3.33Å; L493-K497 PolarHBondContact O-N 2.54Å
494	V	85	Confident	80.4	Confident	95 Å²	95	98.2 Å²	98.2	58%	0.576	49%	0.491	S	S	*	.	H	α-helix	trans	-66.6	-44.1	172.8	169.8	0	0	0	0	111.2	C490 R491 Q492 K497 M498	C490-V494 WeakPolarHBondContact O-CG2 3.45Å; C490-V494 PolarHBondContact O-N 2.87Å; R491-V494 PolarHBondContact O-N 2.99Å; Q492-V494 VanDerWaalsContact C-N 3.35Å; Q492-V494 PolarHBondContact O-N 2.85Å; V494-K497 PolarHBondContact O-N 2.84Å; V494-M498 HydrophobicContact CG1-CG 4.46Å; V494-M498 WeakPolarHBondContact O-CB 3.39Å; V494-M498 VanDerWaalsContact O-CG 3.26Å; V494-M498 WeakPolarHBondContact O-CG 3.35Å; V494-M498 PolarHBondContact O-N 2.79Å
495	Q	83.5	Confident	78.6	Confident	113 Å²	113	102.7 Å²	102.7	53%	0.528	51%	0.507	S	S	.	.	H	α-helix	trans	-62.1	-46.5	175.6	-73.2	174.1	-17.5	0	0	111.8	R491 Q492 K497 M498 H499	R491-Q495 WeakPolarHBondContact O-CG 3.44Å; R491-Q495 PolarHBondContact O-N 3.06Å; Q492-Q495 PolarHBondContact O-N 2.79Å; Q495-K497 VanDerWaalsContact C-N 3.34Å; Q495-K497 PolarHBondContact O-N 3.42Å; Q495-M498 WeakPolarHBondContact O-CB 3.38Å; Q495-M498 PolarHBondContact O-N 2.88Å; Q495-H499 WeakPolarHBondContact O-CB 3.25Å; Q495-H499 PolarHBondContact O-N 3.34Å
496	A	81.5	Confident	76.8	Confident	58 Å²	58	103.7 Å²	103.7	48%	0.479	51%	0.512	S	S	.	.	H	α-helix	trans	-61.2	-40.7	175.6	0	0	0	0	0	111.9	Q492 H499 Y500	Q492-A496 WeakPolarHBondContact O-CB 3.48Å; Q492-A496 PolarHBondContact O-N 3.15Å; A496-H499 PolarHBondContact O-N 2.96Å; A496-Y500 WeakPolarHBondContact O-CB 3.47Å; A496-Y500 PolarHBondContact O-N 2.89Å
497	K	83.8	Confident	74.7	Confident	138 Å²	138	105.4 Å²	105.4	60%	0.6	52%	0.521	S	S	*	.	H	α-helix	trans	-67.6	-38.4	175.3	-173.8	174.9	-179.3	179.7	0	112.7	L493 V494 Q495 H499 Y500 N501	L493-K497 VanDerWaalsContact O-CB 3.23Å; L493-K497 WeakPolarHBondContact O-CB 3.33Å; L493-K497 PolarHBondContact O-N 2.54Å; V494-K497 PolarHBondContact O-N 2.84Å; Q495-K497 VanDerWaalsContact C-N 3.34Å; Q495-K497 PolarHBondContact O-N 3.42Å; K497-H499 VanDerWaalsContact C-N 3.33Å; K497-Y500 PolarHBondContact O-N 3.42Å; K497-N501 WeakPolarHBondContact O-CB 3.36Å; K497-N501 VanDerWaalsContact O-CG 3.29Å; K497-N501 PolarHBondContact O-N 2.74Å; K497-N501 PolarHBondContact O-OD1 2.82Å
498	M	74.2	Confident	72.4	Confident	131 Å²	131	108.9 Å²	108.9	65%	0.645	54%	0.54	S	S	*	.	H	α-helix	trans	-62	-42.3	171.5	-74.6	-75.5	-76.3	0	0	111	V494 Q495 N501 R502	V494-M498 HydrophobicContact CG1-CG 4.46Å; V494-M498 WeakPolarHBondContact O-CB 3.39Å; V494-M498 VanDerWaalsContact O-CG 3.26Å; V494-M498 WeakPolarHBondContact O-CG 3.35Å; V494-M498 PolarHBondContact O-N 2.79Å; Q495-M498 WeakPolarHBondContact O-CB 3.38Å; Q495-M498 PolarHBondContact O-N 2.88Å; M498-N501 PolarHBondContact O-N 3.25Å; M498-R502 WeakPolarHBondContact O-CB 3.25Å; M498-R502 PolarHBondContact O-N 3.47Å
499	H	76.8	Confident	70.1	Confident	126 Å²	126	113.5 Å²	113.5	58%	0.583	56%	0.562	S	S	*	*	H	α-helix	trans	-68.8	-39.8	178.6	-147.2	-48.5	0	0	0	112.3	Q495 A496 K497 R502 I503	Q495-H499 WeakPolarHBondContact O-CB 3.25Å; Q495-H499 PolarHBondContact O-N 3.34Å; A496-H499 PolarHBondContact O-N 2.96Å; K497-H499 VanDerWaalsContact C-N 3.33Å; H499-R502 PolarHBondContact O-N 2.82Å; H499-I503 WeakPolarHBondContact O-CD1 3.4Å; H499-I503 VanDerWaalsContact O-CG1 3.31Å; H499-I503 WeakPolarHBondContact O-CG1 3.32Å; H499-I503 PolarHBondContact O-N 2.94Å; H499-I503 VanDerWaalsContact O-N 3.13Å
500	Y	74.8	Confident	67.8	Low	136 Å²	136	115.3 Å²	115.3	53%	0.533	57%	0.574	S	S	.	*	H	α-helix	trans	-63.5	-47	172.9	-177.1	-92.7	0	0	0	111.4	A496 K497 R502 I503 Q504	A496-Y500 WeakPolarHBondContact O-CB 3.47Å; A496-Y500 PolarHBondContact O-N 2.89Å; K497-Y500 PolarHBondContact O-N 3.42Å; Y500-R502 VanDerWaalsContact C-N 3.27Å; Y500-R502 PolarHBondContact O-N 2.71Å; Y500-I503 PolarHBondContact O-N 2.9Å; Y500-Q504 HydrophobicContact CE1-CB 4.27Å; Y500-Q504 WeakPolarHBondContact O-CB 3.16Å; Y500-Q504 PolarHBondContact O-N 3.21Å; Y500-Q504 PolarHBondContact OH-NE2 2.89Å
501	N	67.7	Low	65.2	Low	69 Å²	69	118 Å²	118	37%	0.369	58%	0.584	S	S	.	*	H	α-helix	trans	-58.9	-37.9	174.9	-78.9	5.5	0	0	0	111.9	K497 M498 I503 Q504 Y505	K497-N501 WeakPolarHBondContact O-CB 3.36Å; K497-N501 VanDerWaalsContact O-CG 3.29Å; K497-N501 PolarHBondContact O-N 2.74Å; K497-N501 PolarHBondContact O-OD1 2.82Å; M498-N501 PolarHBondContact O-N 3.25Å; N501-I503 VanDerWaalsContact C-N 3.3Å; N501-I503 PolarHBondContact O-N 3.49Å; N501-Q504 PolarHBondContact O-N 2.86Å; N501-Y505 CarbonylContact O-C 3.57Å; N501-Y505 WeakPolarHBondContact O-CA 3.44Å; N501-Y505 WeakPolarHBondContact O-CB 3.45Å; N501-Y505 PolarHBondContact O-N 3.23Å
502	R	67.7	Low	62.7	Low	187 Å²	187	120.8 Å²	120.8	71%	0.706	61%	0.607	S	S	*	*	H	α-helix	trans	-70.2	-23.5	177.1	-167.3	175.7	-173.8	173	3.1	113.5	M498 H499 Y500	M498-R502 WeakPolarHBondContact O-CB 3.25Å; M498-R502 PolarHBondContact O-N 3.47Å; H499-R502 PolarHBondContact O-N 2.82Å; Y500-R502 VanDerWaalsContact C-N 3.27Å; Y500-R502 PolarHBondContact O-N 2.71Å
503	I	68.8	Low	60	Low	120 Å²	120	120.4 Å²	120.4	62%	0.615	62%	0.615	S	S	*	*	H	α-helix	trans	-84.5	-43.4	173.6	-67.4	162.4	0	0	0	110.6	H499 Y500 N501	H499-I503 WeakPolarHBondContact O-CD1 3.4Å; H499-I503 VanDerWaalsContact O-CG1 3.31Å; H499-I503 WeakPolarHBondContact O-CG1 3.32Å; H499-I503 PolarHBondContact O-N 2.94Å; H499-I503 VanDerWaalsContact O-N 3.13Å; Y500-I503 PolarHBondContact O-N 2.9Å; N501-I503 VanDerWaalsContact C-N 3.3Å; N501-I503 PolarHBondContact O-N 3.49Å
504	Q	60.3	Low	57.3	Low	98 Å²	98	121.4 Å²	121.4	46%	0.458	63%	0.626	S	S	.	*	H	α-helix	trans	-75.5	-30.7	-178.2	-166.7	175.8	51.1	0	0	112.7	Y500 N501	Y500-Q504 HydrophobicContact CE1-CB 4.27Å; Y500-Q504 WeakPolarHBondContact O-CB 3.16Å; Y500-Q504 PolarHBondContact O-N 3.21Å; Y500-Q504 PolarHBondContact OH-NE2 2.89Å; N501-Q504 PolarHBondContact O-N 2.86Å
505	Y	48.6	Very low	54.9	Low	140 Å²	140	122 Å²	122	55%	0.549	63%	0.634	S	S	.	*	S	Bend	trans	-127.9	83.6	172.5	-57.6	-84.4	0	0	0	109.2	N501 L507	N501-Y505 CarbonylContact O-C 3.57Å; N501-Y505 WeakPolarHBondContact O-CA 3.44Å; N501-Y505 WeakPolarHBondContact O-CB 3.45Å; N501-Y505 PolarHBondContact O-N 3.23Å; Y505-L507 PolarHBondContact O-N 3.16Å
506	P	47.5	Very low	52.7	Low	97 Å²	97	124.2 Å²	124.2	63%	0.63	64%	0.644	S	S	*	*			trans	-58.3	115.2	170.4	-21.2	33.4	0	0	0	109
507	L	45.4	Very low	50.4	Low	137 Å²	137	131.6 Å²	131.6	72%	0.717	66%	0.661	S	S	*	*			trans	-57	136.9	167.3	-71.1	173.2	0	0	0	108	Y505 I509	Y505-L507 PolarHBondContact O-N 3.16Å; L507-I509 PolarHBondContact O-N 2.77Å
508	P	37.1	Very low	47.9	Very low	113 Å²	113	128.9 Å²	128.9	73%	0.734	67%	0.673	S	S	*	*			trans	-59.1	113.5	-176.5	23.7	-33.4	0	0	0	109.5	I510	P508-I510 PolarHBondContact O-N 2.94Å; P508-I510 VanDerWaalsContact O-N 3.11Å
509	I	36.8	Very low	45.9	Very low	129 Å²	129	126.2 Å²	126.2	66%	0.662	68%	0.679	S	S	*	*			trans	-70.3	110	178.4	-52.9	178.8	0	0	0	106.8	L507 D511	L507-I509 PolarHBondContact O-N 2.77Å; I509-D511 HydrophobicContact CG2-CB 4.49Å; I509-D511 WeakPolarHBondContact CG2-OD1 3.33Å; I509-D511 PolarHBondContact O-N 3.33Å
510	I	37.6	Very low	43.6	Very low	152 Å²	152	127.2 Å²	127.2	78%	0.779	69%	0.689	S	S	*	*			trans	-80	79.9	168.9	-57.4	179.9	0	0	0	106.6	P508 N512	P508-I510 PolarHBondContact O-N 2.94Å; P508-I510 VanDerWaalsContact O-N 3.11Å; I510-N512 VanDerWaalsContact C-N 3.26Å; I510-N512 PolarHBondContact O-N 2.85Å
511	D	31.6	Very low	41.5	Very low	120 Å²	120	127.2 Å²	127.2	64%	0.642	70%	0.698	S	S	*	*			trans	-67.3	82.4	174.7	-81.5	-48	0	0	0	110.2	I509 C513	I509-D511 HydrophobicContact CG2-CB 4.49Å; I509-D511 WeakPolarHBondContact CG2-OD1 3.33Å; I509-D511 PolarHBondContact O-N 3.33Å; D511-C513 PolarHBondContact O-N 2.7Å
512	N	33.8	Very low	39.7	Very low	159 Å²	159	128.5 Å²	128.5	85%	0.85	71%	0.712	S	S	*	*			trans	-80.6	78.7	171.5	-136.5	50.8	0	0	0	109.3	I510 T514	I510-N512 VanDerWaalsContact C-N 3.26Å; I510-N512 PolarHBondContact O-N 2.85Å; N512-T514 PolarHBondContact O-N 2.79Å
513	C	30.4	Very low	38	Very low	97 Å²	97	127.2 Å²	127.2	66%	0.655	72%	0.717	S	S	*	*			trans	-62.4	120.5	-174.8	-67.9	0	0	0	0	114.5	D511	D511-C513 PolarHBondContact O-N 2.7Å
514	T	30.2	Very low	36.4	Very low	135 Å²	135	127 Å²	127	83%	0.828	72%	0.722	S	S	*	*			trans	52.1	-175.1	134.6	48.4	0	0	0	0	120.5	N512	N512-T514 PolarHBondContact O-N 2.79Å
515	S	35.8	Very low	35	Very low	107 Å²	107	131 Å²	131	75%	0.748	74%	0.74	S	S	*	*			trans	74.6	98	-175.2	-152.6	0	0	0	0	114.7
516	Q	37.4	Very low	34.4	Very low	159 Å²	159	129.4 Å²	129.4	74%	0.743	75%	0.747	S	S	*	*				77.5	134.1	63.3	-71.2	-165.3	10.4	0	0	115.3
517	Y	32.7	Very low	33.7	Very low	213 Å²	213	133.3 Å²	133.3	84%	0.835	76%	0.757	S	S	*	*			trans	28.7	109.1	160.6	-56.8	-70.7	0	0	0	117.1
518	G	30.8	Very low	33.2	Very low	82 Å²	82	132.2 Å²	132.2	85%	0.845	76%	0.756	S	S	*	*				86.1	114.1	58.6	0	0	0	0	0	109.8
519	G	31.6	Very low	33.2	Very low	75 Å²	75	133 Å²	133	77%	0.773	76%	0.758	S	S	*	*			trans	134.6	136.1	-178.5	0	0	0	0	0	113
520	N	29.6	Very low	33.3	Very low	147 Å²	147	131.7 Å²	131.7	79%	0.786	76%	0.759	S	S	*	*			trans	-50.8	162.2	174.1	-43.8	-23.1	0	0	0	113.5
521	D	31	Very low	33.2	Very low	136 Å²	136	129.8 Å²	129.8	73%	0.727	75%	0.754	S	S	*	*			trans	66.2	108.4	159.4	-66	-56	0	0	0	116.1
522	S	29.8	Very low	33.4	Very low	96 Å²	96	133 Å²	133	67%	0.671	76%	0.762	S	S	*	*				80	154.2	83.9	-64.3	0	0	0	0	113.1
523	I	31.2	Very low	33.5	Very low	159 Å²	159	129.9 Å²	129.9	82%	0.815	75%	0.749	S	S	*	*			trans	78.2	103.9	159.4	-68.6	161.9	0	0	0	118.2
524	V	34.7	Very low	33.6	Very low	117 Å²	117	129.8 Å²	129.8	71%	0.709	74%	0.741	S	S	*	*				69.5	95.5	128.3	-176	0	0	0	0	120.4
525	Q	31.4	Very low	33.9	Very low	181 Å²	181	128.6 Å²	128.6	85%	0.846	73%	0.733	S	S	*	*				62.8	157.4	117.8	-68.2	-170.9	9.8	0	0	123
526	P	36.3	Very low	33.6	Very low	107 Å²	107	126.4 Å²	126.4	70%	0.695	72%	0.718	S	S	*	*			trans	-108.9	173.1	-167.9	42.3	-35.4	0	0	0	114.9
527	Q	31.8	Very low	33.4	Very low	178 Å²	178	124.4 Å²	124.4	83%	0.832	72%	0.717	S	S	*	*			trans	-169.2	157.2	142.7	-112.6	161.6	86.9	0	0	117.3
528	T	35.3	Very low	33.3	Very low	114 Å²	114	119.7 Å²	119.7	70%	0.699	71%	0.711	S	S	*	*			trans	64.2	98.7	150.5	50.9	0	0	0	0	124.4
529	V	36.5	Very low	33.5	Very low	129 Å²	129	121.9 Å²	121.9	78%	0.782	71%	0.708	S	S	*	*				0.5	168.1	116.7	-66.7	0	0	0	0	121.2
530	P	39.5	Very low	33.4	Very low	103 Å²	103	122.7 Å²	122.7	67%	0.669	70%	0.701	S	S	*	*			cis	-151.9	-177.9	-43.2	46.2	-28.4	0	0	0	117.5
531	T	36.3	Very low	33.4	Very low	111 Å²	111	122 Å²	122	68%	0.681	70%	0.702	S	S	*	*			trans	72.7	154.1	147.1	-40.5	0	0	0	0	122
532	K	36.1	Very low	33.6	Very low	188 Å²	188	122.4 Å²	122.4	82%	0.817	70%	0.703	S	S	*	*			trans	92.4	145.8	164.4	-59.6	-167.4	178.8	178.5	0	116.3
533	V	34.5	Very low	33.5	Very low	94 Å²	94	124.6 Å²	124.6	57%	0.57	71%	0.707	S	S	*	*			cis	-159.4	154.1	-7	118	0	0	0	0	112
534	I	32.5	Very low	33.6	Very low	94 Å²	94	122 Å²	122	48%	0.482	70%	0.704	S	S	.	*			trans	6.2	138.2	153.1	-46.7	156.1	0	0	0	119.5
535	T	36.5	Very low	33.4	Very low	110 Å²	110	121.4 Å²	121.4	68%	0.675	70%	0.704	S	S	*	*				169.2	147.2	120.8	-64.9	0	0	0	0	111.6
536	S	30.3	Very low	33.8	Very low	62 Å²	62	118 Å²	118	43%	0.434	70%	0.7	S	S	.	*			trans	-127.3	137.4	173.5	47.9	0	0	0	0	112.2	N1217	S536-N1217 VanDerWaalsContact CB-ND2 3.27Å; S536-N1217 WeakPolarHBondContact CB-ND2 3.28Å; S536-N1217 VanDerWaalsContact OG-CG 3.25Å; S536-N1217 PolarHBondContact OG-ND2 3.41Å; S536-N1217 PolarHBondContact OG-OD1 3.39Å
537	T	33.1	Very low	33.5	Very low	117 Å²	117	120 Å²	120	72%	0.718	70%	0.704	S	S	*	*			trans	-163.5	119.1	158.8	12.6	0	0	0	0	112.2
538	T	30.5	Very low	33.6	Very low	114 Å²	114	116.4 Å²	116.4	70%	0.699	70%	0.696	S	S	*	*				44.4	160.7	126	61	0	0	0	0	123.4
539	T	34.5	Very low	33.5	Very low	128 Å²	128	117.4 Å²	117.4	79%	0.785	70%	0.702	S	S	*	*			trans	78.4	148.1	166	70.9	0	0	0	0	117
540	S	30.4	Very low	33.4	Very low	91 Å²	91	114.6 Å²	114.6	64%	0.636	69%	0.692	S	S	*	*			cis	152.3	143.1	-44.9	60.4	0	0	0	0	110.7
541	V	28.8	Very low	33.1	Very low	133 Å²	133	115.6 Å²	115.6	81%	0.806	70%	0.697	S	S	*	*			trans	73.3	163.2	165.6	-155.9	0	0	0	0	115.6
542	I	35	Very low	33	Very low	145 Å²	145	115.7 Å²	115.7	74%	0.744	70%	0.697	S	S	*	*			trans	94.4	82.8	164.2	-50	174.4	0	0	0	116
543	N	27.9	Very low	32.8	Very low	141 Å²	141	112 Å²	112	75%	0.754	69%	0.691	S	S	*	*				-0.6	142.5	129	-45.4	-13.6	0	0	0	117.8
544	S	33.3	Very low	32.7	Very low	106 Å²	106	113.7 Å²	113.7	74%	0.741	70%	0.701	S	S	*	*				169.8	118.9	117.4	-72.1	0	0	0	0	108.4
545	S	29.9	Very low	32.7	Very low	103 Å²	103	114 Å²	114	72%	0.72	71%	0.711	S	S	*	*				79.3	73.4	52	81.2	0	0	0	0	115.3
546	S	39.8	Very low	32.5	Very low	109 Å²	109	113.6 Å²	113.6	76%	0.762	71%	0.713	S	S	*	*			trans	-155.1	119.8	156.2	44.9	0	0	0	0	108.3
547	I	30.5	Very low	32.5	Very low	150 Å²	150	115.6 Å²	115.6	77%	0.769	73%	0.728	S	S	*	*			cis	65.9	115.2	39.3	-51.4	178	0	0	0	108.5
548	P	33.4	Very low	32.4	Very low	103 Å²	103	115 Å²	115	67%	0.669	73%	0.728	S	S	*	*				-152.5	163	73.2	42.5	-23.5	0	0	0	120
549	T	33.2	Very low	32.4	Very low	134 Å²	134	114.7 Å²	114.7	82%	0.822	73%	0.731	S	S	*	*			trans	65.6	145	144.5	46.1	0	0	0	0	120.3
550	A	34.8	Very low	32.2	Very low	71 Å²	71	117.1 Å²	117.1	59%	0.587	74%	0.738	S	S	*	*			cis	-165.7	162.9	-6.3	0	0	0	0	0	112.2
551	T	34.2	Very low	32.6	Very low	124 Å²	124	118.5 Å²	118.5	76%	0.761	75%	0.747	S	S	*	*			trans	59	134.9	144.8	51.5	0	0	0	0	119.4
552	T	33.3	Very low	32.8	Very low	113 Å²	113	117.1 Å²	117.1	69%	0.693	74%	0.744	S	S	*	*			cis	-165.6	154.5	4.4	6.5	0	0	0	0	112.7
553	T	32.7	Very low	32.8	Very low	111 Å²	111	119.5 Å²	119.5	68%	0.681	75%	0.749	S	S	*	*			trans	50.9	131	147.5	54.7	0	0	0	0	122.7
554	T	31.9	Very low	33.3	Very low	129 Å²	129	118.7 Å²	118.7	79%	0.791	74%	0.743	S	S	*	*			trans	62.7	138.7	141.4	53.8	0	0	0	0	119.4
555	S	32.7	Very low	33.4	Very low	99 Å²	99	116.2 Å²	116.2	69%	0.692	73%	0.726	S	S	*	*			cis	-168	171.3	-2.4	43.4	0	0	0	0	111.4
556	S	32.8	Very low	33.6	Very low	102 Å²	102	114.3 Å²	114.3	71%	0.713	71%	0.707	S	S	*	*			trans	65.5	120.9	154.3	47	0	0	0	0	121.7
557	S	30.5	Very low	33.3	Very low	105 Å²	105	115.4 Å²	115.4	73%	0.734	70%	0.7	S	S	*	*			trans	68.9	111.6	139.1	55.7	0	0	0	0	123.9
558	S	30.3	Very low	33.4	Very low	105 Å²	105	115.2 Å²	115.2	73%	0.734	70%	0.7	S	S	*	*				72.3	100.6	128.2	62.7	0	0	0	0	124.2
559	S	30.4	Very low	33.3	Very low	107 Å²	107	117.2 Å²	117.2	75%	0.748	71%	0.711	S	S	*	*				81	133.1	117	66.8	0	0	0	0	125
560	L	30.8	Very low	33	Very low	178 Å²	178	118.5 Å²	118.5	93%	0.932	71%	0.707	S	S	*	*			trans	83.6	156.2	157.3	-65.6	165.5	0	0	0	119.2
561	S	38.3	Very low	32.6	Very low	120 Å²	120	121.4 Å²	121.4	84%	0.839	71%	0.713	S	S	*	*			trans	-163.2	145.9	-154.7	173.1	0	0	0	0	114.8
562	S	33.7	Very low	32.2	Very low	104 Å²	104	120.8 Å²	120.8	73%	0.727	71%	0.713	S	S	*	*			trans	-171.6	139.4	163.2	55.5	0	0	0	0	116
563	K	35.5	Very low	32	Very low	195 Å²	195	124.9 Å²	124.9	85%	0.848	72%	0.717	S	S	*	*			trans	59.8	161.5	152.1	-67.3	-175.8	174	-177.7	0	121.9
564	I	37.9	Very low	31.6	Very low	125 Å²	125	129 Å²	129	64%	0.641	72%	0.721	S	S	*	*			trans	94.6	-165.6	161.6	-65.6	146.5	0	0	0	116.1
565	S	34.3	Very low	31.3	Very low	54 Å²	54	127.2 Å²	127.2	38%	0.378	71%	0.714	S	S	.	*				-151.3	175.6	-107.4	-66.4	0	0	0	0	118.2	C1096 S1097 L1098	S565-C1096 WeakPolarHBondContact CB-O 3.24Å; S565-C1096 PolarHBondContact OG-O 2.83Å; S565-S1097 WeakPolarHBondContact CA-O 3.41Å; S565-S1097 VanDerWaalsContact CB-N 3.31Å; S565-S1097 WeakPolarHBondContact CB-O 3.34Å; S565-S1097 WeakPolarHBondContact OG-CA 3.45Å; S565-S1097 PolarHBondContact OG-N 3.46Å; S565-S1097 VanDerWaalsContact OG-N 3.13Å; S565-L1098 PolarHBondContact OG-N 3.44Å
566	N	34.2	Very low	31	Very low	62 Å²	62	128.7 Å²	128.7	33%	0.332	72%	0.719	S	S	.	*			cis	-168.5	165.4	-17	-163.6	10	0	0	0	112.7	C1096 S1097 L1098	N566-C1096 HydrophobicContact CB-CB 3.4Å; N566-C1096 PolarHBondContact ND2-SG 3.25Å; N566-S1097 WeakPolarHBondContact CA-O 3.16Å; N566-S1097 VanDerWaalsContact CB-N 3.34Å; N566-S1097 WeakPolarHBondContact CB-O 3.33Å; N566-S1097 PolarHBondContact ND2-N 3.33Å; N566-S1097 PolarHBondContact OD1-O 2.95Å; N566-L1098 VanDerWaalsContact OD1-CD1 3.32Å; N566-L1098 WeakPolarHBondContact OD1-CD1 3.42Å
567	Q	35	Very low	30.7	Very low	132 Å²	132	127 Å²	127	62%	0.617	72%	0.717	S	S	*	*				172.1	162.1	110	-91.5	-131.5	66.5	0	0	113.9	C1096	Q567-C1096 VanDerWaalsContact CG-SG 3.56Å
568	L	31.9	Very low	30.7	Very low	147 Å²	147	129 Å²	129	77%	0.77	72%	0.72	S	S	*	*			trans	-57.2	146.1	178.1	-73.8	148.5	0	0	0	113.5
569	T	30.3	Very low	30.7	Very low	144 Å²	144	130.5 Å²	130.5	88%	0.883	72%	0.72	S	S	*	*			trans	-160	167	138.2	-2.9	0	0	0	0	110.5
570	E	27.3	Very low	30.6	Very low	161 Å²	161	131.7 Å²	131.7	75%	0.752	72%	0.718	S	S	*	*			trans	-89.9	178.7	-162.3	-42.9	-179.9	134.7	0	0	115.2
571	N	27.1	Very low	30.9	Very low	133 Å²	133	129.9 Å²	129.9	71%	0.711	71%	0.708	S	S	*	*			trans	47	106.5	141.3	-69.3	-41.5	0	0	0	118.3
572	C	26.5	Very low	30.6	Very low	111 Å²	111	130.3 Å²	130.3	75%	0.75	70%	0.697	S	S	*	*			trans	-168.1	126.2	134	-103.9	0	0	0	0	116
573	Y	28.2	Very low	30.7	Very low	198 Å²	198	133 Å²	133	78%	0.776	70%	0.703	S	S	*	*				72.4	130.9	125.6	-78.4	-139.6	0	0	0	122
574	Y	25	Very low	30.4	Very low	198 Å²	198	128.7 Å²	128.7	78%	0.776	69%	0.693	S	S	*	*				36.4	128.8	128.7	-71.9	-83	0	0	0	122.3
575	S	25.5	Very low	30.1	Very low	92 Å²	92	131.5 Å²	131.5	64%	0.643	70%	0.701	S	S	*	*				78.3	145.3	128.1	-65.4	0	0	0	0	121.3
576	T	26.5	Very low	29.7	Very low	129 Å²	129	134.9 Å²	134.9	79%	0.791	72%	0.723	S	S	*	*			trans	42.7	93.2	144.9	57.3	0	0	0	0	117.1
577	G	26.6	Very low	29.4	Very low	66 Å²	66	137.6 Å²	137.6	68%	0.68	74%	0.737	S	S	*	*			trans	-66.4	163.3	168.9	0	0	0	0	0	113.9
578	N	30.6	Very low	29.1	Very low	149 Å²	149	137.4 Å²	137.4	80%	0.797	74%	0.738	S	S	*	*			trans	-119.7	123.4	144.7	-77.7	-69.3	0	0	0	105.8
579	N	28.6	Very low	28.9	Very low	136 Å²	136	134.5 Å²	134.5	73%	0.727	72%	0.723	S	S	*	*				63.5	134.6	64.5	-71.1	-39.3	0	0	0	113.1
580	N	28.9	Very low	29	Very low	132 Å²	132	133 Å²	133	71%	0.706	71%	0.705	S	S	*	*			trans	72	144.2	-168.8	-60.7	-42.2	0	0	0	114.9	Q582	N580-Q582 PolarHBondContact OD1-NE2 3.13Å
581	L	36.3	Very low	29.1	Very low	139 Å²	139	130.5 Å²	130.5	73%	0.728	71%	0.705	S	S	*	*			cis	-137	104.9	8.7	-158.5	69.1	0	0	0	113.4
582	Q	33.5	Very low	29.2	Very low	129 Å²	129	130.2 Å²	130.2	60%	0.603	70%	0.704	S	S	*	*			trans	37.2	113.3	131.7	-55.3	164.4	7.7	0	0	119.9	N580 T584	N580-Q582 PolarHBondContact OD1-NE2 3.13Å; Q582-T584 HydrophobicContact CB-CG2 4.28Å
583	N	34.9	Very low	29.4	Very low	161 Å²	161	132.8 Å²	132.8	86%	0.861	71%	0.705	S	S	*	*			trans	-173.5	65	130.4	-97.5	-26.5	0	0	0	109.9
584	T	29.5	Very low	29.6	Very low	104 Å²	104	126.5 Å²	126.5	64%	0.638	70%	0.7	S	S	*	*				53.7	98.9	81.2	74.3	0	0	0	0	116.2	Q582	Q582-T584 HydrophobicContact CB-CG2 4.28Å
585	K	32	Very low	29.8	Very low	185 Å²	185	124.1 Å²	124.1	80%	0.804	70%	0.7	S	S	*	*				-171.9	105.1	120.6	-106.5	173.1	-179.1	179	0	112.5	I587	K585-I587 HydrophobicContact CD-CD1 4.41Å
586	C	25.3	Very low	30.1	Very low	124 Å²	124	124.3 Å²	124.3	84%	0.838	70%	0.701	S	S	*	*			trans	-86.6	142.5	153.7	-53.2	0	0	0	0	108.2
587	I	28.1	Very low	30.3	Very low	120 Å²	120	125.8 Å²	125.8	62%	0.615	70%	0.704	S	S	*	*			trans	-134.3	111.4	176.3	-75.4	-170.9	0	0	0	109	K585 P1222	K585-I587 HydrophobicContact CD-CD1 4.41Å; I587-P1222 HydrophobicContact CD1-CB 4.38Å; I587-P1222 HydrophobicContact CG1-CB 4.21Å; I587-P1222 HydrophobicContact CG2-CB 3.92Å; I587-P1222 HydrophobicContact CG2-CG 3.78Å
588	I	28.7	Very low	30.6	Very low	128 Å²	128	125.9 Å²	125.9	66%	0.656	71%	0.705	S	S	*	*			trans	-117.7	127.4	177.6	-61.2	161.2	0	0	0	107.3	P1222	I588-P1222 WeakPolarHBondContact O-CD 3.34Å; I588-P1222 VanDerWaalsContact O-CG 3.28Å; I588-P1222 WeakPolarHBondContact O-CG 3.34Å
589	N	28.4	Very low	30.6	Very low	85 Å²	85	121.7 Å²	121.7	46%	0.455	69%	0.687	S	S	.	*			trans	-162.4	134.2	154.1	-102.2	-0.7	0	0	0	109.5	T1221 P1222	N589-T1221 WeakPolarHBondContact OD1-CG2 3.47Å; N589-P1222 HydrophobicContact CB-CG 3.99Å; N589-P1222 VanDerWaalsContact CG-CD 3.47Å; N589-P1222 WeakPolarHBondContact ND2-CD 3.35Å; N589-P1222 PolarHBondContact ND2-O 2.92Å; N589-P1222 VanDerWaalsContact ND2-O 3.11Å
590	K	32	Very low	31	Very low	112 Å²	112	118.4 Å²	118.4	49%	0.487	67%	0.673	S	S	.	*			cis	83.7	109.1	42.7	-71.6	-167.6	-170.1	178.6	0	114.6	Y1220 T1221	K590-Y1220 PolarHBondContact NZ-OH 2.88Å; K590-T1221 HydrophobicContact CD-CG2 4.27Å
591	S	28.5	Very low	30.9	Very low	109 Å²	109	117.2 Å²	117.2	76%	0.762	67%	0.666	S	S	*	*				-172.5	144.9	129.4	43.5	0	0	0	0	108.4
592	N	28.7	Very low	30.5	Very low	127 Å²	127	117.8 Å²	117.8	68%	0.679	67%	0.669	S	S	*	*			cis	-156.9	167.2	-6.4	-114.9	14.4	0	0	0	110.7
593	E	31.3	Very low	30.1	Very low	165 Å²	165	115.6 Å²	115.6	77%	0.771	67%	0.669	S	S	*	*			trans	58.2	131.6	152.1	-66.6	150.6	-125.3	0	0	120.5
594	G	32.1	Very low	30	Very low	67 Å²	67	113.6 Å²	113.6	69%	0.691	66%	0.662	S	S	*	*			cis	169.6	169	-10.2	0	0	0	0	0	116.9
595	I	30.4	Very low	30.2	Very low	148 Å²	148	116.5 Å²	116.5	76%	0.759	67%	0.666	S	S	*	*			trans	75.5	109.7	141.6	-52.6	155.2	0	0	0	119
596	S	31.5	Very low	30.3	Very low	96 Å²	96	113.4 Å²	113.4	67%	0.671	66%	0.658	S	S	*	*			trans	74.8	158.3	144.5	80	0	0	0	0	120.7
597	N	31.2	Very low	30.8	Very low	160 Å²	160	113.5 Å²	113.5	86%	0.856	65%	0.65	S	S	*	*			cis	-168.4	150	-29.2	-96.6	-20.4	0	0	0	109.5
598	G	32.4	Very low	30.9	Very low	68 Å²	68	113.9 Å²	113.9	70%	0.701	65%	0.654	S	S	*	*			trans	80.5	142.1	165.1	0	0	0	0	0	116
599	S	30.6	Very low	31.5	Very low	61 Å²	61	116.3 Å²	116.3	43%	0.427	66%	0.662	S	S	.	*			cis	64.8	149.2	-1.1	-53.4	0	0	0	0	118.1	N1210 N1211	S599-N1210 WeakPolarHBondContact CA-OD1 3.24Å; S599-N1210 PolarHBondContact N-OD1 2.81Å; S599-N1211 PolarHBondContact OG-ND2 2.84Å
600	P	36.4	Very low	31.7	Very low	67 Å²	67	118.1 Å²	118.1	44%	0.435	67%	0.672	S	S	.	*			cis	-146.4	-171.4	-38	42.4	-25.2	0	0	0	116.1	N1210 N1211	P600-N1210 VanDerWaalsContact CA-CB 3.44Å; P600-N1210 HydrophobicContact CB-CB 3.6Å; P600-N1211 HydrophobicContact CB-CB 4.36Å; P600-N1211 VanDerWaalsContact CB-O 3.23Å; P600-N1211 WeakPolarHBondContact CB-O 3.26Å
601	L	27.9	Very low	31.9	Very low	106 Å²	106	119.3 Å²	119.3	56%	0.555	68%	0.681	S	S	*	*			trans	70.8	151.7	152.5	-70.4	172.1	0	0	0	121.8
602	L	27	Very low	31.9	Very low	151 Å²	151	121.1 Å²	121.1	79%	0.791	68%	0.681	S	S	*	*			trans	69.9	159	147.9	-104.2	70.2	0	0	0	117.2
603	S	26.2	Very low	32	Very low	84 Å²	84	120.2 Å²	120.2	59%	0.587	68%	0.68	S	S	*	*			cis	-162.1	176.9	-5.8	-164.7	0	0	0	0	110.2
604	T	32.3	Very low	32.2	Very low	118 Å²	118	122.8 Å²	122.8	72%	0.724	68%	0.683	S	S	*	*			trans	69.9	145.4	160.4	69.5	0	0	0	0	117
605	K	32.4	Very low	32.1	Very low	165 Å²	165	126.7 Å²	126.7	72%	0.717	69%	0.687	S	S	*	*			cis	-165.5	169.7	-6.7	-123.1	179.7	174.5	-170.6	0	111.2
606	D	35.1	Very low	32.3	Very low	120 Å²	120	126.2 Å²	126.2	64%	0.642	69%	0.693	S	S	*	*			trans	64	144.1	151.6	-57.4	-12.1	0	0	0	117.2
607	N	34.8	Very low	32.3	Very low	127 Å²	127	130.6 Å²	130.6	68%	0.679	70%	0.695	S	S	*	*			cis	-146.1	147.5	5	-117.7	-36	0	0	0	112.8
608	N	32	Very low	32.2	Very low	128 Å²	128	130.6 Å²	130.6	68%	0.684	69%	0.692	S	S	*	*			trans	-11.8	125.6	158.2	-53.5	-63.5	0	0	0	119
609	H	41	Very low	32.2	Very low	178 Å²	178	130.6 Å²	130.6	82%	0.824	69%	0.692	S	S	*	*				-169.4	119.1	114.9	-82.3	-45.7	0	0	0	107.9
610	N	32.6	Very low	32.4	Very low	124 Å²	124	133.9 Å²	133.9	66%	0.663	71%	0.71	S	S	*	*				88.9	134	58.4	-171.2	32	0	0	0	112.5
611	M	34.8	Very low	32.1	Very low	137 Å²	137	141.9 Å²	141.9	68%	0.675	73%	0.731	S	S	*	*			trans	64.2	122	-168.4	-52.8	-59.9	165.3	0	0	113.7
612	L	28.3	Very low	32.3	Very low	147 Å²	147	145.9 Å²	145.9	77%	0.77	75%	0.749	S	S	*	*				67.8	148.9	61.5	-87.3	81.6	0	0	0	115.2
613	T	32	Very low	32.7	Very low	107 Å²	107	145.6 Å²	145.6	66%	0.656	74%	0.744	S	S	*	*			trans	76.7	139.6	155.8	42	0	0	0	0	121.4
614	R	36.3	Very low	33.4	Very low	219 Å²	219	147.1 Å²	147.1	83%	0.826	75%	0.752	S	S	*	*			trans	77.1	90.2	147.4	-67.2	152.7	-162.6	-90.8	0.5	118.8
615	L	29.5	Very low	33.4	Very low	149 Å²	149	145.1 Å²	145.1	78%	0.78	74%	0.743	S	S	*	*				-15.7	136.9	128	-68.8	163.9	0	0	0	115.5	R617	L615-R617 HydrophobicContact CB-CB 4.46Å; L615-R617 PolarHBondContact O-N 2.93Å
616	P	35	Very low	33.7	Very low	138 Å²	138	143.9 Å²	143.9	90%	0.896	74%	0.743	S	S	*	*			trans	-82.9	89.9	137.8	33	-27.9	0	0	0	109.3
617	R	31.4	Very low	33.7	Very low	188 Å²	188	146.3 Å²	146.3	71%	0.709	75%	0.752	S	S	*	*			trans	-100.7	145.1	155.5	-173.8	-168.8	166.2	134.6	-0.9	106.7	L615	L615-R617 HydrophobicContact CB-CB 4.46Å; L615-R617 PolarHBondContact O-N 2.93Å
618	M	28.9	Very low	33.7	Very low	161 Å²	161	143.5 Å²	143.5	79%	0.793	75%	0.754	S	S	*	*			trans	77.3	139.9	175	-43.9	-58.7	-141.6	0	0	116.5
619	G	31.9	Very low	33.6	Very low	68 Å²	68	142.5 Å²	142.5	70%	0.701	76%	0.756	S	S	*	*			trans	130.7	123.9	143.3	0	0	0	0	0	115.5
620	T	34.4	Very low	33.2	Very low	130 Å²	130	141.9 Å²	141.9	80%	0.798	76%	0.756	S	S	*	*			cis	-160.1	152.9	-6.6	46.4	0	0	0	0	110.7
621	R	30.7	Very low	33.2	Very low	235 Å²	235	140.2 Å²	140.2	89%	0.887	75%	0.754	S	S	*	*			trans	68.6	151.5	162.7	-76	174.2	160	-176.1	-8.2	116.6
622	M	32.6	Very low	33	Very low	189 Å²	189	138.5 Å²	138.5	93%	0.931	76%	0.755	S	S	*	*			cis	-93.6	162.8	3.7	-72	-178.4	-82.7	0	0	114
623	E	35.3	Very low	33.1	Very low	145 Å²	145	137.8 Å²	137.8	68%	0.678	75%	0.752	S	S	*	*			trans	-122.4	159.5	180	-133.7	-166	-107.3	0	0	107.8	S625	E623-S625 WeakPolarHBondContact OE2-CB 3.42Å; E623-S625 PolarHBondContact OE2-N 2.75Å; E623-S625 PolarHBondContact OE2-OG 3.37Å
624	P	40.4	Very low	33.1	Very low	116 Å²	116	138.7 Å²	138.7	75%	0.753	75%	0.753	S	S	*	*				-124.3	152.6	72.6	17.6	4.5	0	0	0	112.4
625	S	32.9	Very low	33	Very low	77 Å²	77	133.2 Å²	133.2	54%	0.538	75%	0.748	S	S	.	*				56.4	122.9	68.1	-85.6	0	0	0	0	111.1	E623	E623-S625 WeakPolarHBondContact OE2-CB 3.42Å; E623-S625 PolarHBondContact OE2-N 2.75Å; E623-S625 PolarHBondContact OE2-OG 3.37Å
626	I	38.6	Very low	33	Very low	139 Å²	139	131.9 Å²	131.9	71%	0.713	75%	0.751	S	S	*	*			cis	-159.3	157.8	33.2	-109.5	149.3	0	0	0	109.4
627	M	35.4	Very low	33	Very low	170 Å²	170	128.8 Å²	128.8	84%	0.837	75%	0.745	S	S	*	*			trans	32.3	127.9	160.5	-67.4	149.2	51.3	0	0	119.1
628	G	33.5	Very low	32.9	Very low	69 Å²	69	124.9 Å²	124.9	71%	0.711	75%	0.747	S	S	*	*			cis	76	132.8	46.2	0	0	0	0	0	110.6
629	S	30.2	Very low	33	Very low	106 Å²	106	125.4 Å²	125.4	74%	0.741	75%	0.745	S	S	*	*			cis	-173.8	177	0.3	46.6	0	0	0	0	108.2
630	M	32.5	Very low	33.3	Very low	165 Å²	165	129.2 Å²	129.2	81%	0.813	74%	0.744	S	S	*	*			trans	69.6	102	168.2	-56.5	175.6	74.7	0	0	113.8
631	S	31.8	Very low	33.4	Very low	90 Å²	90	127.9 Å²	127.9	63%	0.629	73%	0.732	S	S	*	*				81.8	121.7	70.1	72.1	0	0	0	0	114.5
632	S	31.7	Very low	34	Very low	100 Å²	100	126.7 Å²	126.7	70%	0.699	73%	0.733	S	S	*	*			trans	64.8	138.3	149.1	57.6	0	0	0	0	120.2
633	N	30.8	Very low	33.9	Very low	132 Å²	132	123.1 Å²	123.1	71%	0.706	72%	0.718	S	S	*	*			trans	89.4	127.4	149.9	-77.6	39.9	0	0	0	120.9
634	D	31.7	Very low	33.9	Very low	127 Å²	127	122.7 Å²	122.7	68%	0.679	72%	0.72	S	S	*	*			trans	75.9	106.1	133.6	-53.9	-16.7	0	0	0	121.1
635	S	33.6	Very low	33.7	Very low	103 Å²	103	125 Å²	125	72%	0.72	72%	0.718	S	S	*	*				78.5	109.9	118.7	-58.1	0	0	0	0	120.6
636	S	30.6	Very low	33.8	Very low	121 Å²	121	129 Å²	129	85%	0.846	73%	0.73	S	S	*	*			trans	38.9	97.4	132.4	63.9	0	0	0	0	118.9
637	G	33.6	Very low	33.4	Very low	74 Å²	74	127 Å²	127	76%	0.763	73%	0.729	S	S	*	*			trans	-176.6	91.1	169.4	0	0	0	0	0	109.9
638	S	30.5	Very low	33.2	Very low	106 Å²	106	123.1 Å²	123.1	74%	0.741	72%	0.723	S	S	*	*				74.5	108.8	54.1	-158.1	0	0	0	0	113.7
639	F	31.1	Very low	33.3	Very low	171 Å²	171	127 Å²	127	75%	0.75	73%	0.726	S	S	*	*			trans	91.3	139.5	150.9	-83.3	-139.6	0	0	0	122.6
640	H	38.3	Very low	33.3	Very low	148 Å²	148	127.9 Å²	127.9	69%	0.685	73%	0.727	S	S	*	*			trans	71.5	113.3	154	-67.6	-30.7	0	0	0	120.2
641	D	35.7	Very low	33.5	Very low	103 Å²	103	125.7 Å²	125.7	55%	0.551	72%	0.723	S	S	*	*				89.8	98	57.6	-91.7	-69.8	0	0	0	113.7	N643	D641-N643 PolarHBondContact OD1-ND2 3.2Å
642	K	42.7	Very low	33.4	Very low	210 Å²	210	127.8 Å²	127.8	91%	0.913	73%	0.733	S	S	*	*			trans	-161.3	98.5	139.7	-52.6	-174.7	-173.6	153.1	0	106.2
643	N	30.7	Very low	33.6	Very low	114 Å²	114	126.7 Å²	126.7	61%	0.61	74%	0.737	S	S	*	*			cis	70	138	21.4	-147.9	-22.3	0	0	0	113.5	D641	D641-N643 PolarHBondContact OD1-ND2 3.2Å
644	L	35.7	Very low	33.6	Very low	136 Å²	136	129.5 Å²	129.5	71%	0.712	74%	0.742	S	S	*	*			trans	68	141.7	-170.6	-54.6	105.8	0	0	0	114.7
645	K	36.1	Very low	33.4	Very low	165 Å²	165	130.9 Å²	130.9	72%	0.717	75%	0.749	S	S	*	*			cis	-166.3	152.3	7.5	-132.5	175.2	178	169.3	0	114.8
646	M	35.7	Very low	33.4	Very low	159 Å²	159	131.3 Å²	131.3	78%	0.783	75%	0.752	S	S	*	*			trans	65.2	150.5	155.2	-56.1	-158.6	-51.4	0	0	119.5
647	S	30.5	Very low	33.3	Very low	99 Å²	99	134.2 Å²	134.2	69%	0.692	75%	0.752	S	S	*	*			cis	154.3	134.1	-39.5	57	0	0	0	0	111.2
648	A	30.3	Very low	33.3	Very low	88 Å²	88	135 Å²	135	73%	0.727	75%	0.746	S	S	*	*			trans	70	171.1	157.6	0	0	0	0	0	119.3
649	I	36.2	Very low	33.6	Very low	151 Å²	151	140.7 Å²	140.7	77%	0.774	75%	0.751	S	S	*	*			trans	75.9	98.7	-170.6	-47.6	168.4	0	0	0	111.1
650	T	30.1	Very low	33.7	Very low	124 Å²	124	141 Å²	141	76%	0.761	75%	0.752	S	S	*	*			cis	73.6	84.1	19.2	-36.8	0	0	0	0	116.1
651	T	35.5	Very low	33.8	Very low	119 Å²	119	140 Å²	140	73%	0.73	76%	0.76	S	S	*	*			trans	-177.3	107.9	148.2	25.3	0	0	0	0	108.2
652	T	31.4	Very low	33.7	Very low	134 Å²	134	139.1 Å²	139.1	82%	0.822	76%	0.761	S	S	*	*				46.7	102	80.7	69.9	0	0	0	0	115
653	G	34	Very low	33.3	Very low	76 Å²	76	135.8 Å²	135.8	78%	0.784	75%	0.754	S	S	*	*			trans	-170.7	52.7	-172.1	0	0	0	0	0	120.4
654	K	31.5	Very low	33.5	Very low	191 Å²	191	136.6 Å²	136.6	83%	0.83	76%	0.756	S	S	*	*			trans	23	126.5	143	-65.9	175.9	177.8	175.9	0	121.4
655	L	27.3	Very low	33.7	Very low	156 Å²	156	139.1 Å²	139.1	82%	0.817	76%	0.762	S	S	*	*			trans	68	154.6	131.1	-69.2	164.5	0	0	0	121
656	S	33.2	Very low	33.4	Very low	113 Å²	113	138.4 Å²	138.4	79%	0.79	77%	0.766	S	S	*	*			trans	69.5	149.9	167.6	78.8	0	0	0	0	116
657	H	30.3	Very low	33.7	Very low	182 Å²	182	141.4 Å²	141.4	84%	0.843	77%	0.768	S	S	*	*			cis	168.5	159.6	-27.1	-126.8	44.7	0	0	0	104.9
658	S	31.8	Very low	33.9	Very low	91 Å²	91	142 Å²	142	64%	0.636	77%	0.769	S	S	*	*			trans	72.6	149.9	-176.6	89.6	0	0	0	0	114.4
659	R	38.4	Very low	33.8	Very low	225 Å²	225	143 Å²	143	85%	0.849	77%	0.767	S	S	*	*			cis	-147.9	127.2	20.6	-153.3	161.6	-62.9	179.4	3.7	113.7
660	F	32.2	Very low	33.5	Very low	176 Å²	176	140.7 Å²	140.7	77%	0.772	76%	0.764	S	S	*	*			trans	-62.2	165.4	163.8	-87.4	-86.7	0	0	0	111.7
661	P	41.5	Very low	33.5	Very low	129 Å²	129	139.5 Å²	139.5	84%	0.838	76%	0.761	S	S	*	*				-125.2	117.7	100.4	34.7	-30.1	0	0	0	113
662	S	31.9	Very low	33.1	Very low	84 Å²	84	140.2 Å²	140.2	59%	0.587	76%	0.756	S	S	*	*			trans	-79.8	155.5	162.1	48.8	0	0	0	0	110.1
663	N	34.7	Very low	32.9	Very low	140 Å²	140	142.1 Å²	142.1	75%	0.749	75%	0.748	S	S	*	*			trans	-163.5	129.7	160.4	-109.2	-39.7	0	0	0	112.3
664	I	35.3	Very low	32.7	Very low	130 Å²	130	145.2 Å²	145.2	67%	0.667	74%	0.742	S	S	*	*			trans	68.1	113.3	143.1	-64.7	165.8	0	0	0	115.1
665	K	39	Very low	32.5	Very low	190 Å²	190	143.2 Å²	143.2	83%	0.826	74%	0.735	S	S	*	*			cis	-157.6	144.8	17.5	-129.6	166.8	-157.5	164.4	0	113.9
666	D	31.6	Very low	32.5	Very low	150 Å²	150	139.9 Å²	139.9	80%	0.802	73%	0.725	S	S	*	*			trans	-78	156.6	177.6	-57.3	-95.8	0	0	0	115.4
667	R	40.7	Very low	32.3	Very low	221 Å²	221	141.8 Å²	141.8	83%	0.834	72%	0.721	S	S	*	*			trans	-31	135.3	155.9	-166.3	-172.7	-161.8	-158.7	8.3	115.6	V669	R667-V669 HydrophobicContact CG-CG2 4.38Å
668	P	35.1	Very low	32.2	Very low	111 Å²	111	138 Å²	138	72%	0.721	71%	0.711	S	S	*	*				-114.2	148.8	123.3	-7.6	27.4	0	0	0	110.6
669	V	29.4	Very low	32.2	Very low	110 Å²	110	141.2 Å²	141.2	67%	0.667	72%	0.716	S	S	*	*			cis	76.6	142.7	36.7	-177.4	0	0	0	0	112.8	R667	R667-V669 HydrophobicContact CG-CG2 4.38Å
670	S	29.3	Very low	31.8	Very low	103 Å²	103	137.1 Å²	137.1	72%	0.72	71%	0.707	S	S	*	*			trans	91.8	121.1	-165.4	-41.8	0	0	0	0	111.6
671	S	29.3	Very low	31.8	Very low	99 Å²	99	135.5 Å²	135.5	69%	0.692	70%	0.701	S	S	*	*				72.1	131.2	52.6	-71.1	0	0	0	0	112.3
672	E	28	Very low	31.2	Very low	133 Å²	133	136.6 Å²	136.6	62%	0.621	70%	0.695	S	S	*	*			cis	-158.1	168.8	-3.2	-129	161.5	113.2	0	0	112.5	H674	E672-H674 PolarHBondContact O-N 2.8Å
673	R	27.1	Very low	31.2	Very low	175 Å²	175	140.3 Å²	140.3	66%	0.66	70%	0.703	S	S	*	*			trans	-0	105.7	134.5	178.3	-154.8	-70.3	129.4	0.7	113.6
674	H	29.4	Very low	31	Very low	141 Å²	141	139.4 Å²	139.4	65%	0.653	70%	0.703	S	S	*	*				-157.4	131.6	95.7	-86.4	-77.9	0	0	0	106.4	E672	E672-H674 PolarHBondContact O-N 2.8Å
675	E	28.1	Very low	30.8	Very low	149 Å²	149	138.2 Å²	138.2	70%	0.696	70%	0.702	S	S	*	*				63.7	140.9	55.3	-169	-165.7	-112.2	0	0	111.1
676	S	26.8	Very low	30.5	Very low	85 Å²	85	139.1 Å²	139.1	59%	0.594	70%	0.702	S	S	*	*			trans	71.8	144.1	179	-61.8	0	0	0	0	115.7
677	Q	29.2	Very low	30.7	Very low	154 Å²	154	137 Å²	137	72%	0.72	70%	0.697	S	S	*	*			cis	-159	134.5	-7.4	-118.3	166.4	60.5	0	0	112.2
678	T	27.7	Very low	30.7	Very low	103 Å²	103	131.7 Å²	131.7	63%	0.632	69%	0.692	S	S	*	*			trans	64.4	168.3	148.5	71.8	0	0	0	0	120.3
679	Q	30.7	Very low	30.4	Very low	157 Å²	157	132.4 Å²	132.4	73%	0.734	69%	0.689	S	S	*	*			trans	76.8	125	153.4	-74	167.1	101.3	0	0	118.2
680	Q	30.8	Very low	30.5	Very low	140 Å²	140	131 Å²	131	65%	0.654	68%	0.684	S	S	*	*			cis	-164.9	164.9	-18.8	-133.8	176.5	41.9	0	0	110.6
681	Q	31.7	Very low	30.4	Very low	142 Å²	142	132.5 Å²	132.5	66%	0.664	68%	0.684	S	S	*	*			trans	65	102.5	160.3	-63.6	172.2	57.8	0	0	115.6
682	Q	29.6	Very low	30.2	Very low	151 Å²	151	132.3 Å²	132.3	71%	0.706	68%	0.683	S	S	*	*				83.3	142.3	63.5	-78.4	176.5	49.1	0	0	113.4
683	Q	32.3	Very low	30.2	Very low	163 Å²	163	134.3 Å²	134.3	76%	0.762	69%	0.69	S	S	*	*			trans	67.8	142.7	166.2	-62.9	169.3	33.1	0	0	113.8
684	T	30.7	Very low	30.2	Very low	120 Å²	120	133.1 Å²	133.1	74%	0.736	70%	0.696	S	S	*	*			cis	-167.6	160.8	-8.4	17.8	0	0	0	0	105.3
685	T	30.6	Very low	30.1	Very low	105 Å²	105	134 Å²	134	64%	0.644	70%	0.703	S	S	*	*			cis	-162.8	148.7	9.6	-124.9	0	0	0	0	109.5
686	Y	32.6	Very low	30.6	Very low	209 Å²	209	135.2 Å²	135.2	82%	0.82	71%	0.709	S	S	*	*			trans	61.4	102.2	152.3	-78.3	-120.7	0	0	0	120.8
687	C	35.7	Very low	31	Very low	106 Å²	106	135.9 Å²	135.9	72%	0.716	71%	0.711	S	S	*	*				-35.6	176.7	122.1	-38.6	0	0	0	0	114.7
688	P	40.2	Very low	30.9	Very low	110 Å²	110	135.4 Å²	135.4	71%	0.714	71%	0.714	S	S	*	*			cis	-119.1	-129.3	-0.2	24.1	2.9	0	0	0	109
689	D	30.2	Very low	30.8	Very low	126 Å²	126	135.2 Å²	135.2	67%	0.674	72%	0.716	S	S	*	*			cis	-161.9	165.9	-0.2	-148.3	-20.8	0	0	0	112.4
690	S	30.2	Very low	30.7	Very low	79 Å²	79	134.9 Å²	134.9	55%	0.552	72%	0.718	S	S	*	*			trans	42.4	119.1	139.4	-76.8	0	0	0	0	121.5
691	N	26.6	Very low	30.6	Very low	136 Å²	136	138.2 Å²	138.2	73%	0.727	73%	0.726	S	S	*	*				94.3	113.7	57.5	-81.6	-50.4	0	0	0	113.5
692	S	26.8	Very low	30.9	Very low	94 Å²	94	135.8 Å²	135.8	66%	0.657	72%	0.723	S	S	*	*			trans	72.9	162.6	135.2	81.5	0	0	0	0	120.3
693	K	28.1	Very low	31	Very low	176 Å²	176	134.6 Å²	134.6	77%	0.765	72%	0.721	S	S	*	*			trans	74.6	118.3	168.1	-65.1	169.9	-178.1	177.5	0	114.2
694	L	26.8	Very low	31.2	Very low	150 Å²	150	134.4 Å²	134.4	79%	0.785	72%	0.72	S	S	*	*				79.9	142.5	59.7	-83.3	161.8	0	0	0	112.5
695	I	26.4	Very low	31.4	Very low	159 Å²	159	134.9 Å²	134.9	82%	0.815	72%	0.717	S	S	*	*			trans	88.6	117.7	162.9	-62	143	0	0	0	115.3
696	E	38.9	Very low	31.7	Very low	175 Å²	175	136.4 Å²	136.4	82%	0.818	72%	0.717	S	S	*	*			trans	-62.9	-178.3	159.5	-43.3	172.6	129.6	0	0	110
697	P	35.5	Very low	31.6	Very low	98 Å²	98	132.9 Å²	132.9	64%	0.636	71%	0.708	S	S	*	*			cis	-143.4	-164.2	7.4	40.2	-17.9	0	0	0	114.6
698	N	26.5	Very low	31.5	Very low	145 Å²	145	131.8 Å²	131.8	78%	0.775	70%	0.701	S	S	*	*			trans	69.6	135.2	148.6	-68	-16.6	0	0	0	121.9
699	S	25.3	Very low	31	Very low	98 Å²	98	133.6 Å²	133.6	69%	0.685	69%	0.693	S	S	*	*			trans	85.4	123.3	136.1	-75.9	0	0	0	0	122.9
700	I	28.9	Very low	31.2	Very low	150 Å²	150	132 Å²	132	77%	0.769	68%	0.684	S	S	*	*			trans	81.4	113.6	135.7	-62.3	166.6	0	0	0	118.6
701	Y	28.8	Very low	31.2	Very low	211 Å²	211	132.1 Å²	132.1	83%	0.827	68%	0.679	S	S	*	*				21.5	160.4	126.1	-86.2	-94	0	0	0	121.3
702	P	39	Very low	31.4	Very low	91 Å²	91	127.9 Å²	127.9	59%	0.591	67%	0.668	S	S	*	*			cis	-136.9	-169.9	9.2	43.2	-24.9	0	0	0	116
703	D	31.4	Very low	31.8	Very low	125 Å²	125	128.8 Å²	128.8	67%	0.668	67%	0.674	S	S	*	*			trans	22.4	143.6	137.3	-56.6	-31.5	0	0	0	120.1
704	H	35.4	Very low	32	Very low	159 Å²	159	123.7 Å²	123.7	74%	0.736	67%	0.671	S	S	*	*				-176.9	164.5	76.5	-110.1	-66.5	0	0	0	115.6
705	L	35.5	Very low	32.2	Very low	131 Å²	131	123.5 Å²	123.5	69%	0.686	67%	0.671	S	S	*	*			trans	64.3	139.2	156.8	-86.6	100.6	0	0	0	118.8
706	E	36.4	Very low	32.4	Very low	137 Å²	137	121 Å²	121	64%	0.64	66%	0.663	S	S	*	*			cis	-156.8	133.3	-19.3	-131.1	-178	-170.5	0	0	114
707	Q	31	Very low	32	Very low	134 Å²	134	118.2 Å²	118.2	63%	0.626	66%	0.663	S	S	*	*			trans	52.9	131.5	131.9	-81.6	-173.6	72	0	0	124
708	C	32.9	Very low	31.8	Very low	84 Å²	84	116.7 Å²	116.7	57%	0.568	66%	0.658	S	S	*	*				87.2	137.9	127.2	-74.2	0	0	0	0	121.4
709	R	29.6	Very low	31.9	Very low	148 Å²	148	119.7 Å²	119.7	56%	0.558	66%	0.66	S	S	*	*			cis	-172.8	155.7	-21.5	-124.3	-175.9	-173.9	136.2	-5.7	110	Q869	R709-Q869 PolarHBondContact NH2-O 3.42Å
710	L	34.5	Very low	32	Very low	92 Å²	92	120.5 Å²	120.5	48%	0.482	66%	0.664	S	S	.	*			trans	86.1	130.1	135.7	-77	173.5	0	0	0	126.7	Y870 T871	L710-Y870 WeakPolarHBondContact CD1-O 3.26Å; L710-Y870 WeakPolarHBondContact CD2-O 3.44Å; L710-T871 WeakPolarHBondContact CD1-O 3.32Å; L710-T871 WeakPolarHBondContact CD2-O 3.37Å
711	N	31	Very low	32.1	Very low	81 Å²	81	118.7 Å²	118.7	43%	0.433	66%	0.661	S	S	.	*			trans	80.9	141.3	139	-58.7	-31.7	0	0	0	122.2	T871 T872 H873	N711-T871 PolarHBondContact ND2-O 3.14Å; N711-T872 VanDerWaalsContact CG-N 3.32Å; N711-T872 WeakPolarHBondContact ND2-CA 3.39Å; N711-T872 PolarHBondContact ND2-N 3.06Å; N711-T872 VanDerWaalsContact ND2-N 3.15Å; N711-T872 PolarHBondContact ND2-O 3.03Å; N711-T872 VanDerWaalsContact ND2-O 3.17Å; N711-T872 WeakPolarHBondContact OD1-CA 3.35Å; N711-T872 PolarHBondContact OD1-N 3.38Å; N711-H873 PolarHBondContact ND2-N 3.11Å
712	G	31.4	Very low	32.2	Very low	48 Å²	48	113.2 Å²	113.2	50%	0.495	65%	0.653	S	S	.	*			cis	147.3	95.2	6	0	0	0	0	0	114
713	S	35.3	Very low	31.8	Very low	113 Å²	113	117 Å²	117	79%	0.79	66%	0.663	S	S	*	*			trans	46	134.3	150	63.5	0	0	0	0	123.9
714	G	32.2	Very low	31.6	Very low	68 Å²	68	114.1 Å²	114.1	70%	0.701	65%	0.653	S	S	*	*			trans	95.5	161.2	146.3	0	0	0	0	0	117.8
715	D	30.8	Very low	31.4	Very low	147 Å²	147	117 Å²	117	79%	0.786	66%	0.657	S	S	*	*			cis	-166.2	166.9	-19.2	-140.5	-30.8	0	0	0	112.2
716	T	29.5	Very low	31	Very low	106 Å²	106	119.5 Å²	119.5	65%	0.65	66%	0.662	S	S	*	*			trans	49.2	122.2	156.5	59.5	0	0	0	0	122.8
717	S	31.7	Very low	30.6	Very low	116 Å²	116	117.2 Å²	117.2	81%	0.811	66%	0.662	S	S	*	*			trans	72.2	172.1	130	81.4	0	0	0	0	119
718	A	30.5	Very low	30.6	Very low	66 Å²	66	118.2 Å²	118.2	55%	0.545	67%	0.666	S	S	.	*			cis	-158.7	-179.2	10	0	0	0	0	0	113.2
719	Y	28.8	Very low	30.3	Very low	209 Å²	209	120.2 Å²	120.2	82%	0.82	67%	0.672	S	S	*	*			trans	66.3	106.4	159.2	-64.4	-63.9	0	0	0	117.8
720	C	28.4	Very low	30.4	Very low	114 Å²	114	119.5 Å²	119.5	77%	0.77	68%	0.679	S	S	*	*				90.2	161.3	78.1	-93.8	0	0	0	0	113
721	T	30.2	Very low	30.1	Very low	113 Å²	113	119.1 Å²	119.1	69%	0.693	68%	0.684	S	S	*	*			cis	-132	-176	3.3	39.3	0	0	0	0	110.1
722	S	31.7	Very low	29.9	Very low	95 Å²	95	120.2 Å²	120.2	66%	0.664	70%	0.698	S	S	*	*			trans	50	132.2	136.8	61.3	0	0	0	0	119.6
723	E	29	Very low	29.8	Very low	170 Å²	170	123.5 Å²	123.5	79%	0.794	71%	0.708	S	S	*	*			cis	156.7	164.1	0.5	-125.2	-157.6	90.9	0	0	104.3
724	S	28.8	Very low	29.5	Very low	65 Å²	65	124.5 Å²	124.5	46%	0.455	71%	0.705	S	S	.	*			trans	43.2	107.6	141.7	-70.2	0	0	0	0	121.8
725	R	29.4	Very low	29.4	Very low	220 Å²	220	126.2 Å²	126.2	83%	0.83	70%	0.697	S	S	*	*				82.8	147.9	118.7	-65.8	169.7	-178.8	166.3	-0.4	120.1
726	K	28.8	Very low	29.4	Very low	183 Å²	183	125.7 Å²	125.7	80%	0.796	70%	0.695	S	S	*	*			trans	68.4	110.4	158.8	-70.4	179.4	175.1	-171.9	0	115.3
727	S	28.4	Very low	29.4	Very low	90 Å²	90	124.5 Å²	124.5	63%	0.629	69%	0.691	S	S	*	*			cis	77	153.1	49.5	81.5	0	0	0	0	113.8
728	Q	29.1	Very low	29.4	Very low	155 Å²	155	125.3 Å²	125.3	72%	0.724	69%	0.686	S	S	*	*			trans	75.2	126.7	-175.1	-52.6	-164.1	-94.6	0	0	110.3
729	N	28.2	Very low	29.4	Very low	126 Å²	126	126.3 Å²	126.3	67%	0.674	69%	0.689	S	S	*	*				69.2	125.5	102	-58	18	0	0	0	110.3
730	D	32.1	Very low	29.5	Very low	132 Å²	132	123.2 Å²	123.2	71%	0.706	69%	0.685	S	S	*	*			cis	-127	136.9	21.2	-84.1	-67.3	0	0	0	110.8
731	S	27.3	Very low	29.5	Very low	84 Å²	84	123.9 Å²	123.9	59%	0.587	68%	0.68	S	S	*	*				62.8	127.7	67.1	101.8	0	0	0	0	112.3
732	S	27.3	Very low	29.5	Very low	104 Å²	104	124.7 Å²	124.7	73%	0.727	68%	0.68	S	S	*	*			trans	33.9	122.5	164.3	67	0	0	0	0	117.9
733	V	29	Very low	29.4	Very low	118 Å²	118	126.1 Å²	126.1	72%	0.715	68%	0.68	S	S	*	*				-166.1	128.9	74.7	139.6	0	0	0	0	105.4
734	N	28.3	Very low	29.5	Very low	134 Å²	134	125.5 Å²	125.5	72%	0.717	68%	0.682	S	S	*	*				48.6	135.9	92.9	-107.5	1	0	0	0	110.9
735	N	29.7	Very low	29.4	Very low	103 Å²	103	128.7 Å²	128.7	55%	0.551	69%	0.69	S	S	*	*				173.3	148.6	58.3	-120.8	-16.6	0	0	0	105.8
736	N	30.9	Very low	29.2	Very low	136 Å²	136	124.6 Å²	124.6	73%	0.727	68%	0.684	S	S	*	*				56.1	149.7	128.8	-60.1	-8.3	0	0	0	121.2
737	S	30.9	Very low	29.1	Very low	82 Å²	82	121.3 Å²	121.3	57%	0.573	68%	0.68	S	S	*	*			cis	-167.4	174.7	-13.8	48.4	0	0	0	0	106.9
738	N	30.7	Very low	28.9	Very low	133 Å²	133	121.1 Å²	121.1	71%	0.711	68%	0.679	S	S	*	*				-170.8	130.4	80.6	-87.2	-47.9	0	0	0	111.7
739	S	30	Very low	28.9	Very low	87 Å²	87	120.9 Å²	120.9	61%	0.608	68%	0.682	S	S	*	*			trans	64.1	147.7	140.1	74.4	0	0	0	0	117.9
740	I	31.7	Very low	29	Very low	143 Å²	143	118.3 Å²	118.3	73%	0.733	69%	0.686	S	S	*	*			cis	-126	118.3	10.7	-68.3	166.7	0	0	0	104.6
741	I	28.2	Very low	28.8	Very low	128 Å²	128	116.9 Å²	116.9	66%	0.656	69%	0.686	S	S	*	*				62.1	146.8	63.6	-55.8	170.9	0	0	0	110.6
742	N	30.7	Very low	28.9	Very low	130 Å²	130	119.9 Å²	119.9	70%	0.695	69%	0.694	S	S	*	*			trans	71.2	108	-168.4	-47.5	-30	0	0	0	110.6
743	N	29.5	Very low	29	Very low	125 Å²	125	119.6 Å²	119.6	67%	0.668	69%	0.688	S	S	*	*			cis	42.7	95	42.2	-55.8	-19.4	0	0	0	111.4
744	D	30.3	Very low	28.9	Very low	157 Å²	157	120 Å²	120	84%	0.84	69%	0.686	S	S	*	*				-124.2	124.6	100.1	-89.2	-47.5	0	0	0	107.9
745	H	27	Very low	28.8	Very low	132 Å²	132	119.8 Å²	119.8	61%	0.611	68%	0.681	S	S	*	*				61.5	123	55.8	-108.5	-62.5	0	0	0	113.4
746	N	24.5	Very low	28.6	Very low	134 Å²	134	123.6 Å²	123.6	72%	0.717	69%	0.687	S	S	*	*			trans	67	142.6	159.3	-41.5	-37.3	0	0	0	114.2
747	T	27.1	Very low	28.5	Very low	115 Å²	115	126.4 Å²	126.4	71%	0.706	69%	0.693	S	S	*	*			cis	-131.9	147.9	14.5	46.8	0	0	0	0	107.7
748	S	25.3	Very low	28.5	Very low	86 Å²	86	130.3 Å²	130.3	60%	0.601	70%	0.702	S	S	*	*				43.5	138.5	71.2	85.7	0	0	0	0	113.6
749	N	28.5	Very low	28.2	Very low	149 Å²	149	128.4 Å²	128.4	80%	0.797	70%	0.698	S	S	*	*			cis	-137.5	141.8	22.7	-65.8	-85.9	0	0	0	112.4
750	G	30.3	Very low	28	Very low	73 Å²	73	131.2 Å²	131.2	75%	0.753	71%	0.705	S	S	*	*			trans	77.9	174.3	144	0	0	0	0	0	116.8
751	S	28.4	Very low	27.7	Very low	102 Å²	102	129.6 Å²	129.6	71%	0.713	70%	0.702	S	S	*	*			cis	-140.6	141.1	4.7	-144.1	0	0	0	0	107.4
752	I	28.1	Very low	27.6	Very low	147 Å²	147	128.8 Å²	128.8	75%	0.754	70%	0.703	S	S	*	*				41.8	85.6	65.3	-64.7	177	0	0	0	108
753	T	29.4	Very low	27.5	Very low	97 Å²	97	129.8 Å²	129.8	60%	0.595	71%	0.709	S	S	*	*			cis	-141.3	163.5	32.8	46.6	0	0	0	0	110
754	D	26.9	Very low	27.7	Very low	126 Å²	126	127.5 Å²	127.5	67%	0.674	71%	0.714	S	S	*	*				53.8	153.3	54.4	168.8	56.4	0	0	0	112.1
755	Q	27.5	Very low	27.6	Very low	130 Å²	130	126.5 Å²	126.5	61%	0.607	71%	0.709	S	S	*	*			trans	69.6	113.2	-177.8	-68.3	156	72.9	0	0	116
756	R	24.8	Very low	27.7	Very low	183 Å²	183	125.8 Å²	125.8	69%	0.691	71%	0.71	S	S	*	*				89.1	72.4	51.5	-175.9	-150.5	-149	154.4	7.6	112.8	H758	R756-H758 HydrophobicContact CG-CB 3.9Å
757	F	28.6	Very low	28.2	Very low	195 Å²	195	125.2 Å²	125.2	86%	0.855	71%	0.706	S	S	*	*			trans	-138.9	98.3	143.3	-70.5	-77.9	0	0	0	105.8
758	H	30.5	Very low	28.5	Very low	165 Å²	165	126.8 Å²	126.8	76%	0.764	71%	0.71	S	S	*	*			cis	64	50.7	12.4	-147.7	24.2	0	0	0	115.2	R756	R756-H758 HydrophobicContact CG-CB 3.9Å
759	C	24.3	Very low	28.9	Very low	92 Å²	92	127.3 Å²	127.3	62%	0.622	71%	0.714	S	S	*	*			trans	-164.4	138.1	166.1	53.8	0	0	0	0	105.8
760	I	27.1	Very low	29	Very low	146 Å²	146	126.7 Å²	126.7	75%	0.749	71%	0.711	S	S	*	*			cis	-131.4	122.9	0.4	-63.5	-175.4	0	0	0	105
761	T	24.6	Very low	29	Very low	110 Å²	110	128.3 Å²	128.3	68%	0.675	71%	0.706	S	S	*	*				52.9	130	95.6	-5.2	0	0	0	0	114.9
762	T	25.7	Very low	29	Very low	111 Å²	111	129.8 Å²	129.8	68%	0.681	70%	0.702	S	S	*	*			trans	18.3	145	141.2	64.2	0	0	0	0	119.9
763	D	29.4	Very low	29	Very low	151 Å²	151	132 Å²	132	81%	0.807	70%	0.702	S	S	*	*				-164.1	122	82.7	-84	-16.7	0	0	0	114.2
764	G	32.5	Very low	29.5	Very low	76 Å²	76	132.6 Å²	132.6	78%	0.784	71%	0.708	S	S	*	*			trans	74.4	166.7	154.1	0	0	0	0	0	118.8
765	N	28.6	Very low	29.8	Very low	136 Å²	136	132.1 Å²	132.1	73%	0.727	71%	0.711	S	S	*	*			cis	-162.3	142.8	-20.5	-149	1.5	0	0	0	111
766	N	30.6	Very low	29.8	Very low	118 Å²	118	132.1 Å²	132.1	63%	0.631	72%	0.72	S	S	*	*			trans	65.7	151.7	167.7	-49.8	-56.6	0	0	0	117.9
767	N	33.3	Very low	30	Very low	121 Å²	121	129 Å²	129	65%	0.647	72%	0.721	S	S	*	*			cis	-166.1	144.4	-24	-102.2	-21.7	0	0	0	109.7
768	N	33.6	Very low	29.8	Very low	148 Å²	148	125.1 Å²	125.1	79%	0.791	71%	0.714	S	S	*	*			trans	63.1	154.7	156.7	-58.2	-13.8	0	0	0	116.6
769	S	33.4	Very low	29.6	Very low	97 Å²	97	125 Å²	125	68%	0.678	72%	0.718	S	S	*	*			cis	-174.4	145.4	-12.4	43.3	0	0	0	0	105.1
770	N	31.6	Very low	29.7	Very low	137 Å²	137	124.9 Å²	124.9	73%	0.733	72%	0.718	S	S	*	*			cis	-143	148.4	11.4	-96.6	-15.6	0	0	0	107.2
771	T	30.1	Very low	29.7	Very low	106 Å²	106	125 Å²	125	65%	0.65	72%	0.72	S	S	*	*				35.9	136.3	96.5	83.3	0	0	0	0	115.1
772	Q	28.4	Very low	29.9	Very low	133 Å²	133	124.9 Å²	124.9	62%	0.621	72%	0.724	S	S	*	*			cis	-167.1	152.9	34.6	-167.8	109.9	0.1	0	0	111.4
773	Y	27.7	Very low	30.1	Very low	195 Å²	195	125.4 Å²	125.4	77%	0.765	72%	0.722	S	S	*	*			trans	69.5	124.3	159.8	-71.7	-48.6	0	0	0	123.9
774	P	39.3	Very low	30.1	Very low	109 Å²	109	127.5 Å²	127.5	71%	0.708	72%	0.72	S	S	*	*			trans	-89.4	-163	131.3	43.6	-35.4	0	0	0	108.8
775	P	33.9	Very low	30.3	Very low	115 Å²	115	129 Å²	129	75%	0.747	72%	0.716	S	S	*	*			cis	-133.4	-133.1	-3.9	43.8	-23.1	0	0	0	111.6
776	V	28.1	Very low	30.1	Very low	130 Å²	130	128 Å²	128	79%	0.788	72%	0.715	S	S	*	*			trans	-42.7	120.8	172.7	179.9	0	0	0	0	116.2
777	T	28.2	Very low	30	Very low	118 Å²	118	132.1 Å²	132.1	72%	0.724	72%	0.722	S	S	*	*			trans	-158.5	134.8	141.3	51.1	0	0	0	0	107
778	T	24.1	Very low	29.6	Very low	113 Å²	113	132 Å²	132	69%	0.693	73%	0.726	S	S	*	*				40.2	140.7	74.5	54.8	0	0	0	0	115.4
779	L	26.9	Very low	29.4	Very low	163 Å²	163	131 Å²	131	85%	0.853	72%	0.719	S	S	*	*			trans	59.8	115.8	172.1	-60.5	164.1	0	0	0	114.4
780	S	26.2	Very low	29.1	Very low	89 Å²	89	130.6 Å²	130.6	62%	0.622	72%	0.716	S	S	*	*			cis	124.6	126.6	34.1	55.7	0	0	0	0	108.2
781	N	27.1	Very low	28.8	Very low	150 Å²	150	130.8 Å²	130.8	80%	0.802	72%	0.717	S	S	*	*			trans	68.9	151	161.1	-64	-17.8	0	0	0	120.4
782	S	29.1	Very low	28.7	Very low	106 Å²	106	132.7 Å²	132.7	74%	0.741	72%	0.723	S	S	*	*			trans	54.4	117.2	165	38.9	0	0	0	0	116.3
783	D	30.1	Very low	28.9	Very low	123 Å²	123	134 Å²	134	66%	0.658	73%	0.729	S	S	*	*				-152.8	156.9	58.6	-115	-21.8	0	0	0	116.5
784	Y	29.6	Very low	29	Very low	195 Å²	195	134.6 Å²	134.6	77%	0.765	73%	0.731	S	S	*	*	S	Bend	trans	40.2	126.8	166.5	-54	-65.8	0	0	0	121.8
785	P	35.8	Very low	28.8	Very low	106 Å²	106	136.8 Å²	136.8	69%	0.688	74%	0.737	S	S	*	*			cis	-131.3	134	-41.2	28.8	-10.4	0	0	0	113.7
786	T	25.6	Very low	28.8	Very low	115 Å²	115	134.8 Å²	134.8	71%	0.706	74%	0.737	S	S	*	*				15.4	138	118.4	10	0	0	0	0	117.3
787	R	28.8	Very low	29	Very low	205 Å²	205	136.7 Å²	136.7	77%	0.774	74%	0.743	S	S	*	*			cis	-145.6	168.1	38.5	-59	176.9	-172.6	-133.8	-6.8	109.7
788	T	24.4	Very low	29.4	Very low	120 Å²	120	136.3 Å²	136.3	74%	0.736	75%	0.745	S	S	*	*			cis	54.4	150.9	47.6	-7.9	0	0	0	0	110
789	I	28.7	Very low	29.9	Very low	127 Å²	127	137.9 Å²	137.9	65%	0.651	75%	0.754	S	S	*	*			cis	-148.4	167.9	23.3	-48.9	164.3	0	0	0	107.1
790	S	26.4	Very low	30.1	Very low	88 Å²	88	133.7 Å²	133.7	62%	0.615	75%	0.75	S	S	*	*			trans	-43.6	164.5	152.5	-26.4	0	0	0	0	114.5
791	N	26.7	Very low	30.2	Very low	140 Å²	140	138.9 Å²	138.9	75%	0.749	76%	0.764	S	S	*	*			trans	73.8	104.9	151.2	-56.4	-10.7	0	0	0	120.5
792	L	27.5	Very low	30.5	Very low	147 Å²	147	135.1 Å²	135.1	77%	0.77	76%	0.762	S	S	*	*				71.2	134	129.3	-67.6	156.6	0	0	0	122.3
793	H	32	Very low	30.6	Very low	161 Å²	161	137.8 Å²	137.8	75%	0.745	77%	0.766	S	S	*	*			trans	95.6	93.6	157.2	-59.9	113.8	0	0	0	122.7
794	Y	31	Very low	30.6	Very low	207 Å²	207	138.8 Å²	138.8	81%	0.812	78%	0.776	S	S	*	*				63.5	134.6	118.2	-91.7	-88.3	0	0	0	125.9
795	N	33.9	Very low	30.6	Very low	155 Å²	155	133.7 Å²	133.7	83%	0.829	78%	0.775	S	S	*	*			trans	73.5	133.3	153.9	-74.2	-20	0	0	0	121.9
796	G	35.5	Very low	30.5	Very low	73 Å²	73	133.8 Å²	133.8	75%	0.753	78%	0.778	S	S	*	*			trans	179	-21.5	165.6	0	0	0	0	0	125
797	N	32.5	Very low	30.8	Very low	170 Å²	170	135.8 Å²	135.8	91%	0.909	78%	0.784	S	S	*	*			trans	62.5	139.2	179.1	-65.8	-4.7	0	0	0	120.7
798	S	35.7	Very low	31	Very low	110 Å²	110	130.3 Å²	130.3	77%	0.769	78%	0.777	S	S	*	*			trans	123.5	79.5	133.1	-166.4	0	0	0	0	120.4
799	V	33.8	Very low	31.5	Very low	145 Å²	145	130.9 Å²	130.9	88%	0.879	78%	0.775	S	S	*	*			trans	66.3	115.6	142.2	-170.7	0	0	0	0	119.3
800	G	31.8	Very low	31.7	Very low	76 Å²	76	133 Å²	133	78%	0.784	79%	0.787	S	S	*	*			trans	146.4	21.2	160	0	0	0	0	0	117.9
801	E	29.1	Very low	32	Very low	197 Å²	197	132.3 Å²	132.3	92%	0.921	79%	0.794	S	S	*	*			trans	-77	160.8	-170.5	-67.2	162	178.3	0	0	113.8
802	G	31.9	Very low	32.3	Very low	72 Å²	72	129.6 Å²	129.6	74%	0.742	80%	0.799	S	S	*	*			cis	168.4	161	-1.7	0	0	0	0	0	111.8
803	I	31.4	Very low	32.5	Very low	162 Å²	162	127.9 Å²	127.9	83%	0.831	80%	0.799	S	S	*	*			trans	-111.3	163.2	-178.3	-49.6	167	0	0	0	109
804	T	30.2	Very low	32.4	Very low	143 Å²	143	127.3 Å²	127.3	88%	0.877	80%	0.801	S	S	*	*			trans	88.3	-170.9	170.1	79.5	0	0	0	0	116.3
805	A	30	Very low	32.5	Very low	88 Å²	88	124.7 Å²	124.7	73%	0.727	80%	0.8	S	S	*	*			trans	-146.3	171	-149.6	0	0	0	0	0	114.7
806	S	33.1	Very low	32.3	Very low	109 Å²	109	121.5 Å²	121.5	76%	0.762	79%	0.79	S	S	*	*			trans	90.8	121	164.4	-59	0	0	0	0	120
807	L	31.9	Very low	32	Very low	157 Å²	157	125.4 Å²	125.4	82%	0.822	79%	0.793	S	S	*	*			trans	70.9	124	136.1	-68	169.1	0	0	0	122.8
808	S	34.1	Very low	31.8	Very low	90 Å²	90	123 Å²	123	63%	0.629	79%	0.789	S	S	*	*			trans	76.3	113.8	130.6	-80.6	0	0	0	0	123.2
809	D	33.4	Very low	31.6	Very low	131 Å²	131	122.1 Å²	122.1	70%	0.701	79%	0.789	S	S	*	*				84.4	119.7	120	-68.5	-48.6	0	0	0	123.1
810	L	33.1	Very low	31.4	Very low	171 Å²	171	121 Å²	121	90%	0.895	78%	0.782	S	S	*	*			trans	68.2	136.6	135.5	-62.3	170.7	0	0	0	120.8
811	G	33.4	Very low	31.3	Very low	75 Å²	75	124.3 Å²	124.3	77%	0.773	78%	0.78	S	S	*	*			trans	-171.8	-26.9	155.4	0	0	0	0	0	121.1
812	G	32.6	Very low	31.5	Very low	82 Å²	82	119.6 Å²	119.6	85%	0.845	77%	0.767	S	S	*	*			trans	65.1	-166.9	-172.8	0	0	0	0	0	113.3
813	S	32.4	Very low	31.4	Very low	112 Å²	112	123.1 Å²	123.1	78%	0.783	77%	0.768	S	S	*	*			cis	-156.3	-167.8	-5.2	-166.8	0	0	0	0	108.7
814	L	30.7	Very low	31.5	Very low	149 Å²	149	120.2 Å²	120.2	78%	0.78	76%	0.76	S	S	*	*			trans	73.5	135.2	178.1	-49.3	177.3	0	0	0	113.7
815	L	32.5	Very low	31.6	Very low	152 Å²	152	122.2 Å²	122.2	80%	0.796	76%	0.759	S	S	*	*			cis	-157	157.3	-7.5	-96.6	162.1	0	0	0	104.6
816	S	29.4	Very low	31.5	Very low	88 Å²	88	125.2 Å²	125.2	62%	0.615	76%	0.758	S	S	*	*			cis	-171.7	-178.1	4.6	46.7	0	0	0	0	109.8
817	L	29.6	Very low	31.3	Very low	154 Å²	154	129 Å²	129	81%	0.806	76%	0.757	S	S	*	*			trans	71.7	91.1	167	-52.3	179.5	0	0	0	114.7
818	S	28.8	Very low	31.2	Very low	120 Å²	120	127.8 Å²	127.8	84%	0.839	75%	0.747	S	S	*	*				78.6	98.3	56.8	-55.4	0	0	0	0	115.3
819	A	29.7	Very low	31.1	Very low	92 Å²	92	129.4 Å²	129.4	76%	0.76	74%	0.744	S	S	*	*			trans	-156.7	108.4	133.7	0	0	0	0	0	106.7
820	V	31	Very low	31	Very low	122 Å²	122	130.7 Å²	130.7	74%	0.739	75%	0.746	S	S	*	*				69.4	101.9	96.7	168.4	0	0	0	0	111.3
821	I	29.9	Very low	30.8	Very low	145 Å²	145	131.6 Å²	131.6	74%	0.744	74%	0.737	S	S	*	*				71.5	132.4	71	-69.6	168.5	0	0	0	110.6
822	P	32.6	Very low	30.7	Very low	97 Å²	97	134 Å²	134	63%	0.63	73%	0.728	S	S	*	*			cis	-148.2	-176	-8.1	41.2	-21.2	0	0	0	117.5
823	D	29.7	Very low	30.7	Very low	146 Å²	146	137 Å²	137	78%	0.781	72%	0.72	S	S	*	*			trans	62.5	171.1	136.6	-71.9	-23.4	0	0	0	119.4
824	P	34.3	Very low	30.6	Very low	102 Å²	102	136.6 Å²	136.6	66%	0.662	72%	0.716	S	S	*	*				-136.5	-166.1	-85.5	36.7	-14.3	0	0	0	112.5	H826	P824-H826 PolarHBondContact O-N 2.68Å
825	H	30.6	Very low	30.6	Very low	184 Å²	184	140.6 Å²	140.6	85%	0.852	72%	0.721	S	S	*	*			trans	-58.8	119.5	159.9	-73.2	-92.6	0	0	0	111.1
826	H	29.6	Very low	30.8	Very low	151 Å²	151	137.8 Å²	137.8	70%	0.699	71%	0.712	S	S	*	*			trans	-158.8	159.8	156.1	-114.6	68.2	0	0	0	111.1	P824	P824-H826 PolarHBondContact O-N 2.68Å
827	Y	28.4	Very low	30.9	Very low	190 Å²	190	139.5 Å²	139.5	75%	0.745	71%	0.711	S	S	*	*			trans	69.3	130.7	179.2	-62.6	-83.4	0	0	0	117.2
828	H	29.9	Very low	31.2	Very low	130 Å²	130	140.8 Å²	140.8	60%	0.602	71%	0.706	S	S	*	*			cis	-163.9	174.5	-20.1	-137	18.2	0	0	0	113.7
829	H	31.1	Very low	31.4	Very low	125 Å²	125	140.7 Å²	140.7	58%	0.579	70%	0.696	S	S	*	*			trans	67.2	102	158.4	-63.1	-53.2	0	0	0	121.5
830	H	31.1	Very low	31.5	Very low	158 Å²	158	140.9 Å²	140.9	73%	0.731	69%	0.692	S	S	*	*				79.8	144.5	120	-64.9	-27.4	0	0	0	119.8
831	R	29.4	Very low	31.5	Very low	190 Å²	190	140.3 Å²	140.3	72%	0.717	69%	0.693	S	S	*	*			cis	-159.6	136	5.2	-129.5	-179	146	-175.5	-8	112.9
832	H	32.2	Very low	31.5	Very low	124 Å²	124	141.6 Å²	141.6	57%	0.574	70%	0.696	S	S	*	*			trans	61.8	147.7	156.6	-62.3	-53.7	0	0	0	118.7
833	H	31.9	Very low	31.4	Very low	147 Å²	147	142.4 Å²	142.4	68%	0.681	70%	0.699	S	S	*	*			cis	-156.7	138.6	-3.5	-121.6	-51.7	0	0	0	111.8
834	S	30.4	Very low	31.3	Very low	102 Å²	102	141.9 Å²	141.9	71%	0.713	70%	0.696	S	S	*	*			trans	53.9	145	141.7	-58.3	0	0	0	0	122.6
835	R	30.8	Very low	31	Very low	233 Å²	233	141.3 Å²	141.3	88%	0.879	70%	0.695	S	S	*	*			cis	-174.5	141.2	-15.4	-170	179.3	-168.5	-170.5	3	109.6
836	P	36	Very low	30.9	Very low	93 Å²	93	138 Å²	138	60%	0.604	69%	0.687	S	S	*	*			trans	-106.3	179.9	179.8	40	-34.7	0	0	0	114.5
837	Q	32.8	Very low	30.8	Very low	125 Å²	125	136.9 Å²	136.9	58%	0.584	69%	0.686	S	S	*	*				165.5	149.8	127.9	-91.1	-59.9	1.9	0	0	119.4
838	Y	35.7	Very low	31	Very low	181 Å²	181	135 Å²	135	71%	0.71	69%	0.685	S	S	*	*			trans	64.4	102.7	149	-62.8	-49.8	0	0	0	126.6
839	N	32.1	Very low	30.9	Very low	117 Å²	117	136.8 Å²	136.8	63%	0.626	69%	0.693	S	S	*	*				60.6	132.1	101.8	-94.2	8.9	0	0	0	126.8
840	S	31.2	Very low	30.9	Very low	96 Å²	96	138.1 Å²	138.1	67%	0.671	70%	0.703	S	S	*	*				101.6	143.1	125.2	-70.3	0	0	0	0	123.9
841	S	31.4	Very low	31.1	Very low	111 Å²	111	136.8 Å²	136.8	78%	0.776	71%	0.706	S	S	*	*			trans	70.4	147	151.2	48.8	0	0	0	0	120.9
842	E	31.3	Very low	31.4	Very low	172 Å²	172	133 Å²	133	80%	0.804	71%	0.706	S	S	*	*			cis	-171.5	175.4	-21.2	-165.2	171.3	-154.8	0	0	109.7
843	V	30.4	Very low	31.2	Very low	113 Å²	113	133.6 Å²	133.6	69%	0.685	71%	0.713	S	S	*	*			trans	64	130.5	157.1	-98.6	0	0	0	0	124.4
844	N	27.8	Very low	31.1	Very low	136 Å²	136	132.4 Å²	132.4	73%	0.727	71%	0.712	S	S	*	*			trans	79.1	100	134.8	-84.1	-30.4	0	0	0	123.8
845	S	26.6	Very low	31	Very low	90 Å²	90	132 Å²	132	63%	0.629	71%	0.709	S	S	*	*				82.9	148.6	100.9	-69.5	0	0	0	0	123.6
846	T	28.2	Very low	31	Very low	114 Å²	114	131.1 Å²	131.1	70%	0.699	71%	0.712	S	S	*	*			trans	77.1	115.8	150.6	40.3	0	0	0	0	122.1
847	N	27.5	Very low	30.6	Very low	127 Å²	127	131.5 Å²	131.5	68%	0.679	72%	0.717	S	S	*	*			trans	84.5	151.9	133.2	-60.6	-12.4	0	0	0	120.9
848	H	33.1	Very low	30.6	Very low	152 Å²	152	131.9 Å²	131.9	70%	0.704	73%	0.73	S	S	*	*			trans	69.1	123.7	176.5	-50.2	-67.5	0	0	0	114.4
849	Q	27.1	Very low	30.3	Very low	167 Å²	167	128.1 Å²	128.1	78%	0.78	73%	0.73	S	S	*	*			cis	72	142.7	44.9	-163.8	-176.9	15.5	0	0	111.6
850	I	31.7	Very low	30.3	Very low	153 Å²	153	127.4 Å²	127.4	79%	0.785	74%	0.735	S	S	*	*			trans	95.2	119.2	-178.2	-55.1	158.4	0	0	0	113.8
851	T	35.7	Very low	30.3	Very low	129 Å²	129	128.9 Å²	128.9	79%	0.791	74%	0.735	S	S	*	*			trans	-79.1	138.1	159.9	47.8	0	0	0	0	109.8
852	P	35.7	Very low	30.3	Very low	111 Å²	111	135.7 Å²	135.7	72%	0.721	74%	0.744	S	S	*	*				-125.9	159.9	97.5	4.2	17.8	0	0	0	112.1
853	N	27.9	Very low	30.3	Very low	136 Å²	136	131.7 Å²	131.7	73%	0.727	74%	0.735	S	S	*	*			cis	81	141.4	42.9	-128.6	61.8	0	0	0	114.2
854	D	29.3	Very low	30.5	Very low	122 Å²	122	133.7 Å²	133.7	65%	0.652	74%	0.74	S	S	*	*			trans	72	84.2	162.3	-51.4	-42.3	0	0	0	120.7
855	S	27.8	Very low	30.7	Very low	95 Å²	95	133.5 Å²	133.5	66%	0.664	74%	0.739	S	S	*	*				43.6	129	116.2	66.2	0	0	0	0	121.7
856	F	32.3	Very low	31.1	Very low	214 Å²	214	131.8 Å²	131.8	94%	0.939	74%	0.735	S	S	*	*			trans	-137.4	147.2	140.1	-86.5	-73.5	0	0	0	111.8
857	S	28	Very low	31.2	Very low	100 Å²	100	133.8 Å²	133.8	70%	0.699	74%	0.742	S	S	*	*			trans	-93	158.2	-161.2	-44.9	0	0	0	0	114.8
858	P	31.2	Very low	31.5	Very low	134 Å²	134	132 Å²	132	87%	0.87	74%	0.739	S	S	*	*			trans	-86.6	121.9	156	33.6	-28.4	0	0	0	110.6
859	S	30.8	Very low	31.4	Very low	101 Å²	101	129.6 Å²	129.6	71%	0.706	73%	0.729	S	S	*	*			trans	-159.5	162.5	171.1	58.1	0	0	0	0	111.1
860	S	32.3	Very low	31.7	Very low	103 Å²	103	128.7 Å²	128.7	72%	0.72	72%	0.719	S	S	*	*			trans	71.8	129.7	176.3	-72.6	0	0	0	0	115.7
861	N	29.9	Very low	31.6	Very low	126 Å²	126	125.6 Å²	125.6	67%	0.674	71%	0.707	S	S	*	*			cis	-136.5	174	-3.8	-70.4	-46.7	0	0	0	108.4
862	W	30.7	Very low	31.4	Very low	255 Å²	255	123.1 Å²	123.1	97%	0.966	69%	0.692	S	S	*	*				-129.5	141.3	62.8	-74.3	6.8	0	0	0	113.9
863	S	33.3	Very low	31.3	Very low	88 Å²	88	125.2 Å²	125.2	62%	0.615	69%	0.692	S	S	*	*			trans	-75.3	-175.3	161.6	-42.7	0	0	0	0	110
864	I	32.8	Very low	31.4	Very low	155 Å²	155	122.2 Å²	122.2	80%	0.795	68%	0.682	S	S	*	*			cis	-170.6	153.3	37.8	-135	154.6	0	0	0	105.6
865	D	33.7	Very low	31.5	Very low	131 Å²	131	122.8 Å²	122.8	70%	0.701	69%	0.685	S	S	*	*			cis	-160.2	178.1	-10.7	-130.2	41.5	0	0	0	106.9
866	G	34.2	Very low	31.5	Very low	54 Å²	54	124 Å²	124	56%	0.557	68%	0.684	S	S	*	*			cis	162.1	176.2	0.3	0	0	0	0	0	112.1
867	N	31.1	Very low	31.4	Very low	156 Å²	156	119.3 Å²	119.3	83%	0.834	67%	0.669	S	S	*	*			trans	68.5	148	169.6	-65	-41.6	0	0	0	117.4
868	S	32.9	Very low	31.6	Very low	89 Å²	89	121.6 Å²	121.6	62%	0.622	67%	0.668	S	S	*	*			cis	-164.5	133.2	2.2	125	0	0	0	0	114.5
869	Q	31.3	Very low	31.5	Very low	103 Å²	103	120.5 Å²	120.5	48%	0.481	66%	0.655	S	S	.	*			trans	64.8	149.9	140	-51.1	-56.2	20.2	0	0	122	R709	R709-Q869 PolarHBondContact NH2-O 3.42Å
870	Y	32.9	Very low	31.5	Very low	147 Å²	147	121.4 Å²	121.4	58%	0.576	65%	0.652	S	S	*	*			cis	-165.9	143.4	0.3	-116.8	-35.7	0	0	0	112.2	L710	L710-Y870 WeakPolarHBondContact CD1-O 3.26Å; L710-Y870 WeakPolarHBondContact CD2-O 3.44Å
871	T	29.9	Very low	31.4	Very low	88 Å²	88	122.1 Å²	122.1	54%	0.54	65%	0.647	S	S	.	*			trans	58.8	125	146.6	56.6	0	0	0	0	126.1	L710 N711	L710-T871 WeakPolarHBondContact CD1-O 3.32Å; L710-T871 WeakPolarHBondContact CD2-O 3.37Å; N711-T871 PolarHBondContact ND2-O 3.14Å
872	T	30.8	Very low	31.4	Very low	77 Å²	77	122.4 Å²	122.4	47%	0.472	65%	0.645	S	S	.	*			trans	8.1	153.9	137.6	65.1	0	0	0	0	121.8	N711	N711-T872 VanDerWaalsContact CG-N 3.32Å; N711-T872 WeakPolarHBondContact ND2-CA 3.39Å; N711-T872 PolarHBondContact ND2-N 3.06Å; N711-T872 VanDerWaalsContact ND2-N 3.15Å; N711-T872 PolarHBondContact ND2-O 3.03Å; N711-T872 VanDerWaalsContact ND2-O 3.17Å; N711-T872 WeakPolarHBondContact OD1-CA 3.35Å; N711-T872 PolarHBondContact OD1-N 3.38Å
873	H	33.9	Very low	31.3	Very low	155 Å²	155	119.7 Å²	119.7	72%	0.718	64%	0.636	S	S	*	*			cis	-151	173.8	30.2	-90.4	-71.5	0	0	0	114.6	N711	N711-H873 PolarHBondContact ND2-N 3.11Å
874	S	30.9	Very low	31.2	Very low	73 Å²	73	122 Å²	122	51%	0.51	64%	0.64	S	S	.	*			trans	-78.1	162.9	171.2	32.2	0	0	0	0	115
875	N	30	Very low	31.1	Very low	135 Å²	135	122.3 Å²	122.3	72%	0.722	64%	0.637	S	S	*	*				176	149.9	116.9	-103.3	-36.4	0	0	0	118.4
876	N	28.9	Very low	31.1	Very low	120 Å²	120	121.5 Å²	121.5	64%	0.642	64%	0.64	S	S	*	*			trans	69.1	122.6	138.9	-71.9	-25.4	0	0	0	124.2
877	N	30.1	Very low	31.3	Very low	116 Å²	116	125.3 Å²	125.3	62%	0.62	65%	0.647	S	S	*	*				90.5	132.5	121.4	-85.1	-22.2	0	0	0	122.1
878	H	32.6	Very low	31.6	Very low	147 Å²	147	123.6 Å²	123.6	68%	0.681	64%	0.644	S	S	*	*			trans	73.6	142.3	134.8	-75.3	28.1	0	0	0	116.9
879	N	29.2	Very low	31.3	Very low	111 Å²	111	126.7 Å²	126.7	59%	0.594	65%	0.654	S	S	*	*			cis	-165.9	179.9	-14.9	-124.3	-7.1	0	0	0	108.3
880	N	29.4	Very low	31.2	Very low	120 Å²	120	128.4 Å²	128.4	64%	0.642	67%	0.666	S	S	*	*			trans	67.1	133.5	143.6	-76.7	-2.9	0	0	0	120
881	N	30.5	Very low	31	Very low	118 Å²	118	127.5 Å²	127.5	63%	0.631	67%	0.671	S	S	*	*			trans	76.4	141	138.1	-62.4	-10.1	0	0	0	118
882	Q	29.9	Very low	30.9	Very low	132 Å²	132	129.5 Å²	129.5	62%	0.617	68%	0.679	S	S	*	*			cis	-162.2	142.6	-5	-120.9	162.1	17.1	0	0	110
883	Y	30.1	Very low	30.7	Very low	199 Å²	199	131.2 Å²	131.2	78%	0.78	69%	0.685	S	S	*	*			trans	63.2	157.2	141.7	-77.3	-158.5	0	0	0	118.1
884	I	30.1	Very low	30.5	Very low	137 Å²	137	129.4 Å²	129.4	70%	0.703	68%	0.681	S	S	*	*			cis	-162	168.3	-32.9	-127.5	168.3	0	0	0	106.4
885	H	31.4	Very low	30.3	Very low	160 Å²	160	127.9 Å²	127.9	74%	0.741	67%	0.667	S	S	*	*			trans	-48.6	168.3	166	-93.8	-90.3	0	0	0	114
886	P	33.1	Very low	30.3	Very low	115 Å²	115	131 Å²	131	75%	0.747	67%	0.67	S	S	*	*			cis	-143.3	-179.4	25.3	39.9	-19.2	0	0	0	117.4
887	D	39.2	Very low	30.2	Very low	134 Å²	134	128.1 Å²	128.1	72%	0.717	66%	0.657	S	S	*	*			trans	-59.3	164.9	152.5	-57.4	-83.6	0	0	0	111.8
888	P	36.1	Very low	30.3	Very low	119 Å²	119	130 Å²	130	77%	0.773	66%	0.662	S	S	*	*				-145.9	164.4	101.8	39.2	-26.1	0	0	0	116.2
889	N	26.9	Very low	30.4	Very low	155 Å²	155	127.2 Å²	127.2	83%	0.829	66%	0.659	S	S	*	*			trans	-46.4	151	155.2	-56	-74.2	0	0	0	112.5
890	N	29.9	Very low	30.5	Very low	138 Å²	138	131.4 Å²	131.4	74%	0.738	67%	0.668	S	S	*	*				-169	164.8	109.7	-150.8	-3.6	0	0	0	113.4
891	N	27.6	Very low	30.7	Very low	128 Å²	128	134.7 Å²	134.7	68%	0.684	67%	0.673	S	S	*	*			trans	-57.6	-179.1	170.4	-63.7	-84.9	0	0	0	115.3
892	N	29	Very low	30.8	Very low	130 Å²	130	134.6 Å²	134.6	70%	0.695	68%	0.676	S	S	*	*			trans	82.3	110.2	158.8	-63.8	-45.6	0	0	0	114.4
893	N	27.2	Very low	30.7	Very low	114 Å²	114	132.2 Å²	132.2	61%	0.61	67%	0.674	S	S	*	*				84.8	145.9	73.3	-85.6	-44	0	0	0	112.1
894	N	29.9	Very low	30.7	Very low	116 Å²	116	128.7 Å²	128.7	62%	0.62	67%	0.668	S	S	*	*			trans	70.5	128.5	178.3	-54.8	-34.9	0	0	0	112.7
895	N	26.5	Very low	30.6	Very low	42 Å²	42	128.9 Å²	128.9	23%	0.225	66%	0.66	C	S	.	*				59	96.6	59.2	-54.4	10.7	0	0	0	110.6	R905 Q906	N895-R905 VanDerWaalsContact CG-CD 3.47Å; N895-R905 VanDerWaalsContact OD1-CD 3.25Å; N895-R905 WeakPolarHBondContact OD1-CD 3.34Å; N895-R905 PolarHBondContact OD1-NH1 2.97Å; N895-Q906 PolarHBondContact ND2-NE2 3.5Å
896	Y	29.1	Very low	30.5	Very low	200 Å²	200	126.5 Å²	126.5	78%	0.784	65%	0.649	S	S	*	*				-166.6	118.2	115.4	-86.8	-66.1	0	0	0	103.6
897	T	27.3	Very low	30.4	Very low	59 Å²	59	128.1 Å²	128.1	36%	0.362	65%	0.645	S	S	.	*				58.1	170.2	86.3	71.4	0	0	0	0	112.4
898	E	31.7	Very low	30	Very low	155 Å²	155	128.8 Å²	128.8	72%	0.724	65%	0.648	S	S	*	*			cis	-131	163.4	-3.5	-122.2	93.7	-143.7	0	0	104.2
899	S	34.2	Very low	29.9	Very low	89 Å²	89	128.8 Å²	128.8	62%	0.622	65%	0.651	S	S	*	*	S	Bend	cis	-174.4	157.3	28.8	49.8	0	0	0	0	107
900	Y	32	Very low	30.3	Very low	199 Å²	199	127.1 Å²	127.1	78%	0.78	65%	0.649	S	S	*	*	S	Bend	cis	-130	155.2	-7.3	-70.3	-90.1	0	0	0	107.3
901	Y	34	Very low	30.4	Very low	189 Å²	189	128.8 Å²	128.8	74%	0.741	65%	0.652	S	S	*	*	S	Bend	cis	-133.2	136	7.9	-124.6	-82	0	0	0	109.3
902	T	32	Very low	30.8	Very low	116 Å²	116	127.6 Å²	127.6	71%	0.712	65%	0.651	S	S	*	*			trans	26.7	100.7	158.8	54	0	0	0	0	118.3
903	S	27.3	Very low	30.7	Very low	82 Å²	82	126 Å²	126	57%	0.573	65%	0.65	S	S	*	*			cis	74.3	150.9	41.2	-52.8	0	0	0	0	117.2
904	I	29.4	Very low	30.8	Very low	126 Å²	126	126.8 Å²	126.8	65%	0.646	66%	0.659	S	S	*	*			trans	80.9	101.9	171.8	-47.8	-175.9	0	0	0	113.6
905	R	28.9	Very low	30.7	Very low	141 Å²	141	125.6 Å²	125.6	53%	0.532	66%	0.66	S	S	.	*			cis	91.3	161.9	37.3	-60.8	169.9	-172.3	-107.5	-4.8	113.9	N895	N895-R905 VanDerWaalsContact CG-CD 3.47Å; N895-R905 VanDerWaalsContact OD1-CD 3.25Å; N895-R905 WeakPolarHBondContact OD1-CD 3.34Å; N895-R905 PolarHBondContact OD1-NH1 2.97Å
906	Q	30.1	Very low	30.9	Very low	110 Å²	110	129.1 Å²	129.1	51%	0.514	68%	0.683	S	S	.	*			trans	87.9	141.4	159.8	-66.8	168.9	-31.5	0	0	117.5	N895	N895-Q906 PolarHBondContact ND2-NE2 3.5Å
907	F	30.3	Very low	30.9	Very low	149 Å²	149	124.4 Å²	124.4	65%	0.654	68%	0.68	S	S	*	*			cis	-147.3	168.5	-4.4	-112.2	-48.4	0	0	0	111.1
908	N	30	Very low	31.1	Very low	147 Å²	147	126.2 Å²	126.2	79%	0.786	69%	0.694	S	S	*	*			trans	-88.3	153.9	-179	-56.4	-38.2	0	0	0	113
909	S	34.6	Very low	31	Very low	119 Å²	119	122.5 Å²	122.5	83%	0.832	69%	0.686	S	S	*	*			trans	49.2	163.8	142.1	-75.3	0	0	0	0	121.5
910	P	35	Very low	30.8	Very low	121 Å²	121	127.1 Å²	127.1	79%	0.786	70%	0.695	S	S	*	*			cis	-129.8	-166	8.5	39.6	-20.3	0	0	0	115.3
911	E	32.4	Very low	30.8	Very low	172 Å²	172	124.5 Å²	124.5	80%	0.804	69%	0.693	S	S	*	*			trans	-55.8	-178.3	161.9	-46.3	179.5	129.4	0	0	114
912	P	37	Very low	30.6	Very low	104 Å²	104	121 Å²	121	68%	0.675	70%	0.697	S	S	*	*			cis	-134.2	175.9	-7.5	25.8	-2.7	0	0	0	115.7
913	S	26.6	Very low	30.7	Very low	96 Å²	96	118.8 Å²	118.8	67%	0.671	70%	0.697	S	S	*	*			trans	70.3	149.1	145	74.7	0	0	0	0	120.8
914	T	29.2	Very low	31	Very low	131 Å²	131	126.5 Å²	126.5	80%	0.804	71%	0.713	S	S	*	*			trans	61.2	143.6	171.6	70.4	0	0	0	0	116.1
915	S	27.8	Very low	31	Very low	91 Å²	91	127.4 Å²	127.4	64%	0.636	72%	0.719	S	S	*	*			cis	-170	-174.7	-24	51.7	0	0	0	0	106.4
916	T	29.5	Very low	31.4	Very low	115 Å²	115	131 Å²	131	71%	0.706	74%	0.735	S	S	*	*			trans	51.9	90.4	149	48.5	0	0	0	0	119.1
917	S	29.6	Very low	31.7	Very low	102 Å²	102	131.7 Å²	131.7	71%	0.713	74%	0.742	S	S	*	*				71	154.2	121.8	61.4	0	0	0	0	122.7
918	S	31.1	Very low	31.8	Very low	96 Å²	96	131 Å²	131	67%	0.671	75%	0.745	S	S	*	*			trans	60.2	102.4	151.6	52.9	0	0	0	0	117.6
919	S	29.8	Very low	32.1	Very low	78 Å²	78	133.3 Å²	133.3	55%	0.545	75%	0.748	S	S	.	*				99.7	151.2	60.7	61.9	0	0	0	0	113
920	F	30.9	Very low	32.3	Very low	186 Å²	186	132.9 Å²	132.9	82%	0.816	75%	0.745	S	S	*	*			trans	74.2	155.3	172.2	-44.8	-58.5	0	0	0	115.6
921	I	31.1	Very low	32.4	Very low	143 Å²	143	132 Å²	132	73%	0.733	74%	0.742	S	S	*	*			cis	-156.5	160.6	-19.9	-115.4	166.6	0	0	0	110.9
922	S	29.8	Very low	32.5	Very low	117 Å²	117	130.9 Å²	130.9	82%	0.818	74%	0.741	S	S	*	*			trans	-11.9	151.5	166	-43.2	0	0	0	0	122.7
923	G	33.7	Very low	32.5	Very low	69 Å²	69	133.4 Å²	133.4	71%	0.711	74%	0.744	S	S	*	*			trans	-164.9	73.9	167.9	0	0	0	0	0	119.9
924	R	33.6	Very low	32.8	Very low	243 Å²	243	135.2 Å²	135.2	92%	0.917	74%	0.742	S	S	*	*			trans	54.8	126.6	152.1	-56.8	171.3	-179.9	156.5	0.1	119.3
925	N	29.5	Very low	33.2	Very low	146 Å²	146	136.4 Å²	136.4	78%	0.781	74%	0.742	S	S	*	*				72.5	114	50.3	-83.3	10.1	0	0	0	118.5
926	Y	37.8	Very low	33.7	Very low	217 Å²	217	137.9 Å²	137.9	85%	0.851	75%	0.749	S	S	*	*			trans	-145.7	117.2	147.3	-73.1	-81.9	0	0	0	106.4
927	N	35.5	Very low	33.8	Very low	124 Å²	124	137.5 Å²	137.5	66%	0.663	75%	0.752	S	S	*	*				70	129.2	77.8	-66.3	3.6	0	0	0	113.3
928	N	34	Very low	34.1	Very low	135 Å²	135	138.7 Å²	138.7	72%	0.722	76%	0.755	S	S	*	*			cis	-154.5	154.8	-2.1	-76.4	-36.4	0	0	0	108
929	K	36.5	Very low	34.2	Very low	195 Å²	195	138.6 Å²	138.6	85%	0.848	75%	0.754	S	S	*	*				-177.3	137.8	77.8	-81.9	177.9	179.5	175.6	0	108.9
930	S	37.6	Very low	34.5	Very low	110 Å²	110	141.4 Å²	141.4	77%	0.769	76%	0.763	S	S	*	*				65.4	130.4	100.2	-144.6	0	0	0	0	115.9
931	S	37.5	Very low	34.7	Very low	103 Å²	103	138.2 Å²	138.2	72%	0.72	76%	0.755	S	S	*	*			cis	-168.3	170.8	-2.3	28.5	0	0	0	0	112.8
932	N	34.9	Very low	34.8	Very low	148 Å²	148	137.8 Å²	137.8	79%	0.791	75%	0.754	S	S	*	*			trans	-51.1	179.6	-177.8	-33.1	-17.8	0	0	0	117.2
933	E	36.1	Very low	35	Very low	156 Å²	156	138.7 Å²	138.7	73%	0.729	75%	0.749	S	S	*	*			cis	-156.7	-177.5	25.2	-88	-146.8	-165.3	0	0	111.6
934	Q	34.1	Very low	34.9	Very low	135 Å²	135	141.4 Å²	141.4	63%	0.631	75%	0.748	S	S	*	*			cis	179.6	110.8	-39.4	179.8	163.2	-127.6	0	0	113.9
935	L	36.3	Very low	35.1	Very low	156 Å²	156	136.2 Å²	136.2	82%	0.817	74%	0.738	S	S	*	*			trans	62.7	-179.6	156.8	-61.8	173.6	0	0	0	119.3
936	P	38.5	Very low	35.1	Very low	121 Å²	121	136.7 Å²	136.7	79%	0.786	74%	0.741	S	S	*	*			cis	-130.7	-174.4	-17.8	19.8	6.3	0	0	0	116.7
937	S	32.4	Very low	35.1	Very low	108 Å²	108	133.3 Å²	133.3	76%	0.755	73%	0.732	S	S	*	*			trans	-72.1	160.2	-179.6	55.2	0	0	0	0	120.5
938	T	35.8	Very low	34.7	Very low	127 Å²	127	134.2 Å²	134.2	78%	0.779	74%	0.737	S	S	*	*				-175.9	117.4	127.4	30.5	0	0	0	0	109.3
939	S	32.5	Very low	34.7	Very low	94 Å²	94	136.2 Å²	136.2	66%	0.657	74%	0.736	S	S	*	*				58.1	110.9	89.9	71.2	0	0	0	0	116.8
940	D	36.6	Very low	34.5	Very low	137 Å²	137	132.9 Å²	132.9	73%	0.733	73%	0.727	S	S	*	*				-178.5	156.2	108.4	-102.1	10.6	0	0	0	116.3
941	N	35.6	Very low	34	Very low	119 Å²	119	135 Å²	135	64%	0.636	73%	0.73	S	S	*	*			trans	28.8	119.3	149.9	-66.4	-60.2	0	0	0	121.2
942	N	32.2	Very low	33.8	Very low	133 Å²	133	136 Å²	136	71%	0.711	73%	0.734	S	S	*	*				81.8	146	69.9	-100.8	-32.8	0	0	0	115.3
943	N	35.1	Very low	33.4	Very low	136 Å²	136	133.7 Å²	133.7	73%	0.727	73%	0.73	S	S	*	*			trans	70.1	154.1	167.9	-65.9	-36.1	0	0	0	118.1
944	N	31.7	Very low	33.3	Very low	126 Å²	126	131.9 Å²	131.9	67%	0.674	73%	0.731	S	S	*	*			cis	-172.4	175.3	-42.2	-123.3	-38.8	0	0	0	109.8
945	N	36.7	Very low	33	Very low	134 Å²	134	129.6 Å²	129.6	72%	0.717	73%	0.73	S	S	*	*			trans	65.8	91.4	154.3	-61	-12.3	0	0	0	119.9
946	N	29.9	Very low	32.5	Very low	156 Å²	156	129 Å²	129	83%	0.834	73%	0.728	S	S	*	*				-7.3	123.4	125	-61.9	-22	0	0	0	117.4
947	H	37.3	Very low	32.1	Very low	147 Å²	147	129.5 Å²	129.5	68%	0.681	72%	0.72	S	S	*	*			trans	-149	127.6	137.1	-84.6	-72.5	0	0	0	105.2	Y949	H947-Y949 HydrophobicContact CB-CD2 3.87Å; H947-Y949 HydrophobicContact CB-CE2 3.77Å; H947-Y949 AromaticContact CG-CE2 3.75Å; H947-Y949 AromaticContact ND1-CE2 3.69Å
948	N	28	Very low	31.9	Very low	142 Å²	142	132 Å²	132	76%	0.759	72%	0.719	S	S	*	*			cis	64	72	26.6	-155.9	29.9	0	0	0	114.6
949	Y	33.4	Very low	31.5	Very low	177 Å²	177	131.8 Å²	131.8	69%	0.694	71%	0.707	S	S	*	*			trans	-133.8	110.3	156.6	-78.8	-86.9	0	0	0	105.5	H947	H947-Y949 HydrophobicContact CB-CD2 3.87Å; H947-Y949 HydrophobicContact CB-CE2 3.77Å; H947-Y949 AromaticContact CG-CE2 3.75Å; H947-Y949 AromaticContact ND1-CE2 3.69Å
950	N	32.8	Very low	31.3	Very low	125 Å²	125	136.4 Å²	136.4	67%	0.668	71%	0.71	S	S	*	*				86.5	116.8	86	-76.5	4.3	0	0	0	113.1
951	N	26.6	Very low	30.9	Very low	154 Å²	154	135.4 Å²	135.4	82%	0.824	71%	0.705	S	S	*	*			trans	-56.3	149	158.6	-71	-21.6	0	0	0	110.6
952	P	33.8	Very low	31.1	Very low	124 Å²	124	137.5 Å²	137.5	81%	0.805	71%	0.713	S	S	*	*			trans	-124.5	111.6	135.5	33.8	-24.6	0	0	0	111.3
953	S	25.8	Very low	30.9	Very low	101 Å²	101	138 Å²	138	71%	0.706	72%	0.716	S	S	*	*			trans	-72.3	174.7	141.4	-7.8	0	0	0	0	108.9
954	P	35.1	Very low	30.5	Very low	117 Å²	117	136 Å²	136	76%	0.76	71%	0.712	S	S	*	*			cis	-128.2	-119.3	-18.6	37	-17.4	0	0	0	107.7
955	S	26.4	Very low	30.3	Very low	88 Å²	88	134.9 Å²	134.9	62%	0.615	71%	0.71	S	S	*	*			trans	78.6	126.5	163.9	92.4	0	0	0	0	113.5
956	N	26.9	Very low	29.8	Very low	142 Å²	142	136.1 Å²	136.1	76%	0.759	71%	0.709	S	S	*	*				74.6	120.6	89	-66.6	1.9	0	0	0	111.1
957	E	29	Very low	29.8	Very low	132 Å²	132	134.8 Å²	134.8	62%	0.617	70%	0.702	S	S	*	*			cis	-138.1	144.3	3	-99.6	173.5	92.5	0	0	107.5	K959	E957-K959 IonicContact OE1-NZ 2.74Å; E957-K959 PolarHBondContact OE1-NZ 3.18Å
958	H	27.7	Very low	29.3	Very low	160 Å²	160	134.2 Å²	134.2	74%	0.741	70%	0.703	S	S	*	*				52.9	123.6	76	-138.6	86.2	0	0	0	111.2
959	K	28.9	Very low	29.2	Very low	123 Å²	123	132.1 Å²	132.1	54%	0.535	70%	0.7	S	S	.	*			trans	76.2	146.3	177.4	-40.9	142.3	-174	165.2	0	113.7	E957	E957-K959 IonicContact OE1-NZ 2.74Å; E957-K959 PolarHBondContact OE1-NZ 3.18Å
960	R	27.8	Very low	28.9	Very low	191 Å²	191	130.1 Å²	130.1	72%	0.721	70%	0.7	S	S	*	*			cis	-170.7	150.1	-11.2	-112.3	168.8	-151.1	151	2.8	107.1
961	N	28	Very low	28.5	Very low	116 Å²	116	134.5 Å²	134.5	62%	0.62	71%	0.707	S	S	*	*			trans	65.6	137.4	160	-50.8	-6.9	0	0	0	114.9
962	M	39.5	Very low	28.5	Very low	164 Å²	164	131 Å²	131	81%	0.808	70%	0.695	S	S	*	*			cis	-121	135.1	9.5	-50	-73.3	168.5	0	0	107.7
963	N	29.5	Very low	28.1	Very low	143 Å²	143	131.7 Å²	131.7	77%	0.765	69%	0.692	S	S	*	*			cis	57.7	116.1	4.3	-129.7	27.5	0	0	0	115.9
964	S	25.9	Very low	28.2	Very low	94 Å²	94	134.7 Å²	134.7	66%	0.657	70%	0.696	S	S	*	*			trans	63.8	141.7	-148.3	-77.6	0	0	0	0	112.7
965	T	27.1	Very low	27.9	Very low	102 Å²	102	136.3 Å²	136.3	63%	0.626	69%	0.691	S	S	*	*			cis	-135	161.3	4.8	22.5	0	0	0	0	109.1
966	K	26.8	Very low	28.2	Very low	160 Å²	160	141.7 Å²	141.7	70%	0.696	70%	0.704	S	S	*	*				38	138.5	84	-26.3	173.2	-167.6	169.6	0	113.4
967	D	28.5	Very low	28.2	Very low	128 Å²	128	140.9 Å²	140.9	68%	0.684	70%	0.696	S	S	*	*			cis	-132.2	157.6	19	-75.3	-79.1	0	0	0	110.6
968	L	27.2	Very low	28.5	Very low	136 Å²	136	143.9 Å²	143.9	71%	0.712	71%	0.707	S	S	*	*				59.4	46.1	51.9	-81.9	171	0	0	0	114.7	I970	L968-I970 HydrophobicContact CD2-CD1 3.73Å
969	S	27.2	Very low	28.6	Very low	98 Å²	98	139.6 Å²	139.6	69%	0.685	70%	0.695	S	S	*	*			trans	-137.5	117.1	146.7	-92.1	0	0	0	0	108.8
970	I	26.3	Very low	28.7	Very low	135 Å²	135	140.6 Å²	140.6	69%	0.692	71%	0.706	S	S	*	*			cis	47.9	54.8	26.3	-37.7	-179.9	0	0	0	112.1	L968	L968-I970 HydrophobicContact CD2-CD1 3.73Å
971	R	24	Very low	28.8	Very low	217 Å²	217	138.3 Å²	138.3	82%	0.819	70%	0.701	S	S	*	*			trans	-171.3	103	139.7	-98.1	138.6	-168.6	-152.9	-1.5	108.7
972	S	26.3	Very low	28.9	Very low	81 Å²	81	141.8 Å²	141.8	57%	0.566	71%	0.706	S	S	*	*				68.6	150.7	70.4	82.8	0	0	0	0	113.3
973	N	27.1	Very low	28.6	Very low	138 Å²	138	138.9 Å²	138.9	74%	0.738	69%	0.69	S	S	*	*			trans	49.1	108.5	149	-59.2	-45.4	0	0	0	115
974	M	27.9	Very low	28.7	Very low	164 Å²	164	138 Å²	138	81%	0.808	68%	0.682	S	S	*	*				-171.5	139.2	61.9	-76.3	-166.4	-160.9	0	0	112.6
975	K	28.4	Very low	29	Very low	150 Å²	150	140.3 Å²	140.3	65%	0.652	68%	0.682	S	S	*	*				25.5	105	127.3	-56	174	177.5	179.6	0	117.6	Q977	K975-Q977 HydrophobicContact CB-CB 4.3Å
976	F	32.3	Very low	29.2	Very low	201 Å²	201	141.1 Å²	141.1	88%	0.882	68%	0.678	S	S	*	*				-123.4	119.3	111.8	-80.4	-88.9	0	0	0	105.5
977	Q	27.3	Very low	29.3	Very low	125 Å²	125	139.6 Å²	139.6	58%	0.584	67%	0.673	S	S	*	*			cis	57.7	57.3	29	-92.1	-164.8	-22.9	0	0	113.8	K975 S979	K975-Q977 HydrophobicContact CB-CB 4.3Å; Q977-S979 VanDerWaalsContact C-OG 3.25Å; Q977-S979 WeakPolarHBondContact CA-OG 3.44Å; Q977-S979 PolarHBondContact O-OG 2.9Å
978	K	35.2	Very low	29.4	Very low	196 Å²	196	140.3 Å²	140.3	85%	0.852	67%	0.672	S	S	*	*				-122	113.9	118	-65.2	175.8	-176	169.8	0	106.4
979	S	28.8	Very low	29.8	Very low	69 Å²	69	142 Å²	142	48%	0.483	68%	0.676	S	S	.	*			cis	50.5	75.4	13.2	76.4	0	0	0	0	114	Q977	Q977-S979 VanDerWaalsContact C-OG 3.25Å; Q977-S979 WeakPolarHBondContact CA-OG 3.44Å; Q977-S979 PolarHBondContact O-OG 2.9Å
980	D	32.8	Very low	30.3	Very low	144 Å²	144	146 Å²	146	77%	0.77	68%	0.683	S	S	*	*			trans	-164.7	148.2	134.7	-99.6	-7.2	0	0	0	110
981	F	29.7	Very low	30.7	Very low	144 Å²	144	144.2 Å²	144.2	63%	0.632	68%	0.681	S	S	*	*			cis	-172.2	164.4	-29	-144.5	-124.2	0	0	0	107.2
982	R	30.2	Very low	31	Very low	188 Å²	188	142.5 Å²	142.5	71%	0.709	68%	0.679	S	S	*	*			trans	72.4	149.3	163.8	-50.7	-166.4	-166.6	-94	-5	117.7
983	H	32.4	Very low	31.1	Very low	103 Å²	103	145.4 Å²	145.4	48%	0.477	69%	0.688	S	S	.	*			cis	-156.5	135.1	-18.9	-107.9	-7.6	0	0	0	109.7
984	Q	31.5	Very low	31.3	Very low	126 Å²	126	146.2 Å²	146.2	59%	0.589	69%	0.687	S	S	*	*				70.3	137	111.1	-70.8	172.8	-19.2	0	0	117.9
985	H	32.6	Very low	31.5	Very low	142 Å²	142	144.5 Å²	144.5	66%	0.657	68%	0.681	S	S	*	*			trans	70.5	149.1	142.8	-67.5	-160.9	0	0	0	116.3
986	H	31.4	Very low	31.5	Very low	119 Å²	119	141.4 Å²	141.4	55%	0.551	68%	0.678	S	S	*	*			cis	-148.5	140.6	-7.2	-121	10.4	0	0	0	108.5
987	Q	29.4	Very low	31.3	Very low	128 Å²	128	138.3 Å²	138.3	60%	0.598	67%	0.671	S	S	*	*				61	139.7	112.2	-74	-179.3	1.1	0	0	118.1
988	H	29.6	Very low	31.3	Very low	143 Å²	143	138.7 Å²	138.7	66%	0.662	68%	0.676	S	S	*	*			trans	48.6	123.9	145.8	-53.9	-48.9	0	0	0	118.7
989	H	35.8	Very low	30.8	Very low	170 Å²	170	136.7 Å²	136.7	79%	0.787	67%	0.673	S	S	*	*				-165.8	140.7	51.8	-100.3	-67	0	0	0	113.1
990	H	37.5	Very low	30.7	Very low	182 Å²	182	138.7 Å²	138.7	84%	0.843	68%	0.683	S	S	*	*			trans	-61.9	147	145.4	-74.3	-73	0	0	0	109.3
991	P	34.9	Very low	30.4	Very low	98 Å²	98	139.8 Å²	139.8	64%	0.636	68%	0.683	S	S	*	*				-154.2	142.6	96.9	37.1	-18.1	0	0	0	118.2
992	K	30.2	Very low	30.4	Very low	181 Å²	181	140.6 Å²	140.6	79%	0.787	69%	0.688	S	S	*	*				65.8	121.5	127.7	-63.4	177	-172.7	174	0	118.5
993	L	29	Very low	30.3	Very low	142 Å²	142	138.3 Å²	138.3	74%	0.743	69%	0.691	S	S	*	*				105.7	159.5	52.1	-92.6	-179.3	0	0	0	110.8
994	H	31.6	Very low	30.5	Very low	155 Å²	155	137.6 Å²	137.6	72%	0.718	70%	0.695	S	S	*	*			trans	79	131.5	-179.9	-47.4	96.8	0	0	0	113.4
995	N	31.4	Very low	30.2	Very low	128 Å²	128	138.9 Å²	138.9	68%	0.684	70%	0.701	S	S	*	*			cis	-142.1	149.8	-1.9	-101.8	-25.6	0	0	0	108
996	S	28.7	Very low	30.1	Very low	86 Å²	86	139.1 Å²	139.1	60%	0.601	70%	0.7	S	S	*	*				56.4	139.7	66.3	108.5	0	0	0	0	112.1
997	N	27.4	Very low	30.2	Very low	136 Å²	136	142.6 Å²	142.6	73%	0.727	71%	0.714	S	S	*	*			cis	-168.4	171.6	7.7	-138.5	-13.2	0	0	0	109.5
998	L	27.1	Very low	30.3	Very low	132 Å²	132	141.2 Å²	141.2	69%	0.691	71%	0.714	S	S	*	*			trans	65.2	142.5	172.3	-77.5	75.5	0	0	0	115
999	I	25.5	Very low	30.7	Very low	155 Å²	155	143.1 Å²	143.1	80%	0.795	72%	0.72	S	S	*	*			cis	79.1	136.2	42.4	-58.7	167.4	0	0	0	112.6
1000	T	26.2	Very low	30.7	Very low	110 Å²	110	142.4 Å²	142.4	68%	0.675	72%	0.717	S	S	*	*			trans	102.2	104.5	172	-34.7	0	0	0	0	116.2
1001	E	27.1	Very low	30.7	Very low	167 Å²	167	139 Å²	139	78%	0.78	71%	0.705	S	S	*	*				16.2	168.1	129.9	-48.4	-179.9	131.9	0	0	122.9
1002	H	28.5	Very low	30.8	Very low	161 Å²	161	142.4 Å²	142.4	75%	0.745	71%	0.71	S	S	*	*			trans	85.6	85.8	155.2	-88.7	-81.1	0	0	0	121.7
1003	N	27.9	Very low	31.1	Very low	141 Å²	141	138.3 Å²	138.3	75%	0.754	71%	0.705	S	S	*	*				71.6	-164.7	117.6	-141	15.3	0	0	0	116.6
1004	P	36.4	Very low	31.4	Very low	87 Å²	87	136.6 Å²	136.6	57%	0.565	70%	0.704	S	S	*	*				-132.4	-166.9	-116	44.3	-26	0	0	0	116.8
1005	Q	26.8	Very low	31.4	Very low	154 Å²	154	134.7 Å²	134.7	72%	0.72	71%	0.708	S	S	*	*			trans	86.4	144.2	152.1	-79.9	-178.7	25.6	0	0	121.7
1006	K	30	Very low	31.9	Very low	147 Å²	147	134.2 Å²	134.2	64%	0.639	71%	0.712	S	S	*	*			trans	70.8	158	165.6	-59.8	158	-175	176.6	0	115.2
1007	F	32.8	Very low	31.9	Very low	192 Å²	192	135.6 Å²	135.6	84%	0.842	72%	0.722	S	S	*	*			cis	-132.4	174.7	6.4	-73.2	-95.2	0	0	0	110.9
1008	V	31.9	Very low	31.9	Very low	99 Å²	99	134.3 Å²	134.3	60%	0.6	72%	0.723	S	S	*	*				-174.8	124.3	-59.7	137	0	0	0	0	109
1009	K	37.4	Very low	32	Very low	183 Å²	183	135 Å²	135	80%	0.796	73%	0.726	S	S	*	*			trans	176.3	111.1	159.4	-100.4	153.6	-174.5	-173.1	0	108.1
1010	E	36.8	Very low	32.2	Very low	154 Å²	154	136.6 Å²	136.6	72%	0.72	73%	0.73	S	S	*	*				76.5	126.3	78.5	-71	164.7	179.7	0	0	111.1
1011	D	38.1	Very low	32.5	Very low	110 Å²	110	135.9 Å²	135.9	59%	0.588	73%	0.728	S	S	*	*			cis	-159.4	150.9	19.1	-144.2	-13.4	0	0	0	114.9
1012	K	36.5	Very low	32.5	Very low	170 Å²	170	135.4 Å²	135.4	74%	0.739	73%	0.73	S	S	*	*			trans	51.6	144.4	159.4	-71.4	140	-165.9	159.6	0	121.7
1013	S	35.6	Very low	32.6	Very low	96 Å²	96	137.4 Å²	137.4	67%	0.671	74%	0.737	S	S	*	*			cis	-170.2	146.4	-10.9	47.3	0	0	0	0	113.4
1014	S	35.3	Very low	32.6	Very low	106 Å²	106	136.4 Å²	136.4	74%	0.741	74%	0.736	S	S	*	*			trans	58.3	139.5	150.5	56.8	0	0	0	0	121.1
1015	S	32.7	Very low	32.3	Very low	114 Å²	114	141 Å²	141	80%	0.797	75%	0.747	S	S	*	*			cis	-159.4	158.8	-10.5	-91.9	0	0	0	0	110.8
1016	P	40.8	Very low	32.5	Very low	118 Å²	118	140.5 Å²	140.5	77%	0.766	75%	0.749	S	S	*	*			trans	-128.4	-159.8	-162	43.6	-27.4	0	0	0	114.8
1017	S	29.3	Very low	32.4	Very low	115 Å²	115	139.6 Å²	139.6	80%	0.804	75%	0.751	S	S	*	*			trans	96	157.8	163.4	81	0	0	0	0	117.8
1018	S	27.9	Very low	32.3	Very low	109 Å²	109	138.4 Å²	138.4	76%	0.762	75%	0.748	S	S	*	*			cis	-179.6	-176.5	-36.5	-168.4	0	0	0	0	107.6
1019	I	28.4	Very low	32.2	Very low	146 Å²	146	142 Å²	142	75%	0.749	76%	0.755	S	S	*	*			trans	76.8	115	170	-49.4	164.1	0	0	0	115.2
1020	H	29	Very low	31.8	Very low	189 Å²	189	143 Å²	143	88%	0.875	76%	0.756	S	S	*	*			trans	-159.4	123.6	146	-125.1	-61.1	0	0	0	113.2
1021	P	33.2	Very low	31.3	Very low	96 Å²	96	140.7 Å²	140.7	62%	0.623	76%	0.756	S	S	*	*			trans	-121.4	159.9	152	36.8	-27.8	0	0	0	112
1022	N	27.1	Very low	30.8	Very low	156 Å²	156	144.3 Å²	144.3	83%	0.834	77%	0.77	S	S	*	*			trans	14.6	105.5	156.9	-60.2	-18.1	0	0	0	119.4
1023	K	30.4	Very low	30.3	Very low	203 Å²	203	141.1 Å²	141.1	88%	0.883	76%	0.76	S	S	*	*				-174	146.6	114.1	-102.5	161.1	-174.4	174.6	0	115.3
1024	T	27.6	Very low	29.9	Very low	120 Å²	120	141.9 Å²	141.9	74%	0.736	75%	0.753	S	S	*	*			trans	-50.5	134.7	170.3	53.6	0	0	0	0	115
1025	K	31.3	Very low	29.7	Very low	184 Å²	184	143 Å²	143	80%	0.8	75%	0.751	S	S	*	*				168.9	132.2	106.5	-92.8	179.7	-178.4	-178	0	114.2
1026	N	29.8	Very low	29.8	Very low	143 Å²	143	144.8 Å²	144.8	77%	0.765	75%	0.746	S	S	*	*			trans	70	146.6	143.7	-85.7	-4.7	0	0	0	123.6
1027	L	29.4	Very low	29.4	Very low	128 Å²	128	143.6 Å²	143.6	67%	0.67	74%	0.738	S	S	*	*			trans	73.5	98.4	155.4	-93.5	71.3	0	0	0	120.5
1028	Q	29.9	Very low	29.3	Very low	167 Å²	167	144.3 Å²	144.3	78%	0.78	73%	0.732	S	S	*	*				85.6	139.1	121.7	-79.9	177.4	-13.7	0	0	122.1
1029	K	29.5	Very low	29.3	Very low	174 Å²	174	145 Å²	145	76%	0.757	72%	0.719	S	S	*	*			trans	86.3	102.8	154.1	-80.1	-175.4	176.1	-177.2	0	120.4
1030	Y	28.2	Very low	29.5	Very low	206 Å²	206	142.6 Å²	142.6	81%	0.808	71%	0.713	S	S	*	*			trans	84.9	148.6	143.1	-74.9	-69.2	0	0	0	121
1031	S	27.9	Very low	29.7	Very low	105 Å²	105	141.2 Å²	141.2	73%	0.734	71%	0.711	S	S	*	*			trans	58.6	74	169.8	-38.2	0	0	0	0	115.3
1032	Q	27.7	Very low	29.6	Very low	185 Å²	185	142.4 Å²	142.4	86%	0.864	72%	0.719	S	S	*	*				63.9	106.1	89.5	-67.8	-178.4	-1.2	0	0	114.9
1033	L	24.7	Very low	29.9	Very low	104 Å²	104	140 Å²	140	55%	0.545	71%	0.712	S	S	.	*				-179.7	176.3	122	-96.2	171.2	0	0	0	111.4	P371 Y373	P371-L1033 HydrophobicContact CB-CD1 3.63Å; P371-L1033 HydrophobicContact CB-CD2 3.55Å; P371-L1033 HydrophobicContact CB-CG 4.24Å; Y373-L1033 HydrophobicContact CE2-CD1 4.33Å
1034	H	28.4	Very low	29.6	Very low	112 Å²	112	137.4 Å²	137.4	52%	0.519	71%	0.707	S	S	.	*			trans	67.9	118.8	175.6	-80.8	-79	0	0	0	116.4	Y373	Y373-H1034 AromaticContact CD2-NE2 3.99Å
1035	N	29.6	Very low	29.4	Very low	129 Å²	129	141.7 Å²	141.7	69%	0.69	71%	0.711	S	S	*	*				-168.2	141.1	52	-88	-39.7	0	0	0	109.8
1036	H	34.7	Very low	29.1	Very low	151 Å²	151	138.1 Å²	138.1	70%	0.699	71%	0.708	S	S	*	*				65.4	132.8	80.4	-75.8	-47.3	0	0	0	114.7
1037	P	33.1	Very low	28.9	Very low	93 Å²	93	137.3 Å²	137.3	60%	0.604	70%	0.704	S	S	*	*				-144.2	154.6	67.3	40.8	-23.7	0	0	0	119.7
1038	L	28	Very low	28.9	Very low	130 Å²	130	138.8 Å²	138.8	68%	0.681	71%	0.707	S	S	*	*				47.1	161.7	129.5	-55.7	171.9	0	0	0	125.4
1039	Y	27.7	Very low	28.7	Very low	123 Å²	123	136.2 Å²	136.2	48%	0.482	71%	0.707	S	S	.	*			trans	88.8	155.4	160.1	-66.2	-62.3	0	0	0	119.3	Y355 L356 V1431	Y355-Y1039 WeakPolarHBondContact O-CE1 3.42Å; Y355-Y1039 WeakPolarHBondContact O-CE2 2.45Å; Y355-Y1039 PolarHBondContact O-OH 2.76Å; L356-Y1039 VanDerWaalsContact O-CD2 3.31Å; L356-Y1039 WeakPolarHBondContact O-CD2 2.87Å; Y1039-V1431 VanDerWaalsContact CB-CG2 3.49Å; Y1039-V1431 HydrophobicContact CD2-CG2 4.41Å; Y1039-V1431 HydrophobicContact CG-CG2 4.25Å
1040	P	31.8	Very low	28.7	Very low	97 Å²	97	136.9 Å²	136.9	63%	0.63	71%	0.706	S	S	*	*			trans	-132.7	-162.2	-138.3	43.6	-24.7	0	0	0	116.6
1041	L	32.9	Very low	29.1	Very low	160 Å²	160	134.9 Å²	134.9	84%	0.838	70%	0.698	S	S	*	*			trans	-41	154.3	168.6	-63.9	166.2	0	0	0	114.1
1042	P	31.7	Very low	29.3	Very low	121 Å²	121	136 Å²	136	79%	0.786	70%	0.702	S	S	*	*			cis	-145.2	-127.4	42	45.5	-21.5	0	0	0	114.7
1043	P	33.7	Very low	29.5	Very low	105 Å²	105	133.6 Å²	133.6	68%	0.682	69%	0.694	S	S	*	*			trans	-133.7	-173.7	-143.9	39	-13.7	0	0	0	118.4
1044	L	23.5	Very low	29.9	Very low	149 Å²	149	137.2 Å²	137.2	78%	0.78	71%	0.706	S	S	*	*			trans	80.3	153.3	160.1	-58.3	171	0	0	0	120.9
1045	Y	24.5	Very low	30.2	Very low	210 Å²	210	137.3 Å²	137.3	82%	0.824	71%	0.71	S	S	*	*			trans	66.7	105.5	162.8	-73.9	-73.4	0	0	0	122.4
1046	C	24.2	Very low	30.2	Very low	108 Å²	108	136.9 Å²	136.9	73%	0.73	71%	0.706	S	S	*	*				16.5	120.1	117.8	-107.4	0	0	0	0	119.4
1047	N	25.8	Very low	30	Very low	127 Å²	127	134.9 Å²	134.9	68%	0.679	71%	0.709	S	S	*	*				177.2	149.3	100.1	-92.8	-4.1	0	0	0	115.6
1048	E	28.7	Very low	30.1	Very low	158 Å²	158	135.4 Å²	135.4	74%	0.738	71%	0.712	S	S	*	*			trans	24	118.3	144.4	-59.6	-175.8	128.2	0	0	123.1
1049	C	26.4	Very low	30.1	Very low	114 Å²	114	136.2 Å²	136.2	77%	0.77	72%	0.715	S	S	*	*				46.6	128.3	115.5	-63	0	0	0	0	123.8
1050	Y	30.5	Very low	30.2	Very low	188 Å²	188	138.1 Å²	138.1	74%	0.737	73%	0.725	S	S	*	*				113.4	105.7	121.2	-109.2	-118.1	0	0	0	122.1
1051	Y	36.1	Very low	30.1	Very low	164 Å²	164	138.2 Å²	138.2	64%	0.643	73%	0.727	S	S	*	*			trans	62.7	159.7	141.6	-79.4	-112.9	0	0	0	120.2	I1053	Y1051-I1053 HydrophobicContact CD1-CG1 4.06Å
1052	P	31.8	Very low	29.8	Very low	127 Å²	127	137.1 Å²	137.1	83%	0.825	72%	0.722	S	S	*	*				-139.3	173.1	100.5	39	-26.5	0	0	0	115
1053	I	32.2	Very low	29.7	Very low	136 Å²	136	136.7 Å²	136.7	70%	0.697	72%	0.718	S	S	*	*			trans	-122.1	145.2	177.4	-50.5	166.3	0	0	0	108.5	Y1051	Y1051-I1053 HydrophobicContact CD1-CG1 4.06Å
1054	K	32.6	Very low	29.5	Very low	180 Å²	180	136.5 Å²	136.5	78%	0.783	72%	0.719	S	S	*	*			trans	159.4	136.1	133.8	-87.3	153.4	-170.7	171.9	0	114.6
1055	D	34.4	Very low	29.7	Very low	113 Å²	113	136 Å²	136	60%	0.604	72%	0.717	S	S	*	*				-171.6	165.6	123.6	-114.2	14.5	0	0	0	109.3	K1130	D1055-K1130 WeakPolarHBondContact OD2-CE 3.48Å; D1055-K1130 IonicContact OD2-NZ 3.05Å; D1055-K1130 PolarHBondContact OD2-NZ 3.16Å
1056	I	29.2	Very low	29.9	Very low	120 Å²	120	132 Å²	132	62%	0.615	71%	0.708	S	S	*	*				-161.2	124.4	-72.2	-110.3	171.4	0	0	0	109.7
1057	S	30.3	Very low	30	Very low	109 Å²	109	132.9 Å²	132.9	76%	0.762	71%	0.706	S	S	*	*			trans	57.8	-171.2	154.4	-48.5	0	0	0	0	118.5
1058	P	36.1	Very low	30.1	Very low	104 Å²	104	134.1 Å²	134.1	68%	0.675	71%	0.708	S	S	*	*			cis	-135.8	-175.7	-16.6	29.1	-5.7	0	0	0	115.9
1059	M	28.4	Very low	30.1	Very low	147 Å²	147	133.3 Å²	133.3	72%	0.724	70%	0.704	S	S	*	*			trans	82	145.9	151.3	-58.1	-141.3	178.7	0	0	119.5
1060	K	30.3	Very low	30.1	Very low	163 Å²	163	135.3 Å²	135.3	71%	0.709	71%	0.706	S	S	*	*			cis	-165.9	178.6	-11.4	-120.9	-176.5	-173.2	160.6	0	112.2
1061	C	27.9	Very low	29.9	Very low	99 Å²	99	131.5 Å²	131.5	67%	0.669	71%	0.707	S	S	*	*			trans	79.2	121.5	160.6	-70.5	0	0	0	0	115.7
1062	N	27.9	Very low	29.5	Very low	138 Å²	138	130.2 Å²	130.2	74%	0.738	71%	0.71	S	S	*	*				97.2	139.5	52.7	-79.9	15.1	0	0	0	110.1
1063	T	29.3	Very low	29.3	Very low	112 Å²	112	130.5 Å²	130.5	69%	0.687	70%	0.703	S	S	*	*			cis	-166.4	164.3	3.8	9.2	0	0	0	0	110.5
1064	S	29.3	Very low	29	Very low	101 Å²	101	129.8 Å²	129.8	71%	0.706	70%	0.7	S	S	*	*			trans	68.7	162.8	150.4	80.6	0	0	0	0	115.8
1065	N	28.4	Very low	28.8	Very low	138 Å²	138	127.3 Å²	127.3	74%	0.738	70%	0.7	S	S	*	*			cis	-162.2	173.3	-10.4	-117.9	-1.7	0	0	0	106
1066	I	28	Very low	28.7	Very low	125 Å²	125	127 Å²	127	64%	0.641	71%	0.708	S	S	*	*			cis	-145.3	176	2	-140.9	155.2	0	0	0	108.8
1067	N	25.7	Very low	28.7	Very low	128 Å²	128	128.4 Å²	128.4	68%	0.684	71%	0.714	S	S	*	*			trans	-44.6	165.9	167.5	-35.8	-54.6	0	0	0	113.1
1068	E	28.5	Very low	28.8	Very low	152 Å²	152	128.6 Å²	128.6	71%	0.71	71%	0.713	S	S	*	*				-162	139.6	74.8	-89.6	-152.6	120.6	0	0	115.7
1069	Q	29.8	Very low	28.4	Very low	142 Å²	142	128.2 Å²	128.2	66%	0.664	71%	0.713	S	S	*	*			trans	56.8	103.2	145.2	-56.5	-170.5	46.6	0	0	117.7
1070	L	25	Very low	28.4	Very low	156 Å²	156	128.5 Å²	128.5	82%	0.817	72%	0.716	S	S	*	*				74	153.4	70.6	-73.7	167.8	0	0	0	113.7
1071	S	26.9	Very low	28.2	Very low	107 Å²	107	127 Å²	127	75%	0.748	72%	0.715	S	S	*	*			trans	77.1	146	169.5	96.3	0	0	0	0	114
1072	I	27.3	Very low	28.2	Very low	138 Å²	138	128.1 Å²	128.1	71%	0.708	71%	0.714	S	S	*	*			cis	-158.6	140.1	-2	-133.9	168.9	0	0	0	110.3
1073	I	28	Very low	28.4	Very low	132 Å²	132	129.4 Å²	129.4	68%	0.677	71%	0.713	S	S	*	*			trans	50.9	142.4	141.6	-68.4	171.6	0	0	0	119.7
1074	N	26.5	Very low	28.4	Very low	121 Å²	121	130.5 Å²	130.5	65%	0.647	71%	0.714	S	S	*	*			cis	-177.3	-178.1	-15.9	-95.8	-13.4	0	0	0	106.4
1075	T	28.2	Very low	28.3	Very low	128 Å²	128	131.3 Å²	131.3	79%	0.785	71%	0.71	S	S	*	*			trans	67.5	143.5	147.7	55.2	0	0	0	0	119.2
1076	S	31.2	Very low	28.4	Very low	108 Å²	108	132.2 Å²	132.2	76%	0.755	71%	0.709	S	S	*	*			cis	-160.5	158.6	-10.5	-101.6	0	0	0	0	112
1077	I	30	Very low	28.3	Very low	148 Å²	148	130.8 Å²	130.8	76%	0.759	71%	0.711	S	S	*	*			trans	-92.6	146.2	170.4	-28.8	177.1	0	0	0	108.9
1078	P	31.1	Very low	28.3	Very low	113 Å²	113	133.8 Å²	133.8	73%	0.734	71%	0.714	S	S	*	*				-139.3	156.3	100.9	33.5	-17.4	0	0	0	112.4
1079	S	28.3	Very low	28.2	Very low	96 Å²	96	132.6 Å²	132.6	67%	0.671	71%	0.708	S	S	*	*			cis	78.6	149.4	36.7	-60.9	0	0	0	0	115
1080	I	29.6	Very low	28	Very low	153 Å²	153	133 Å²	133	79%	0.785	71%	0.708	S	S	*	*			trans	99.3	142.1	-177.8	-59.4	164.5	0	0	0	114.1
1081	I	26.4	Very low	28.1	Very low	133 Å²	133	134.1 Å²	134.1	68%	0.682	70%	0.703	S	S	*	*			cis	172	147.4	-42.9	-97.1	163.7	0	0	0	109.3
1082	N	27.5	Very low	28	Very low	122 Å²	122	134.5 Å²	134.5	65%	0.652	70%	0.697	S	S	*	*			trans	76	113.7	157.9	-79.6	-19.4	0	0	0	123.7
1083	K	31	Very low	27.9	Very low	164 Å²	164	134 Å²	134	71%	0.713	70%	0.695	S	S	*	*				87.4	159.1	110.7	-75	178.7	-177.9	-177.2	0	123.2
1084	N	29.5	Very low	27.8	Very low	135 Å²	135	135.8 Å²	135.8	72%	0.722	70%	0.698	S	S	*	*			trans	80.8	139.4	153.3	-74.5	6.9	0	0	0	117.1
1085	L	28.1	Very low	27.8	Very low	118 Å²	118	138.7 Å²	138.7	62%	0.618	70%	0.702	S	S	*	*			cis	-169.9	168.1	-12.1	-151.6	52	0	0	0	110.5
1086	H	29	Very low	27.7	Very low	157 Å²	157	135.5 Å²	135.5	73%	0.727	68%	0.683	S	S	*	*			trans	67.4	118.8	154.1	-71.6	148.6	0	0	0	118.9
1087	S	26.2	Very low	27.5	Very low	95 Å²	95	133.8 Å²	133.8	66%	0.664	67%	0.672	S	S	*	*				82.6	144.2	81.6	82.5	0	0	0	0	113.5
1088	Y	25.8	Very low	27.5	Very low	191 Å²	191	131.2 Å²	131.2	75%	0.749	66%	0.659	S	S	*	*			cis	-161.9	138.2	11	-138.1	-147.1	0	0	0	109.2
1089	E	26.3	Very low	27.4	Very low	128 Å²	128	130.7 Å²	130.7	60%	0.598	65%	0.654	S	S	*	*				58.2	159.3	122	-128	166.7	-103.1	0	0	124
1090	F	26.3	Very low	27.4	Very low	151 Å²	151	133.1 Å²	133.1	66%	0.662	66%	0.659	S	S	*	*			trans	95.7	101.7	161.8	-89.9	-106.8	0	0	0	124.5
1091	Y	26.3	Very low	27.5	Very low	178 Å²	178	134.7 Å²	134.7	70%	0.698	66%	0.661	S	S	*	*				70.5	119.7	128.1	-83.1	-114.5	0	0	0	124.5
1092	D	25.5	Very low	27.6	Very low	116 Å²	116	133.6 Å²	133.6	62%	0.62	66%	0.66	S	S	*	*				68.7	119.8	122.6	-69.9	25.3	0	0	0	126
1093	N	25.7	Very low	27.5	Very low	126 Å²	126	134.3 Å²	134.3	67%	0.674	66%	0.663	S	S	*	*				80.3	126.4	127.5	-75.1	-44.1	0	0	0	124.3
1094	F	26	Very low	27.3	Very low	171 Å²	171	134.2 Å²	134.2	75%	0.75	67%	0.666	S	S	*	*			trans	79.9	112.9	149.6	-81.1	-125	0	0	0	122.5
1095	Y	25.5	Very low	27.2	Very low	182 Å²	182	132.4 Å²	132.4	71%	0.714	66%	0.661	S	S	*	*			trans	79.1	128.3	143.5	-85.3	-110.5	0	0	0	124.1
1096	C	25.5	Very low	27.3	Very low	60 Å²	60	132.8 Å²	132.8	41%	0.405	67%	0.668	S	S	.	*			trans	92.7	172.6	137.8	-102	0	0	0	0	122.4	S565 N566 Q567	S565-C1096 WeakPolarHBondContact CB-O 3.24Å; S565-C1096 PolarHBondContact OG-O 2.83Å; N566-C1096 HydrophobicContact CB-CB 3.4Å; N566-C1096 PolarHBondContact ND2-SG 3.25Å; Q567-C1096 VanDerWaalsContact CG-SG 3.56Å
1097	S	28.3	Very low	27.4	Very low	73 Å²	73	130.7 Å²	130.7	51%	0.51	66%	0.662	S	S	.	*			trans	-113.4	146.4	-171.7	170.4	0	0	0	0	118.8	S565 N566	S565-S1097 WeakPolarHBondContact CA-O 3.41Å; S565-S1097 VanDerWaalsContact CB-N 3.31Å; S565-S1097 WeakPolarHBondContact CB-O 3.34Å; S565-S1097 WeakPolarHBondContact OG-CA 3.45Å; S565-S1097 PolarHBondContact OG-N 3.46Å; S565-S1097 VanDerWaalsContact OG-N 3.13Å; N566-S1097 WeakPolarHBondContact CA-O 3.16Å; N566-S1097 VanDerWaalsContact CB-N 3.34Å; N566-S1097 WeakPolarHBondContact CB-O 3.33Å; N566-S1097 PolarHBondContact ND2-N 3.33Å; N566-S1097 PolarHBondContact OD1-O 2.95Å
1098	L	29.1	Very low	27.6	Very low	93 Å²	93	129.6 Å²	129.6	49%	0.487	65%	0.649	S	S	.	*			trans	-173.2	155.1	140.7	-130.3	75.2	0	0	0	113.6	S565 N566	S565-L1098 PolarHBondContact OG-N 3.44Å; N566-L1098 VanDerWaalsContact OD1-CD1 3.32Å; N566-L1098 WeakPolarHBondContact OD1-CD1 3.42Å
1099	T	30.2	Very low	27.9	Very low	102 Å²	102	124.6 Å²	124.6	63%	0.626	63%	0.632	S	S	*	*			trans	43.7	106	155.8	48.7	0	0	0	0	122.1
1100	N	28	Very low	28.1	Very low	147 Å²	147	124.9 Å²	124.9	79%	0.786	63%	0.631	S	S	*	*				64.8	137.6	118.1	-82.3	-38.3	0	0	0	124.3
1101	K	31.7	Very low	28.3	Very low	187 Å²	187	124.5 Å²	124.5	81%	0.813	63%	0.632	S	S	*	*			trans	83.6	108.5	143.7	-79.4	-175.8	176.5	180	0	122.3
1102	T	27.4	Very low	28.4	Very low	110 Å²	110	125.5 Å²	125.5	68%	0.675	64%	0.643	S	S	*	*				107.9	100	111.6	-66.7	0	0	0	0	120.6
1103	I	25.5	Very low	28.4	Very low	137 Å²	137	122.2 Å²	122.2	70%	0.703	63%	0.629	S	S	*	*			trans	44.4	140.1	130.9	-32.3	173.4	0	0	0	121.1
1104	M	26.9	Very low	28.6	Very low	161 Å²	161	119.3 Å²	119.3	79%	0.793	61%	0.613	S	S	*	*			trans	107.4	127.5	154.2	-56.3	-61.8	-96.3	0	0	114.8
1105	T	28.2	Very low	28.7	Very low	98 Å²	98	115.9 Å²	115.9	60%	0.601	60%	0.602	S	S	*	*			cis	162.4	160.3	-28	34.3	0	0	0	0	106.7
1106	T	29.9	Very low	28.8	Very low	126 Å²	126	108.1 Å²	108.1	77%	0.773	57%	0.572	S	S	*	*			trans	77.2	148.2	167.4	73.3	0	0	0	0	119.3
1107	N	31	Very low	28.9	Very low	112 Å²	112	110.2 Å²	110.2	60%	0.599	58%	0.576	S	S	*	*			cis	-167.1	144.5	-45	-109.4	16.3	0	0	0	113.6	P1246 C1247	N1107-P1246 CarbonylContact O-C 3.53Å; N1107-C1247 PolarHBondContact O-N 3.08Å
1108	N	31	Very low	29	Very low	73 Å²	73	110.9 Å²	110.9	39%	0.39	58%	0.581	S	S	.	*			trans	76.1	115	135.6	-66.5	23.2	0	0	0	124.1	C1247	N1108-C1247 VanDerWaalsContact O-CA 3.27Å; N1108-C1247 WeakPolarHBondContact O-CA 3.17Å; N1108-C1247 PolarHBondContact O-N 3.08Å
1109	E	31.2	Very low	29	Very low	86 Å²	86	115.5 Å²	115.5	40%	0.402	60%	0.597	S	S	.	*				99.3	152.2	115.6	-79.5	175.7	-121.8	0	0	124.3	C1247 L1248	E1109-C1247 PolarHBondContact O-SG 3.4Å; E1109-C1247 VanDerWaalsContact O-SG 3.38Å; E1109-L1248 WeakPolarHBondContact O-CG 3.45Å
1110	K	31.2	Very low	28.9	Very low	133 Å²	133	118.2 Å²	118.2	58%	0.578	60%	0.6	S	S	*	*			trans	70.3	139.3	156.9	-74.5	157.1	175.6	131	0	117.9	L1248	K1110-L1248 WeakPolarHBondContact O-CD1 3.37Å
1111	E	30.7	Very low	29.2	Very low	143 Å²	143	119.6 Å²	119.6	67%	0.668	60%	0.602	S	S	*	*			cis	-139.6	144.9	-2.2	-96.8	139.5	-146.2	0	0	107.5
1112	Q	27.2	Very low	29	Very low	200 Å²	200	119.5 Å²	119.5	94%	0.935	60%	0.602	S	S	*	*				56.7	58.7	56.6	-67.1	-141.8	14.2	0	0	115.4
1113	S	27.3	Very low	29	Very low	46 Å²	46	122.4 Å²	122.4	32%	0.322	61%	0.614	S	S	.	*			trans	-160.1	147	164.2	71.2	0	0	0	0	106.9	R187	R187-S1113 VanDerWaalsContact CZ-CB 3.48Å; R187-S1113 VanDerWaalsContact CZ-OG 3.3Å; R187-S1113 PolarHBondContact NH1-OG 2.61Å; R187-S1113 PolarHBondContact NH2-OG 3.43Å
1114	I	29.3	Very low	29.2	Very low	65 Å²	65	125.2 Å²	125.2	33%	0.333	62%	0.621	S	S	.	*			cis	-104.4	81.5	6.2	-58.7	124.8	0	0	0	125.5	D185 P186 R187 N1116	D185-I1114 CarbonylContact C-O 3.58Å; D185-I1114 HydrophobicContact CB-CG2 3.91Å; D185-I1114 WeakPolarHBondContact OD1-CG2 3.18Å; D185-I1114 WeakPolarHBondContact OD2-CG2 3.23Å; P186-I1114 VanDerWaalsContact CA-CB 3.49Å; P186-I1114 WeakPolarHBondContact CA-O 3.28Å; P186-I1114 HydrophobicContact CB-CB 3.93Å; P186-I1114 WeakPolarHBondContact CB-O 3.26Å; P186-I1114 VanDerWaalsContact CD-N 3.3Å; P186-I1114 WeakPolarHBondContact CD-O 3.49Å; P186-I1114 HydrophobicContact CG-CB 3.6Å; P186-I1114 WeakPolarHBondContact CG-O 3.25Å; P186-I1114 WeakPolarHBondContact O-CA 3.17Å; R187-I1114 HydrophobicContact CG-CG1 3.9Å; I1114-N1116 PolarHBondContact O-N 3.1Å
1115	L	28.6	Very low	29.5	Very low	99 Å²	99	124.3 Å²	124.3	52%	0.518	62%	0.619	S	S	.	*			trans	-60	110.1	157	-79	165.8	0	0	0	108.5	D185 F194	D185-L1115 CarbonylContact O-C 3.56Å; D185-L1115 VanDerWaalsContact O-O 3.11Å; F194-L1115 HydrophobicContact CD2-CD1 3.99Å; F194-L1115 HydrophobicContact CE2-CD1 3.58Å; F194-L1115 HydrophobicContact CE2-CD2 4.21Å; F194-L1115 HydrophobicContact CZ-CD1 4.14Å
1116	N	26.9	Very low	29.7	Very low	19 Å²	19	125.9 Å²	125.9	10%	0.102	62%	0.622	C	S	.	*				153.4	138.8	108	-76	-53.4	0	0	0	113.6	C184 D185 C191 C193 I1114	C184-N1116 CarbonylContact C-O 3.59Å; C184-N1116 WeakPolarHBondContact CA-O 3.3Å; D185-N1116 PolarHBondContact N-O 3.34Å; C191-N1116 HydrophobicContact CB-CB 3.34Å; C191-N1116 VanDerWaalsContact SG-CB 3.55Å; C193-N1116 VanDerWaalsContact CB-OD1 3.29Å; C193-N1116 WeakPolarHBondContact CB-OD1 3.28Å; I1114-N1116 PolarHBondContact O-N 3.1Å
1117	Q	28.4	Very low	29.5	Very low	105 Å²	105	127.4 Å²	127.4	49%	0.491	63%	0.625	S	S	.	*			trans	169.8	171.7	147.8	-98.1	173.6	-5.7	0	0	108.7	C184 C191	C184-Q1117 HydrophobicContact CB-CB 3.92Å; C184-Q1117 WeakPolarHBondContact SG-CB 3.47Å; C184-Q1117 PolarHBondContact SG-O 3.33Å; C191-Q1117 WeakPolarHBondContact SG-CG 3.43Å
1118	S	30.1	Very low	29.6	Very low	87 Å²	87	128.8 Å²	128.8	61%	0.608	63%	0.631	S	S	*	*	S	Bend	trans	63.3	59.6	175.8	-59.4	0	0	0	0	116.8
1119	F	28.3	Very low	29.8	Very low	189 Å²	189	132.1 Å²	132.1	83%	0.829	65%	0.649	S	S	*	*				-169	81.2	115.2	-105.1	-69.2	0	0	0	112.6
1120	K	28.9	Very low	29.9	Very low	159 Å²	159	135.2 Å²	135.2	69%	0.691	66%	0.661	S	S	*	*			trans	-131.6	58.2	160.1	-162.9	-161	-111.9	171.1	0	111.7	P192	P192-K1120 HydrophobicContact CB-CB 4.11Å; P192-K1120 HydrophobicContact CB-CD 3.84Å; P192-K1120 HydrophobicContact CB-CG 4.25Å; P192-K1120 HydrophobicContact CG-CB 3.78Å; P192-K1120 HydrophobicContact CG-CD 3.64Å; P192-K1120 HydrophobicContact CG-CG 4.17Å
1121	Q	32.9	Very low	29.9	Very low	176 Å²	176	135.7 Å²	135.7	82%	0.822	68%	0.676	S	S	*	*			trans	-160.8	96.8	170.1	-116.9	164.5	-40.3	0	0	110.4
1122	F	28.1	Very low	29.8	Very low	185 Å²	185	135.4 Å²	135.4	81%	0.811	68%	0.679	S	S	*	*	S	Bend		-179.4	77.4	118.9	-156.2	-92.2	0	0	0	111.3
1123	N	26.8	Very low	29.9	Very low	171 Å²	171	133 Å²	133	91%	0.914	67%	0.67	S	S	*	*			trans	-154.5	89.3	154.6	-117.3	-20.8	0	0	0	109.7
1124	K	30.6	Very low	29.9	Very low	196 Å²	196	137 Å²	137	85%	0.852	69%	0.687	S	S	*	*			trans	-155.9	96.8	176.7	178.3	-171.4	177.1	-179.6	0	108.5
1125	L	32	Very low	29.7	Very low	143 Å²	143	140 Å²	140	75%	0.749	70%	0.704	S	S	*	*			trans	-170.4	121.9	158.5	-98.1	163.2	0	0	0	108
1126	I	32.6	Very low	29.7	Very low	131 Å²	131	144 Å²	144	67%	0.672	72%	0.72	S	S	*	*			trans	50.5	111.3	147.1	-52	170.6	0	0	0	117.2	I1128	I1126-I1128 HydrophobicContact CG2-CB 4.39Å; I1126-I1128 HydrophobicContact CG2-CD1 4.43Å
1127	N	27.2	Very low	30.3	Very low	157 Å²	157	151.1 Å²	151.1	84%	0.84	75%	0.752	S	S	*	*			cis	67.5	85.7	6.6	-157	73.1	0	0	0	116.8
1128	I	32.7	Very low	30.6	Very low	141 Å²	141	151.9 Å²	151.9	72%	0.723	77%	0.766	S	S	*	*			trans	176.2	137.7	167.9	-98.6	152.9	0	0	0	106.3	I1126	I1126-I1128 HydrophobicContact CG2-CB 4.39Å; I1126-I1128 HydrophobicContact CG2-CD1 4.43Å
1129	D	35.2	Very low	30.8	Very low	144 Å²	144	152.9 Å²	152.9	77%	0.77	77%	0.769	S	S	*	*			cis	-152.9	176.2	-14.8	-124.5	-34.6	0	0	0	112
1130	K	32.8	Very low	30.8	Very low	150 Å²	150	151.2 Å²	151.2	65%	0.652	77%	0.768	S	S	*	*			trans	-89.9	154	179.2	-56.9	174.7	176.2	-169.1	0	112.5	D1055	D1055-K1130 WeakPolarHBondContact OD2-CE 3.48Å; D1055-K1130 IonicContact OD2-NZ 3.05Å; D1055-K1130 PolarHBondContact OD2-NZ 3.16Å
1131	T	32	Very low	30.7	Very low	144 Å²	144	147.5 Å²	147.5	88%	0.883	76%	0.762	S	S	*	*			trans	-169.8	153.9	130.5	23.1	0	0	0	0	114.9
1132	N	28.3	Very low	30.6	Very low	137 Å²	137	145 Å²	145	73%	0.733	75%	0.754	S	S	*	*			trans	-79.6	167.2	179.6	-45.6	-38.4	0	0	0	113.8
1133	I	29	Very low	30.7	Very low	148 Å²	148	141.8 Å²	141.8	76%	0.759	74%	0.744	S	S	*	*			trans	168.7	108.3	131.7	-86	152.2	0	0	0	105.3
1134	I	26.2	Very low	31	Very low	132 Å²	132	142.7 Å²	142.7	68%	0.677	74%	0.736	S	S	*	*				67.3	145.8	68.8	-48.1	160.5	0	0	0	112.2
1135	N	27.1	Very low	31.3	Very low	127 Å²	127	140.2 Å²	140.2	68%	0.679	73%	0.728	S	S	*	*			trans	84.1	104.6	-174.4	-48.6	-18.5	0	0	0	112.5
1136	E	28.5	Very low	31.4	Very low	183 Å²	183	139.2 Å²	139.2	86%	0.855	73%	0.728	S	S	*	*				95.4	129.7	64.4	-83.2	178.1	-169.6	0	0	112.1
1137	E	39.5	Very low	31.9	Very low	169 Å²	169	137.7 Å²	137.7	79%	0.79	73%	0.726	S	S	*	*			trans	-85.4	147.3	-176.7	175.4	179.3	-140	0	0	111.5
1138	P	34.2	Very low	32.2	Very low	121 Å²	121	140.3 Å²	140.3	79%	0.786	73%	0.726	S	S	*	*			trans	-133.5	120.3	146.3	34.3	-21.3	0	0	0	113.3
1139	T	33.7	Very low	32.3	Very low	108 Å²	108	137.6 Å²	137.6	66%	0.663	73%	0.725	S	S	*	*			trans	-79.4	120.2	157.9	54.2	0	0	0	0	110.2
1140	L	28.1	Very low	32	Very low	153 Å²	153	135.8 Å²	135.8	80%	0.801	72%	0.723	S	S	*	*			trans	-156.3	122.9	159.3	-118.7	74.5	0	0	0	105.3
1141	S	27.3	Very low	32.1	Very low	81 Å²	81	134 Å²	134	57%	0.566	73%	0.725	S	S	*	*				59.3	134.1	96	88.6	0	0	0	0	113.1
1142	D	31.4	Very low	32.2	Very low	125 Å²	125	132.4 Å²	132.4	67%	0.668	72%	0.715	S	S	*	*			cis	-166.3	152.9	48.2	-96	-53.8	0	0	0	114.4
1143	I	30.4	Very low	32.5	Very low	116 Å²	116	133.3 Å²	133.3	60%	0.595	72%	0.718	S	S	*	*			trans	46.7	120.5	139.8	-38.3	154.8	0	0	0	117.2
1144	Y	32.4	Very low	32.7	Very low	190 Å²	190	133.3 Å²	133.3	75%	0.745	71%	0.714	S	S	*	*				-155.5	124	74.9	-102.5	-83.8	0	0	0	116
1145	E	35.8	Very low	33.1	Very low	145 Å²	145	133.2 Å²	133.2	68%	0.678	72%	0.715	S	S	*	*			trans	50.4	113.1	139.9	-65.4	178	174.1	0	0	120.7
1146	T	34.9	Very low	33.5	Very low	122 Å²	122	135.7 Å²	135.7	75%	0.748	72%	0.723	S	S	*	*				81.5	167.2	53	68.3	0	0	0	0	114.9
1147	P	43.1	Very low	34.1	Very low	98 Å²	98	131.2 Å²	131.2	64%	0.636	71%	0.71	S	S	*	*			cis	-121.7	-170.3	-25.1	16.3	10.3	0	0	0	110.4
1148	Y	33.1	Very low	33.7	Very low	212 Å²	212	130.7 Å²	130.7	83%	0.831	71%	0.711	S	S	*	*			cis	-145.5	136.1	24.6	-92.6	-95.2	0	0	0	108.3
1149	A	34.5	Very low	33.5	Very low	85 Å²	85	128.4 Å²	128.4	70%	0.702	71%	0.709	S	S	*	*				77.1	147.2	76.4	0	0	0	0	0	114.6
1150	S	30.6	Very low	33.3	Very low	106 Å²	106	128.2 Å²	128.2	74%	0.741	70%	0.704	S	S	*	*			cis	-170.9	151.5	-12.8	42.5	0	0	0	0	107.9
1151	V	33.1	Very low	33.3	Very low	112 Å²	112	128.7 Å²	128.7	68%	0.679	70%	0.702	S	S	*	*				167.8	108.7	87.6	158.3	0	0	0	0	104.5
1152	T	34	Very low	33.5	Very low	110 Å²	110	135.2 Å²	135.2	68%	0.675	72%	0.716	S	S	*	*				46.5	131.7	88.4	57.9	0	0	0	0	118.8
1153	I	36.5	Very low	33.7	Very low	157 Å²	157	134.3 Å²	134.3	81%	0.805	72%	0.717	S	S	*	*			trans	148.4	136.5	132.2	-78.5	160.7	0	0	0	110.5
1154	H	33.2	Very low	33.5	Very low	147 Å²	147	136.2 Å²	136.2	68%	0.681	73%	0.725	S	S	*	*			cis	-171.1	176.1	-34.1	-133.1	-98.1	0	0	0	109.4
1155	D	34.4	Very low	33.2	Very low	130 Å²	130	135 Å²	135	70%	0.695	72%	0.724	S	S	*	*			trans	76.1	90	152.7	-55	-28.2	0	0	0	123.9
1156	E	34.3	Very low	32.7	Very low	179 Å²	179	132.6 Å²	132.6	84%	0.836	72%	0.722	S	S	*	*				58.3	161.9	99.7	-79.7	-101.7	121.9	0	0	123
1157	P	41.1	Very low	32.3	Very low	90 Å²	90	134 Å²	134	58%	0.584	72%	0.723	S	S	*	*				-140.4	-138.1	-128.9	40.6	-15.7	0	0	0	115.9
1158	I	30.7	Very low	31.6	Very low	157 Å²	157	133.9 Å²	133.9	81%	0.805	73%	0.725	S	S	*	*			trans	92.4	140.1	167.1	-55.1	156.1	0	0	0	116.9
1159	G	30.6	Very low	31.5	Very low	73 Å²	73	133.1 Å²	133.1	75%	0.753	73%	0.726	S	S	*	*			trans	167.7	48.5	171.7	0	0	0	0	0	121.9
1160	D	29.9	Very low	31.4	Very low	105 Å²	105	136.2 Å²	136.2	56%	0.561	73%	0.731	S	S	*	*			trans	37.8	116.4	146.9	-70.9	-15.3	0	0	0	124.7
1161	Q	28.5	Very low	31.7	Very low	162 Å²	162	136.5 Å²	136.5	76%	0.757	73%	0.73	S	S	*	*				99.2	134	113.5	-159.6	159.1	95.5	0	0	123.4
1162	Y	31.3	Very low	31.3	Very low	219 Å²	219	136.1 Å²	136.1	86%	0.859	73%	0.731	S	S	*	*			trans	-58.9	179.5	168.9	-72.5	-88.8	0	0	0	114.2
1163	P	35.1	Very low	31.2	Very low	105 Å²	105	137.6 Å²	137.6	68%	0.682	74%	0.735	S	S	*	*			cis	-149.5	172.3	19.5	40	-17.6	0	0	0	120.3
1164	M	26.1	Very low	31	Very low	157 Å²	157	135.8 Å²	135.8	77%	0.773	74%	0.736	S	S	*	*			trans	58.3	162.2	148.9	-64.6	-87.8	-178.7	0	0	119.4
1165	K	27.3	Very low	31	Very low	164 Å²	164	135.7 Å²	135.7	71%	0.713	74%	0.739	S	S	*	*			cis	167.2	158.2	-23.1	-165.9	-167.1	-108	176.7	0	104.9
1166	C	24.6	Very low	30.8	Very low	95 Å²	95	135.2 Å²	135.2	64%	0.642	75%	0.746	S	S	*	*			trans	90.4	118	155.9	-63.5	0	0	0	0	122.7
1167	I	26.3	Very low	30.7	Very low	150 Å²	150	129.9 Å²	129.9	77%	0.769	74%	0.739	S	S	*	*				77.6	101.3	124.7	-58.7	169.8	0	0	0	120
1168	S	27.7	Very low	30.4	Very low	97 Å²	97	133.7 Å²	133.7	68%	0.678	75%	0.754	S	S	*	*				40	122.9	126	-173.8	0	0	0	0	121.2
1169	K	32.3	Very low	30.5	Very low	196 Å²	196	131.4 Å²	131.4	85%	0.852	75%	0.751	S	S	*	*				-176	132.1	124.1	-96.8	147.4	-167.7	169.5	0	113.6
1170	D	32.3	Very low	30.7	Very low	150 Å²	150	135 Å²	135	80%	0.802	75%	0.751	S	S	*	*			trans	-63.3	167.5	153.3	-60.4	-72.8	0	0	0	110.7
1171	P	35.7	Very low	30.9	Very low	111 Å²	111	135.8 Å²	135.8	72%	0.721	76%	0.755	S	S	*	*			cis	-151.6	173.9	27.2	44.5	-23.6	0	0	0	120.2
1172	C	26.4	Very low	31.2	Very low	104 Å²	104	138 Å²	138	70%	0.703	76%	0.756	S	S	*	*			trans	49.5	120.5	141.2	-68.2	0	0	0	0	124.2
1173	N	30.1	Very low	31.1	Very low	142 Å²	142	132.3 Å²	132.3	76%	0.759	74%	0.744	S	S	*	*				52.4	119.5	123.9	-57.6	-9.1	0	0	0	122.3
1174	S	33.2	Very low	31.2	Very low	119 Å²	119	134.9 Å²	134.9	83%	0.832	75%	0.747	S	S	*	*				170.1	164.2	122.7	41.7	0	0	0	0	112.2
1175	I	32.6	Very low	31.5	Very low	145 Å²	145	134.3 Å²	134.3	74%	0.744	75%	0.748	S	S	*	*			cis	-173.2	154	-49.4	-111.6	165	0	0	0	108.7
1176	S	31.3	Very low	31.5	Very low	119 Å²	119	131.8 Å²	131.8	83%	0.832	75%	0.749	S	S	*	*			trans	76.2	148.4	178.4	-40.5	0	0	0	0	116.2
1177	G	32.7	Very low	31.8	Very low	68 Å²	68	131.7 Å²	131.7	70%	0.701	75%	0.75	S	S	*	*			cis	-171.4	179.8	-4.5	0	0	0	0	0	108.6
1178	L	33.4	Very low	32	Very low	169 Å²	169	131.3 Å²	131.3	89%	0.885	75%	0.749	S	S	*	*			cis	-159	161.9	13.6	-67.7	166.8	0	0	0	110
1179	S	32.5	Very low	32.1	Very low	109 Å²	109	134 Å²	134	76%	0.762	76%	0.755	S	S	*	*			trans	68.5	134	143.7	-162.5	0	0	0	0	119.9
1180	M	36.1	Very low	31.9	Very low	150 Å²	150	132.4 Å²	132.4	74%	0.739	76%	0.755	S	S	*	*			cis	-164.1	152.3	-4.2	-122.7	-174.1	-179.8	0	0	112.4
1181	N	34.2	Very low	32	Very low	120 Å²	120	130.4 Å²	130.4	64%	0.642	75%	0.75	S	S	*	*			trans	67.7	137.1	151.3	-59.5	-28.4	0	0	0	119.1
1182	R	33.9	Very low	31.9	Very low	208 Å²	208	135 Å²	135	79%	0.785	76%	0.759	S	S	*	*			cis	-160.6	142.8	2.3	-128.8	-178.4	-166.3	-139.7	3.1	112
1183	T	28.6	Very low	32.2	Very low	100 Å²	100	135 Å²	135	61%	0.613	76%	0.758	S	S	*	*			trans	47.3	130.3	146.8	47	0	0	0	0	119.8
1184	E	37.2	Very low	32	Very low	160 Å²	160	135.1 Å²	135.1	75%	0.748	76%	0.758	S	S	*	*			cis	-147	137.2	13.9	-103.2	134.2	-133.5	0	0	111.9
1185	D	33.5	Very low	31.7	Very low	145 Å²	145	138.3 Å²	138.3	78%	0.775	75%	0.754	S	S	*	*			trans	41.4	146.1	130.7	-56.4	2.3	0	0	0	122.8
1186	C	27.7	Very low	31.6	Very low	110 Å²	110	141 Å²	141	74%	0.743	75%	0.754	S	S	*	*			cis	-173.4	166.9	-31.4	-125.9	0	0	0	0	111
1187	S	31.3	Very low	31.7	Very low	94 Å²	94	141.1 Å²	141.1	66%	0.657	75%	0.753	S	S	*	*			trans	69.2	119.6	152.4	40.9	0	0	0	0	123.5
1188	N	30.2	Very low	31.4	Very low	141 Å²	141	141.9 Å²	141.9	75%	0.754	75%	0.747	S	S	*	*				84.6	105.5	126.2	-58.7	-11.1	0	0	0	123.7
1189	L	28.6	Very low	31.1	Very low	154 Å²	154	139.1 Å²	139.1	81%	0.806	74%	0.737	S	S	*	*				55.7	144.8	116.4	-64.5	168.7	0	0	0	123.4
1190	L	28.7	Very low	30.9	Very low	163 Å²	163	142.4 Å²	142.4	85%	0.853	74%	0.74	S	S	*	*			trans	80.4	154.2	165.1	-97.4	66.9	0	0	0	119.1
1191	P	35	Very low	30.4	Very low	108 Å²	108	140.6 Å²	140.6	70%	0.701	73%	0.732	S	S	*	*			trans	-113.1	155.2	-167.4	40.7	-31.7	0	0	0	116.4
1192	K	32.4	Very low	30.1	Very low	206 Å²	206	142 Å²	142	90%	0.896	74%	0.74	S	S	*	*			trans	65.9	160.5	-179.3	-61.7	-173	177.2	-177.2	0	113.5
1193	P	33.2	Very low	29.9	Very low	106 Å²	106	137.4 Å²	137.4	69%	0.688	73%	0.731	S	S	*	*			cis	-133.4	-175.2	7.6	44	-27.1	0	0	0	116.2
1194	N	25.9	Very low	30.1	Very low	144 Å²	144	139.6 Å²	139.6	77%	0.77	74%	0.739	S	S	*	*			trans	52.7	116.2	143.5	-67.1	3.3	0	0	0	124
1195	Y	26.4	Very low	29.8	Very low	186 Å²	186	137.2 Å²	137.2	73%	0.729	73%	0.731	S	S	*	*				60.3	118.8	121	-103.8	-107.3	0	0	0	123.1
1196	W	31.7	Very low	29.7	Very low	201 Å²	201	136.5 Å²	136.5	76%	0.761	73%	0.728	S	S	*	*			trans	68.4	146	147.9	-71.8	8.2	0	0	0	119.2
1197	P	32.9	Very low	29.9	Very low	122 Å²	122	136.6 Å²	136.6	79%	0.792	72%	0.721	S	S	*	*				-103	144.3	89.9	-11.8	29.9	0	0	0	112.1
1198	S	26.3	Very low	30	Very low	84 Å²	84	138 Å²	138	59%	0.587	72%	0.721	S	S	*	*				71.5	108.3	60.4	-54.4	0	0	0	0	112.7
1199	V	26.7	Very low	30.1	Very low	111 Å²	111	137 Å²	137	67%	0.673	72%	0.715	S	S	*	*				73.2	124.7	99.6	170	0	0	0	0	111.4	I1201	V1199-I1201 HydrophobicContact CG1-CD1 3.94Å; V1199-I1201 HydrophobicContact CG1-CG1 4.31Å; V1199-I1201 HydrophobicContact CG2-CD1 4.29Å
1200	Q	28.9	Very low	30.4	Very low	178 Å²	178	132.6 Å²	132.6	83%	0.832	69%	0.693	S	S	*	*			cis	-130.1	152.9	49.2	-28.3	-154.4	-95.7	0	0	111.5
1201	I	25.6	Very low	30.7	Very low	111 Å²	111	129.4 Å²	129.4	57%	0.569	68%	0.676	S	S	*	*			cis	71.2	96.3	39.7	-52.4	179.8	0	0	0	113.9	V1199	V1199-I1201 HydrophobicContact CG1-CD1 3.94Å; V1199-I1201 HydrophobicContact CG1-CG1 4.31Å; V1199-I1201 HydrophobicContact CG2-CD1 4.29Å
1202	N	28.3	Very low	30.7	Very low	149 Å²	149	127.5 Å²	127.5	80%	0.797	67%	0.666	S	S	*	*			trans	177.2	114.7	132.3	-88.4	-24.9	0	0	0	106.2
1203	D	28.3	Very low	30.8	Very low	112 Å²	112	123.3 Å²	123.3	60%	0.599	65%	0.653	S	S	*	*				71.5	99.7	53.8	-61.5	-45.8	0	0	0	114.4
1204	N	32.5	Very low	30.8	Very low	147 Å²	147	122.7 Å²	122.7	79%	0.786	64%	0.644	S	S	*	*				-153.8	122.9	126.5	-89.7	-50.9	0	0	0	107.7
1205	N	31	Very low	31.2	Very low	110 Å²	110	120.3 Å²	120.3	59%	0.588	63%	0.631	S	S	*	*				65	132.2	67.7	-63.2	-43.6	0	0	0	111.6
1206	N	32.4	Very low	31.6	Very low	130 Å²	130	115.8 Å²	115.8	70%	0.695	62%	0.62	S	S	*	*			cis	-139	147.5	13.7	-98.3	-44.4	0	0	0	109.5
1207	N	32	Very low	31.7	Very low	112 Å²	112	110.3 Å²	110.3	60%	0.599	61%	0.605	S	S	*	*				53.9	140.7	79.2	-66.2	-46.3	0	0	0	113.9
1208	N	33.4	Very low	31.7	Very low	123 Å²	123	109.7 Å²	109.7	66%	0.658	60%	0.604	S	S	*	*			cis	-149.3	152.9	18	-132.7	-30.8	0	0	0	115.2
1209	N	32.3	Very low	32.1	Very low	120 Å²	120	111.3 Å²	111.3	64%	0.642	62%	0.615	S	S	*	*			trans	-34.1	164.8	156.2	-58.2	-80	0	0	0	116.3
1210	N	33.8	Very low	32.3	Very low	61 Å²	61	114.8 Å²	114.8	33%	0.326	62%	0.617	S	S	.	*				168.8	109.5	96.8	-88.4	-64.9	0	0	0	117	S599 P600	S599-N1210 WeakPolarHBondContact CA-OD1 3.24Å; S599-N1210 PolarHBondContact N-OD1 2.81Å; P600-N1210 VanDerWaalsContact CA-CB 3.44Å; P600-N1210 HydrophobicContact CB-CB 3.6Å
1211	N	35.1	Very low	32.5	Very low	96 Å²	96	110.3 Å²	110.3	51%	0.513	60%	0.602	S	S	.	*				45.8	130.3	112.4	-151.3	20.1	0	0	0	121.3	S599 P600	S599-N1211 PolarHBondContact OG-ND2 2.84Å; P600-N1211 HydrophobicContact CB-CB 4.36Å; P600-N1211 VanDerWaalsContact CB-O 3.23Å; P600-N1211 WeakPolarHBondContact CB-O 3.26Å
1212	S	35.7	Very low	32.9	Very low	68 Å²	68	106.9 Å²	106.9	48%	0.476	59%	0.587	S	S	.	*				151.3	168.4	97.5	-151.4	0	0	0	0	116.2
1213	N	33.6	Very low	33.1	Very low	118 Å²	118	105.9 Å²	105.9	63%	0.631	59%	0.591	S	S	*	*			trans	82.2	135.4	173.6	-53.7	-66.6	0	0	0	116.7
1214	N	34.2	Very low	33.1	Very low	94 Å²	94	108.4 Å²	108.4	50%	0.503	60%	0.602	S	S	.	*			cis	-162.9	165.2	-2.8	-122.9	-23	0	0	0	114.6
1215	N	34.5	Very low	33.1	Very low	93 Å²	93	105.5 Å²	105.5	50%	0.497	60%	0.599	S	S	.	*			trans	69.8	140.9	160.8	-57.9	-10.1	0	0	0	117.4
1216	N	34.7	Very low	33.2	Very low	92 Å²	92	106.8 Å²	106.8	49%	0.492	61%	0.606	S	S	.	*			cis	-162.3	135	-2.6	-104.8	-15.7	0	0	0	111.9
1217	N	33.8	Very low	33.1	Very low	86 Å²	86	108.6 Å²	108.6	46%	0.46	61%	0.61	S	S	.	*			trans	51.4	127	148.2	-45.4	-47.6	0	0	0	120.8	S536	S536-N1217 VanDerWaalsContact CB-ND2 3.27Å; S536-N1217 WeakPolarHBondContact CB-ND2 3.28Å; S536-N1217 VanDerWaalsContact OG-CG 3.25Å; S536-N1217 PolarHBondContact OG-ND2 3.41Å; S536-N1217 PolarHBondContact OG-OD1 3.39Å
1218	S	31.9	Very low	33.1	Very low	109 Å²	109	106.7 Å²	106.7	76%	0.762	61%	0.609	S	S	*	*			cis	82.9	126.4	14.8	127.4	0	0	0	0	118.6
1219	S	35.5	Very low	33.1	Very low	117 Å²	117	108.7 Å²	108.7	82%	0.818	62%	0.615	S	S	*	*			trans	-162.6	168.2	177.2	65.8	0	0	0	0	112.2
1220	Y	30.7	Very low	32.9	Very low	184 Å²	184	108.8 Å²	108.8	72%	0.722	61%	0.614	S	S	*	*			trans	-144.9	136.2	-153.2	-111.1	-133.2	0	0	0	117.8	K590	K590-Y1220 PolarHBondContact NZ-OH 2.88Å
1221	T	33.5	Very low	32.9	Very low	84 Å²	84	112 Å²	112	52%	0.515	63%	0.631	S	S	.	*			trans	67.3	138.7	136.3	59.5	0	0	0	0	125.6	N589 K590	N589-T1221 WeakPolarHBondContact OD1-CG2 3.47Å; K590-T1221 HydrophobicContact CD-CG2 4.27Å
1222	P	34.2	Very low	32.6	Very low	39 Å²	39	115.5 Å²	115.5	25%	0.253	64%	0.641	S	S	.	*			trans	-101.5	-173.4	167.7	42.6	-42.2	0	0	0	115.5	I587 I588 N589	I587-P1222 HydrophobicContact CD1-CB 4.38Å; I587-P1222 HydrophobicContact CG1-CB 4.21Å; I587-P1222 HydrophobicContact CG2-CB 3.92Å; I587-P1222 HydrophobicContact CG2-CG 3.78Å; I588-P1222 WeakPolarHBondContact O-CD 3.34Å; I588-P1222 VanDerWaalsContact O-CG 3.28Å; I588-P1222 WeakPolarHBondContact O-CG 3.34Å; N589-P1222 HydrophobicContact CB-CG 3.99Å; N589-P1222 VanDerWaalsContact CG-CD 3.47Å; N589-P1222 WeakPolarHBondContact ND2-CD 3.35Å; N589-P1222 PolarHBondContact ND2-O 2.92Å; N589-P1222 VanDerWaalsContact ND2-O 3.11Å
1223	C	31.3	Very low	32.2	Very low	129 Å²	129	119.7 Å²	119.7	87%	0.872	66%	0.655	S	S	*	*			trans	-144.4	165.4	179.2	56.1	0	0	0	0	114.1
1224	I	28.1	Very low	32	Very low	164 Å²	164	122.5 Å²	122.5	84%	0.841	66%	0.662	S	S	*	*			trans	-112.6	143.4	-173.9	-63.5	166.5	0	0	0	111.9
1225	A	33.2	Very low	31.8	Very low	86 Å²	86	122.7 Å²	122.7	71%	0.711	67%	0.666	S	S	*	*			trans	-154.8	124.8	156.7	0	0	0	0	0	107.6
1226	N	32.5	Very low	31.6	Very low	137 Å²	137	126.4 Å²	126.4	73%	0.733	68%	0.68	S	S	*	*				63.6	127.4	73.3	-68.9	-11.4	0	0	0	112.3
1227	H	32	Very low	31.4	Very low	169 Å²	169	129.3 Å²	129.3	78%	0.782	70%	0.696	S	S	*	*			cis	-164	-178.8	0	-153.4	-106.5	0	0	0	108.8
1228	A	31	Very low	31.3	Very low	71 Å²	71	130.1 Å²	130.1	59%	0.587	71%	0.706	S	S	*	*			trans	66.2	118.3	146.5	0	0	0	0	0	117.8
1229	E	33.4	Very low	31.1	Very low	165 Å²	165	129.4 Å²	129.4	77%	0.771	70%	0.701	S	S	*	*				82	143.7	90.7	-72.4	-132.6	146.5	0	0	114.1
1230	L	29.3	Very low	30.7	Very low	122 Å²	122	132.3 Å²	132.3	64%	0.639	70%	0.701	S	S	*	*			cis	-160.8	-171.1	-17.8	-153	65.4	0	0	0	106.8
1231	I	32.9	Very low	30.7	Very low	130 Å²	130	127.7 Å²	127.7	67%	0.667	69%	0.694	S	S	*	*			trans	61.9	92.9	152.7	-71	164.7	0	0	0	114.1
1232	K	28.9	Very low	30.4	Very low	168 Å²	168	133.9 Å²	133.9	73%	0.73	71%	0.708	S	S	*	*				79.5	148.4	82.2	-90.1	-178.8	174.4	172.8	0	113.4
1233	M	28.1	Very low	30.1	Very low	156 Å²	156	137.7 Å²	137.7	77%	0.768	73%	0.725	S	S	*	*			trans	72.7	140.6	150.9	-76.5	163	163.9	0	0	116.3
1234	K	28.6	Very low	30.3	Very low	178 Å²	178	139.7 Å²	139.7	77%	0.774	72%	0.719	S	S	*	*			cis	-169.5	179.5	-17.4	-149.7	-177.2	165.7	-170.9	0	107.3
1235	V	30.8	Very low	30.3	Very low	98 Å²	98	136.7 Å²	136.7	59%	0.594	71%	0.705	S	S	*	*			trans	80.7	142.2	146.5	162.5	0	0	0	0	117.7
1236	E	30.4	Very low	30.5	Very low	171 Å²	171	136.7 Å²	136.7	80%	0.799	70%	0.698	S	S	*	*			trans	58.4	91.5	161.2	-78.3	140.4	-140.6	0	0	121.4
1237	N	29.1	Very low	30.2	Very low	153 Å²	153	132.9 Å²	132.9	82%	0.818	68%	0.681	S	S	*	*				-35.2	143.9	115	-90.7	-28.9	0	0	0	111.1
1238	P	32.2	Very low	29.9	Very low	103 Å²	103	130.2 Å²	130.2	67%	0.669	67%	0.672	S	S	*	*				-152.9	-167.1	64.2	40.7	-20.6	0	0	0	115.5
1239	S	27	Very low	29.8	Very low	94 Å²	94	131.7 Å²	131.7	66%	0.657	68%	0.678	S	S	*	*			trans	67.7	126.1	157	47.2	0	0	0	0	116.8
1240	H	27.9	Very low	29.6	Very low	178 Å²	178	128.6 Å²	128.6	82%	0.824	68%	0.675	S	S	*	*				48.4	143.5	78.8	-78.3	-43.2	0	0	0	113.9
1241	P	30.6	Very low	29.5	Very low	87 Å²	87	130.1 Å²	130.1	57%	0.565	68%	0.682	S	S	*	*			cis	-145.8	-151.9	-16.1	30.6	-4.6	0	0	0	111
1242	R	27.1	Very low	29.2	Very low	214 Å²	214	126.6 Å²	126.6	81%	0.808	68%	0.678	S	S	*	*			trans	70.5	161.1	152	-67.2	167.6	-163.4	-143.4	6.8	114.9
1243	L	27.4	Very low	29.3	Very low	118 Å²	118	129.1 Å²	129.1	62%	0.618	68%	0.684	S	S	*	*			cis	-159.5	178.5	-18.1	-113.1	164.5	0	0	0	106.7
1244	F	35	Very low	29.6	Very low	171 Å²	171	126.6 Å²	126.6	75%	0.75	68%	0.68	S	S	*	*			trans	68.3	115.8	161.6	-64.8	-58.4	0	0	0	115.4
1245	N	29.2	Very low	29.5	Very low	102 Å²	102	125.4 Å²	125.4	55%	0.545	68%	0.681	S	S	.	*			cis	59.1	152.5	16.7	-121.8	41.3	0	0	0	112.8
1246	P	36.7	Very low	29.3	Very low	86 Å²	86	126 Å²	126	56%	0.558	68%	0.684	S	S	*	*			cis	-143.8	160.5	12.1	43.8	-25.5	0	0	0	117.2	N1107	N1107-P1246 CarbonylContact O-C 3.53Å
1247	C	26.6	Very low	29.3	Very low	56 Å²	56	126.7 Å²	126.7	38%	0.378	68%	0.681	S	S	.	*				70	139	128.5	-70.6	0	0	0	0	123	N1107 N1108 E1109	N1107-C1247 PolarHBondContact O-N 3.08Å; N1108-C1247 VanDerWaalsContact O-CA 3.27Å; N1108-C1247 WeakPolarHBondContact O-CA 3.17Å; N1108-C1247 PolarHBondContact O-N 3.08Å; E1109-C1247 PolarHBondContact O-SG 3.4Å; E1109-C1247 VanDerWaalsContact O-SG 3.38Å
1248	L	26.3	Very low	29.4	Very low	113 Å²	113	125 Å²	125	59%	0.592	68%	0.678	S	S	*	*				39.4	146.2	117.5	-42.3	168.6	0	0	0	119.2	E1109 K1110	E1109-L1248 WeakPolarHBondContact O-CG 3.45Å; K1110-L1248 WeakPolarHBondContact O-CD1 3.37Å
1249	S	28.9	Very low	29.1	Very low	103 Å²	103	126.3 Å²	126.3	72%	0.72	68%	0.675	S	S	*	*			cis	-153.1	148.8	21.8	40.8	0	0	0	0	109.1
1250	S	27.8	Very low	29.5	Very low	99 Å²	99	128.3 Å²	128.3	69%	0.692	69%	0.686	S	S	*	*			cis	70.4	144	46.5	-163.6	0	0	0	0	114
1251	I	27.6	Very low	29.4	Very low	154 Å²	154	126.2 Å²	126.2	79%	0.79	68%	0.678	S	S	*	*			trans	71.5	119.4	-177.9	-46.1	160.8	0	0	0	113.8
1252	G	28.2	Very low	29.4	Very low	56 Å²	56	132.5 Å²	132.5	58%	0.577	69%	0.692	S	S	*	*			cis	141.8	146.4	-7.3	0	0	0	0	0	113.4
1253	Y	29.1	Very low	29.5	Very low	221 Å²	221	126.9 Å²	126.9	87%	0.867	68%	0.682	S	S	*	*			trans	71	163.2	162.2	-48.1	-70.7	0	0	0	117.8
1254	P	34.4	Very low	29.5	Very low	104 Å²	104	126.9 Å²	126.9	68%	0.675	69%	0.691	S	S	*	*			cis	-128.3	-170.5	-10	25.7	-1.9	0	0	0	113.6
1255	L	27.1	Very low	29.2	Very low	152 Å²	152	122.5 Å²	122.5	80%	0.796	69%	0.687	S	S	*	*			trans	78.8	148.8	156.7	-53.3	-174.2	0	0	0	119.7
1256	V	27.3	Very low	29.2	Very low	110 Å²	110	124.1 Å²	124.1	67%	0.667	70%	0.701	S	S	*	*			cis	-168.7	122.3	-43.5	123	0	0	0	0	109.4
1257	Y	29	Very low	28.7	Very low	186 Å²	186	124.3 Å²	124.3	73%	0.729	70%	0.703	S	S	*	*			trans	59.7	175.6	159.6	-81.1	-102.3	0	0	0	117.1	H1259	Y1257-H1259 AromaticContact CD1-CD2 3.99Å; Y1257-H1259 AromaticContact CE1-CD2 3.61Å; Y1257-H1259 AromaticContact CE1-NE2 3.67Å
1258	P	31.2	Very low	28.9	Very low	118 Å²	118	129.4 Å²	129.4	77%	0.766	72%	0.721	S	S	*	*			cis	-117.3	165.2	-0.1	40.4	-27.8	0	0	0	116.5
1259	H	26.2	Very low	29.1	Very low	130 Å²	130	129.2 Å²	129.2	60%	0.602	73%	0.729	S	S	*	*			trans	-77.7	148.5	162.1	-51.2	-95.8	0	0	0	110.5	Y1257 M1261	Y1257-H1259 AromaticContact CD1-CD2 3.99Å; Y1257-H1259 AromaticContact CE1-CD2 3.61Å; Y1257-H1259 AromaticContact CE1-NE2 3.67Å; H1259-M1261 HydrophobicContact CB-CG 4.23Å; H1259-M1261 PolarHBondContact O-N 2.79Å; H1259-M1261 VanDerWaalsContact O-N 3.13Å
1260	P	36.2	Very low	29.2	Very low	136 Å²	136	134 Å²	134	88%	0.883	74%	0.737	S	S	*	*			trans	-71	96.2	148.9	30.5	-30.2	0	0	0	109
1261	M	25.3	Very low	29.4	Very low	135 Å²	135	138 Å²	138	67%	0.665	74%	0.737	S	S	*	*			trans	-96	109.2	167.1	-90.6	-97.4	74.1	0	0	109.9	H1259	H1259-M1261 HydrophobicContact CB-CG 4.23Å; H1259-M1261 PolarHBondContact O-N 2.79Å; H1259-M1261 VanDerWaalsContact O-N 3.13Å
1262	Y	31.1	Very low	29.3	Very low	219 Å²	219	141.4 Å²	141.4	86%	0.859	74%	0.741	S	S	*	*			trans	-126.7	101.9	146.7	-94	-101.9	0	0	0	105.6
1263	T	28.7	Very low	29.5	Very low	96 Å²	96	143.6 Å²	143.6	59%	0.589	74%	0.737	S	S	*	*				54.9	127.3	79.3	70.5	0	0	0	0	112.3
1264	S	27.7	Very low	29.5	Very low	117 Å²	117	139 Å²	139	82%	0.818	73%	0.727	S	S	*	*			cis	-161.2	170.5	-2.8	58.4	0	0	0	0	107.5
1265	A	29	Very low	29.4	Very low	80 Å²	80	139.8 Å²	139.8	66%	0.661	73%	0.73	S	S	*	*			cis	-159.9	157.2	25.6	0	0	0	0	0	113.5
1266	T	28.3	Very low	29.7	Very low	136 Å²	136	136 Å²	136	83%	0.834	72%	0.721	S	S	*	*				46.2	135.3	125.2	-55.2	0	0	0	0	121
1267	C	26	Very low	29.9	Very low	89 Å²	89	137.2 Å²	137.2	60%	0.601	73%	0.728	S	S	*	*			cis	-173.3	176.8	-16.1	-171.2	0	0	0	0	108.7
1268	H	31.9	Very low	30	Very low	164 Å²	164	133.7 Å²	133.7	76%	0.759	73%	0.73	S	S	*	*			trans	71.5	113.1	169.6	-39.9	108.5	0	0	0	115.4
1269	S	30	Very low	30.1	Very low	108 Å²	108	131.5 Å²	131.5	76%	0.755	72%	0.722	S	S	*	*			cis	79.7	107.5	13.1	-158.2	0	0	0	0	117.9
1270	K	31.5	Very low	30.5	Very low	204 Å²	204	128.4 Å²	128.4	89%	0.887	72%	0.716	S	S	*	*			trans	160.4	111.7	160.7	-92.8	163.4	-175.9	179.6	0	105.5
1271	R	30.8	Very low	30.3	Very low	184 Å²	184	128.1 Å²	128.1	69%	0.694	71%	0.711	S	S	*	*			cis	73.9	94.2	22.1	-164.2	-177	-175.3	-179.5	0.7	116.3	Q1273	R1271-Q1273 HydrophobicContact CG-CG 4Å
1272	Y	26.9	Very low	30.7	Very low	224 Å²	224	128.4 Å²	128.4	88%	0.878	71%	0.714	S	S	*	*				-142.9	126	126.8	-90.2	-87.7	0	0	0	104.8
1273	Q	31.7	Very low	30.7	Very low	103 Å²	103	124.7 Å²	124.7	48%	0.481	71%	0.714	S	S	.	*				67.3	125.8	55.9	-50.9	-78.5	-106.1	0	0	111.6	R1271	R1271-Q1273 HydrophobicContact CG-CG 4Å
1274	N	28.9	Very low	30.8	Very low	124 Å²	124	123.7 Å²	123.7	66%	0.663	72%	0.723	S	S	*	*			cis	-157.4	163.5	2.1	-100.6	-12.1	0	0	0	113.7
1275	T	32.3	Very low	30.9	Very low	120 Å²	120	122.8 Å²	122.8	74%	0.736	72%	0.722	S	S	*	*			trans	-35.6	137.3	152.6	46.1	0	0	0	0	114.5
1276	A	33.5	Very low	31.1	Very low	73 Å²	73	125 Å²	125	60%	0.603	73%	0.727	S	S	*	*				83.4	149.6	60.8	0	0	0	0	0	114.8
1277	V	31.1	Very low	31.2	Very low	135 Å²	135	123.6 Å²	123.6	82%	0.818	72%	0.723	S	S	*	*			trans	149.9	127.4	154.1	162.1	0	0	0	0	114
1278	S	31.1	Very low	31.6	Very low	112 Å²	112	124 Å²	124	78%	0.783	73%	0.727	S	S	*	*			trans	1	162.1	145.2	-45.7	0	0	0	0	122.4
1279	A	33.1	Very low	31.6	Very low	72 Å²	72	121.4 Å²	121.4	60%	0.595	73%	0.727	S	S	*	*			cis	-176.3	-154.1	-18.6	0	0	0	0	0	109.9	I199	I199-A1279 HydrophobicContact CD1-CB 3.47Å; I199-A1279 VanDerWaalsContact CD1-CB 3.47Å; I199-A1279 HydrophobicContact CG1-CB 4.48Å
1280	S	34.9	Very low	31.8	Very low	66 Å²	66	121 Å²	121	46%	0.462	72%	0.724	S	S	.	*			trans	89.1	118.7	168.2	-40	0	0	0	0	118.4	N198 I199	N198-S1280 PolarHBondContact O-OG 2.87Å; N198-S1280 VanDerWaalsContact O-OG 3.13Å; I199-S1280 WeakPolarHBondContact CD1-OG 3.46Å; I199-S1280 WeakPolarHBondContact CG1-OG 3.32Å
1281	V	33	Very low	31.9	Very low	129 Å²	129	115.7 Å²	115.7	78%	0.782	71%	0.713	S	S	*	*				50.8	137.3	75	-111.3	0	0	0	0	114.8
1282	I	32.9	Very low	31.9	Very low	141 Å²	141	113.6 Å²	113.6	72%	0.723	72%	0.721	S	S	*	*			cis	-150.1	147	36.1	-62.9	179.9	0	0	0	114.7
1283	T	31.6	Very low	32.1	Very low	142 Å²	142	107.6 Å²	107.6	87%	0.871	72%	0.717	S	S	*	*			trans	57.6	142.5	160.7	54.2	0	0	0	0	124.1
1284	G	29.8	Very low	32.1	Very low	75 Å²	75	107.4 Å²	107.4	77%	0.773	73%	0.734	S	S	*	*			trans	165.5	104.3	152.2	0	0	0	0	0	113.9
1285	A	31.7	Very low	32.1	Very low	97 Å²	97	107.2 Å²	107.2	80%	0.802	74%	0.737	S	S	*	*			trans	-67.3	159.7	177.3	0	0	0	0	0	111.8
1286	V	31.9	Very low	32.3	Very low	127 Å²	127	107.1 Å²	107.1	77%	0.77	74%	0.741	S	S	*	*				-159	166.7	52.9	-73	0	0	0	0	114.3
1287	S	31.7	Very low	32.2	Very low	106 Å²	106	109.8 Å²	109.8	74%	0.741	75%	0.75	S	S	*	*			trans	10.1	145.9	136.6	-52.5	0	0	0	0	119.9
1288	S	33.8	Very low	32.3	Very low	98 Å²	98	110.6 Å²	110.6	69%	0.685	75%	0.749	S	S	*	*			cis	-179.2	165.5	2.7	41.5	0	0	0	0	110.6
1289	S	32.3	Very low	32.4	Very low	110 Å²	110	111.8 Å²	111.8	77%	0.769	75%	0.751	S	S	*	*			trans	60.6	153	157.6	45.7	0	0	0	0	118
1290	S	33.3	Very low	32.3	Very low	98 Å²	98	114 Å²	114	69%	0.685	76%	0.757	S	S	*	*			cis	-164.4	-177.1	-18	51.1	0	0	0	0	107.8
1291	S	33	Very low	32.3	Very low	94 Å²	94	117.4 Å²	117.4	66%	0.657	78%	0.776	S	S	*	*			trans	23.7	130.1	147	60.1	0	0	0	0	119.2
1292	T	32.5	Very low	32.2	Very low	139 Å²	139	114.8 Å²	114.8	85%	0.853	77%	0.774	S	S	*	*			cis	-165.7	172.8	40.9	-28.3	0	0	0	0	111
1293	A	29.4	Very low	32.4	Very low	98 Å²	98	116.7 Å²	116.7	81%	0.81	78%	0.783	S	S	*	*			trans	-77.1	152.1	177.7	0	0	0	0	0	114.1
1294	A	31.6	Very low	32.8	Very low	100 Å²	100	115.4 Å²	115.4	83%	0.826	78%	0.777	S	S	*	*			trans	-151.1	127.7	153.1	0	0	0	0	0	110.8
1295	T	30	Very low	33.4	Very low	120 Å²	120	117.6 Å²	117.6	74%	0.736	78%	0.777	S	S	*	*			trans	-65.5	149.2	-177.7	-50.6	0	0	0	0	113.5	T1297	T1295-T1297 HydrophobicContact CG2-CG2 4.15Å
1296	S	35.6	Very low	33.7	Very low	118 Å²	118	119.5 Å²	119.5	83%	0.825	79%	0.785	S	S	*	*			trans	-147.8	98.8	156.1	-75.6	0	0	0	0	110.8
1297	T	31.4	Very low	34.3	Very low	129 Å²	129	116.5 Å²	116.5	79%	0.791	78%	0.779	S	S	*	*			trans	-81.4	122.2	174	44.6	0	0	0	0	110.4	T1295	T1295-T1297 HydrophobicContact CG2-CG2 4.15Å
1298	I	34.7	Very low	34.7	Very low	152 Å²	152	119.5 Å²	119.5	78%	0.779	78%	0.782	S	S	*	*			trans	-131.1	108.1	165.1	-57.9	-178.9	0	0	0	109.1
1299	T	32.9	Very low	35.1	Very low	137 Å²	137	121.2 Å²	121.2	84%	0.84	79%	0.787	S	S	*	*			trans	-81.6	119.2	164	33.1	0	0	0	0	110.3
1300	T	31.4	Very low	35.4	Very low	117 Å²	117	123.4 Å²	123.4	72%	0.718	78%	0.78	S	S	*	*			trans	-169	124.5	147	8.4	0	0	0	0	112.1
1301	T	33.6	Very low	36	Very low	139 Å²	139	123.4 Å²	123.4	85%	0.853	78%	0.777	S	S	*	*			trans	24.4	111	146.6	55.7	0	0	0	0	120.1
1302	G	31	Very low	36.7	Very low	73 Å²	73	124.4 Å²	124.4	75%	0.753	77%	0.773	S	S	*	*			trans	166.5	106.5	157.6	0	0	0	0	0	117.7
1303	M	37.8	Very low	37.7	Very low	182 Å²	182	124 Å²	124	90%	0.897	77%	0.766	S	S	*	*			trans	55.3	130.2	156	-55.5	-176.3	72.3	0	0	120.2
1304	P	39.8	Very low	38.7	Very low	115 Å²	115	123 Å²	123	75%	0.747	75%	0.747	S	S	*	*			trans	-73.1	153.5	166.3	32.7	-34.5	0	0	0	111.5	S1306	P1304-S1306 PolarHBondContact O-N 2.79Å
1305	P	42.1	Very low	39.5	Very low	121 Å²	121	127 Å²	127	79%	0.786	74%	0.741	S	S	*	*			trans	-66.6	129.3	-179	26.7	-34.2	0	0	0	112	G1307	P1305-G1307 PolarHBondContact O-N 3.48Å; P1305-G1307 VanDerWaalsContact O-N 3.16Å
1306	S	38.8	Very low	40.9	Very low	137 Å²	137	128.4 Å²	128.4	96%	0.958	74%	0.744	S	S	*	*	S	Bend	trans	-69.7	108	176.7	-168.6	0	0	0	0	110.2	P1304	P1304-S1306 PolarHBondContact O-N 2.79Å
1307	G	43.4	Very low	42.4	Very low	63 Å²	63	126.4 Å²	126.4	65%	0.649	72%	0.723	S	S	*	*			trans	170.4	-3	-176.4	0	0	0	0	0	117.4	P1305 V1309	P1305-G1307 PolarHBondContact O-N 3.48Å; P1305-G1307 VanDerWaalsContact O-N 3.16Å; G1307-V1309 PolarHBondContact O-N 3.49Å
1308	Q	40	Very low	44.7	Very low	170 Å²	170	124.3 Å²	124.3	79%	0.794	71%	0.705	S	S	*	*			trans	-70.7	90.8	175.9	-71.4	-162.1	2.3	0	0	111.9	Y1310	Q1308-Y1310 PolarHBondContact O-N 3Å
1309	V	42.7	Very low	47	Very low	133 Å²	133	119 Å²	119	81%	0.806	68%	0.677	S	S	*	*			trans	-66.9	111.8	163	179.3	0	0	0	0	107.8	G1307	G1307-V1309 PolarHBondContact O-N 3.49Å
1310	Y	37.8	Very low	49.6	Very low	156 Å²	156	120 Å²	120	61%	0.612	67%	0.665	S	S	*	*			trans	-63.7	130	170.4	-72.1	-95.3	0	0	0	109.2	Q1308 M1312	Q1308-Y1310 PolarHBondContact O-N 3Å; Y1310-M1312 PolarHBondContact O-N 3.21Å
1311	P	46.9	Very low	52.2	Low	98 Å²	98	116 Å²	116	64%	0.636	64%	0.641	S	S	*	*			trans	-62.9	112.4	173	25.1	-32.7	0	0	0	109.3	D1313	P1311-D1313 PolarHBondContact O-N 3.17Å
1312	M	46.3	Very low	54.9	Low	116 Å²	116	113.5 Å²	113.5	57%	0.571	63%	0.625	S	S	*	*	G	3₁₀ helix	trans	-74.6	-13.4	-167.3	-156.2	65.1	151.5	0	0	112.7	Y1310 N1314 W1315	Y1310-M1312 PolarHBondContact O-N 3.21Å; M1312-N1314 PolarHBondContact O-N 3.1Å; M1312-W1315 HydrophobicContact CE-CH2 3.46Å; M1312-W1315 VanDerWaalsContact CE-CH2 3.46Å; M1312-W1315 HydrophobicContact CE-CZ2 3.43Å; M1312-W1315 VanDerWaalsContact CE-CZ2 3.43Å; M1312-W1315 HydrophobicContact CE-CZ3 4.28Å; M1312-W1315 HydrophobicContact SD-CH2 4.25Å; M1312-W1315 HydrophobicContact SD-CZ2 3.68Å
1313	D	53.8	Low	57.6	Low	131 Å²	131	114.7 Å²	114.7	70%	0.701	61%	0.609	S	S	*	*	G	3₁₀ helix	trans	-68.3	-16.8	-173.5	-43.2	-74.8	0	0	0	113.3	P1311 W1315 N1316	P1311-D1313 PolarHBondContact O-N 3.17Å; D1313-W1315 PolarHBondContact O-N 3.22Å; D1313-N1316 PolarHBondContact O-N 3.29Å
1314	N	50.8	Low	60	Low	77 Å²	77	112.7 Å²	112.7	41%	0.412	60%	0.596	S	S	.	*	G	3₁₀ helix	trans	-65.8	-10.8	-175.1	-144.5	18.7	0	0	0	113.6	M1312 N1316 M1317	M1312-N1314 PolarHBondContact O-N 3.1Å; N1314-N1316 VanDerWaalsContact C-N 3.26Å; N1314-N1316 PolarHBondContact O-N 2.77Å; N1314-M1317 PolarHBondContact O-N 3.45Å; N1314-M1317 VanDerWaalsContact OD1-CG 3.3Å; N1314-M1317 WeakPolarHBondContact OD1-CG 3.08Å; N1314-M1317 PolarHBondContact OD1-SD 2.73Å
1315	W	49.6	Very low	62.3	Low	183 Å²	183	112.4 Å²	112.4	69%	0.693	58%	0.58	S	S	*	*	G	3₁₀ helix	trans	-71.6	-19.1	-179.9	-64.9	9.4	0	0	0	113.3	M1312 D1313	M1312-W1315 HydrophobicContact CE-CH2 3.46Å; M1312-W1315 VanDerWaalsContact CE-CH2 3.46Å; M1312-W1315 HydrophobicContact CE-CZ2 3.43Å; M1312-W1315 VanDerWaalsContact CE-CZ2 3.43Å; M1312-W1315 HydrophobicContact CE-CZ3 4.28Å; M1312-W1315 HydrophobicContact SD-CH2 4.25Å; M1312-W1315 HydrophobicContact SD-CZ2 3.68Å; D1313-W1315 PolarHBondContact O-N 3.22Å
1316	N	58.6	Low	64.5	Low	150 Å²	150	113.5 Å²	113.5	80%	0.802	59%	0.587	S	S	*	*	G	3₁₀ helix	trans	-90.1	4.3	177.2	-76	-23	0	0	0	114.1	D1313 N1314 M1318	D1313-N1316 PolarHBondContact O-N 3.29Å; N1314-N1316 VanDerWaalsContact C-N 3.26Å; N1314-N1316 PolarHBondContact O-N 2.77Å; N1316-M1318 PolarHBondContact O-N 3.05Å
1317	M	67.2	Low	66.7	Low	76 Å²	76	112 Å²	112	37%	0.374	57%	0.568	S	S	.	*			trans	-63.9	133.1	174.4	-75.3	-152.2	95.8	0	0	112	N1314 I1337	N1314-M1317 PolarHBondContact O-N 3.45Å; N1314-M1317 VanDerWaalsContact OD1-CG 3.3Å; N1314-M1317 WeakPolarHBondContact OD1-CG 3.08Å; N1314-M1317 PolarHBondContact OD1-SD 2.73Å; M1317-I1337 HydrophobicContact CB-CB 3.84Å; M1317-I1337 HydrophobicContact CB-CD1 3.93Å; M1317-I1337 HydrophobicContact CB-CG1 3.94Å; M1317-I1337 HydrophobicContact CB-CG2 4.47Å; M1317-I1337 HydrophobicContact CE-CD1 4.33Å; M1317-I1337 PolarHBondContact O-N 2.81Å; M1317-I1337 HydrophobicContact SD-CD1 4.38Å
1318	M	80.1	Confident	68.8	Low	84 Å²	84	110.8 Å²	110.8	41%	0.414	56%	0.555	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-124	132	179.9	-80.7	-86.1	-179.5	0	0	109.9	N1316 R1334 R1335 P1336	N1316-M1318 PolarHBondContact O-N 3.05Å; M1318-R1334 HydrophobicContact CB-CG 3.84Å; M1318-R1334 HydrophobicContact CG-CG 4.29Å; M1318-R1334 HydrophobicContact SD-CG 3.89Å; M1318-R1335 CarbonylContact C-O 3.57Å; M1318-R1335 WeakPolarHBondContact CA-O 3.48Å; M1318-P1336 HydrophobicContact CE-CG 4.08Å; M1318-P1336 HydrophobicContact SD-CG 4.35Å
1319	E	83.4	Confident	70.5	Confident	42 Å²	42	105.7 Å²	105.7	20%	0.196	54%	0.536	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	143	173.5	57	-173.9	-136.8	0	0	111.6	V1321 R1334 R1335 I1337	E1319-V1321 HydrophobicContact CG-CG2 4.14Å; E1319-R1334 CarbonylContact O-C 3.52Å; E1319-R1334 WeakPolarHBondContact O-CA 3.25Å; E1319-R1335 HydrophobicContact CG-CG 3.7Å; E1319-R1335 PolarHBondContact N-O 2.68Å; E1319-R1335 PolarHBondContact O-N 3.07Å; E1319-R1335 IonicContact OE1-CZ 2.71Å; E1319-R1335 IonicContact OE1-NE 2.73Å; E1319-R1335 PolarHBondContact OE1-NE 2.72Å; E1319-R1335 IonicContact OE1-NH2 3.31Å; E1319-R1335 PolarHBondContact OE1-NH2 2.83Å; E1319-I1337 HydrophobicContact CB-CD1 3.69Å; E1319-I1337 HydrophobicContact CB-CG1 3.69Å; E1319-I1337 HydrophobicContact CG-CD1 4.35Å; E1319-I1337 HydrophobicContact CG-CG1 3.82Å
1320	W	86.2	Confident	72.7	Confident	157 Å²	157	108.1 Å²	108.1	60%	0.595	53%	0.53	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.7	125.8	171.6	-65	108.9	0	0	0	109.6	I1332 R1334	W1320-I1332 HydrophobicContact CB-CG2 4Å; W1320-I1332 HydrophobicContact CD2-CG2 4.44Å; W1320-I1332 HydrophobicContact CE3-CG2 3.8Å; W1320-R1334 HydrophobicContact CD2-CB 4.32Å; W1320-R1334 HydrophobicContact CD2-CG 4.07Å; W1320-R1334 HydrophobicContact CE3-CB 3.72Å; W1320-R1334 HydrophobicContact CE3-CG 3.98Å; W1320-R1334 HydrophobicContact CH2-CB 4.28Å; W1320-R1334 HydrophobicContact CH2-CG 4.37Å; W1320-R1334 HydrophobicContact CZ2-CG 4.41Å; W1320-R1334 HydrophobicContact CZ3-CB 3.71Å; W1320-R1334 HydrophobicContact CZ3-CG 4.15Å
1321	V	86.4	Confident	75.1	Confident	34 Å²	34	104.1 Å²	104.1	21%	0.206	52%	0.515	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	125.1	-176.6	179.4	0	0	0	0	109.6	E1319 K1323 I1332 T1333 R1335	E1319-V1321 HydrophobicContact CG-CG2 4.14Å; V1321-K1323 HydrophobicContact CG1-CG 4.31Å; V1321-K1323 PolarHBondContact O-N 3.2Å; V1321-I1332 WeakPolarHBondContact O-CA 3.39Å; V1321-T1333 PolarHBondContact N-O 2.66Å; V1321-T1333 PolarHBondContact O-N 3.32Å; V1321-T1333 PolarHBondContact O-OG1 3.3Å; V1321-R1335 HydrophobicContact CG2-CG 4.04Å
1322	V	89.7	Confident	76.9	Confident	86 Å²	86	104.5 Å²	104.5	52%	0.521	51%	0.51	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	107.6	174.8	-175.4	0	0	0	0	109	R1330 Y1331 I1332	V1322-R1330 HydrophobicContact CG1-CB 3.81Å; V1322-R1330 HydrophobicContact CG1-CG 4.23Å; V1322-Y1331 CarbonylContact C-O 3.6Å; V1322-Y1331 WeakPolarHBondContact CA-O 3.35Å; V1322-I1332 HydrophobicContact CG2-CG1 4.47Å
1323	K	88	Confident	79	Confident	98 Å²	98	101 Å²	101	43%	0.426	50%	0.495	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	145.4	173.4	-63.5	-176.6	73.8	-166.5	0	109.8	V1321 R1330 Y1331 T1333	V1321-K1323 HydrophobicContact CG1-CG 4.31Å; V1321-K1323 PolarHBondContact O-N 3.2Å; K1323-R1330 CarbonylContact O-C 3.37Å; K1323-R1330 VanDerWaalsContact O-CA 3.32Å; K1323-R1330 WeakPolarHBondContact O-CA 3.29Å; K1323-Y1331 HydrophobicContact CB-CD1 4.03Å; K1323-Y1331 HydrophobicContact CB-CD2 4.4Å; K1323-Y1331 HydrophobicContact CB-CE1 3.53Å; K1323-Y1331 HydrophobicContact CB-CE2 3.93Å; K1323-Y1331 HydrophobicContact CB-CG 4.45Å; K1323-Y1331 VanDerWaalsContact CB-CZ 3.47Å; K1323-Y1331 HydrophobicContact CD-CE2 3.98Å; K1323-Y1331 VanDerWaalsContact CE-OH 3.28Å; K1323-Y1331 WeakPolarHBondContact CE-OH 3.1Å; K1323-Y1331 HydrophobicContact CG-CE2 4.46Å; K1323-Y1331 PolarHBondContact N-O 3.11Å; K1323-Y1331 PolarHBondContact NZ-OH 3.49Å; K1323-Y1331 VanDerWaalsContact NZ-OH 3.1Å; K1323-Y1331 WeakPolarHBondContact O-CD1 3.3Å; K1323-Y1331 PolarHBondContact O-N 2.9Å; K1323-T1333 HydrophobicContact CD-CG2 3.85Å; K1323-T1333 HydrophobicContact CG-CG2 4.48Å
1324	K	89.2	Confident	80.5	Confident	140 Å²	140	102 Å²	102	61%	0.609	49%	0.489	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.5	143.6	171.6	-161.7	-174	168.2	-169.7	0	108.8	T1329	K1324-T1329 CarbonylContact C-O 3.5Å; K1324-T1329 WeakPolarHBondContact CA-O 3.33Å
1325	R	87.7	Confident	81.9	Confident	109 Å²	109	104 Å²	104	41%	0.411	49%	0.491	S	S	.	.	P	Polyproline II helix	trans	-89.4	163.5	167.7	-65.5	-170.5	-174.2	103.4	-6	110	D1327 G1328 T1329 Y1331	R1325-D1327 VanDerWaalsContact CB-OD1 3.26Å; R1325-D1327 WeakPolarHBondContact CB-OD1 3.21Å; R1325-D1327 WeakPolarHBondContact CD-OD2 3.47Å; R1325-D1327 PolarHBondContact O-N 3.5Å; R1325-G1328 PolarHBondContact O-N 2.74Å; R1325-G1328 VanDerWaalsContact O-N 3.16Å; R1325-T1329 WeakPolarHBondContact CD-OG1 3.38Å; R1325-T1329 PolarHBondContact N-O 2.84Å; R1325-T1329 PolarHBondContact NH1-OG1 3.44Å; R1325-Y1331 HydrophobicContact CG-CD1 3.64Å; R1325-Y1331 HydrophobicContact CG-CE1 3.72Å
1326	P	87.6	Confident	83.4	Confident	144 Å²	144	98.8 Å²	98.8	94%	0.935	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.7	-39.8	170.6	-26.2	36	0	0	0	112.6	G1328	P1326-G1328 PolarHBondContact O-N 3.24Å
1327	D	86.3	Confident	84.1	Confident	106 Å²	106	92 Å²	92	57%	0.567	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	3.4	176.6	66.5	36.9	0	0	0	115.9	R1325 T1329	R1325-D1327 VanDerWaalsContact CB-OD1 3.26Å; R1325-D1327 WeakPolarHBondContact CB-OD1 3.21Å; R1325-D1327 WeakPolarHBondContact CD-OD2 3.47Å; R1325-D1327 PolarHBondContact O-N 3.5Å; D1327-T1329 VanDerWaalsContact C-N 3.29Å; D1327-T1329 PolarHBondContact O-N 2.93Å; D1327-T1329 WeakPolarHBondContact OD1-CA 3.4Å; D1327-T1329 WeakPolarHBondContact OD1-CB 3.23Å; D1327-T1329 VanDerWaalsContact OD1-CG2 3.25Å; D1327-T1329 WeakPolarHBondContact OD1-CG2 3.39Å; D1327-T1329 PolarHBondContact OD1-N 3.34Å; D1327-T1329 PolarHBondContact OD1-OG1 3.34Å
1328	G	86.7	Confident	84.3	Confident	36 Å²	36	97 Å²	97	37%	0.371	46%	0.459	S	S	.	.	S	Bend	trans	88.8	-23.8	-180	0	0	0	0	0	115.2	R1325 P1326	R1325-G1328 PolarHBondContact O-N 2.74Å; R1325-G1328 VanDerWaalsContact O-N 3.16Å; P1326-G1328 PolarHBondContact O-N 3.24Å
1329	T	76	Confident	84	Confident	64 Å²	64	98.3 Å²	98.3	39%	0.393	47%	0.468	S	S	.	.			trans	-71.2	164.5	-176.7	71.3	0	0	0	0	112.3	K1324 R1325 D1327	K1324-T1329 CarbonylContact C-O 3.5Å; K1324-T1329 WeakPolarHBondContact CA-O 3.33Å; R1325-T1329 WeakPolarHBondContact CD-OG1 3.38Å; R1325-T1329 PolarHBondContact N-O 2.84Å; R1325-T1329 PolarHBondContact NH1-OG1 3.44Å; D1327-T1329 VanDerWaalsContact C-N 3.29Å; D1327-T1329 PolarHBondContact O-N 2.93Å; D1327-T1329 WeakPolarHBondContact OD1-CA 3.4Å; D1327-T1329 WeakPolarHBondContact OD1-CB 3.23Å; D1327-T1329 VanDerWaalsContact OD1-CG2 3.25Å; D1327-T1329 WeakPolarHBondContact OD1-CG2 3.39Å; D1327-T1329 PolarHBondContact OD1-N 3.34Å; D1327-T1329 PolarHBondContact OD1-OG1 3.34Å
1330	R	89.4	Confident	83.5	Confident	183 Å²	183	102.2 Å²	102.2	69%	0.691	48%	0.481	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.2	141.4	-175.7	-62.5	-179.8	-172.2	-114.8	6.7	111.1	V1322 K1323	V1322-R1330 HydrophobicContact CG1-CB 3.81Å; V1322-R1330 HydrophobicContact CG1-CG 4.23Å; K1323-R1330 CarbonylContact O-C 3.37Å; K1323-R1330 VanDerWaalsContact O-CA 3.32Å; K1323-R1330 WeakPolarHBondContact O-CA 3.29Å
1331	Y	86.7	Confident	83	Confident	73 Å²	73	97 Å²	97	29%	0.286	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	153.2	176.1	66.2	-76.3	0	0	0	110.3	V1322 K1323 R1325 T1333	V1322-Y1331 CarbonylContact C-O 3.6Å; V1322-Y1331 WeakPolarHBondContact CA-O 3.35Å; K1323-Y1331 HydrophobicContact CB-CD1 4.03Å; K1323-Y1331 HydrophobicContact CB-CD2 4.4Å; K1323-Y1331 HydrophobicContact CB-CE1 3.53Å; K1323-Y1331 HydrophobicContact CB-CE2 3.93Å; K1323-Y1331 HydrophobicContact CB-CG 4.45Å; K1323-Y1331 VanDerWaalsContact CB-CZ 3.47Å; K1323-Y1331 HydrophobicContact CD-CE2 3.98Å; K1323-Y1331 VanDerWaalsContact CE-OH 3.28Å; K1323-Y1331 WeakPolarHBondContact CE-OH 3.1Å; K1323-Y1331 HydrophobicContact CG-CE2 4.46Å; K1323-Y1331 PolarHBondContact N-O 3.11Å; K1323-Y1331 PolarHBondContact NZ-OH 3.49Å; K1323-Y1331 VanDerWaalsContact NZ-OH 3.1Å; K1323-Y1331 WeakPolarHBondContact O-CD1 3.3Å; K1323-Y1331 PolarHBondContact O-N 2.9Å; R1325-Y1331 HydrophobicContact CG-CD1 3.64Å; R1325-Y1331 HydrophobicContact CG-CE1 3.72Å; Y1331-T1333 HydrophobicContact CD2-CG2 3.68Å; Y1331-T1333 HydrophobicContact CE2-CG2 3.45Å; Y1331-T1333 VanDerWaalsContact CE2-CG2 3.45Å
1332	I	86.1	Confident	82.6	Confident	105 Å²	105	99.8 Å²	99.8	54%	0.538	48%	0.478	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	124.7	-176.5	-41.8	-177.5	0	0	0	109.1	W1320 V1321 V1322	W1320-I1332 HydrophobicContact CB-CG2 4Å; W1320-I1332 HydrophobicContact CD2-CG2 4.44Å; W1320-I1332 HydrophobicContact CE3-CG2 3.8Å; V1321-I1332 WeakPolarHBondContact O-CA 3.39Å; V1322-I1332 HydrophobicContact CG2-CG1 4.47Å
1333	T	88.9	Confident	82.3	Confident	43 Å²	43	103.7 Å²	103.7	26%	0.264	49%	0.487	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	138.6	175.4	56.2	0	0	0	0	110.6	V1321 K1323 Y1331	V1321-T1333 PolarHBondContact N-O 2.66Å; V1321-T1333 PolarHBondContact O-N 3.32Å; V1321-T1333 PolarHBondContact O-OG1 3.3Å; K1323-T1333 HydrophobicContact CD-CG2 3.85Å; K1323-T1333 HydrophobicContact CG-CG2 4.48Å; Y1331-T1333 HydrophobicContact CD2-CG2 3.68Å; Y1331-T1333 HydrophobicContact CE2-CG2 3.45Å; Y1331-T1333 VanDerWaalsContact CE2-CG2 3.45Å
1334	R	86	Confident	81.9	Confident	152 Å²	152	103.1 Å²	103.1	57%	0.574	49%	0.486	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.6	121.2	174	-156.8	-179.7	73.5	-170.6	0.4	109.9	M1318 E1319 W1320	M1318-R1334 HydrophobicContact CB-CG 3.84Å; M1318-R1334 HydrophobicContact CG-CG 4.29Å; M1318-R1334 HydrophobicContact SD-CG 3.89Å; E1319-R1334 CarbonylContact O-C 3.52Å; E1319-R1334 WeakPolarHBondContact O-CA 3.25Å; W1320-R1334 HydrophobicContact CD2-CB 4.32Å; W1320-R1334 HydrophobicContact CD2-CG 4.07Å; W1320-R1334 HydrophobicContact CE3-CB 3.72Å; W1320-R1334 HydrophobicContact CE3-CG 3.98Å; W1320-R1334 HydrophobicContact CH2-CB 4.28Å; W1320-R1334 HydrophobicContact CH2-CG 4.37Å; W1320-R1334 HydrophobicContact CZ2-CG 4.41Å; W1320-R1334 HydrophobicContact CZ3-CB 3.71Å; W1320-R1334 HydrophobicContact CZ3-CG 4.15Å
1335	R	80	Confident	81.5	Confident	119 Å²	119	104.5 Å²	104.5	45%	0.449	49%	0.488	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	152.3	178.5	71.4	176.9	-173.4	-161.2	-6.5	112.2	M1318 E1319 V1321	M1318-R1335 CarbonylContact C-O 3.57Å; M1318-R1335 WeakPolarHBondContact CA-O 3.48Å; E1319-R1335 HydrophobicContact CG-CG 3.7Å; E1319-R1335 PolarHBondContact N-O 2.68Å; E1319-R1335 PolarHBondContact O-N 3.07Å; E1319-R1335 IonicContact OE1-CZ 2.71Å; E1319-R1335 IonicContact OE1-NE 2.73Å; E1319-R1335 PolarHBondContact OE1-NE 2.72Å; E1319-R1335 IonicContact OE1-NH2 3.31Å; E1319-R1335 PolarHBondContact OE1-NH2 2.83Å; V1321-R1335 HydrophobicContact CG2-CG 4.04Å
1336	P	81.3	Confident	81.1	Confident	73 Å²	73	102.1 Å²	102.1	47%	0.474	49%	0.491	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.6	142.1	176	-21.8	33.6	0	0	0	112.7	M1318 R1338	M1318-P1336 HydrophobicContact CE-CG 4.08Å; M1318-P1336 HydrophobicContact SD-CG 4.35Å; P1336-R1338 PolarHBondContact O-N 3.13Å
1337	I	73.2	Confident	80.8	Confident	7 Å²	7	101.1 Å²	101.1	4%	0.036	47%	0.472	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.8	13.5	-178.9	-60.6	-162.2	0	0	0	112.8	M1317 E1319 N1339 R1340 I1341	M1317-I1337 HydrophobicContact CB-CB 3.84Å; M1317-I1337 HydrophobicContact CB-CD1 3.93Å; M1317-I1337 HydrophobicContact CB-CG1 3.94Å; M1317-I1337 HydrophobicContact CB-CG2 4.47Å; M1317-I1337 HydrophobicContact CE-CD1 4.33Å; M1317-I1337 PolarHBondContact O-N 2.81Å; M1317-I1337 HydrophobicContact SD-CD1 4.38Å; E1319-I1337 HydrophobicContact CB-CD1 3.69Å; E1319-I1337 HydrophobicContact CB-CG1 3.69Å; E1319-I1337 HydrophobicContact CG-CD1 4.35Å; E1319-I1337 HydrophobicContact CG-CG1 3.82Å; I1337-N1339 PolarHBondContact O-N 3.23Å; I1337-R1340 HydrophobicContact CG2-CB 3.6Å; I1337-R1340 HydrophobicContact CG2-CG 4.41Å; I1337-R1340 PolarHBondContact O-N 2.9Å; I1337-I1341 HydrophobicContact CG2-CG1 4.41Å; I1337-I1341 PolarHBondContact O-N 2.97Å; I1337-I1341 VanDerWaalsContact O-N 3.15Å
1338	R	72.3	Confident	80.4	Confident	181 Å²	181	101.6 Å²	101.6	68%	0.683	47%	0.466	S	S	*	.	H	α-helix	trans	-49.1	-41	-178.6	-166.3	-179.5	-175.7	101.4	-6.3	112.6	P1336 I1341 L1342	P1336-R1338 PolarHBondContact O-N 3.13Å; R1338-I1341 PolarHBondContact O-N 2.88Å; R1338-L1342 HydrophobicContact CG-CD1 3.98Å; R1338-L1342 HydrophobicContact CG-CG 4.43Å; R1338-L1342 WeakPolarHBondContact O-CB 2.95Å; R1338-L1342 VanDerWaalsContact O-CG 3.25Å; R1338-L1342 WeakPolarHBondContact O-CG 3.31Å; R1338-L1342 PolarHBondContact O-N 2.86Å
1339	N	72.3	Confident	79.8	Confident	112 Å²	112	102.4 Å²	102.4	60%	0.599	46%	0.462	S	S	*	.	H	α-helix	trans	-70	-33.3	-178.4	-66.4	13.3	0	0	0	112.9	I1337 K1343	I1337-N1339 PolarHBondContact O-N 3.23Å; N1339-K1343 VanDerWaalsContact O-CB 3.28Å; N1339-K1343 WeakPolarHBondContact O-CB 3.3Å; N1339-K1343 PolarHBondContact O-N 2.67Å
1340	R	73.3	Confident	79.9	Confident	124 Å²	124	102.2 Å²	102.2	47%	0.468	47%	0.467	S	S	.	.	H	α-helix	trans	-70.3	-44.8	174.3	-167.1	178.6	77.4	-163.1	3.3	110.6	I1337 L1342 K1343 E1344	I1337-R1340 HydrophobicContact CG2-CB 3.6Å; I1337-R1340 HydrophobicContact CG2-CG 4.41Å; I1337-R1340 PolarHBondContact O-N 2.9Å; R1340-L1342 VanDerWaalsContact C-N 3.34Å; R1340-L1342 PolarHBondContact O-N 3.46Å; R1340-K1343 PolarHBondContact O-N 2.84Å; R1340-E1344 WeakPolarHBondContact O-CB 3.13Å; R1340-E1344 PolarHBondContact O-N 3.49Å
1341	I	77	Confident	79.3	Confident	47 Å²	47	98.5 Å²	98.5	24%	0.241	46%	0.457	C	S	.	.	H	α-helix	trans	-62.9	-41.3	177.8	-62.7	168.3	0	0	0	110.6	I1337 R1338 R1345	I1337-I1341 HydrophobicContact CG2-CG1 4.41Å; I1337-I1341 PolarHBondContact O-N 2.97Å; I1337-I1341 VanDerWaalsContact O-N 3.15Å; R1338-I1341 PolarHBondContact O-N 2.88Å; I1341-R1345 VanDerWaalsContact O-CB 3.24Å; I1341-R1345 WeakPolarHBondContact O-CB 3.39Å; I1341-R1345 PolarHBondContact O-N 2.92Å
1342	L	76.8	Confident	78.8	Confident	94 Å²	94	101.4 Å²	101.4	49%	0.492	47%	0.473	S	S	.	.	H	α-helix	trans	-65.8	-42.6	174.1	-73	172.1	0	0	0	112.3	R1338 R1340 R1345 A1346	R1338-L1342 HydrophobicContact CG-CD1 3.98Å; R1338-L1342 HydrophobicContact CG-CG 4.43Å; R1338-L1342 WeakPolarHBondContact O-CB 2.95Å; R1338-L1342 VanDerWaalsContact O-CG 3.25Å; R1338-L1342 WeakPolarHBondContact O-CG 3.31Å; R1338-L1342 PolarHBondContact O-N 2.86Å; R1340-L1342 VanDerWaalsContact C-N 3.34Å; R1340-L1342 PolarHBondContact O-N 3.46Å; L1342-R1345 PolarHBondContact O-N 3.29Å; L1342-A1346 VanDerWaalsContact O-CB 3.25Å; L1342-A1346 WeakPolarHBondContact O-CB 3.33Å; L1342-A1346 PolarHBondContact O-N 3.33Å
1343	K	82.5	Confident	77.8	Confident	167 Å²	167	101.2 Å²	101.2	73%	0.726	47%	0.466	S	S	*	.	H	α-helix	trans	-66.4	-39.7	177.1	-173.6	171.1	-177.6	174	0	112.3	N1339 R1340 A1346 K1347	N1339-K1343 VanDerWaalsContact O-CB 3.28Å; N1339-K1343 WeakPolarHBondContact O-CB 3.3Å; N1339-K1343 PolarHBondContact O-N 2.67Å; R1340-K1343 PolarHBondContact O-N 2.84Å; K1343-A1346 PolarHBondContact O-N 2.71Å; K1343-K1347 PolarHBondContact O-N 3.12Å
1344	E	80.9	Confident	76.2	Confident	87 Å²	87	103.2 Å²	103.2	41%	0.407	48%	0.482	S	S	.	.	H	α-helix	trans	-68.3	-44.3	176.1	-167.8	-174.8	154.6	0	0	111.3	R1340 A1346 K1347 R1348	R1340-E1344 WeakPolarHBondContact O-CB 3.13Å; R1340-E1344 PolarHBondContact O-N 3.49Å; E1344-A1346 VanDerWaalsContact C-N 3.29Å; E1344-A1346 PolarHBondContact O-N 2.88Å; E1344-K1347 PolarHBondContact O-N 3.22Å; E1344-R1348 WeakPolarHBondContact O-CG 3.44Å; E1344-R1348 PolarHBondContact O-N 3.16Å; E1344-R1348 IonicContact OE1-CZ 2.68Å; E1344-R1348 IonicContact OE1-NE 2.58Å; E1344-R1348 PolarHBondContact OE1-NE 3.39Å; E1344-R1348 IonicContact OE1-NH2 3.94Å; E1344-R1348 PolarHBondContact OE1-NH2 3.26Å
1345	R	79.6	Confident	74.9	Confident	168 Å²	168	99.8 Å²	99.8	63%	0.634	49%	0.494	S	S	*	.	H	α-helix	trans	-62.1	-36.9	172.9	-169.6	178.6	-174.5	-175	2.9	111.7	I1341 L1342 L1349	I1341-R1345 VanDerWaalsContact O-CB 3.24Å; I1341-R1345 WeakPolarHBondContact O-CB 3.39Å; I1341-R1345 PolarHBondContact O-N 2.92Å; L1342-R1345 PolarHBondContact O-N 3.29Å; R1345-L1349 HydrophobicContact CG-CD1 3.99Å; R1345-L1349 HydrophobicContact CG-CG 4.42Å; R1345-L1349 VanDerWaalsContact O-CB 3.23Å; R1345-L1349 WeakPolarHBondContact O-CB 3.35Å; R1345-L1349 WeakPolarHBondContact O-CD1 3.08Å; R1345-L1349 WeakPolarHBondContact O-CG 3.44Å; R1345-L1349 PolarHBondContact O-N 2.74Å
1346	A	80.9	Confident	73.5	Confident	59 Å²	59	101.5 Å²	101.5	49%	0.488	51%	0.51	S	S	.	.	H	α-helix	trans	-66.7	-41.4	173.9	0	0	0	0	0	112.1	L1342 K1343 E1344 L1349 A1350	L1342-A1346 VanDerWaalsContact O-CB 3.25Å; L1342-A1346 WeakPolarHBondContact O-CB 3.33Å; L1342-A1346 PolarHBondContact O-N 3.33Å; K1343-A1346 PolarHBondContact O-N 2.71Å; E1344-A1346 VanDerWaalsContact C-N 3.29Å; E1344-A1346 PolarHBondContact O-N 2.88Å; A1346-L1349 PolarHBondContact O-N 3.32Å; A1346-A1350 PolarHBondContact O-N 3.28Å; A1346-A1350 VanDerWaalsContact O-N 3.08Å
1347	K	80.9	Confident	71.7	Confident	123 Å²	123	101.6 Å²	101.6	54%	0.535	51%	0.509	S	S	.	.	H	α-helix	trans	-60.5	-52.6	172.4	-174.1	-176.2	-179.6	-92.3	0	110.7	K1343 E1344 L1349 A1350 E1351	K1343-K1347 PolarHBondContact O-N 3.12Å; E1344-K1347 PolarHBondContact O-N 3.22Å; K1347-L1349 VanDerWaalsContact C-N 3.3Å; K1347-L1349 PolarHBondContact O-N 3.39Å; K1347-A1350 CarbonylContact O-C 3.19Å; K1347-A1350 WeakPolarHBondContact O-CA 3.43Å; K1347-A1350 WeakPolarHBondContact O-CB 3.37Å; K1347-A1350 PolarHBondContact O-N 2.95Å; K1347-E1351 IonicContact NZ-OE1 3.92Å; K1347-E1351 PolarHBondContact NZ-OE1 2.74Å; K1347-E1351 IonicContact NZ-OE2 3.72Å; K1347-E1351 PolarHBondContact NZ-OE2 3.15Å; K1347-E1351 WeakPolarHBondContact O-CB 3.48Å; K1347-E1351 PolarHBondContact O-N 3.19Å
1348	R	77.5	Confident	70.7	Confident	116 Å²	116	105.6 Å²	105.6	44%	0.438	53%	0.534	S	S	.	.	H	α-helix	trans	-57.9	-41.6	177.6	-66.2	-174.3	-166	-152.3	5.5	111.6	E1344 A1350 E1351 E1352	E1344-R1348 WeakPolarHBondContact O-CG 3.44Å; E1344-R1348 PolarHBondContact O-N 3.16Å; E1344-R1348 IonicContact OE1-CZ 2.68Å; E1344-R1348 IonicContact OE1-NE 2.58Å; E1344-R1348 PolarHBondContact OE1-NE 3.39Å; E1344-R1348 IonicContact OE1-NH2 3.94Å; E1344-R1348 PolarHBondContact OE1-NH2 3.26Å; R1348-A1350 PolarHBondContact O-N 3.45Å; R1348-E1351 PolarHBondContact O-N 3.02Å; R1348-E1351 VanDerWaalsContact O-N 3.16Å; R1348-E1352 VanDerWaalsContact O-CB 3.26Å; R1348-E1352 WeakPolarHBondContact O-CB 3.46Å; R1348-E1352 VanDerWaalsContact O-CG 3.24Å; R1348-E1352 WeakPolarHBondContact O-CG 3.37Å; R1348-E1352 PolarHBondContact O-N 3.27Å
1349	L	75.3	Confident	69.6	Low	54 Å²	54	103 Å²	103	28%	0.283	53%	0.534	S	S	.	.	H	α-helix	trans	-69.4	-11.3	175.4	-74.6	170.3	0	0	0	114.8	R1345 A1346 K1347 R1353	R1345-L1349 HydrophobicContact CG-CD1 3.99Å; R1345-L1349 HydrophobicContact CG-CG 4.42Å; R1345-L1349 VanDerWaalsContact O-CB 3.23Å; R1345-L1349 WeakPolarHBondContact O-CB 3.35Å; R1345-L1349 WeakPolarHBondContact O-CD1 3.08Å; R1345-L1349 WeakPolarHBondContact O-CG 3.44Å; R1345-L1349 PolarHBondContact O-N 2.74Å; A1346-L1349 PolarHBondContact O-N 3.32Å; K1347-L1349 VanDerWaalsContact C-N 3.3Å; K1347-L1349 PolarHBondContact O-N 3.39Å; L1349-R1353 VanDerWaalsContact O-CD 3.28Å; L1349-R1353 WeakPolarHBondContact O-CD 3.46Å; L1349-R1353 VanDerWaalsContact O-CG 3.3Å; L1349-R1353 WeakPolarHBondContact O-CG 3.37Å; L1349-R1353 PolarHBondContact O-NH1 3.07Å
1350	A	77.9	Confident	68.6	Low	60 Å²	60	103.9 Å²	103.9	50%	0.496	54%	0.539	S	S	.	.	H	α-helix	trans	-94.4	-34.8	168.5	0	0	0	0	0	111.5	A1346 K1347 R1348 R1353 S1354	A1346-A1350 PolarHBondContact O-N 3.28Å; A1346-A1350 VanDerWaalsContact O-N 3.08Å; K1347-A1350 CarbonylContact O-C 3.19Å; K1347-A1350 WeakPolarHBondContact O-CA 3.43Å; K1347-A1350 WeakPolarHBondContact O-CB 3.37Å; K1347-A1350 PolarHBondContact O-N 2.95Å; R1348-A1350 PolarHBondContact O-N 3.45Å; A1350-R1353 CarbonylContact O-C 3.54Å; A1350-R1353 WeakPolarHBondContact O-CA 3.28Å; A1350-R1353 WeakPolarHBondContact O-CB 3.36Å; A1350-R1353 PolarHBondContact O-N 3.42Å; A1350-R1353 VanDerWaalsContact O-N 3.17Å; A1350-S1354 PolarHBondContact O-N 2.78Å
1351	E	76.6	Confident	67.5	Low	104 Å²	104	103.9 Å²	103.9	49%	0.486	55%	0.548	S	S	.	.	H	α-helix	trans	-76.3	-38.7	-179.6	-162.1	160	-149.1	0	0	112	K1347 R1348 R1353 S1354	K1347-E1351 IonicContact NZ-OE1 3.92Å; K1347-E1351 PolarHBondContact NZ-OE1 2.74Å; K1347-E1351 IonicContact NZ-OE2 3.72Å; K1347-E1351 PolarHBondContact NZ-OE2 3.15Å; K1347-E1351 WeakPolarHBondContact O-CB 3.48Å; K1347-E1351 PolarHBondContact O-N 3.19Å; R1348-E1351 PolarHBondContact O-N 3.02Å; R1348-E1351 VanDerWaalsContact O-N 3.16Å; E1351-R1353 PolarHBondContact O-N 3.04Å; E1351-S1354 WeakPolarHBondContact CA-OG 3.16Å; E1351-S1354 PolarHBondContact O-N 3.18Å; E1351-S1354 PolarHBondContact O-OG 2.97Å
1352	E	74.8	Confident	66.1	Low	135 Å²	135	105.5 Å²	105.5	63%	0.631	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.5	-10.3	165.4	-67.6	169.6	171.7	0	0	112.8	R1348	R1348-E1352 VanDerWaalsContact O-CB 3.26Å; R1348-E1352 WeakPolarHBondContact O-CB 3.46Å; R1348-E1352 VanDerWaalsContact O-CG 3.24Å; R1348-E1352 WeakPolarHBondContact O-CG 3.37Å; R1348-E1352 PolarHBondContact O-N 3.27Å
1353	R	66.9	Low	64.6	Low	101 Å²	101	107.7 Å²	107.7	38%	0.381	58%	0.579	S	S	.	*	T	Hydrogen-bonded Turn	trans	-104.8	-27.6	176.7	-85.2	-173.1	179	70.9	12.5	113.2	L1349 A1350 E1351 G1355 I1356 T1357	L1349-R1353 VanDerWaalsContact O-CD 3.28Å; L1349-R1353 WeakPolarHBondContact O-CD 3.46Å; L1349-R1353 VanDerWaalsContact O-CG 3.3Å; L1349-R1353 WeakPolarHBondContact O-CG 3.37Å; L1349-R1353 PolarHBondContact O-NH1 3.07Å; A1350-R1353 CarbonylContact O-C 3.54Å; A1350-R1353 WeakPolarHBondContact O-CA 3.28Å; A1350-R1353 WeakPolarHBondContact O-CB 3.36Å; A1350-R1353 PolarHBondContact O-N 3.42Å; A1350-R1353 VanDerWaalsContact O-N 3.17Å; E1351-R1353 PolarHBondContact O-N 3.04Å; R1353-G1355 PolarHBondContact O-N 3.31Å; R1353-I1356 PolarHBondContact O-N 3.36Å; R1353-T1357 HydrophobicContact CB-CG2 3.77Å; R1353-T1357 HydrophobicContact CG-CG2 4.21Å; R1353-T1357 PolarHBondContact O-N 3.03Å; R1353-T1357 PolarHBondContact O-OG1 3.48Å
1354	S	54.8	Low	62.7	Low	85 Å²	85	104.5 Å²	104.5	59%	0.594	58%	0.578	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.3	104.3	171.4	54.2	0	0	0	0	108.9	A1350 E1351	A1350-S1354 PolarHBondContact O-N 2.78Å; E1351-S1354 WeakPolarHBondContact CA-OG 3.16Å; E1351-S1354 PolarHBondContact O-N 3.18Å; E1351-S1354 PolarHBondContact O-OG 2.97Å
1355	G	58	Low	60.9	Low	80 Å²	80	107 Å²	107	83%	0.825	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	142.6	-20.8	-172.3	0	0	0	0	0	114.3	R1353	R1353-G1355 PolarHBondContact O-N 3.31Å
1356	I	50.9	Low	59.1	Low	155 Å²	155	106.9 Å²	106.9	80%	0.795	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-154	15.1	175.1	-153.4	159.5	0	0	0	115.8	R1353	R1353-I1356 PolarHBondContact O-N 3.36Å
1357	T	43.1	Very low	57.3	Low	75 Å²	75	111.3 Å²	111.3	46%	0.46	61%	0.609	S	S	.	*			trans	-76.5	129.3	175.8	38.2	0	0	0	0	113	R1353 D1359	R1353-T1357 HydrophobicContact CB-CG2 3.77Å; R1353-T1357 HydrophobicContact CG-CG2 4.21Å; R1353-T1357 PolarHBondContact O-N 3.03Å; R1353-T1357 PolarHBondContact O-OG1 3.48Å; T1357-D1359 PolarHBondContact O-N 3.44Å
1358	T	52.5	Low	55.4	Low	91 Å²	91	112.2 Å²	112.2	56%	0.558	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.4	39.6	-177.5	-33.4	0	0	0	0	114.3	D1361	T1358-D1361 HydrophobicContact CG2-CB 4.16Å; T1358-D1361 VanDerWaalsContact CG2-OD2 3.28Å; T1358-D1361 WeakPolarHBondContact CG2-OD2 3.36Å
1359	D	50.3	Low	53.6	Low	127 Å²	127	110 Å²	110	68%	0.679	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.5	-30.6	-173.5	-134	14.6	0	0	0	112	T1357 D1361 A1362	T1357-D1359 PolarHBondContact O-N 3.44Å; D1359-D1361 VanDerWaalsContact C-N 3.3Å; D1359-D1361 PolarHBondContact O-N 3.19Å; D1359-A1362 WeakPolarHBondContact O-CB 3.13Å; D1359-A1362 PolarHBondContact O-N 3.45Å; D1359-A1362 VanDerWaalsContact O-N 3.15Å
1360	D	49.9	Very low	52.9	Low	130 Å²	130	115.4 Å²	115.4	70%	0.695	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.8	-34.1	170.4	-87.2	-50.3	0	0	0	112.1	A1362 I1363	D1360-A1362 PolarHBondContact O-N 3.12Å; D1360-I1363 WeakPolarHBondContact O-CG2 3.4Å; D1360-I1363 PolarHBondContact O-N 2.58Å
1361	D	50.5	Low	51.8	Low	123 Å²	123	121.6 Å²	121.6	66%	0.658	67%	0.666	S	S	*	*	H	α-helix	trans	-63.2	-22.5	175.4	-71	-48.1	0	0	0	112.4	T1358 D1359 I1363	T1358-D1361 HydrophobicContact CG2-CB 4.16Å; T1358-D1361 VanDerWaalsContact CG2-OD2 3.28Å; T1358-D1361 WeakPolarHBondContact CG2-OD2 3.36Å; D1359-D1361 VanDerWaalsContact C-N 3.3Å; D1359-D1361 PolarHBondContact O-N 3.19Å; D1361-I1363 VanDerWaalsContact C-N 3.31Å
1362	A	46.8	Very low	51.7	Low	81 Å²	81	121.9 Å²	121.9	67%	0.669	66%	0.663	S	S	*	*	H	α-helix	trans	-77.9	-13.6	175.7	0	0	0	0	0	113.4	D1359 D1360	D1359-A1362 WeakPolarHBondContact O-CB 3.13Å; D1359-A1362 PolarHBondContact O-N 3.45Å; D1359-A1362 VanDerWaalsContact O-N 3.15Å; D1360-A1362 PolarHBondContact O-N 3.12Å
1363	I	46.7	Very low	51.8	Low	140 Å²	140	119.1 Å²	119.1	72%	0.718	65%	0.652	S	S	*	*	H	α-helix	trans	-97.6	-9.3	-176.3	-135.5	169.1	0	0	0	113.7	D1360 D1361	D1360-I1363 WeakPolarHBondContact O-CG2 3.4Å; D1360-I1363 PolarHBondContact O-N 2.58Å; D1361-I1363 VanDerWaalsContact C-N 3.31Å
1364	S	43	Very low	51.8	Low	100 Å²	100	121.8 Å²	121.8	70%	0.699	66%	0.662	S	S	*	*	H	α-helix	trans	-104.3	-19.6	-166.1	-161.7	0	0	0	0	116.3	L1366	S1364-L1366 PolarHBondContact O-N 3.46Å
1365	E	41.9	Very low	52.8	Low	140 Å²	140	122 Å²	122	65%	0.654	66%	0.664	S	S	*	*			trans	-94.8	87.9	170.5	-89.2	-143.4	156.5	0	0	112.2	K1367	E1365-K1367 PolarHBondContact O-N 2.79Å; E1365-K1367 IonicContact OE1-NZ 3.96Å; E1365-K1367 PolarHBondContact OE1-NZ 2.75Å; E1365-K1367 IonicContact OE2-NZ 3.84Å; E1365-K1367 PolarHBondContact OE2-NZ 2.68Å
1366	L	41.4	Very low	53.8	Low	166 Å²	166	120.5 Å²	120.5	87%	0.869	64%	0.636	S	S	*	*			trans	-72.9	52.5	174.4	-159	82.6	0	0	0	113.1	S1364 T1368	S1364-L1366 PolarHBondContact O-N 3.46Å; L1366-T1368 PolarHBondContact O-N 2.61Å
1367	K	43	Very low	55.1	Low	152 Å²	152	119.4 Å²	119.4	66%	0.661	62%	0.621	S	S	*	*			trans	-81.6	111.6	-178	-167.3	167.6	-81.9	145.6	0	109.2	E1365 G1369	E1365-K1367 PolarHBondContact O-N 2.79Å; E1365-K1367 IonicContact OE1-NZ 3.96Å; E1365-K1367 PolarHBondContact OE1-NZ 2.75Å; E1365-K1367 IonicContact OE2-NZ 3.84Å; E1365-K1367 PolarHBondContact OE2-NZ 2.68Å; K1367-G1369 PolarHBondContact O-N 2.99Å
1368	T	41.9	Very low	57.1	Low	142 Å²	142	122.7 Å²	122.7	87%	0.871	63%	0.629	S	S	*	*			trans	-62.9	79.3	-166.4	41.2	0	0	0	0	115	L1366 R1370	L1366-T1368 PolarHBondContact O-N 2.61Å; T1368-R1370 PolarHBondContact O-N 2.97Å
1369	G	39.9	Very low	58.6	Low	68 Å²	68	125.7 Å²	125.7	70%	0.701	63%	0.634	S	S	*	*	P	Polyproline II helix	trans	-74.6	116.6	178.5	0	0	0	0	0	113.2	K1367 Y1371	K1367-G1369 PolarHBondContact O-N 2.99Å; G1369-Y1371 PolarHBondContact O-N 3.2Å
1370	R	60	Low	60.1	Low	168 Å²	168	124.1 Å²	124.1	63%	0.634	62%	0.623	S	S	*	*	P	Polyproline II helix	trans	-54.8	119.4	170.6	-177.2	-178.6	-175.6	-91.6	7.5	109.8	T1368 W1372 E1376	T1368-R1370 PolarHBondContact O-N 2.97Å; R1370-W1372 PolarHBondContact O-N 3.19Å; R1370-W1372 PolarHBondContact O-NE1 2.77Å; R1370-E1376 IonicContact CZ-OE1 3.64Å; R1370-E1376 IonicContact NH1-OE1 2.77Å; R1370-E1376 PolarHBondContact NH1-OE1 3.39Å; R1370-E1376 IonicContact NH1-OE2 3.37Å; R1370-E1376 PolarHBondContact NH1-OE2 3.29Å; R1370-E1376 IonicContact NH2-OE1 3.55Å
1371	Y	54.6	Low	61.7	Low	191 Å²	191	123.1 Å²	123.1	75%	0.749	62%	0.617	S	S	*	*	P	Polyproline II helix	trans	-65.4	120.8	-176.6	-164.9	-95.6	0	0	0	111.4	G1369	G1369-Y1371 PolarHBondContact O-N 3.2Å
1372	W	76	Confident	63.3	Low	110 Å²	110	123.6 Å²	123.6	42%	0.417	62%	0.616	S	S	.	*			trans	-84	115.8	179.1	-70.5	69.1	0	0	0	109.7	R1370 E1376 R1377 Q1380	R1370-W1372 PolarHBondContact O-N 3.19Å; R1370-W1372 PolarHBondContact O-NE1 2.77Å; W1372-E1376 HydrophobicContact CB-CB 4.46Å; W1372-E1376 HydrophobicContact CD2-CB 4.46Å; W1372-E1376 HydrophobicContact CE3-CB 3.65Å; W1372-E1376 HydrophobicContact CZ3-CB 4.2Å; W1372-R1377 PolarHBondContact O-NH2 3.15Å; W1372-Q1380 HydrophobicContact CD2-CG 4.47Å; W1372-Q1380 VanDerWaalsContact CD2-NE2 3.29Å; W1372-Q1380 HydrophobicContact CE3-CG 3.61Å; W1372-Q1380 HydrophobicContact CH2-CG 4.27Å; W1372-Q1380 HydrophobicContact CZ3-CG 3.51Å
1373	N	75.1	Confident	65.3	Low	77 Å²	77	126.6 Å²	126.6	41%	0.412	61%	0.613	S	S	.	*			trans	-66.9	167.2	178.5	75.4	37.8	0	0	0	111.5	S1375 E1376 R1377	N1373-S1375 PolarHBondContact O-N 3.43Å; N1373-S1375 PolarHBondContact OD1-N 2.95Å; N1373-S1375 VanDerWaalsContact OD1-N 3.15Å; N1373-E1376 PolarHBondContact N-OE2 3.41Å; N1373-E1376 PolarHBondContact O-N 2.89Å; N1373-E1376 WeakPolarHBondContact OD1-CG 3.35Å; N1373-E1376 PolarHBondContact OD1-N 3.17Å; N1373-R1377 VanDerWaalsContact O-CB 3.31Å; N1373-R1377 WeakPolarHBondContact O-CB 3.19Å; N1373-R1377 PolarHBondContact O-N 3.37Å
1374	R	68	Low	67.2	Low	156 Å²	156	122 Å²	122	59%	0.589	60%	0.596	S	S	*	*	H	α-helix	trans	-56.4	-37.8	-172.4	-163	173.3	-178	-114.5	-8.4	112.5	K1378	R1374-K1378 PolarHBondContact O-N 3.18Å
1375	S	75.6	Confident	69.4	Low	90 Å²	90	124 Å²	124	63%	0.629	59%	0.592	S	S	*	*	H	α-helix	trans	-74.7	-44.5	178.8	-49.2	0	0	0	0	112.8	N1373 R1377 K1378 K1379	N1373-S1375 PolarHBondContact O-N 3.43Å; N1373-S1375 PolarHBondContact OD1-N 2.95Å; N1373-S1375 VanDerWaalsContact OD1-N 3.15Å; S1375-R1377 PolarHBondContact O-N 2.96Å; S1375-K1378 PolarHBondContact O-N 2.85Å; S1375-K1379 VanDerWaalsContact O-CB 3.3Å; S1375-K1379 WeakPolarHBondContact O-CB 3.43Å; S1375-K1379 PolarHBondContact O-N 3.21Å
1376	E	79.9	Confident	71.5	Confident	49 Å²	49	119.9 Å²	119.9	23%	0.229	58%	0.582	C	S	.	*	H	α-helix	trans	-59.7	-36.4	172.3	-73.7	-176.9	141.8	0	0	111.2	R1370 W1372 N1373 Q1380	R1370-E1376 IonicContact CZ-OE1 3.64Å; R1370-E1376 IonicContact NH1-OE1 2.77Å; R1370-E1376 PolarHBondContact NH1-OE1 3.39Å; R1370-E1376 IonicContact NH1-OE2 3.37Å; R1370-E1376 PolarHBondContact NH1-OE2 3.29Å; R1370-E1376 IonicContact NH2-OE1 3.55Å; W1372-E1376 HydrophobicContact CB-CB 4.46Å; W1372-E1376 HydrophobicContact CD2-CB 4.46Å; W1372-E1376 HydrophobicContact CE3-CB 3.65Å; W1372-E1376 HydrophobicContact CZ3-CB 4.2Å; N1373-E1376 PolarHBondContact N-OE2 3.41Å; N1373-E1376 PolarHBondContact O-N 2.89Å; N1373-E1376 WeakPolarHBondContact OD1-CG 3.35Å; N1373-E1376 PolarHBondContact OD1-N 3.17Å; E1376-Q1380 PolarHBondContact O-N 3.26Å
1377	R	77.5	Confident	73.7	Confident	131 Å²	131	114.3 Å²	114.3	49%	0.494	55%	0.554	S	S	.	*	H	α-helix	trans	-70.8	-44.9	176.7	-160.6	-179.7	-55.7	-177	4.7	112.5	W1372 N1373 S1375 K1379 Q1380 L1381	W1372-R1377 PolarHBondContact O-NH2 3.15Å; N1373-R1377 VanDerWaalsContact O-CB 3.31Å; N1373-R1377 WeakPolarHBondContact O-CB 3.19Å; N1373-R1377 PolarHBondContact O-N 3.37Å; S1375-R1377 PolarHBondContact O-N 2.96Å; R1377-K1379 VanDerWaalsContact C-N 3.3Å; R1377-K1379 PolarHBondContact O-N 3.43Å; R1377-Q1380 PolarHBondContact O-N 3.3Å; R1377-L1381 PolarHBondContact O-N 3.01Å
1378	K	83.9	Confident	75.8	Confident	144 Å²	144	116 Å²	116	63%	0.626	56%	0.556	S	S	*	*	H	α-helix	trans	-56.3	-45.7	171.6	-167.3	172	-178.4	176.1	0	110	R1374 S1375 L1381 E1382	R1374-K1378 PolarHBondContact O-N 3.18Å; S1375-K1378 PolarHBondContact O-N 2.85Å; K1378-L1381 PolarHBondContact O-N 3.37Å; K1378-E1382 WeakPolarHBondContact O-CB 3.32Å; K1378-E1382 PolarHBondContact O-N 3.4Å
1379	K	84.6	Confident	78	Confident	154 Å²	154	116 Å²	116	67%	0.67	54%	0.543	S	S	*	.	H	α-helix	trans	-67.9	-34.2	178.7	-164.7	166.5	-171.9	166.5	0	114.1	S1375 R1377 K1383	S1375-K1379 VanDerWaalsContact O-CB 3.3Å; S1375-K1379 WeakPolarHBondContact O-CB 3.43Å; S1375-K1379 PolarHBondContact O-N 3.21Å; R1377-K1379 VanDerWaalsContact C-N 3.3Å; R1377-K1379 PolarHBondContact O-N 3.43Å; K1379-K1383 VanDerWaalsContact O-CB 3.28Å; K1379-K1383 WeakPolarHBondContact O-CB 3.48Å; K1379-K1383 PolarHBondContact O-N 2.89Å
1380	Q	82.2	Confident	80.3	Confident	94 Å²	94	119.3 Å²	119.3	44%	0.439	54%	0.535	S	S	.	.	H	α-helix	trans	-65.1	-48	169.2	-88.9	-158	7.9	0	0	111.9	W1372 E1376 R1377 E1382 K1383 A1384	W1372-Q1380 HydrophobicContact CD2-CG 4.47Å; W1372-Q1380 VanDerWaalsContact CD2-NE2 3.29Å; W1372-Q1380 HydrophobicContact CE3-CG 3.61Å; W1372-Q1380 HydrophobicContact CH2-CG 4.27Å; W1372-Q1380 HydrophobicContact CZ3-CG 3.51Å; E1376-Q1380 PolarHBondContact O-N 3.26Å; R1377-Q1380 PolarHBondContact O-N 3.3Å; Q1380-E1382 VanDerWaalsContact C-N 3.31Å; Q1380-E1382 PolarHBondContact O-N 3.43Å; Q1380-K1383 PolarHBondContact O-N 3.22Å; Q1380-A1384 WeakPolarHBondContact O-CB 3.38Å; Q1380-A1384 PolarHBondContact O-N 3.45Å
1381	L	84.3	Confident	81.6	Confident	110 Å²	110	118.2 Å²	118.2	58%	0.576	54%	0.535	S	S	*	.	H	α-helix	trans	-62.6	-40.6	-178.4	-178.9	61.3	0	0	0	111.5	R1377 K1378 A1384 K1385	R1377-L1381 PolarHBondContact O-N 3.01Å; K1378-L1381 PolarHBondContact O-N 3.37Å; L1381-A1384 PolarHBondContact O-N 3.3Å; L1381-K1385 WeakPolarHBondContact O-CG 3.16Å; L1381-K1385 PolarHBondContact O-N 3.34Å
1382	E	83.3	Confident	82.8	Confident	133 Å²	133	115.2 Å²	115.2	62%	0.621	53%	0.527	S	S	*	.	H	α-helix	trans	-64.5	-47.4	173.9	-175.6	172.9	-140.3	0	0	112	K1378 Q1380 A1384 K1385 A1386	K1378-E1382 WeakPolarHBondContact O-CB 3.32Å; K1378-E1382 PolarHBondContact O-N 3.4Å; Q1380-E1382 VanDerWaalsContact C-N 3.31Å; Q1380-E1382 PolarHBondContact O-N 3.43Å; E1382-A1384 VanDerWaalsContact C-N 3.28Å; E1382-A1384 PolarHBondContact O-N 2.92Å; E1382-K1385 PolarHBondContact O-N 2.89Å; E1382-A1386 WeakPolarHBondContact O-CB 3.35Å; E1382-A1386 PolarHBondContact O-N 3.42Å
1383	K	87.7	Confident	83.1	Confident	143 Å²	143	114.5 Å²	114.5	62%	0.622	53%	0.531	S	S	*	.	H	α-helix	trans	-58.7	-39.8	173.8	-174.4	178.1	178.4	-176.8	0	111.8	K1379 Q1380 A1386 D1387	K1379-K1383 VanDerWaalsContact O-CB 3.28Å; K1379-K1383 WeakPolarHBondContact O-CB 3.48Å; K1379-K1383 PolarHBondContact O-N 2.89Å; Q1380-K1383 PolarHBondContact O-N 3.22Å; K1383-A1386 PolarHBondContact O-N 3.3Å; K1383-D1387 WeakPolarHBondContact O-CB 3.27Å; K1383-D1387 PolarHBondContact O-N 2.93Å
1384	A	86.8	Confident	83.3	Confident	43 Å²	43	114.9 Å²	114.9	36%	0.355	53%	0.534	S	S	.	.	H	α-helix	trans	-67.6	-39.4	176.2	0	0	0	0	0	112.5	Q1380 L1381 E1382 R1388	Q1380-A1384 WeakPolarHBondContact O-CB 3.38Å; Q1380-A1384 PolarHBondContact O-N 3.45Å; L1381-A1384 PolarHBondContact O-N 3.3Å; E1382-A1384 VanDerWaalsContact C-N 3.28Å; E1382-A1384 PolarHBondContact O-N 2.92Å; A1384-R1388 WeakPolarHBondContact O-CB 3.31Å; A1384-R1388 VanDerWaalsContact O-CG 3.27Å; A1384-R1388 WeakPolarHBondContact O-CG 3.36Å; A1384-R1388 PolarHBondContact O-N 2.93Å
1385	K	89.9	Confident	83.9	Confident	143 Å²	143	111.8 Å²	111.8	62%	0.622	53%	0.528	S	S	*	.	H	α-helix	trans	-62.1	-43.6	170.2	-78.6	-176.7	176	-177	0	111.1	L1381 E1382 R1388 K1389	L1381-K1385 WeakPolarHBondContact O-CG 3.16Å; L1381-K1385 PolarHBondContact O-N 3.34Å; E1382-K1385 PolarHBondContact O-N 2.89Å; K1385-R1388 PolarHBondContact O-N 2.92Å; K1385-K1389 WeakPolarHBondContact O-CB 3.18Å; K1385-K1389 PolarHBondContact O-N 3.27Å
1386	A	86.6	Confident	84	Confident	54 Å²	54	111.6 Å²	111.6	45%	0.446	52%	0.519	S	S	.	.	H	α-helix	trans	-65.5	-42.9	177.7	0	0	0	0	0	112.7	E1382 K1383 K1389 R1390	E1382-A1386 WeakPolarHBondContact O-CB 3.35Å; E1382-A1386 PolarHBondContact O-N 3.42Å; K1383-A1386 PolarHBondContact O-N 3.3Å; A1386-K1389 PolarHBondContact O-N 2.95Å; A1386-R1390 WeakPolarHBondContact O-CB 3.5Å; A1386-R1390 PolarHBondContact O-N 3.35Å
1387	D	86.9	Confident	83.7	Confident	49 Å²	49	113.4 Å²	113.4	26%	0.262	53%	0.533	S	S	.	.	H	α-helix	trans	-65.6	-36.8	174.1	-83	-38.2	0	0	0	111.8	K1383 R1390 K1391	K1383-D1387 WeakPolarHBondContact O-CB 3.27Å; K1383-D1387 PolarHBondContact O-N 2.93Å; D1387-R1390 IonicContact OD1-CZ 3.13Å; D1387-R1390 IonicContact OD1-NH1 2.68Å; D1387-R1390 PolarHBondContact OD1-NH1 3.39Å; D1387-R1390 IonicContact OD1-NH2 2.74Å; D1387-R1390 PolarHBondContact OD1-NH2 3.38Å; D1387-K1391 WeakPolarHBondContact O-CB 3.41Å; D1387-K1391 VanDerWaalsContact O-CG 3.3Å; D1387-K1391 WeakPolarHBondContact O-CG 3.35Å; D1387-K1391 PolarHBondContact O-N 3.4Å
1388	R	87.4	Confident	83.3	Confident	186 Å²	186	113 Å²	113	70%	0.702	54%	0.537	S	S	*	.	H	α-helix	trans	-63.8	-46.2	171	-75.1	175.7	-175.7	-168.8	2.3	111.7	A1384 K1385 K1391 Q1392	A1384-R1388 WeakPolarHBondContact O-CB 3.31Å; A1384-R1388 VanDerWaalsContact O-CG 3.27Å; A1384-R1388 WeakPolarHBondContact O-CG 3.36Å; A1384-R1388 PolarHBondContact O-N 2.93Å; K1385-R1388 PolarHBondContact O-N 2.92Å; R1388-K1391 PolarHBondContact O-N 3.16Å; R1388-Q1392 PolarHBondContact O-N 3.33Å
1389	K	87.5	Confident	82.2	Confident	142 Å²	142	111.4 Å²	111.4	62%	0.617	53%	0.532	S	S	*	.	H	α-helix	trans	-64.1	-39.3	177.5	-164.9	170.9	-176.7	176.5	0	111.8	K1385 A1386 Q1392 L1393	K1385-K1389 WeakPolarHBondContact O-CB 3.18Å; K1385-K1389 PolarHBondContact O-N 3.27Å; A1386-K1389 PolarHBondContact O-N 2.95Å; K1389-Q1392 PolarHBondContact O-N 3Å; K1389-L1393 HydrophobicContact CG-CD1 4.41Å; K1389-L1393 WeakPolarHBondContact O-CB 3.34Å; K1389-L1393 WeakPolarHBondContact O-CG 3.4Å; K1389-L1393 PolarHBondContact O-N 2.88Å
1390	R	88.3	Confident	80.9	Confident	139 Å²	139	108 Å²	108	53%	0.525	52%	0.521	S	S	.	.	H	α-helix	trans	-66.3	-37.7	173.1	-166.3	173.7	73.7	-98	-5.9	112.3	A1386 D1387 N1394	A1386-R1390 WeakPolarHBondContact O-CB 3.5Å; A1386-R1390 PolarHBondContact O-N 3.35Å; D1387-R1390 IonicContact OD1-CZ 3.13Å; D1387-R1390 IonicContact OD1-NH1 2.68Å; D1387-R1390 PolarHBondContact OD1-NH1 3.39Å; D1387-R1390 IonicContact OD1-NH2 2.74Å; D1387-R1390 PolarHBondContact OD1-NH2 3.38Å; R1390-N1394 WeakPolarHBondContact O-CB 3.48Å; R1390-N1394 VanDerWaalsContact O-CG 3.32Å; R1390-N1394 PolarHBondContact O-N 2.94Å; R1390-N1394 PolarHBondContact O-OD1 3.32Å
1391	K	86.8	Confident	79.3	Confident	144 Å²	144	106.9 Å²	106.9	63%	0.626	52%	0.523	S	S	*	.	H	α-helix	trans	-63.1	-45.5	172.8	-76.7	175.7	-179.8	-174.7	0	111.8	D1387 R1388 N1394 I1395	D1387-K1391 WeakPolarHBondContact O-CB 3.41Å; D1387-K1391 VanDerWaalsContact O-CG 3.3Å; D1387-K1391 WeakPolarHBondContact O-CG 3.35Å; D1387-K1391 PolarHBondContact O-N 3.4Å; R1388-K1391 PolarHBondContact O-N 3.16Å; K1391-N1394 PolarHBondContact O-N 2.95Å; K1391-I1395 VanDerWaalsContact O-CG1 3.3Å; K1391-I1395 WeakPolarHBondContact O-CG1 3.34Å; K1391-I1395 PolarHBondContact O-N 2.84Å
1392	Q	80.8	Confident	77.6	Confident	128 Å²	128	108.6 Å²	108.6	60%	0.598	53%	0.528	S	S	*	.	H	α-helix	trans	-60.6	-48.5	174.6	-77.4	179.3	-27.8	0	0	112.2	R1388 K1389 N1394 I1395 I1396	R1388-Q1392 PolarHBondContact O-N 3.33Å; K1389-Q1392 PolarHBondContact O-N 3Å; Q1392-N1394 VanDerWaalsContact C-N 3.33Å; Q1392-N1394 PolarHBondContact O-N 2.83Å; Q1392-I1395 PolarHBondContact O-N 3.22Å; Q1392-I1395 VanDerWaalsContact O-N 3.16Å; Q1392-I1396 WeakPolarHBondContact O-CG1 3.49Å; Q1392-I1396 PolarHBondContact O-N 3Å
1393	L	82	Confident	75.6	Confident	95 Å²	95	109.6 Å²	109.6	50%	0.497	53%	0.53	S	S	.	.	H	α-helix	trans	-60.2	-39.9	177.2	-75	168.1	0	0	0	112.5	K1389 I1396 T1397	K1389-L1393 HydrophobicContact CG-CD1 4.41Å; K1389-L1393 WeakPolarHBondContact O-CB 3.34Å; K1389-L1393 WeakPolarHBondContact O-CG 3.4Å; K1389-L1393 PolarHBondContact O-N 2.88Å; L1393-I1396 PolarHBondContact O-N 3.27Å; L1393-T1397 VanDerWaalsContact O-CB 3.31Å; L1393-T1397 WeakPolarHBondContact O-CB 3.32Å; L1393-T1397 PolarHBondContact O-N 2.74Å; L1393-T1397 PolarHBondContact O-OG1 2.9Å
1394	N	79.6	Confident	73.2	Confident	86 Å²	86	108.8 Å²	108.8	46%	0.46	53%	0.533	S	S	.	.	H	α-helix	trans	-65.5	-39	175.1	-77.7	9.9	0	0	0	112.3	R1390 K1391 Q1392 T1397 Q1398	R1390-N1394 WeakPolarHBondContact O-CB 3.48Å; R1390-N1394 VanDerWaalsContact O-CG 3.32Å; R1390-N1394 PolarHBondContact O-N 2.94Å; R1390-N1394 PolarHBondContact O-OD1 3.32Å; K1391-N1394 PolarHBondContact O-N 2.95Å; Q1392-N1394 VanDerWaalsContact C-N 3.33Å; Q1392-N1394 PolarHBondContact O-N 2.83Å; N1394-T1397 PolarHBondContact O-N 2.82Å; N1394-Q1398 WeakPolarHBondContact O-CB 3.3Å; N1394-Q1398 WeakPolarHBondContact O-CG 3.3Å; N1394-Q1398 PolarHBondContact O-N 2.85Å
1395	I	80.8	Confident	70.8	Confident	91 Å²	91	113.7 Å²	113.7	47%	0.467	55%	0.552	S	S	.	*	H	α-helix	trans	-64.8	-47.1	175.6	-69.8	163.9	0	0	0	110.5	K1391 Q1392 T1397 Q1398 Q1399	K1391-I1395 VanDerWaalsContact O-CG1 3.3Å; K1391-I1395 WeakPolarHBondContact O-CG1 3.34Å; K1391-I1395 PolarHBondContact O-N 2.84Å; Q1392-I1395 PolarHBondContact O-N 3.22Å; Q1392-I1395 VanDerWaalsContact O-N 3.16Å; I1395-T1397 VanDerWaalsContact C-N 3.31Å; I1395-T1397 PolarHBondContact O-N 3.35Å; I1395-Q1398 PolarHBondContact O-N 2.82Å; I1395-Q1399 WeakPolarHBondContact O-CG 3.46Å; I1395-Q1399 PolarHBondContact O-N 3.37Å
1396	I	76.9	Confident	68.2	Low	85 Å²	85	113.2 Å²	113.2	44%	0.436	56%	0.561	S	S	.	*	H	α-helix	trans	-60.9	-41.4	176.5	-66.6	163.5	0	0	0	110.7	Q1392 L1393 Q1399 N1400	Q1392-I1396 WeakPolarHBondContact O-CG1 3.49Å; Q1392-I1396 PolarHBondContact O-N 3Å; L1393-I1396 PolarHBondContact O-N 3.27Å; I1396-Q1399 PolarHBondContact O-N 2.77Å; I1396-N1400 WeakPolarHBondContact O-CB 3.4Å; I1396-N1400 PolarHBondContact O-N 2.68Å
1397	T	73.4	Confident	65.7	Low	88 Å²	88	117.7 Å²	117.7	54%	0.54	58%	0.577	S	S	.	*	H	α-helix	trans	-65.4	-41	177.6	-54.6	0	0	0	0	111.8	L1393 N1394 I1395 N1400 S1401	L1393-T1397 VanDerWaalsContact O-CB 3.31Å; L1393-T1397 WeakPolarHBondContact O-CB 3.32Å; L1393-T1397 PolarHBondContact O-N 2.74Å; L1393-T1397 PolarHBondContact O-OG1 2.9Å; N1394-T1397 PolarHBondContact O-N 2.82Å; I1395-T1397 VanDerWaalsContact C-N 3.31Å; I1395-T1397 PolarHBondContact O-N 3.35Å; T1397-N1400 PolarHBondContact O-N 3.37Å; T1397-S1401 PolarHBondContact O-N 2.69Å; T1397-S1401 PolarHBondContact O-OG 2.94Å
1398	Q	69.1	Low	62.9	Low	123 Å²	123	121.5 Å²	121.5	58%	0.575	60%	0.602	S	S	*	*	H	α-helix	trans	-67.5	-38.2	174.6	-72.6	175.2	19.6	0	0	112.3	N1394 I1395 N1400 S1401 H1402	N1394-Q1398 WeakPolarHBondContact O-CB 3.3Å; N1394-Q1398 WeakPolarHBondContact O-CG 3.3Å; N1394-Q1398 PolarHBondContact O-N 2.85Å; I1395-Q1398 PolarHBondContact O-N 2.82Å; Q1398-N1400 VanDerWaalsContact C-N 3.29Å; Q1398-N1400 PolarHBondContact O-N 3.4Å; Q1398-S1401 WeakPolarHBondContact CA-OG 3.46Å; Q1398-S1401 PolarHBondContact O-N 2.87Å; Q1398-S1401 PolarHBondContact O-OG 3.43Å; Q1398-H1402 PolarHBondContact O-CD2 3.39Å; Q1398-H1402 VanDerWaalsContact O-CD2 3.3Å; Q1398-H1402 PolarHBondContact O-N 2.91Å
1399	Q	60.7	Low	60.3	Low	110 Å²	110	119.7 Å²	119.7	51%	0.514	61%	0.612	S	S	.	*	H	α-helix	trans	-64.8	-34.7	173.6	-72	176.3	2.3	0	0	111.9	I1395 I1396 K1403	I1395-Q1399 WeakPolarHBondContact O-CG 3.46Å; I1395-Q1399 PolarHBondContact O-N 3.37Å; I1396-Q1399 PolarHBondContact O-N 2.77Å; Q1399-K1403 WeakPolarHBondContact O-CG 3.45Å; Q1399-K1403 PolarHBondContact O-N 2.85Å
1400	N	57	Low	57.5	Low	82 Å²	82	119.1 Å²	119.1	44%	0.439	62%	0.62	S	S	.	*	H	α-helix	trans	-78.2	-28.8	176.2	-75.6	-10.3	0	0	0	113.6	I1396 T1397 Q1398 K1403 N1404	I1396-N1400 WeakPolarHBondContact O-CB 3.4Å; I1396-N1400 PolarHBondContact O-N 2.68Å; T1397-N1400 PolarHBondContact O-N 3.37Å; Q1398-N1400 VanDerWaalsContact C-N 3.29Å; Q1398-N1400 PolarHBondContact O-N 3.4Å; N1400-K1403 PolarHBondContact O-N 3.23Å; N1400-N1404 PolarHBondContact O-N 3.38Å; N1400-N1404 PolarHBondContact O-ND2 2.93Å
1401	S	48.8	Very low	54.9	Low	70 Å²	70	120 Å²	120	49%	0.49	64%	0.636	S	S	.	*	H	α-helix	trans	-71	-37.1	170.6	63.5	0	0	0	0	112	T1397 Q1398 K1403 N1404	T1397-S1401 PolarHBondContact O-N 2.69Å; T1397-S1401 PolarHBondContact O-OG 2.94Å; Q1398-S1401 WeakPolarHBondContact CA-OG 3.46Å; Q1398-S1401 PolarHBondContact O-N 2.87Å; Q1398-S1401 PolarHBondContact O-OG 3.43Å; S1401-K1403 VanDerWaalsContact C-N 3.27Å; S1401-K1403 PolarHBondContact O-N 3.31Å; S1401-N1404 PolarHBondContact O-N 3.45Å
1402	H	49	Very low	52.5	Low	147 Å²	147	118.6 Å²	118.6	68%	0.681	64%	0.644	S	S	*	*	H	α-helix	trans	-67	-23.6	171.8	-84	-72.4	0	0	0	114	Q1398	Q1398-H1402 PolarHBondContact O-CD2 3.39Å; Q1398-H1402 VanDerWaalsContact O-CD2 3.3Å; Q1398-H1402 PolarHBondContact O-N 2.91Å
1403	K	42.6	Very low	50.4	Low	153 Å²	153	118 Å²	118	67%	0.665	65%	0.654	S	S	*	*	H	α-helix	trans	-82.7	-12.1	173.6	-74.8	174	179.9	178.4	0	114.6	Q1399 N1400 S1401	Q1399-K1403 WeakPolarHBondContact O-CG 3.45Å; Q1399-K1403 PolarHBondContact O-N 2.85Å; N1400-K1403 PolarHBondContact O-N 3.23Å; S1401-K1403 VanDerWaalsContact C-N 3.27Å; S1401-K1403 PolarHBondContact O-N 3.31Å
1404	N	36.8	Very low	48.3	Very low	126 Å²	126	119.2 Å²	119.2	67%	0.674	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.4	13.8	-179.2	-77.7	-79.7	0	0	0	113.9	N1400 S1401	N1400-N1404 PolarHBondContact O-N 3.38Å; N1400-N1404 PolarHBondContact O-ND2 2.93Å; S1401-N1404 PolarHBondContact O-N 3.45Å
1405	L	35.2	Very low	45.9	Very low	146 Å²	146	121.9 Å²	121.9	76%	0.764	68%	0.68	S	S	*	*	S	Bend	trans	-118.1	21.9	-178.7	-152.1	71.4	0	0	0	114.3
1406	V	36.9	Very low	43.6	Very low	134 Å²	134	123.3 Å²	123.3	81%	0.812	69%	0.689	S	S	*	*	S	Bend	trans	-138.9	58.7	171.4	-165.6	0	0	0	0	110.4
1407	L	32.8	Very low	41.4	Very low	148 Å²	148	128 Å²	128	78%	0.775	71%	0.706	S	S	*	*			trans	-147.8	27.7	-178.1	-115.9	161.2	0	0	0	114.3
1408	T	29	Very low	39.3	Very low	129 Å²	129	127.8 Å²	127.8	79%	0.791	71%	0.708	S	S	*	*			trans	-141.5	56.4	-177.9	58.9	0	0	0	0	114.3
1409	T	31.4	Very low	37.5	Very low	147 Å²	147	129.1 Å²	129.1	90%	0.902	72%	0.72	S	S	*	*			trans	-166.1	84.8	157.5	15.1	0	0	0	0	112.4
1410	T	29.6	Very low	36.1	Very low	130 Å²	130	126.9 Å²	126.9	80%	0.798	73%	0.726	S	S	*	*			trans	-136.2	140.6	162.6	48.5	0	0	0	0	110.1
1411	N	34.2	Very low	34.9	Very low	158 Å²	158	129.4 Å²	129.4	85%	0.845	74%	0.739	S	S	*	*			trans	115.8	90.9	170.6	-62.4	-22.2	0	0	0	116.1
1412	S	36.7	Very low	34	Very low	114 Å²	114	133.1 Å²	133.1	80%	0.797	75%	0.754	S	S	*	*				-171.2	148	123.6	41.3	0	0	0	0	112.4
1413	S	36.3	Very low	32.9	Very low	117 Å²	117	131.4 Å²	131.4	82%	0.818	75%	0.754	S	S	*	*			trans	75.2	127.1	162.9	-54.6	0	0	0	0	118.6
1414	P	36.8	Very low	32.2	Very low	120 Å²	120	129.5 Å²	129.5	78%	0.779	76%	0.755	S	S	*	*			trans	-115.6	-162.2	177.6	31.8	-12.4	0	0	0	113.2
1415	I	30.6	Very low	31.7	Very low	141 Å²	141	130.5 Å²	130.5	72%	0.723	76%	0.759	S	S	*	*			trans	108.7	111.4	155.1	-59	176.4	0	0	0	117.5
1416	N	31.8	Very low	31.3	Very low	122 Å²	122	129 Å²	129	65%	0.652	76%	0.756	S	S	*	*			trans	67.6	131.5	149.6	-73.3	-25	0	0	0	122.7
1417	K	31.1	Very low	30.9	Very low	182 Å²	182	126 Å²	126	79%	0.791	74%	0.738	S	S	*	*				50.5	145.8	121.3	-56.3	178.2	-174.3	-176.3	0	120.3
1418	S	29	Very low	30.6	Very low	84 Å²	84	124.3 Å²	124.3	59%	0.587	73%	0.728	S	S	*	*			cis	-169.9	174.9	-12.4	46.6	0	0	0	0	108.7
1419	D	30.7	Very low	30.7	Very low	152 Å²	152	121 Å²	121	81%	0.813	71%	0.707	S	S	*	*			trans	66.7	174.6	164.3	-41.6	-54.8	0	0	0	115.5
1420	G	32	Very low	30.4	Very low	63 Å²	63	117.2 Å²	117.2	65%	0.649	68%	0.684	S	S	*	*			trans	119.9	31.2	170.6	0	0	0	0	0	118.4
1421	N	32.2	Very low	30.5	Very low	135 Å²	135	116.3 Å²	116.3	72%	0.722	68%	0.679	S	S	*	*			trans	35	139.2	133.8	-44.8	-18	0	0	0	120.7
1422	N	28.7	Very low	30.3	Very low	148 Å²	148	114.3 Å²	114.3	79%	0.791	67%	0.67	S	S	*	*			trans	68.7	143.1	135.7	-72.1	8.8	0	0	0	119.4
1423	T	27.4	Very low	30	Very low	110 Å²	110	114.3 Å²	114.3	68%	0.675	66%	0.664	S	S	*	*			cis	-168.9	168.3	-23.2	-0.6	0	0	0	0	107.1
1424	T	26.6	Very low	29.7	Very low	113 Å²	113	114.1 Å²	114.1	69%	0.693	66%	0.655	S	S	*	*			trans	53.5	106.7	143.1	-54	0	0	0	0	117.4
1425	L	26.9	Very low	29.2	Very low	147 Å²	147	113.8 Å²	113.8	77%	0.77	65%	0.648	S	S	*	*				-172	134.8	92.1	-85.3	172.9	0	0	0	108.2
1426	V	27	Very low	29.2	Very low	115 Å²	115	112.1 Å²	112.1	70%	0.697	64%	0.643	S	S	*	*				72.8	140.3	71	161.1	0	0	0	0	113.2
1427	T	28.3	Very low	29	Very low	71 Å²	71	111.4 Å²	111.4	44%	0.436	64%	0.642	S	S	.	*			cis	-174.7	152.8	-19.7	-78.5	0	0	0	0	107	Y355	Y355-T1427 PolarHBondContact OH-O 3.49Å
1428	M	25.9	Very low	28.8	Very low	112 Å²	112	106.4 Å²	106.4	55%	0.552	63%	0.632	S	S	*	*			trans	161.8	111.5	131.3	-86.2	-56.3	-179.4	0	0	112.4	Y355	Y355-M1428 WeakPolarHBondContact CA-O 3.44Å; Y355-M1428 HydrophobicContact CD1-CB 4.11Å; Y355-M1428 WeakPolarHBondContact CD1-O 3.44Å; Y355-M1428 WeakPolarHBondContact CD2-O 3.3Å; Y355-M1428 HydrophobicContact CE1-CB 3.77Å; Y355-M1428 WeakPolarHBondContact CE1-O 3.28Å; Y355-M1428 PolarHBondContact N-O 2.99Å; Y355-M1428 PolarHBondContact OH-N 3.05Å
1429	T	31.4	Very low	28.8	Very low	59 Å²	59	108.1 Å²	108.1	36%	0.362	64%	0.635	S	S	.	*			trans	-67.3	173.1	157.2	-18.1	0	0	0	0	109.2	N354	N354-T1429 WeakPolarHBondContact OD1-CA 3.03Å; N354-T1429 VanDerWaalsContact OD1-CB 3.3Å; N354-T1429 WeakPolarHBondContact OD1-CB 3.5Å; N354-T1429 WeakPolarHBondContact OD1-CG2 3.45Å; N354-T1429 PolarHBondContact OD1-N 3.41Å; N354-T1429 PolarHBondContact OD1-OG1 3.22Å
1430	T	25.7	Very low	28.7	Very low	69 Å²	69	104.4 Å²	104.4	42%	0.423	62%	0.62	S	S	.	*			cis	-162.6	153.6	6.6	-24.5	0	0	0	0	105.8	L356 I357	L356-T1430 CarbonylContact C-O 3.41Å; L356-T1430 VanDerWaalsContact C-O 3.29Å; I357-T1430 WeakPolarHBondContact CA-O 3.31Å; I357-T1430 WeakPolarHBondContact CB-O 3.49Å; I357-T1430 VanDerWaalsContact CD1-O 3.25Å; I357-T1430 WeakPolarHBondContact CD1-O 3.46Å; I357-T1430 WeakPolarHBondContact CG1-O 3.37Å; I357-T1430 PolarHBondContact N-O 3.45Å
1431	V	31.8	Very low	28.4	Very low	111 Å²	111	108.2 Å²	108.2	67%	0.673	62%	0.618	S	S	*	*				-110.3	0	113.9	-162.8	0	0	0	0	105.3	I357 Y1039	I357-V1431 HydrophobicContact CB-CG2 4.35Å; I357-V1431 HydrophobicContact CD1-CG1 4.36Å; I357-V1431 HydrophobicContact CG1-CB 3.92Å; I357-V1431 HydrophobicContact CG1-CG1 3.94Å; I357-V1431 HydrophobicContact CG1-CG2 3.59Å; Y1039-V1431 VanDerWaalsContact CB-CG2 3.49Å; Y1039-V1431 HydrophobicContact CD2-CG2 4.41Å; Y1039-V1431 HydrophobicContact CG-CG2 4.25Å

Retrieved 1,431 of 1,431 residues in 1143.5 ms (Link to these results)

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