A0A087XJ92_POEFO Loading...

Protein phosphatase 1, regulatory subunit 13Bb

AlphaFold DB , UniProt , Accession A0A087XJ92, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,114 aa.

						>A0A087XJ92_POEFO|A0A087XJ92
MMPMILTVYLSDGEQTAAEVPITPETTCRDVVEFCKEPGESGCHLAEVWRGNERAIPFEHMMYEHLQKWGPRKQEVKFFLRHEDSPTESSDQGSQQSQDQTGRRSGNAGEKHNENGVGNQRVELTLSELQEMATRQQHQIEAQQQMLVAKEQRLRYLKQQERRQQQTVSESEKLQRLKERVESQEAKLKKIRAMRGQVDYSKVINGNLSAEIEQVTSLFQEKQAELQAAVLRVEQLSLQLEDLRRGKLNGIQTGLGGQVTGAAALELRKLYQELQIRNKLNQEQNSKLQQQKELLNKRNMEVTLMDKRISELRERLYKKKAEARQKENLPLNRANGPPSPQPAPGTLGRVAAVGPYIQVPVPSRQDGGYTLPPDPLKPQALGVNNQANQGRPKSDGVRKPPGPWKVSDLDIVVDPVPPSFPESHPGPGASRGSDGTSPNDTGWPTIGKSGTTLKPPERRDSGADSQGKSPTSGSPVTPNAEKVLDPKLAVSSPAITKPQPPPYGSHLTSANPASSLERRKDAPPPRPLPNPPAPAWPRVPSSTGSSSQQIQQRISVPPSPTFQPNVPLFPPALSERLDHPPAVAVRPFIPDRGTRPQSPRKGPPTVNSSSIYHMYLQHAAPKSQPPKPAVKAVYGKPVLSSSSTPASPLPYVQAGGAFPALQGLAGSDDSVDGELDDPESFQPSAPPPSVENIPRPLSPTKLTPMVHSPLRYQSDADLEVLRKKLANAPRPLKKRSSITEPEGPSGPNIQKLLYQRFNTLAGGIEGNGGSGSGGSNGAGNGTPFYQPAIPPGYLGGDSLADTNNGNLLPETQLPPPPGGEEPGSEASSTNDANANEPKAPEGAADPGEEEEPEDDNNNNVGGSQASLPSPVPEVSSPEESGTAVSQQLEKRTNLKKPDSERTGHGFRVKFNPLALLLDASLEGEFDLVQRIIYEVENPSTPNDEGITPLHNAVCAGHHHIVKFLLDFGVNVNAADSDGWTPLHCAASCNSVHLCKLLVESGAAIFASTISDVETAADKCEEMEEGYIQCSQFLYGVQEKLGVMNKGTVYALWDYEAQSPDELSFKEGDAITILRRQDENETEWWWSRLEDKEGYVPRNLLGLCPRIKPRQRSLA
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	52.1	Low	77.8	Confident	187 Å²	187	72.7 Å²	72.7	92%	0.921	38%	0.383	S	S	*	.				0	162.9	0	-71.6	167.8	171.3	0	0	108.3	P24	M1-P24 HydrophobicContact SD-CG 3.71Å
2	M	53.9	Low	77.2	Confident	177 Å²	177	76.4 Å²	76.4	87%	0.872	40%	0.403	S	S	*	.	P	Polyproline II helix	trans	-80.4	138.9	159.3	-71.5	175.7	170.9	0	0	108
3	P	64.3	Low	76.2	Confident	83 Å²	83	73.8 Å²	73.8	54%	0.539	41%	0.407	S	S	.	.	P	Polyproline II helix	trans	-65.5	145.7	173.1	29	-34.1	0	0	0	109.9
4	M	79	Confident	75.9	Confident	51 Å²	51	74.6 Å²	74.6	25%	0.251	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	120.2	174.2	177.8	173	168.9	0	0	108.9	I22 L66 K73	M4-I22 PolarHBondContact N-O 2.94Å; M4-I22 WeakPolarHBondContact O-CA 3.34Å; M4-I22 VanDerWaalsContact O-CB 3.23Å; M4-I22 WeakPolarHBondContact O-CB 3.41Å; M4-I22 WeakPolarHBondContact O-CG1 3.47Å; M4-I22 PolarHBondContact O-N 3.43Å; M4-L66 HydrophobicContact CE-CB 4.11Å; M4-L66 HydrophobicContact CE-CD1 3.97Å; M4-L66 HydrophobicContact CE-CD2 4.35Å; M4-L66 HydrophobicContact CE-CG 4.38Å; M4-L66 HydrophobicContact SD-CB 4.11Å; M4-L66 HydrophobicContact SD-CD1 4.11Å; M4-K73 HydrophobicContact CE-CD 3.86Å; M4-K73 HydrophobicContact CE-CG 4.29Å; M4-K73 HydrophobicContact SD-CD 4.47Å; M4-K73 PolarHBondContact SD-NZ 3.14Å
5	I	84.9	Confident	75.2	Confident	99 Å²	99	81.4 Å²	81.4	51%	0.508	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	135.9	175.2	-57.8	175.2	0	0	0	109.5	E19	I5-E19 HydrophobicContact CG2-CB 3.81Å; I5-E19 HydrophobicContact CG2-CG 4.18Å
6	L	89	Confident	75.4	Confident	6 Å²	6	80.5 Å²	80.5	3%	0.031	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	123.4	173.6	177.6	63.1	0	0	0	109.6	V8 V20 I22 V31 M62 L66 F78	L6-V8 HydrophobicContact CD2-CG2 4.02Å; L6-V8 HydrophobicContact CG-CG2 4Å; L6-V20 PolarHBondContact N-O 3.41Å; L6-V20 PolarHBondContact O-N 2.98Å; L6-I22 HydrophobicContact CB-CD1 4.06Å; L6-I22 HydrophobicContact CB-CG1 3.64Å; L6-I22 HydrophobicContact CD2-CD1 4.07Å; L6-I22 HydrophobicContact CD2-CG1 4.27Å; L6-V31 HydrophobicContact CD2-CG1 4.19Å; L6-M62 HydrophobicContact CD2-CE 3.53Å; L6-L66 HydrophobicContact CB-CD1 4.38Å; L6-L66 HydrophobicContact CD1-CD1 4.08Å; L6-L66 HydrophobicContact CD1-CD2 3.75Å; L6-L66 HydrophobicContact CD2-CD1 4.35Å; L6-F78 HydrophobicContact CD1-CD2 3.48Å; L6-F78 VanDerWaalsContact CD1-CD2 3.48Å; L6-F78 HydrophobicContact CD1-CE2 3.78Å; L6-F78 HydrophobicContact CD1-CG 3.91Å; L6-F78 HydrophobicContact CD1-CZ 4.42Å
7	T	89.4	Confident	76	Confident	55 Å²	55	78.9 Å²	78.9	34%	0.337	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	119.6	171.7	-47.8	0	0	0	0	109.5	A17 A18	T7-A17 HydrophobicContact CG2-CB 3.89Å; T7-A18 WeakPolarHBondContact CA-O 3.43Å
8	V	91.4	Very high	76.7	Confident	0 Å²	0	75.6 Å²	75.6	0%	0	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	120.4	176	-179.1	0	0	0	0	109	L6 L10 A17 A18 V20 V31 C35 L45 F78 L80	L6-V8 HydrophobicContact CD2-CG2 4.02Å; L6-V8 HydrophobicContact CG-CG2 4Å; V8-L10 HydrophobicContact CG1-CD2 4.45Å; V8-A17 CarbonylContact O-C 3.58Å; V8-A17 WeakPolarHBondContact O-CA 3.33Å; V8-A18 PolarHBondContact N-O 2.89Å; V8-A18 PolarHBondContact O-N 2.77Å; V8-V20 HydrophobicContact CG2-CG2 4.14Å; V8-V31 HydrophobicContact CG2-CG1 3.84Å; V8-C35 HydrophobicContact CG1-CB 4.49Å; V8-L45 HydrophobicContact CB-CD1 4.48Å; V8-L45 HydrophobicContact CG1-CD1 3.58Å; V8-L45 HydrophobicContact CG2-CD1 4.05Å; V8-F78 CarbonylContact C-O 3.53Å; V8-F78 WeakPolarHBondContact CA-O 3.4Å; V8-F78 HydrophobicContact CG2-CB 4.47Å; V8-L80 HydrophobicContact CG1-CB 4.32Å
9	Y	89.8	Confident	77.4	Confident	45 Å²	45	78.6 Å²	78.6	18%	0.176	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	129.3	176.4	-62.9	-79.9	0	0	0	110.4	E14 T16 A17 K77 F78 F79 L80	Y9-E14 HydrophobicContact CD1-CB 3.95Å; Y9-E14 HydrophobicContact CD1-CG 4.1Å; Y9-E14 HydrophobicContact CE1-CB 3.89Å; Y9-E14 HydrophobicContact CE1-CG 4.12Å; Y9-E14 HydrophobicContact CG-CG 4.48Å; Y9-T16 WeakPolarHBondContact CA-O 3.45Å; Y9-A17 HydrophobicContact CD1-CB 3.82Å; Y9-A17 HydrophobicContact CE1-CB 4.16Å; Y9-K77 HydrophobicContact CD2-CB 4.16Å; Y9-K77 HydrophobicContact CE2-CB 3.91Å; Y9-K77 HydrophobicContact CE2-CD 3.92Å; Y9-K77 HydrophobicContact CE2-CG 3.96Å; Y9-F78 WeakPolarHBondContact CD2-O 3.25Å; Y9-F78 PolarHBondContact N-O 2.98Å; Y9-F79 HydrophobicContact CD2-CE1 4.26Å; Y9-F79 HydrophobicContact CD2-CE2 4.45Å; Y9-F79 HydrophobicContact CD2-CZ 4.18Å; Y9-F79 HydrophobicContact CG-CD1 4.37Å; Y9-F79 HydrophobicContact CG-CE1 4.04Å; Y9-F79 HydrophobicContact CG-CZ 4.38Å; Y9-F79 WeakPolarHBondContact O-CA 3.38Å; Y9-L80 PolarHBondContact O-N 2.69Å
10	L	85.9	Confident	78	Confident	56 Å²	56	75 Å²	75	29%	0.293	41%	0.409	S	S	.	.	S	Bend	trans	-93.3	1.3	-178	-51.6	-178.8	0	0	0	112.4	V8 T16 A18 C35 L80	V8-L10 HydrophobicContact CG1-CD2 4.45Å; L10-T16 PolarHBondContact N-O 3.37Å; L10-A18 HydrophobicContact CD2-CB 4.48Å; L10-C35 HydrophobicContact CD2-CB 3.82Å; L10-C35 WeakPolarHBondContact CD2-O 3.32Å; L10-L80 HydrophobicContact CD2-CB 4.21Å; L10-L80 HydrophobicContact CD2-CD2 4.13Å
11	S	76.4	Confident	78.4	Confident	41 Å²	41	74.8 Å²	74.8	29%	0.287	41%	0.411	S	S	.	.	S	Bend	trans	-156.5	152.5	174	62.5	0	0	0	0	111.8	G13 E14 T16	S11-G13 PolarHBondContact O-N 3.18Å; S11-E14 PolarHBondContact O-N 3.03Å; S11-T16 PolarHBondContact OG-OG1 3.03Å
12	D	70	Confident	80.1	Confident	117 Å²	117	65.9 Å²	65.9	63%	0.626	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54	-21.9	175	-65.7	64.6	0	0	0	114.5	E14 R81	D12-E14 VanDerWaalsContact C-N 3.28Å; D12-E14 PolarHBondContact O-N 2.74Å; D12-R81 IonicContact OD1-NH1 2.64Å; D12-R81 PolarHBondContact OD1-NH1 3.4Å; D12-R81 IonicContact OD2-CZ 3.96Å; D12-R81 IonicContact OD2-NH1 2.66Å; D12-R81 PolarHBondContact OD2-NH1 3.28Å; D12-R81 IonicContact OD2-NH2 3.12Å
13	G	63.9	Low	81.6	Confident	43 Å²	43	60.1 Å²	60.1	44%	0.443	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.5	-0.9	-177.1	0	0	0	0	0	115.1	S11 Q15	S11-G13 PolarHBondContact O-N 3.18Å; G13-Q15 PolarHBondContact O-N 3.46Å
14	E	72.2	Confident	82.5	Confident	84 Å²	84	58.4 Å²	58.4	39%	0.393	33%	0.331	S	S	.	.	S	Bend	trans	55.3	8.1	-174.2	-61.7	-174	-158.9	0	0	115.6	Y9 S11 D12 K77 F79	Y9-E14 HydrophobicContact CD1-CB 3.95Å; Y9-E14 HydrophobicContact CD1-CG 4.1Å; Y9-E14 HydrophobicContact CE1-CB 3.89Å; Y9-E14 HydrophobicContact CE1-CG 4.12Å; Y9-E14 HydrophobicContact CG-CG 4.48Å; S11-E14 PolarHBondContact O-N 3.03Å; D12-E14 VanDerWaalsContact C-N 3.28Å; D12-E14 PolarHBondContact O-N 2.74Å; E14-K77 WeakPolarHBondContact OE1-CD 3.34Å; E14-K77 IonicContact OE1-NZ 2.64Å; E14-K77 PolarHBondContact OE1-NZ 2.95Å; E14-K77 IonicContact OE2-NZ 3.49Å; E14-K77 PolarHBondContact OE2-NZ 2.91Å; E14-F79 HydrophobicContact CG-CE1 4.24Å; E14-F79 HydrophobicContact CG-CZ 4.13Å
15	Q	65.8	Low	82.8	Confident	177 Å²	177	62.1 Å²	62.1	83%	0.827	35%	0.348	S	S	*	.	S	Bend	trans	-83.4	-20.5	-177	-78.3	164	67.5	0	0	113.6	G13	G13-Q15 PolarHBondContact O-N 3.46Å
16	T	78.2	Confident	83.1	Confident	67 Å²	67	58.3 Å²	58.3	41%	0.411	33%	0.329	S	S	.	.			trans	-120.8	126.6	175.6	50.3	0	0	0	0	109.5	Y9 L10 S11	Y9-T16 WeakPolarHBondContact CA-O 3.45Å; L10-T16 PolarHBondContact N-O 3.37Å; S11-T16 PolarHBondContact OG-OG1 3.03Å
17	A	86.4	Confident	83.2	Confident	54 Å²	54	59.5 Å²	59.5	45%	0.446	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	145.9	178.5	0	0	0	0	0	111.5	T7 V8 Y9	T7-A17 HydrophobicContact CG2-CB 3.89Å; V8-A17 CarbonylContact O-C 3.58Å; V8-A17 WeakPolarHBondContact O-CA 3.33Å; Y9-A17 HydrophobicContact CD1-CB 3.82Å; Y9-A17 HydrophobicContact CE1-CB 4.16Å
18	A	87.7	Confident	83.2	Confident	19 Å²	19	56.9 Å²	56.9	16%	0.157	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	141.5	171.8	0	0	0	0	0	110.2	T7 V8 L10	T7-A18 WeakPolarHBondContact CA-O 3.43Å; V8-A18 PolarHBondContact N-O 2.89Å; V8-A18 PolarHBondContact O-N 2.77Å; L10-A18 HydrophobicContact CD2-CB 4.48Å
19	E	89.6	Confident	83.1	Confident	132 Å²	132	62.8 Å²	62.8	62%	0.617	34%	0.343	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.8	111.5	171.4	-71	-166.9	165.1	0	0	109.8	I5	I5-E19 HydrophobicContact CG2-CB 3.81Å; I5-E19 HydrophobicContact CG2-CG 4.18Å
20	V	89.1	Confident	83.1	Confident	6 Å²	6	64.5 Å²	64.5	4%	0.036	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	123	-174.1	-165.6	0	0	0	0	110	L6 V8 I22 V31 F34 C35	L6-V20 PolarHBondContact N-O 3.41Å; L6-V20 PolarHBondContact O-N 2.98Å; V8-V20 HydrophobicContact CG2-CG2 4.14Å; V20-I22 HydrophobicContact CB-CD1 4.35Å; V20-I22 HydrophobicContact CG1-CD1 4.1Å; V20-I22 PolarHBondContact O-N 2.97Å; V20-V31 HydrophobicContact CG1-CG1 4.48Å; V20-V31 HydrophobicContact CG1-CG2 4.23Å; V20-V31 HydrophobicContact CG2-CG1 4.28Å; V20-F34 HydrophobicContact CB-CD1 4.27Å; V20-F34 HydrophobicContact CB-CE1 4.42Å; V20-F34 HydrophobicContact CG1-CD1 3.85Å; V20-F34 HydrophobicContact CG1-CE1 4.25Å; V20-F34 HydrophobicContact CG1-CG 4.21Å; V20-F34 HydrophobicContact CG2-CD1 3.67Å; V20-F34 HydrophobicContact CG2-CE1 3.97Å; V20-C35 VanDerWaalsContact CG2-SG 3.56Å
21	P	87.4	Confident	83.3	Confident	72 Å²	72	61.8 Å²	61.8	47%	0.468	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	110.4	177.5	30.3	-32.6	0	0	0	111
22	I	87.4	Confident	83.8	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	123.5	179.7	-50.7	-56	0	0	0	110.5	M4 L6 V20 T26 V31 M62 L66	M4-I22 PolarHBondContact N-O 2.94Å; M4-I22 WeakPolarHBondContact O-CA 3.34Å; M4-I22 VanDerWaalsContact O-CB 3.23Å; M4-I22 WeakPolarHBondContact O-CB 3.41Å; M4-I22 WeakPolarHBondContact O-CG1 3.47Å; M4-I22 PolarHBondContact O-N 3.43Å; L6-I22 HydrophobicContact CB-CD1 4.06Å; L6-I22 HydrophobicContact CB-CG1 3.64Å; L6-I22 HydrophobicContact CD2-CD1 4.07Å; L6-I22 HydrophobicContact CD2-CG1 4.27Å; V20-I22 HydrophobicContact CB-CD1 4.35Å; V20-I22 HydrophobicContact CG1-CD1 4.1Å; V20-I22 PolarHBondContact O-N 2.97Å; I22-T26 HydrophobicContact CD1-CG2 4.1Å; I22-V31 HydrophobicContact CD1-CG2 3.5Å; I22-V31 VanDerWaalsContact CD1-CG2 3.5Å; I22-M62 HydrophobicContact CD1-CB 4.27Å; I22-M62 HydrophobicContact CG2-CB 3.9Å; I22-L66 HydrophobicContact CG1-CD1 4.12Å; I22-L66 HydrophobicContact CG2-CD1 4.47Å
23	T	86	Confident	84.7	Confident	55 Å²	55	59.7 Å²	59.7	34%	0.337	32%	0.323	S	S	.	.			trans	-101.5	167.2	166.8	77.6	0	0	0	0	109.9	E25 T26	T23-E25 WeakPolarHBondContact CB-OE2 3.35Å; T23-E25 PolarHBondContact O-N 2.98Å; T23-E25 VanDerWaalsContact O-N 3.08Å; T23-E25 PolarHBondContact OG1-N 3.2Å; T23-E25 PolarHBondContact OG1-OE2 2.89Å; T23-T26 PolarHBondContact N-OG1 3.37Å; T23-T26 PolarHBondContact O-N 3.29Å; T23-T26 VanDerWaalsContact O-N 3.16Å; T23-T26 PolarHBondContact O-OG1 3.42Å; T23-T26 PolarHBondContact OG1-OG1 3.39Å
24	P	83.8	Confident	85.8	Confident	48 Å²	48	63.8 Å²	63.8	31%	0.312	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55	-24.4	175.2	-26.5	36.3	0	0	0	114.4	M1 M61 Y63	M1-P24 HydrophobicContact SD-CG 3.71Å; P24-M61 VanDerWaalsContact O-CE 3.25Å; P24-M61 WeakPolarHBondContact O-CE 3.34Å; P24-Y63 HydrophobicContact CB-CG 4.47Å; P24-Y63 HydrophobicContact CG-CD2 4.38Å; P24-Y63 HydrophobicContact CG-CE2 4.45Å; P24-Y63 HydrophobicContact CG-CG 4.46Å
25	E	85.2	Confident	86.5	Confident	128 Å²	128	60.3 Å²	60.3	60%	0.598	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.2	-9.3	-176.5	-50.5	73.7	-157.4	0	0	113.7	T23 M61	T23-E25 WeakPolarHBondContact CB-OE2 3.35Å; T23-E25 PolarHBondContact O-N 2.98Å; T23-E25 VanDerWaalsContact O-N 3.08Å; T23-E25 PolarHBondContact OG1-N 3.2Å; T23-E25 PolarHBondContact OG1-OE2 2.89Å; E25-M61 VanDerWaalsContact C-CE 3.4Å; E25-M61 VanDerWaalsContact O-CE 3.29Å; E25-M61 WeakPolarHBondContact O-CE 3.09Å
26	T	89.8	Confident	87.4	Confident	19 Å²	19	54.4 Å²	54.4	12%	0.117	29%	0.286	C	S	.	.			trans	-76.1	124.7	-176.4	-41.4	0	0	0	0	112.2	I22 T23 D30 V31 M62	I22-T26 HydrophobicContact CD1-CG2 4.1Å; T23-T26 PolarHBondContact N-OG1 3.37Å; T23-T26 PolarHBondContact O-N 3.29Å; T23-T26 VanDerWaalsContact O-N 3.16Å; T23-T26 PolarHBondContact O-OG1 3.42Å; T23-T26 PolarHBondContact OG1-OG1 3.39Å; T26-D30 HydrophobicContact CG2-CB 3.96Å; T26-V31 HydrophobicContact CG2-CG2 4.02Å; T26-M62 PolarHBondContact O-N 2.77Å
27	T	91.5	Very high	87.5	Confident	32 Å²	32	57.9 Å²	57.9	20%	0.196	30%	0.297	C	S	.	.	B	Isolated β-bridge	trans	-89.8	166.4	174.8	73.1	0	0	0	0	112.3	R29 D30 V31 H60 M61	T27-R29 PolarHBondContact O-N 3.12Å; T27-R29 PolarHBondContact OG1-N 2.92Å; T27-D30 WeakPolarHBondContact CA-OD2 3.34Å; T27-D30 VanDerWaalsContact CB-OD2 3.31Å; T27-D30 WeakPolarHBondContact CB-OD2 3.44Å; T27-D30 PolarHBondContact N-OD2 2.89Å; T27-D30 PolarHBondContact O-N 2.68Å; T27-D30 PolarHBondContact OG1-N 3.33Å; T27-D30 PolarHBondContact OG1-OD2 3.35Å; T27-V31 PolarHBondContact O-N 2.94Å; T27-H60 CarbonylContact C-O 3.59Å; T27-H60 WeakPolarHBondContact CA-O 3.45Å; T27-M61 HydrophobicContact CG2-CE 4.38Å; T27-M61 HydrophobicContact CG2-SD 4.02Å
28	C	89.6	Confident	86.8	Confident	0 Å²	0	62 Å²	62	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-61.5	-34.1	172	-177.9	0	0	0	0	111.8	V31 V32 I56 P57 F58 H60 M62	C28-V31 PolarHBondContact O-N 2.88Å; C28-V32 WeakPolarHBondContact O-CG2 3.5Å; C28-V32 PolarHBondContact O-N 3.45Å; C28-I56 HydrophobicContact CB-CG2 4.02Å; C28-I56 PolarHBondContact SG-O 2.7Å; C28-P57 WeakPolarHBondContact CB-O 3.19Å; C28-F58 PolarHBondContact N-O 3.49Å; C28-H60 PolarHBondContact N-O 2.71Å; C28-M62 HydrophobicContact CB-CG 4.25Å; C28-M62 HydrophobicContact CB-SD 3.84Å
29	R	89.3	Confident	85.7	Confident	123 Å²	123	65 Å²	65	46%	0.464	35%	0.352	S	S	.	.	H	α-helix	trans	-61.4	-42.6	174.7	-171.5	172	-68.7	146.3	9.5	112.4	T27 V31 V32 E33 F58 E59	T27-R29 PolarHBondContact O-N 3.12Å; T27-R29 PolarHBondContact OG1-N 2.92Å; R29-V31 VanDerWaalsContact C-N 3.3Å; R29-V31 PolarHBondContact O-N 2.74Å; R29-V32 PolarHBondContact O-N 2.79Å; R29-E33 PolarHBondContact O-N 3.01Å; R29-F58 HydrophobicContact CB-CB 4.21Å; R29-F58 HydrophobicContact CB-CD1 4.26Å; R29-F58 PolarHBondContact N-O 2.79Å; R29-F58 VanDerWaalsContact N-O 3.14Å; R29-E59 IonicContact CZ-OE1 2.61Å; R29-E59 IonicContact NH2-OE1 2.78Å; R29-E59 PolarHBondContact NH2-OE1 2.99Å
30	D	90.1	Very high	85.1	Confident	81 Å²	81	61.5 Å²	61.5	43%	0.433	34%	0.336	S	S	.	.	H	α-helix	trans	-65.3	-36.5	-179.6	-51	-49.2	0	0	0	111.5	T26 T27 F34	T26-D30 HydrophobicContact CG2-CB 3.96Å; T27-D30 WeakPolarHBondContact CA-OD2 3.34Å; T27-D30 VanDerWaalsContact CB-OD2 3.31Å; T27-D30 WeakPolarHBondContact CB-OD2 3.44Å; T27-D30 PolarHBondContact N-OD2 2.89Å; T27-D30 PolarHBondContact O-N 2.68Å; T27-D30 PolarHBondContact OG1-N 3.33Å; T27-D30 PolarHBondContact OG1-OD2 3.35Å; D30-F34 VanDerWaalsContact O-CB 3.25Å; D30-F34 WeakPolarHBondContact O-CB 3.48Å; D30-F34 PolarHBondContact O-N 3.46Å
31	V	89.2	Confident	84.3	Confident	0 Å²	0	66.3 Å²	66.3	0%	0	37%	0.37	C	S	.	.	H	α-helix	trans	-67.8	-41.1	173.9	178.5	0	0	0	0	111.5	L6 V8 V20 I22 T26 T27 C28 R29 F34 C35 L45 M62	L6-V31 HydrophobicContact CD2-CG1 4.19Å; V8-V31 HydrophobicContact CG2-CG1 3.84Å; V20-V31 HydrophobicContact CG1-CG1 4.48Å; V20-V31 HydrophobicContact CG1-CG2 4.23Å; V20-V31 HydrophobicContact CG2-CG1 4.28Å; I22-V31 HydrophobicContact CD1-CG2 3.5Å; I22-V31 VanDerWaalsContact CD1-CG2 3.5Å; T26-V31 HydrophobicContact CG2-CG2 4.02Å; T27-V31 PolarHBondContact O-N 2.94Å; C28-V31 PolarHBondContact O-N 2.88Å; R29-V31 VanDerWaalsContact C-N 3.3Å; R29-V31 PolarHBondContact O-N 2.74Å; V31-F34 PolarHBondContact O-N 3.43Å; V31-C35 WeakPolarHBondContact O-CB 3.43Å; V31-C35 PolarHBondContact O-N 3.39Å; V31-C35 VanDerWaalsContact O-N 3.15Å; V31-C35 PolarHBondContact O-SG 3.44Å; V31-C35 VanDerWaalsContact O-SG 3.4Å; V31-L45 HydrophobicContact CB-CD2 4.4Å; V31-L45 HydrophobicContact CG1-CD1 4.46Å; V31-L45 HydrophobicContact CG1-CD2 3.9Å; V31-M62 HydrophobicContact CG2-CG 3.91Å
32	V	88.8	Confident	83.8	Confident	1 Å²	1	64 Å²	64	1%	0.006	36%	0.359	C	S	.	.	H	α-helix	trans	-63.9	-50.3	176.9	168.6	0	0	0	0	111.2	C28 R29 F34 C35 K36 C43 L45 F58 L80	C28-V32 WeakPolarHBondContact O-CG2 3.5Å; C28-V32 PolarHBondContact O-N 3.45Å; R29-V32 PolarHBondContact O-N 2.79Å; V32-F34 VanDerWaalsContact C-N 3.26Å; V32-F34 PolarHBondContact O-N 3.12Å; V32-C35 PolarHBondContact O-N 3.32Å; V32-C35 VanDerWaalsContact O-N 3.13Å; V32-K36 HydrophobicContact CG1-CD 4.48Å; V32-K36 WeakPolarHBondContact O-CB 3.49Å; V32-K36 PolarHBondContact O-N 3.35Å; V32-C43 HydrophobicContact CG1-CB 4.08Å; V32-L45 HydrophobicContact CG2-CB 3.83Å; V32-F58 HydrophobicContact CB-CE1 4.45Å; V32-F58 HydrophobicContact CG1-CE1 4.33Å; V32-F58 HydrophobicContact CG2-CE1 4.19Å; V32-L80 HydrophobicContact CG1-CD1 4.16Å; V32-L80 HydrophobicContact CG2-CD1 4.27Å
33	E	87.4	Confident	83.8	Confident	112 Å²	112	64.6 Å²	64.6	52%	0.523	36%	0.362	S	S	.	.	H	α-helix	trans	-68.8	-22.5	180	-65.5	-62.1	126	0	0	113	R29 K36	R29-E33 PolarHBondContact O-N 3.01Å; E33-K36 IonicContact OE1-NZ 2.68Å; E33-K36 PolarHBondContact OE1-NZ 2.89Å; E33-K36 IonicContact OE2-NZ 2.81Å; E33-K36 PolarHBondContact OE2-NZ 2.89Å
34	F	88.1	Confident	83.9	Confident	129 Å²	129	62.6 Å²	62.6	57%	0.566	35%	0.349	S	S	*	.	H	α-helix	trans	-75.1	-28.5	170.8	-175.6	-88.2	0	0	0	113.4	V20 D30 V31 V32	V20-F34 HydrophobicContact CB-CD1 4.27Å; V20-F34 HydrophobicContact CB-CE1 4.42Å; V20-F34 HydrophobicContact CG1-CD1 3.85Å; V20-F34 HydrophobicContact CG1-CE1 4.25Å; V20-F34 HydrophobicContact CG1-CG 4.21Å; V20-F34 HydrophobicContact CG2-CD1 3.67Å; V20-F34 HydrophobicContact CG2-CE1 3.97Å; D30-F34 VanDerWaalsContact O-CB 3.25Å; D30-F34 WeakPolarHBondContact O-CB 3.48Å; D30-F34 PolarHBondContact O-N 3.46Å; V31-F34 PolarHBondContact O-N 3.43Å; V32-F34 VanDerWaalsContact C-N 3.26Å; V32-F34 PolarHBondContact O-N 3.12Å
35	C	86.8	Confident	84.3	Confident	11 Å²	11	60.3 Å²	60.3	7%	0.074	34%	0.335	C	S	.	.	H	α-helix	trans	-96.9	-6.4	-174.7	-74.6	0	0	0	0	115.1	V8 L10 V20 V31 V32 L80	V8-C35 HydrophobicContact CG1-CB 4.49Å; L10-C35 HydrophobicContact CD2-CB 3.82Å; L10-C35 WeakPolarHBondContact CD2-O 3.32Å; V20-C35 VanDerWaalsContact CG2-SG 3.56Å; V31-C35 WeakPolarHBondContact O-CB 3.43Å; V31-C35 PolarHBondContact O-N 3.39Å; V31-C35 VanDerWaalsContact O-N 3.15Å; V31-C35 PolarHBondContact O-SG 3.44Å; V31-C35 VanDerWaalsContact O-SG 3.4Å; V32-C35 PolarHBondContact O-N 3.32Å; V32-C35 VanDerWaalsContact O-N 3.13Å; C35-L80 HydrophobicContact CB-CD2 4.18Å; C35-L80 WeakPolarHBondContact O-CD2 3.24Å
36	K	84.2	Confident	84.5	Confident	54 Å²	54	54.2 Å²	54.2	24%	0.235	31%	0.306	C	S	.	.	S	Bend	trans	-103	140.8	-165.9	170.4	-172.7	162.7	-145	0	111.8	V32 E33 E40 C43 L80	V32-K36 HydrophobicContact CG1-CD 4.48Å; V32-K36 WeakPolarHBondContact O-CB 3.49Å; V32-K36 PolarHBondContact O-N 3.35Å; E33-K36 IonicContact OE1-NZ 2.68Å; E33-K36 PolarHBondContact OE1-NZ 2.89Å; E33-K36 IonicContact OE2-NZ 2.81Å; E33-K36 PolarHBondContact OE2-NZ 2.89Å; K36-E40 WeakPolarHBondContact CE-O 3.45Å; K36-E40 HydrophobicContact CG-CB 3.91Å; K36-C43 HydrophobicContact CD-CB 4.13Å; K36-C43 HydrophobicContact CG-CB 4.45Å; K36-L80 HydrophobicContact CB-CD2 4.41Å
37	E	81.2	Confident	84.6	Confident	139 Å²	139	53.7 Å²	53.7	65%	0.65	30%	0.302	S	S	*	.			trans	-81.6	149.1	-178.1	-65.6	-160.6	161.3	0	0	113.1	G39 E40	E37-G39 PolarHBondContact O-N 2.92Å; E37-E40 HydrophobicContact CB-CG 4.04Å; E37-E40 PolarHBondContact N-OE2 3.12Å; E37-E40 PolarHBondContact O-N 2.99Å; E37-E40 VanDerWaalsContact O-N 3.09Å
38	P	71.1	Confident	84.5	Confident	142 Å²	142	53.7 Å²	53.7	92%	0.922	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	105.1	-179.6	-24.2	35.2	0	0	0	113.3
39	G	65.3	Low	84.4	Confident	81 Å²	81	56.5 Å²	56.5	84%	0.835	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	118.4	-7	-179.4	0	0	0	0	0	114.3	E37	E37-G39 PolarHBondContact O-N 2.92Å
40	E	76.3	Confident	84	Confident	59 Å²	59	59 Å²	59	28%	0.276	32%	0.322	S	S	.	.			trans	-72.5	148.1	170.6	-60.6	-174.2	137.5	0	0	111.7	K36 E37 H82	K36-E40 WeakPolarHBondContact CE-O 3.45Å; K36-E40 HydrophobicContact CG-CB 3.91Å; E37-E40 HydrophobicContact CB-CG 4.04Å; E37-E40 PolarHBondContact N-OE2 3.12Å; E37-E40 PolarHBondContact O-N 2.99Å; E37-E40 VanDerWaalsContact O-N 3.09Å; E40-H82 IonicContact OE1-CD2 3.14Å; E40-H82 PolarHBondContact OE1-CD2 2.91Å; E40-H82 VanDerWaalsContact OE1-CD2 3.3Å; E40-H82 IonicContact OE1-CE1 3.83Å; E40-H82 IonicContact OE1-NE2 3.51Å; E40-H82 PolarHBondContact OE1-NE2 3.11Å; E40-H82 IonicContact OE2-CD2 3.74Å; E40-H82 IonicContact OE2-NE2 3.53Å; E40-H82 PolarHBondContact OE2-NE2 2.86Å
41	S	71.8	Confident	83.3	Confident	107 Å²	107	58.4 Å²	58.4	75%	0.748	34%	0.336	S	S	*	.			trans	-147.6	147.9	176.7	64.5	0	0	0	0	110.8
42	G	77.7	Confident	82.9	Confident	23 Å²	23	63.2 Å²	63.2	24%	0.237	36%	0.361	C	S	.	.	S	Bend	trans	75.3	51.1	-171.3	0	0	0	0	0	111.6	H82 E83 D84	G42-H82 CarbonylContact O-C 3.58Å; G42-H82 WeakPolarHBondContact O-CA 3.41Å; G42-E83 CarbonylContact O-C 3.06Å; G42-E83 VanDerWaalsContact O-C 3.28Å; G42-E83 PolarHBondContact O-N 3.21Å; G42-D84 WeakPolarHBondContact CA-OD1 3.42Å
43	C	86.5	Confident	82.9	Confident	12 Å²	12	67.1 Å²	67.1	8%	0.081	38%	0.38	C	S	.	.			trans	-112	130.9	179.8	-52	0	0	0	0	110.5	V32 K36 F58 L80 R81	V32-C43 HydrophobicContact CG1-CB 4.08Å; K36-C43 HydrophobicContact CD-CB 4.13Å; K36-C43 HydrophobicContact CG-CB 4.45Å; C43-F58 WeakPolarHBondContact O-CZ 3.47Å; C43-L80 HydrophobicContact CB-CD1 4.24Å; C43-R81 CarbonylContact C-O 3.59Å; C43-R81 VanDerWaalsContact CA-O 3.28Å; C43-R81 WeakPolarHBondContact CA-O 3.42Å
44	H	89.1	Confident	82.8	Confident	14 Å²	14	67.1 Å²	67.1	7%	0.065	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	158.2	173.5	73.5	-94.3	0	0	0	112	A55 F58 R81 E83	H44-A55 VanDerWaalsContact CD2-CB 3.49Å; H44-A55 WeakPolarHBondContact CD2-CB 3.27Å; H44-F58 HydrophobicContact CB-CZ 4.3Å; H44-R81 PolarHBondContact N-O 3.34Å; H44-R81 PolarHBondContact O-N 2.91Å; H44-E83 PolarHBondContact ND1-O 2.82Å
45	L	90.9	Very high	82.8	Confident	0 Å²	0	62.6 Å²	62.6	0%	0	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	127.5	176.5	-169.2	68.4	0	0	0	109.7	V8 V31 V32 I56 M62 F78	V8-L45 HydrophobicContact CB-CD1 4.48Å; V8-L45 HydrophobicContact CG1-CD1 3.58Å; V8-L45 HydrophobicContact CG2-CD1 4.05Å; V31-L45 HydrophobicContact CB-CD2 4.4Å; V31-L45 HydrophobicContact CG1-CD1 4.46Å; V31-L45 HydrophobicContact CG1-CD2 3.9Å; V32-L45 HydrophobicContact CG2-CB 3.83Å; L45-I56 HydrophobicContact CD2-CD1 4.08Å; L45-I56 HydrophobicContact CG-CD1 4.24Å; L45-I56 PolarHBondContact O-N 2.66Å; L45-M62 HydrophobicContact CD2-CE 3.47Å; L45-M62 VanDerWaalsContact CD2-CE 3.47Å; L45-M62 HydrophobicContact CD2-SD 4.14Å; L45-F78 HydrophobicContact CD1-CB 4.28Å
46	A	90.8	Very high	82.9	Confident	0 Å²	0	62.2 Å²	62.2	0%	0	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	133.2	178.7	0	0	0	0	0	111.6	E53 R54 F78 F79 R81	A46-E53 HydrophobicContact CB-CG 3.97Å; A46-E53 VanDerWaalsContact CB-OE1 3.23Å; A46-E53 WeakPolarHBondContact CB-OE1 3.45Å; A46-R54 CarbonylContact C-O 3.28Å; A46-R54 VanDerWaalsContact CA-O 3.31Å; A46-R54 WeakPolarHBondContact CA-O 3.36Å; A46-F78 CarbonylContact O-C 3.55Å; A46-F78 VanDerWaalsContact O-CA 3.32Å; A46-F78 WeakPolarHBondContact O-CA 3.43Å; A46-F79 PolarHBondContact N-O 2.91Å; A46-F79 PolarHBondContact O-N 3.48Å; A46-R81 HydrophobicContact CB-CG 3.78Å
47	E	91.2	Very high	83	Confident	8 Å²	8	61.8 Å²	61.8	4%	0.037	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	128.4	166.7	51.8	163.7	-150.4	0	0	110.8	E53 R54 I56 H65 W69 V76 F78	E47-E53 CarbonylContact O-C 3.16Å; E47-E53 WeakPolarHBondContact O-CA 3.39Å; E47-R54 HydrophobicContact CG-CB 4.11Å; E47-R54 WeakPolarHBondContact CG-O 3.16Å; E47-R54 PolarHBondContact N-O 2.8Å; E47-R54 PolarHBondContact O-N 3.17Å; E47-R54 IonicContact OE1-CZ 3.63Å; E47-R54 IonicContact OE1-NE 3.6Å; E47-R54 PolarHBondContact OE1-NE 2.89Å; E47-R54 IonicContact OE1-NH2 2.73Å; E47-R54 PolarHBondContact OE1-NH2 2.96Å; E47-I56 HydrophobicContact CB-CD1 4.17Å; E47-I56 HydrophobicContact CB-CG1 4.4Å; E47-I56 HydrophobicContact CG-CD1 4.32Å; E47-I56 HydrophobicContact CG-CG1 4.05Å; E47-H65 IonicContact OE1-NE2 2.65Å; E47-H65 IonicContact OE2-NE2 3.64Å; E47-W69 VanDerWaalsContact OE2-CE2 3.31Å; E47-W69 VanDerWaalsContact OE2-CZ2 3.27Å; E47-W69 WeakPolarHBondContact OE2-CZ2 3.17Å; E47-W69 PolarHBondContact OE2-NE1 3.21Å; E47-V76 HydrophobicContact CB-CG1 4.05Å; E47-F78 HydrophobicContact CB-CD1 4.15Å; E47-F78 HydrophobicContact CB-CE1 3.86Å
48	V	89.8	Confident	83.3	Confident	31 Å²	31	57.1 Å²	57.1	19%	0.188	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	120.9	178.4	179.9	0	0	0	0	109.4	N52 E53 K77 F79	V48-N52 WeakPolarHBondContact CA-O 3.19Å; V48-E53 HydrophobicContact CG2-CB 4.03Å; V48-E53 HydrophobicContact CG2-CG 3.78Å; V48-K77 PolarHBondContact N-O 2.94Å; V48-K77 PolarHBondContact O-N 3.47Å; V48-F79 HydrophobicContact CB-CD2 4.08Å; V48-F79 HydrophobicContact CB-CE2 4.03Å; V48-F79 HydrophobicContact CG2-CD2 3.58Å; V48-F79 HydrophobicContact CG2-CE2 3.95Å
49	W	87.4	Confident	84	Confident	59 Å²	59	56.3 Å²	56.3	22%	0.223	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	119.4	176.6	-177.4	74	0	0	0	110.9	G51 N52 W69 E75 V76	W49-G51 PolarHBondContact O-N 2.9Å; W49-N52 PolarHBondContact N-O 3.19Å; W49-N52 PolarHBondContact O-N 2.86Å; W49-W69 HydrophobicContact CB-CH2 3.93Å; W49-W69 HydrophobicContact CB-CZ3 4.48Å; W49-W69 HydrophobicContact CD2-CH2 4.01Å; W49-W69 AromaticContact CD2-CZ3 3.95Å; W49-W69 HydrophobicContact CD2-CZ3 3.95Å; W49-W69 HydrophobicContact CE3-CH2 4.31Å; W49-W69 HydrophobicContact CE3-CZ3 4.46Å; W49-W69 AromaticContact CG-CH2 3.87Å; W49-W69 HydrophobicContact CG-CH2 3.87Å; W49-W69 AromaticContact CG-CZ3 3.97Å; W49-W69 HydrophobicContact CG-CZ3 3.97Å; W49-E75 PolarHBondContact NE1-OE2 3.07Å; W49-V76 HydrophobicContact CB-CG2 4.33Å; W49-V76 HydrophobicContact CG-CG2 4.29Å
50	R	81.6	Confident	85.1	Confident	175 Å²	175	55.7 Å²	55.7	66%	0.66	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.4	36.7	179.2	-57.3	-179.9	-174.1	-108.7	-4.1	114	N52 E75	R50-N52 VanDerWaalsContact C-N 3.28Å; R50-N52 PolarHBondContact O-N 3.06Å; R50-E75 IonicContact CZ-OE2 2.74Å; R50-E75 IonicContact NE-OE2 3.3Å; R50-E75 IonicContact NH2-OE1 3.82Å; R50-E75 PolarHBondContact NH2-OE1 3.31Å; R50-E75 VanDerWaalsContact NH2-OE1 3.17Å; R50-E75 IonicContact NH2-OE2 3.88Å; R50-E75 PolarHBondContact NH2-OE2 2.96Å
51	G	75.2	Confident	85.8	Confident	70 Å²	70	55.8 Å²	55.8	72%	0.722	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	81	-2	-179.4	0	0	0	0	0	115.1	W49	W49-G51 PolarHBondContact O-N 2.9Å
52	N	80.6	Confident	86.6	Confident	100 Å²	100	50.7 Å²	50.7	54%	0.535	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	125.9	166.7	-68.6	-45.6	0	0	0	109.3	V48 W49 R50	V48-N52 WeakPolarHBondContact CA-O 3.19Å; W49-N52 PolarHBondContact N-O 3.19Å; W49-N52 PolarHBondContact O-N 2.86Å; R50-N52 VanDerWaalsContact C-N 3.28Å; R50-N52 PolarHBondContact O-N 3.06Å
53	E	88.2	Confident	87	Confident	84 Å²	84	52.6 Å²	52.6	39%	0.393	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	143	177.9	-178.1	160.3	-178.4	0	0	110.7	A46 E47 V48 R81	A46-E53 HydrophobicContact CB-CG 3.97Å; A46-E53 VanDerWaalsContact CB-OE1 3.23Å; A46-E53 WeakPolarHBondContact CB-OE1 3.45Å; E47-E53 CarbonylContact O-C 3.16Å; E47-E53 WeakPolarHBondContact O-CA 3.39Å; V48-E53 HydrophobicContact CG2-CB 4.03Å; V48-E53 HydrophobicContact CG2-CG 3.78Å; E53-R81 IonicContact OE1-CZ 2.95Å; E53-R81 IonicContact OE1-NE 3.53Å; E53-R81 PolarHBondContact OE1-NE 3.11Å; E53-R81 IonicContact OE1-NH2 3.17Å; E53-R81 PolarHBondContact OE1-NH2 3.08Å; E53-R81 IonicContact OE2-CZ 3.05Å; E53-R81 IonicContact OE2-NE 2.73Å; E53-R81 IonicContact OE2-NH2 2.63Å; E53-R81 PolarHBondContact OE2-NH2 3.38Å
54	R	86.1	Confident	87	Confident	111 Å²	111	57.8 Å²	57.8	42%	0.419	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	132.9	173.4	-67.2	-177.4	-68.4	-85.6	-2.1	111.2	A46 E47	A46-R54 CarbonylContact C-O 3.28Å; A46-R54 VanDerWaalsContact CA-O 3.31Å; A46-R54 WeakPolarHBondContact CA-O 3.36Å; E47-R54 HydrophobicContact CG-CB 4.11Å; E47-R54 WeakPolarHBondContact CG-O 3.16Å; E47-R54 PolarHBondContact N-O 2.8Å; E47-R54 PolarHBondContact O-N 3.17Å; E47-R54 IonicContact OE1-CZ 3.63Å; E47-R54 IonicContact OE1-NE 3.6Å; E47-R54 PolarHBondContact OE1-NE 2.89Å; E47-R54 IonicContact OE1-NH2 2.73Å; E47-R54 PolarHBondContact OE1-NH2 2.96Å
55	A	87.1	Confident	86.8	Confident	34 Å²	34	58.3 Å²	58.3	28%	0.281	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	140	167.2	0	0	0	0	0	111.2	H44 P86	H44-A55 VanDerWaalsContact CD2-CB 3.49Å; H44-A55 WeakPolarHBondContact CD2-CB 3.27Å; A55-P86 HydrophobicContact CB-CG 4.3Å
56	I	88.6	Confident	86.5	Confident	4 Å²	4	58.5 Å²	58.5	2%	0.021	29%	0.29	C	S	.	.	P	Polyproline II helix	trans	-96.8	122.9	173.6	-56	175	0	0	0	107.9	C28 L45 E47 H60 M62 F78	C28-I56 HydrophobicContact CB-CG2 4.02Å; C28-I56 PolarHBondContact SG-O 2.7Å; L45-I56 HydrophobicContact CD2-CD1 4.08Å; L45-I56 HydrophobicContact CG-CD1 4.24Å; L45-I56 PolarHBondContact O-N 2.66Å; E47-I56 HydrophobicContact CB-CD1 4.17Å; E47-I56 HydrophobicContact CB-CG1 4.4Å; E47-I56 HydrophobicContact CG-CD1 4.32Å; E47-I56 HydrophobicContact CG-CG1 4.05Å; I56-H60 HydrophobicContact CG2-CB 4.06Å; I56-M62 HydrophobicContact CD1-CE 4.24Å; I56-M62 HydrophobicContact CD1-SD 4.47Å; I56-M62 HydrophobicContact CG2-SD 4.2Å; I56-F78 HydrophobicContact CD1-CD1 3.86Å; I56-F78 HydrophobicContact CD1-CE1 3.87Å
57	P	87	Confident	86.2	Confident	45 Å²	45	64.4 Å²	64.4	29%	0.292	32%	0.318	S	S	.	.	P	Polyproline II helix	trans	-63.4	140.7	179.1	-21.7	32.8	0	0	0	112.1	C28 E59 H60	C28-P57 WeakPolarHBondContact CB-O 3.19Å; P57-E59 PolarHBondContact O-N 3.34Å; P57-H60 WeakPolarHBondContact O-CB 3.39Å; P57-H60 PolarHBondContact O-N 3.07Å
58	F	86.9	Confident	85.9	Confident	41 Å²	41	70.1 Å²	70.1	18%	0.18	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.5	-31.7	-173.7	-68.9	-65.7	0	0	0	114.4	C28 R29 V32 C43 H44 H60	C28-F58 PolarHBondContact N-O 3.49Å; R29-F58 HydrophobicContact CB-CB 4.21Å; R29-F58 HydrophobicContact CB-CD1 4.26Å; R29-F58 PolarHBondContact N-O 2.79Å; R29-F58 VanDerWaalsContact N-O 3.14Å; V32-F58 HydrophobicContact CB-CE1 4.45Å; V32-F58 HydrophobicContact CG1-CE1 4.33Å; V32-F58 HydrophobicContact CG2-CE1 4.19Å; C43-F58 WeakPolarHBondContact O-CZ 3.47Å; H44-F58 HydrophobicContact CB-CZ 4.3Å; F58-H60 VanDerWaalsContact C-N 3.29Å; F58-H60 PolarHBondContact O-N 3.36Å
59	E	86.7	Confident	85.4	Confident	125 Å²	125	70.1 Å²	70.1	58%	0.584	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.8	-4.5	-177.5	-60.8	64.3	-139	0	0	113.6	R29 P57	R29-E59 IonicContact CZ-OE1 2.61Å; R29-E59 IonicContact NH2-OE1 2.78Å; R29-E59 PolarHBondContact NH2-OE1 2.99Å; P57-E59 PolarHBondContact O-N 3.34Å
60	H	88.4	Confident	85	Confident	68 Å²	68	68.7 Å²	68.7	32%	0.315	34%	0.343	S	S	.	.	S	Bend	trans	-76.4	130.6	-178.9	-85.7	54.9	0	0	0	112.7	T27 C28 I56 P57 F58 M62 H65	T27-H60 CarbonylContact C-O 3.59Å; T27-H60 WeakPolarHBondContact CA-O 3.45Å; C28-H60 PolarHBondContact N-O 2.71Å; I56-H60 HydrophobicContact CG2-CB 4.06Å; P57-H60 WeakPolarHBondContact O-CB 3.39Å; P57-H60 PolarHBondContact O-N 3.07Å; F58-H60 VanDerWaalsContact C-N 3.29Å; F58-H60 PolarHBondContact O-N 3.36Å; H60-M62 PolarHBondContact O-N 2.79Å; H60-H65 AromaticContact CD2-CE1 2.85Å; H60-H65 PolarHBondContact CD2-CE1 3.34Å; H60-H65 AromaticContact CD2-ND1 3.84Å; H60-H65 AromaticContact CG-CE1 3.76Å; H60-H65 AromaticContact NE2-CE1 3.7Å
61	M	89.9	Confident	84.6	Confident	61 Å²	61	66.5 Å²	66.5	30%	0.3	35%	0.351	S	S	.	.	B	Isolated β-bridge	trans	-67.6	116.8	169.4	-51.8	-50.7	-64.4	0	0	109.8	P24 E25 T27 Y63 E64 H65	P24-M61 VanDerWaalsContact O-CE 3.25Å; P24-M61 WeakPolarHBondContact O-CE 3.34Å; E25-M61 VanDerWaalsContact C-CE 3.4Å; E25-M61 VanDerWaalsContact O-CE 3.29Å; E25-M61 WeakPolarHBondContact O-CE 3.09Å; T27-M61 HydrophobicContact CG2-CE 4.38Å; T27-M61 HydrophobicContact CG2-SD 4.02Å; M61-Y63 VanDerWaalsContact C-N 3.31Å; M61-Y63 PolarHBondContact O-N 3.48Å; M61-E64 HydrophobicContact CB-CB 4.36Å; M61-E64 HydrophobicContact CB-CG 4.18Å; M61-E64 PolarHBondContact O-N 2.88Å; M61-H65 WeakPolarHBondContact O-CB 3.23Å; M61-H65 PolarHBondContact O-N 2.62Å
62	M	88.9	Confident	84.6	Confident	0 Å²	0	68.9 Å²	68.9	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-69	-31.6	-172.9	-72.6	-60.8	-67.5	0	0	112.3	L6 I22 T26 C28 V31 L45 I56 H60 H65 L66	L6-M62 HydrophobicContact CD2-CE 3.53Å; I22-M62 HydrophobicContact CD1-CB 4.27Å; I22-M62 HydrophobicContact CG2-CB 3.9Å; T26-M62 PolarHBondContact O-N 2.77Å; C28-M62 HydrophobicContact CB-CG 4.25Å; C28-M62 HydrophobicContact CB-SD 3.84Å; V31-M62 HydrophobicContact CG2-CG 3.91Å; L45-M62 HydrophobicContact CD2-CE 3.47Å; L45-M62 VanDerWaalsContact CD2-CE 3.47Å; L45-M62 HydrophobicContact CD2-SD 4.14Å; I56-M62 HydrophobicContact CD1-CE 4.24Å; I56-M62 HydrophobicContact CD1-SD 4.47Å; I56-M62 HydrophobicContact CG2-SD 4.2Å; H60-M62 PolarHBondContact O-N 2.79Å; M62-H65 PolarHBondContact O-N 3.3Å; M62-L66 VanDerWaalsContact O-CB 3.29Å; M62-L66 WeakPolarHBondContact O-CB 3.5Å; M62-L66 WeakPolarHBondContact O-CD1 3.45Å; M62-L66 WeakPolarHBondContact O-CG 3.26Å; M62-L66 PolarHBondContact O-N 3Å
63	Y	86.6	Confident	84.4	Confident	62 Å²	62	67 Å²	67	24%	0.243	33%	0.326	C	S	.	.	H	α-helix	trans	-60.6	-50	175.1	-168	-89	0	0	0	112.1	P24 M61 Q67	P24-Y63 HydrophobicContact CB-CG 4.47Å; P24-Y63 HydrophobicContact CG-CD2 4.38Å; P24-Y63 HydrophobicContact CG-CE2 4.45Å; P24-Y63 HydrophobicContact CG-CG 4.46Å; M61-Y63 VanDerWaalsContact C-N 3.31Å; M61-Y63 PolarHBondContact O-N 3.48Å; Y63-Q67 WeakPolarHBondContact O-CB 3.27Å; Y63-Q67 PolarHBondContact O-N 3.37Å
64	E	85.6	Confident	83.6	Confident	121 Å²	121	72.2 Å²	72.2	57%	0.565	35%	0.35	S	S	*	.	H	α-helix	trans	-65	-42.8	175.8	-63.6	-166.2	160.1	0	0	111.8	M61 L66 Q67 K68	M61-E64 HydrophobicContact CB-CB 4.36Å; M61-E64 HydrophobicContact CB-CG 4.18Å; M61-E64 PolarHBondContact O-N 2.88Å; E64-L66 PolarHBondContact O-N 3.49Å; E64-Q67 WeakPolarHBondContact O-CB 3.41Å; E64-Q67 PolarHBondContact O-N 3.38Å; E64-K68 WeakPolarHBondContact O-CG 3.22Å; E64-K68 PolarHBondContact O-N 2.87Å; E64-K68 VanDerWaalsContact O-N 3.14Å
65	H	85.8	Confident	83.4	Confident	26 Å²	26	71 Å²	71	12%	0.12	35%	0.349	C	S	.	.	H	α-helix	trans	-61.5	-44.9	-179.4	-169.4	89.2	0	0	0	111.3	E47 H60 M61 M62 Q67 K68	E47-H65 IonicContact OE1-NE2 2.65Å; E47-H65 IonicContact OE2-NE2 3.64Å; H60-H65 AromaticContact CD2-CE1 2.85Å; H60-H65 PolarHBondContact CD2-CE1 3.34Å; H60-H65 AromaticContact CD2-ND1 3.84Å; H60-H65 AromaticContact CG-CE1 3.76Å; H60-H65 AromaticContact NE2-CE1 3.7Å; M61-H65 WeakPolarHBondContact O-CB 3.23Å; M61-H65 PolarHBondContact O-N 2.62Å; M62-H65 PolarHBondContact O-N 3.3Å; H65-Q67 VanDerWaalsContact C-N 3.28Å; H65-Q67 PolarHBondContact O-N 3.13Å; H65-K68 PolarHBondContact CE1-NZ 2.88Å; H65-K68 WeakPolarHBondContact O-CB 3.38Å; H65-K68 PolarHBondContact O-N 2.68Å
66	L	85.3	Confident	83.4	Confident	3 Å²	3	69.9 Å²	69.9	2%	0.016	34%	0.339	C	S	.	.	H	α-helix	trans	-65.8	-28.5	172.7	-68.3	167.3	0	0	0	112.5	M4 L6 I22 M62 E64 K73 F78	M4-L66 HydrophobicContact CE-CB 4.11Å; M4-L66 HydrophobicContact CE-CD1 3.97Å; M4-L66 HydrophobicContact CE-CD2 4.35Å; M4-L66 HydrophobicContact CE-CG 4.38Å; M4-L66 HydrophobicContact SD-CB 4.11Å; M4-L66 HydrophobicContact SD-CD1 4.11Å; L6-L66 HydrophobicContact CB-CD1 4.38Å; L6-L66 HydrophobicContact CD1-CD1 4.08Å; L6-L66 HydrophobicContact CD1-CD2 3.75Å; L6-L66 HydrophobicContact CD2-CD1 4.35Å; I22-L66 HydrophobicContact CG1-CD1 4.12Å; I22-L66 HydrophobicContact CG2-CD1 4.47Å; M62-L66 VanDerWaalsContact O-CB 3.29Å; M62-L66 WeakPolarHBondContact O-CB 3.5Å; M62-L66 WeakPolarHBondContact O-CD1 3.45Å; M62-L66 WeakPolarHBondContact O-CG 3.26Å; M62-L66 PolarHBondContact O-N 3Å; E64-L66 PolarHBondContact O-N 3.49Å; L66-K73 VanDerWaalsContact O-CE 3.23Å; L66-K73 WeakPolarHBondContact O-CE 3.35Å; L66-K73 WeakPolarHBondContact O-CG 3.37Å; L66-K73 PolarHBondContact O-NZ 3.24Å; L66-F78 HydrophobicContact CD2-CE1 4.17Å; L66-F78 HydrophobicContact CD2-CE2 3.79Å; L66-F78 HydrophobicContact CD2-CZ 3.47Å; L66-F78 VanDerWaalsContact CD2-CZ 3.47Å
67	Q	83.5	Confident	83.5	Confident	124 Å²	124	73.2 Å²	73.2	58%	0.579	35%	0.353	S	S	*	.	H	α-helix	trans	-70.1	-33.3	178	-168.7	169.2	-4.3	0	0	112.4	Y63 E64 H65 W69 G70	Y63-Q67 WeakPolarHBondContact O-CB 3.27Å; Y63-Q67 PolarHBondContact O-N 3.37Å; E64-Q67 WeakPolarHBondContact O-CB 3.41Å; E64-Q67 PolarHBondContact O-N 3.38Å; H65-Q67 VanDerWaalsContact C-N 3.28Å; H65-Q67 PolarHBondContact O-N 3.13Å; Q67-W69 PolarHBondContact O-N 3.44Å; Q67-G70 PolarHBondContact O-N 3.27Å
68	K	83.9	Confident	83.7	Confident	129 Å²	129	71.3 Å²	71.3	56%	0.561	34%	0.34	S	S	*	.	H	α-helix	trans	-55.2	-32.5	175.4	-64.2	164.4	-167.3	169.3	0	113	E64 H65 G70	E64-K68 WeakPolarHBondContact O-CG 3.22Å; E64-K68 PolarHBondContact O-N 2.87Å; E64-K68 VanDerWaalsContact O-N 3.14Å; H65-K68 PolarHBondContact CE1-NZ 2.88Å; H65-K68 WeakPolarHBondContact O-CB 3.38Å; H65-K68 PolarHBondContact O-N 2.68Å; K68-G70 VanDerWaalsContact C-N 3.34Å
69	W	80.9	Confident	83.9	Confident	30 Å²	30	70 Å²	70	11%	0.114	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-17	179.5	-73.3	107.3	0	0	0	114.3	E47 W49 Q67 R72 K73 V76	E47-W69 VanDerWaalsContact OE2-CE2 3.31Å; E47-W69 VanDerWaalsContact OE2-CZ2 3.27Å; E47-W69 WeakPolarHBondContact OE2-CZ2 3.17Å; E47-W69 PolarHBondContact OE2-NE1 3.21Å; W49-W69 HydrophobicContact CB-CH2 3.93Å; W49-W69 HydrophobicContact CB-CZ3 4.48Å; W49-W69 HydrophobicContact CD2-CH2 4.01Å; W49-W69 AromaticContact CD2-CZ3 3.95Å; W49-W69 HydrophobicContact CD2-CZ3 3.95Å; W49-W69 HydrophobicContact CE3-CH2 4.31Å; W49-W69 HydrophobicContact CE3-CZ3 4.46Å; W49-W69 AromaticContact CG-CH2 3.87Å; W49-W69 HydrophobicContact CG-CH2 3.87Å; W49-W69 AromaticContact CG-CZ3 3.97Å; W49-W69 HydrophobicContact CG-CZ3 3.97Å; Q67-W69 PolarHBondContact O-N 3.44Å; W69-R72 WeakPolarHBondContact O-CB 3.4Å; W69-R72 PolarHBondContact O-N 3.22Å; W69-K73 HydrophobicContact CB-CG 4.19Å; W69-V76 HydrophobicContact CD2-CG2 3.55Å; W69-V76 HydrophobicContact CE3-CG2 3.54Å; W69-V76 HydrophobicContact CG-CG2 4.09Å; W69-V76 HydrophobicContact CH2-CG2 3.99Å; W69-V76 HydrophobicContact CZ2-CG1 4.41Å; W69-V76 HydrophobicContact CZ2-CG2 4Å; W69-V76 HydrophobicContact CZ3-CG2 3.76Å
70	G	78.8	Confident	84.1	Confident	30 Å²	30	64.3 Å²	64.3	31%	0.309	31%	0.308	S	S	.	.	G	3₁₀ helix	trans	56.7	-130.1	173.7	0	0	0	0	0	113.1	Q67 K68 R72 K73	Q67-G70 PolarHBondContact O-N 3.27Å; K68-G70 VanDerWaalsContact C-N 3.34Å; G70-R72 PolarHBondContact O-N 3.28Å; G70-K73 WeakPolarHBondContact O-CD 3.48Å; G70-K73 WeakPolarHBondContact O-CE 3.33Å; G70-K73 VanDerWaalsContact O-CG 3.23Å; G70-K73 WeakPolarHBondContact O-CG 3.38Å
71	P	73.9	Confident	84.1	Confident	128 Å²	128	63.2 Å²	63.2	83%	0.831	30%	0.301	S	S	*	.	G	3₁₀ helix	trans	-70	-13.7	177.5	30	-35.1	0	0	0	113.6	K73	P71-K73 VanDerWaalsContact C-N 3.31Å; P71-K73 PolarHBondContact O-N 3.03Å
72	R	74.2	Confident	83.8	Confident	120 Å²	120	64.7 Å²	64.7	45%	0.453	31%	0.307	S	S	.	.	G	3₁₀ helix	trans	-87.1	7.1	-178.3	-62.9	174.6	-64.7	-172.7	1.8	113.9	W69 G70 Q74 E75	W69-R72 WeakPolarHBondContact O-CB 3.4Å; W69-R72 PolarHBondContact O-N 3.22Å; G70-R72 PolarHBondContact O-N 3.28Å; R72-Q74 PolarHBondContact O-N 3.2Å; R72-E75 HydrophobicContact CB-CG 4.42Å; R72-E75 WeakPolarHBondContact O-CB 3.32Å; R72-E75 PolarHBondContact O-N 3.25Å
73	K	75.6	Confident	83.1	Confident	61 Å²	61	71.8 Å²	71.8	27%	0.265	34%	0.34	S	S	.	.	G	3₁₀ helix	trans	-46.9	-36.7	175.3	-74.3	157.6	-178.9	-76.7	0	112.9	M4 L66 W69 G70 P71 E75 V76	M4-K73 HydrophobicContact CE-CD 3.86Å; M4-K73 HydrophobicContact CE-CG 4.29Å; M4-K73 HydrophobicContact SD-CD 4.47Å; M4-K73 PolarHBondContact SD-NZ 3.14Å; L66-K73 VanDerWaalsContact O-CE 3.23Å; L66-K73 WeakPolarHBondContact O-CE 3.35Å; L66-K73 WeakPolarHBondContact O-CG 3.37Å; L66-K73 PolarHBondContact O-NZ 3.24Å; W69-K73 HydrophobicContact CB-CG 4.19Å; G70-K73 WeakPolarHBondContact O-CD 3.48Å; G70-K73 WeakPolarHBondContact O-CE 3.33Å; G70-K73 VanDerWaalsContact O-CG 3.23Å; G70-K73 WeakPolarHBondContact O-CG 3.38Å; P71-K73 VanDerWaalsContact C-N 3.31Å; P71-K73 PolarHBondContact O-N 3.03Å; K73-E75 VanDerWaalsContact C-N 3.34Å; K73-V76 PolarHBondContact O-N 2.89Å
74	Q	71.7	Confident	81.9	Confident	194 Å²	194	75.5 Å²	75.5	91%	0.907	36%	0.364	S	S	*	.	G	3₁₀ helix	trans	-77.8	-11.1	-179.6	-63	177.3	1.3	0	0	114.5	R72	R72-Q74 PolarHBondContact O-N 3.2Å
75	E	81.9	Confident	80.3	Confident	85 Å²	85	70.3 Å²	70.3	40%	0.397	34%	0.342	S	S	.	.	G	3₁₀ helix	trans	-86.5	-13.1	173.2	-61.2	-172.5	-177.9	0	0	112.9	W49 R50 R72 K73	W49-E75 PolarHBondContact NE1-OE2 3.07Å; R50-E75 IonicContact CZ-OE2 2.74Å; R50-E75 IonicContact NE-OE2 3.3Å; R50-E75 IonicContact NH2-OE1 3.82Å; R50-E75 PolarHBondContact NH2-OE1 3.31Å; R50-E75 VanDerWaalsContact NH2-OE1 3.17Å; R50-E75 IonicContact NH2-OE2 3.88Å; R50-E75 PolarHBondContact NH2-OE2 2.96Å; R72-E75 HydrophobicContact CB-CG 4.42Å; R72-E75 WeakPolarHBondContact O-CB 3.32Å; R72-E75 PolarHBondContact O-N 3.25Å; K73-E75 VanDerWaalsContact C-N 3.34Å
76	V	87.8	Confident	78.9	Confident	10 Å²	10	73.6 Å²	73.6	6%	0.061	37%	0.365	C	S	.	.			trans	-103.7	130.3	-173.5	-172.5	0	0	0	0	108.9	E47 W49 W69 K73 F78	E47-V76 HydrophobicContact CB-CG1 4.05Å; W49-V76 HydrophobicContact CB-CG2 4.33Å; W49-V76 HydrophobicContact CG-CG2 4.29Å; W69-V76 HydrophobicContact CD2-CG2 3.55Å; W69-V76 HydrophobicContact CE3-CG2 3.54Å; W69-V76 HydrophobicContact CG-CG2 4.09Å; W69-V76 HydrophobicContact CH2-CG2 3.99Å; W69-V76 HydrophobicContact CZ2-CG1 4.41Å; W69-V76 HydrophobicContact CZ2-CG2 4Å; W69-V76 HydrophobicContact CZ3-CG2 3.76Å; K73-V76 PolarHBondContact O-N 2.89Å; V76-F78 HydrophobicContact CB-CE2 4.07Å; V76-F78 HydrophobicContact CB-CZ 4.22Å; V76-F78 HydrophobicContact CG1-CD2 4.48Å; V76-F78 HydrophobicContact CG1-CE1 4.21Å; V76-F78 HydrophobicContact CG1-CE2 3.77Å; V76-F78 HydrophobicContact CG1-CZ 3.6Å
77	K	89.6	Confident	77.2	Confident	74 Å²	74	78 Å²	78	32%	0.322	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	145	173.9	-61.9	-170.8	-172.9	-175.7	0	109.3	Y9 E14 V48 F79	Y9-K77 HydrophobicContact CD2-CB 4.16Å; Y9-K77 HydrophobicContact CE2-CB 3.91Å; Y9-K77 HydrophobicContact CE2-CD 3.92Å; Y9-K77 HydrophobicContact CE2-CG 3.96Å; E14-K77 WeakPolarHBondContact OE1-CD 3.34Å; E14-K77 IonicContact OE1-NZ 2.64Å; E14-K77 PolarHBondContact OE1-NZ 2.95Å; E14-K77 IonicContact OE2-NZ 3.49Å; E14-K77 PolarHBondContact OE2-NZ 2.91Å; V48-K77 PolarHBondContact N-O 2.94Å; V48-K77 PolarHBondContact O-N 3.47Å; K77-F79 HydrophobicContact CB-CD2 4.27Å; K77-F79 HydrophobicContact CB-CE2 3.58Å; K77-F79 HydrophobicContact CB-CZ 4.29Å; K77-F79 HydrophobicContact CD-CE2 4.48Å; K77-F79 HydrophobicContact CD-CZ 4.46Å
78	F	91.6	Very high	75.2	Confident	6 Å²	6	79 Å²	79	3%	0.026	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	124.1	-179.4	-62.4	-92.1	0	0	0	108.1	L6 V8 Y9 L45 A46 E47 I56 L66 V76	L6-F78 HydrophobicContact CD1-CD2 3.48Å; L6-F78 VanDerWaalsContact CD1-CD2 3.48Å; L6-F78 HydrophobicContact CD1-CE2 3.78Å; L6-F78 HydrophobicContact CD1-CG 3.91Å; L6-F78 HydrophobicContact CD1-CZ 4.42Å; V8-F78 CarbonylContact C-O 3.53Å; V8-F78 WeakPolarHBondContact CA-O 3.4Å; V8-F78 HydrophobicContact CG2-CB 4.47Å; Y9-F78 WeakPolarHBondContact CD2-O 3.25Å; Y9-F78 PolarHBondContact N-O 2.98Å; L45-F78 HydrophobicContact CD1-CB 4.28Å; A46-F78 CarbonylContact O-C 3.55Å; A46-F78 VanDerWaalsContact O-CA 3.32Å; A46-F78 WeakPolarHBondContact O-CA 3.43Å; E47-F78 HydrophobicContact CB-CD1 4.15Å; E47-F78 HydrophobicContact CB-CE1 3.86Å; I56-F78 HydrophobicContact CD1-CD1 3.86Å; I56-F78 HydrophobicContact CD1-CE1 3.87Å; L66-F78 HydrophobicContact CD2-CE1 4.17Å; L66-F78 HydrophobicContact CD2-CE2 3.79Å; L66-F78 HydrophobicContact CD2-CZ 3.47Å; L66-F78 VanDerWaalsContact CD2-CZ 3.47Å; V76-F78 HydrophobicContact CB-CE2 4.07Å; V76-F78 HydrophobicContact CB-CZ 4.22Å; V76-F78 HydrophobicContact CG1-CD2 4.48Å; V76-F78 HydrophobicContact CG1-CE1 4.21Å; V76-F78 HydrophobicContact CG1-CE2 3.77Å; V76-F78 HydrophobicContact CG1-CZ 3.6Å
79	F	90.8	Very high	72.8	Confident	13 Å²	13	78.1 Å²	78.1	6%	0.057	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	138.1	-178.1	-70.2	-94.6	0	0	0	109.9	Y9 E14 A46 V48 K77	Y9-F79 HydrophobicContact CD2-CE1 4.26Å; Y9-F79 HydrophobicContact CD2-CE2 4.45Å; Y9-F79 HydrophobicContact CD2-CZ 4.18Å; Y9-F79 HydrophobicContact CG-CD1 4.37Å; Y9-F79 HydrophobicContact CG-CE1 4.04Å; Y9-F79 HydrophobicContact CG-CZ 4.38Å; Y9-F79 WeakPolarHBondContact O-CA 3.38Å; E14-F79 HydrophobicContact CG-CE1 4.24Å; E14-F79 HydrophobicContact CG-CZ 4.13Å; A46-F79 PolarHBondContact N-O 2.91Å; A46-F79 PolarHBondContact O-N 3.48Å; V48-F79 HydrophobicContact CB-CD2 4.08Å; V48-F79 HydrophobicContact CB-CE2 4.03Å; V48-F79 HydrophobicContact CG2-CD2 3.58Å; V48-F79 HydrophobicContact CG2-CE2 3.95Å; K77-F79 HydrophobicContact CB-CD2 4.27Å; K77-F79 HydrophobicContact CB-CE2 3.58Å; K77-F79 HydrophobicContact CB-CZ 4.29Å; K77-F79 HydrophobicContact CD-CE2 4.48Å; K77-F79 HydrophobicContact CD-CZ 4.46Å
80	L	90.6	Very high	70.8	Confident	6 Å²	6	81.8 Å²	81.8	3%	0.031	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	128.3	162.6	-170.1	69.5	0	0	0	108	V8 Y9 L10 V32 C35 K36 C43	V8-L80 HydrophobicContact CG1-CB 4.32Å; Y9-L80 PolarHBondContact O-N 2.69Å; L10-L80 HydrophobicContact CD2-CB 4.21Å; L10-L80 HydrophobicContact CD2-CD2 4.13Å; V32-L80 HydrophobicContact CG1-CD1 4.16Å; V32-L80 HydrophobicContact CG2-CD1 4.27Å; C35-L80 HydrophobicContact CB-CD2 4.18Å; C35-L80 WeakPolarHBondContact O-CD2 3.24Å; K36-L80 HydrophobicContact CB-CD2 4.41Å; C43-L80 HydrophobicContact CB-CD1 4.24Å
81	R	88.5	Confident	68.8	Low	45 Å²	45	87.2 Å²	87.2	17%	0.17	46%	0.46	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	123.7	-178.2	-65	-54.2	-156.6	171.9	10.8	110.8	D12 C43 H44 A46 E53 E83	D12-R81 IonicContact OD1-NH1 2.64Å; D12-R81 PolarHBondContact OD1-NH1 3.4Å; D12-R81 IonicContact OD2-CZ 3.96Å; D12-R81 IonicContact OD2-NH1 2.66Å; D12-R81 PolarHBondContact OD2-NH1 3.28Å; D12-R81 IonicContact OD2-NH2 3.12Å; C43-R81 CarbonylContact C-O 3.59Å; C43-R81 VanDerWaalsContact CA-O 3.28Å; C43-R81 WeakPolarHBondContact CA-O 3.42Å; H44-R81 PolarHBondContact N-O 3.34Å; H44-R81 PolarHBondContact O-N 2.91Å; A46-R81 HydrophobicContact CB-CG 3.78Å; E53-R81 IonicContact OE1-CZ 2.95Å; E53-R81 IonicContact OE1-NE 3.53Å; E53-R81 PolarHBondContact OE1-NE 3.11Å; E53-R81 IonicContact OE1-NH2 3.17Å; E53-R81 PolarHBondContact OE1-NH2 3.08Å; E53-R81 IonicContact OE2-CZ 3.05Å; E53-R81 IonicContact OE2-NE 2.73Å; E53-R81 IonicContact OE2-NH2 2.63Å; E53-R81 PolarHBondContact OE2-NH2 3.38Å; R81-E83 PolarHBondContact O-N 2.94Å; R81-E83 VanDerWaalsContact O-N 3.15Å
82	H	84.8	Confident	66.9	Low	92 Å²	92	90.6 Å²	90.6	43%	0.426	46%	0.464	S	S	.	.			trans	-86.9	49	178.6	-55.7	76.6	0	0	0	112.4	E40 G42	E40-H82 IonicContact OE1-CD2 3.14Å; E40-H82 PolarHBondContact OE1-CD2 2.91Å; E40-H82 VanDerWaalsContact OE1-CD2 3.3Å; E40-H82 IonicContact OE1-CE1 3.83Å; E40-H82 IonicContact OE1-NE2 3.51Å; E40-H82 PolarHBondContact OE1-NE2 3.11Å; E40-H82 IonicContact OE2-CD2 3.74Å; E40-H82 IonicContact OE2-NE2 3.53Å; E40-H82 PolarHBondContact OE2-NE2 2.86Å; G42-H82 CarbonylContact O-C 3.58Å; G42-H82 WeakPolarHBondContact O-CA 3.41Å
83	E	74.1	Confident	64.7	Low	149 Å²	149	88.6 Å²	88.6	70%	0.696	48%	0.48	S	S	*	.	S	Bend	trans	-129.9	145.3	171.8	-62.6	-169.3	156.6	0	0	109.6	G42 H44 R81	G42-E83 CarbonylContact O-C 3.06Å; G42-E83 VanDerWaalsContact O-C 3.28Å; G42-E83 PolarHBondContact O-N 3.21Å; H44-E83 PolarHBondContact ND1-O 2.82Å; R81-E83 PolarHBondContact O-N 2.94Å; R81-E83 VanDerWaalsContact O-N 3.15Å
84	D	61.1	Low	62.5	Low	139 Å²	139	91.6 Å²	91.6	74%	0.743	51%	0.509	S	S	*	.			trans	-56.8	142.3	176	-70.2	-44.4	0	0	0	111.3	G42	G42-D84 WeakPolarHBondContact CA-OD1 3.42Å
85	S	52.1	Low	60.6	Low	13 Å²	13	91.9 Å²	91.9	9%	0.091	51%	0.511	C	S	.	.			trans	-63.8	129.3	-172.7	87.7	0	0	0	0	110.9	T87 E88	S85-T87 PolarHBondContact O-N 2.86Å; S85-T87 PolarHBondContact OG-OG1 2.91Å; S85-E88 PolarHBondContact O-N 2.72Å; S85-E88 WeakPolarHBondContact OG-CG 3.49Å; S85-E88 PolarHBondContact OG-OE2 3.46Å
86	P	57.1	Low	58.1	Low	94 Å²	94	97.1 Å²	97.1	61%	0.61	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.7	2.3	-179.6	27.9	-35.5	0	0	0	113.4	A55	A55-P86 HydrophobicContact CB-CG 4.3Å
87	T	48.2	Very low	55.4	Low	97 Å²	97	102.8 Å²	102.8	60%	0.595	58%	0.575	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.7	-19.4	177.6	29.6	0	0	0	0	114.5	S85	S85-T87 PolarHBondContact O-N 2.86Å; S85-T87 PolarHBondContact OG-OG1 2.91Å
88	E	42	Very low	52.7	Low	143 Å²	143	107.7 Å²	107.7	67%	0.668	60%	0.599	S	S	*	*	S	Bend	trans	-94.3	-8.7	-174.1	-76.2	172.9	101.5	0	0	114.3	S85 S90	S85-E88 PolarHBondContact O-N 2.72Å; S85-E88 WeakPolarHBondContact OG-CG 3.49Å; S85-E88 PolarHBondContact OG-OE2 3.46Å; E88-S90 PolarHBondContact O-N 2.72Å
89	S	33.9	Very low	49.7	Very low	112 Å²	112	113 Å²	113	78%	0.783	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.7	41.3	-178.5	73.3	0	0	0	0	114.5
90	S	39.2	Very low	46.9	Very low	106 Å²	106	119.3 Å²	119.3	74%	0.741	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-144	17.8	-174.3	-166.2	0	0	0	0	116.8	E88	E88-S90 PolarHBondContact O-N 2.72Å
91	D	36.2	Very low	44	Very low	145 Å²	145	125.8 Å²	125.8	78%	0.775	70%	0.697	S	S	*	*	S	Bend	trans	-144.8	64.4	176.3	-135.2	-22.1	0	0	0	116.4
92	Q	33.4	Very low	41.3	Very low	199 Å²	199	126.8 Å²	126.8	93%	0.93	72%	0.722	S	S	*	*			trans	176.2	113.4	140.6	-98.7	153.6	95.3	0	0	111
93	G	29.3	Very low	38.8	Very low	77 Å²	77	134.1 Å²	134.1	79%	0.794	75%	0.746	S	S	*	*			trans	-174	10.9	-176.7	0	0	0	0	0	119.8
94	S	29.2	Very low	36.9	Very low	125 Å²	125	138.5 Å²	138.5	87%	0.874	76%	0.756	S	S	*	*			trans	-165.1	101.4	172.5	-86.5	0	0	0	0	113.8
95	Q	30.7	Very low	35.5	Very low	200 Å²	200	137.6 Å²	137.6	94%	0.935	76%	0.761	S	S	*	*			trans	-153.7	66.1	159.7	-138.8	173.2	49.7	0	0	114.4
96	Q	30.8	Very low	34.5	Very low	195 Å²	195	140.2 Å²	140.2	91%	0.911	79%	0.79	S	S	*	*			trans	-149.9	76.5	155.5	-125.8	179.2	38.3	0	0	112.4
97	S	30.3	Very low	33.5	Very low	129 Å²	129	144.1 Å²	144.1	90%	0.902	81%	0.806	S	S	*	*			trans	-155.6	102.8	161.3	-77.9	0	0	0	0	108.1
98	Q	32.5	Very low	32.7	Very low	176 Å²	176	144.4 Å²	144.4	82%	0.822	82%	0.818	S	S	*	*			trans	-98.5	113.4	177.7	171.1	-175.6	-18	0	0	108
99	D	28.7	Very low	32.3	Very low	117 Å²	117	141 Å²	141	63%	0.626	82%	0.82	S	S	*	*				-170.2	147.9	115.6	-116.7	-36.4	0	0	0	117.2
100	Q	31.8	Very low	32.4	Very low	146 Å²	146	144.7 Å²	144.7	68%	0.682	83%	0.826	S	S	*	*			trans	44.3	122.1	146	-80.5	163.9	79.4	0	0	124.9
101	T	31.3	Very low	32.3	Very low	142 Å²	142	150 Å²	150	87%	0.871	84%	0.835	S	S	*	*			trans	73	142	150.5	67.6	0	0	0	0	119.2
102	G	30.3	Very low	32.1	Very low	67 Å²	67	151.2 Å²	151.2	69%	0.691	84%	0.836	S	S	*	*			cis	167.4	147.9	-12.4	0	0	0	0	0	115.3
103	R	33.2	Very low	32	Very low	246 Å²	246	147 Å²	147	93%	0.928	82%	0.819	S	S	*	*			trans	70	109.2	178.9	-52.2	-179.1	-178.3	-149.2	-1.2	113.7
104	R	33.5	Very low	32.4	Very low	241 Å²	241	150.5 Å²	150.5	91%	0.909	82%	0.815	S	S	*	*				77.9	102.6	70.3	-83.7	-164.4	172.6	-164.3	-0.8	115.2
105	S	31.9	Very low	32.6	Very low	119 Å²	119	151.8 Å²	151.8	83%	0.832	81%	0.813	S	S	*	*				75.4	114.6	116.4	-173.5	0	0	0	0	120.4
106	G	31.5	Very low	33.1	Very low	68 Å²	68	145.6 Å²	145.6	70%	0.701	80%	0.802	S	S	*	*				119.8	126.8	110.2	0	0	0	0	0	116.8
107	N	35.6	Very low	33.5	Very low	177 Å²	177	144 Å²	144	95%	0.947	81%	0.806	S	S	*	*			trans	-63.7	142.7	168.4	-68.1	-2.4	0	0	0	111.5
108	A	31.2	Very low	33.8	Very low	103 Å²	103	141.2 Å²	141.2	85%	0.851	80%	0.797	S	S	*	*			trans	-144.3	132.3	145.6	0	0	0	0	0	108.2
109	G	34.9	Very low	34.2	Very low	70 Å²	70	140.9 Å²	140.9	72%	0.722	80%	0.801	S	S	*	*			trans	-86.1	162.1	178.2	0	0	0	0	0	113
110	E	36.1	Very low	34.8	Very low	191 Å²	191	144.5 Å²	144.5	89%	0.893	81%	0.814	S	S	*	*			trans	39.4	115.4	154	-58.5	-173.6	115.9	0	0	119.5
111	K	35.2	Very low	35.4	Very low	217 Å²	217	148.1 Å²	148.1	94%	0.943	82%	0.822	S	S	*	*				-152.6	155	128.8	-113.6	152.2	-167.5	172.6	0	113.7
112	H	33.1	Very low	36.6	Very low	171 Å²	171	147.4 Å²	147.4	79%	0.792	82%	0.817	S	S	*	*			trans	-91.4	134.4	-169.8	-157.3	70.7	0	0	0	110
113	N	31.6	Very low	37.7	Very low	109 Å²	109	152.7 Å²	152.7	58%	0.583	82%	0.823	S	S	*	*				173.8	128.1	120.5	-95.1	36	0	0	0	113.3
114	E	36.4	Very low	39.3	Very low	151 Å²	151	145.7 Å²	145.7	71%	0.706	80%	0.804	S	S	*	*				63	127.7	129.2	-60	174.5	146.7	0	0	123.2
115	N	34.9	Very low	41.4	Very low	153 Å²	153	137.8 Å²	137.8	82%	0.818	78%	0.783	S	S	*	*			trans	72.4	87.6	142.8	-59.5	-23.4	0	0	0	121.7
116	G	39.9	Very low	43.8	Very low	70 Å²	70	138.7 Å²	138.7	72%	0.722	78%	0.777	S	S	*	*				103.4	137.3	99.1	0	0	0	0	0	121.2
117	V	39.7	Very low	46.3	Very low	161 Å²	161	139.7 Å²	139.7	98%	0.976	77%	0.773	S	S	*	*			trans	74.7	128.8	160.3	-168.9	0	0	0	0	118.1
118	G	36.8	Very low	48.7	Very low	70 Å²	70	135.4 Å²	135.4	72%	0.722	75%	0.748	S	S	*	*			trans	129.4	50.9	153.6	0	0	0	0	0	119.5	Q120	G118-Q120 PolarHBondContact O-N 2.87Å
119	N	39.8	Very low	51.4	Low	169 Å²	169	135.6 Å²	135.6	90%	0.904	73%	0.734	S	S	*	*			trans	-75.2	117.5	168.6	-87.8	-33.8	0	0	0	111.7
120	Q	42.3	Very low	53.9	Low	193 Å²	193	138.2 Å²	138.2	90%	0.902	73%	0.727	S	S	*	*			trans	-93.6	114.2	155.9	-78.5	-173.4	-12.7	0	0	109.2	G118	G118-Q120 PolarHBondContact O-N 2.87Å
121	R	45	Very low	56.5	Low	223 Å²	223	133.5 Å²	133.5	84%	0.842	71%	0.705	S	S	*	*			trans	-88.3	126.9	164.5	-80.8	-160.9	-89	-137.4	0	109.1	E123	R121-E123 PolarHBondContact O-N 2.87Å
122	V	56.5	Low	59	Low	127 Å²	127	127.5 Å²	127.5	77%	0.77	68%	0.682	S	S	*	*			trans	-81.4	107.2	161.4	179.5	0	0	0	0	106.7	L124	V122-L124 HydrophobicContact CG1-CD2 4.48Å; V122-L124 HydrophobicContact CG1-CG 4.47Å; V122-L124 PolarHBondContact O-N 2.83Å
123	E	53.2	Low	61.7	Low	177 Å²	177	121.9 Å²	121.9	83%	0.827	67%	0.665	S	S	*	*			trans	-80.6	102.7	170	-69.8	-170.2	143.8	0	0	108.8	R121	R121-E123 PolarHBondContact O-N 2.87Å
124	L	65.8	Low	64.6	Low	100 Å²	100	119.9 Å²	119.9	52%	0.524	66%	0.657	S	S	.	*			trans	-71.6	130.6	169.6	-67.5	161	0	0	0	108.7	V122 M132	V122-L124 HydrophobicContact CG1-CD2 4.48Å; V122-L124 HydrophobicContact CG1-CG 4.47Å; V122-L124 PolarHBondContact O-N 2.83Å; L124-M132 HydrophobicContact CD1-CE 4.02Å
125	T	78.9	Confident	67.3	Low	75 Å²	75	120.3 Å²	120.3	46%	0.46	65%	0.652	S	S	.	*			trans	-70	155.8	178.2	66.9	0	0	0	0	111	S127 E128 L129	T125-S127 PolarHBondContact O-N 2.8Å; T125-S127 VanDerWaalsContact O-N 3.16Å; T125-E128 VanDerWaalsContact CB-OE2 3.27Å; T125-E128 WeakPolarHBondContact CB-OE2 3.26Å; T125-E128 WeakPolarHBondContact CG2-OE2 3.5Å; T125-E128 PolarHBondContact N-OE2 3.48Å; T125-E128 PolarHBondContact O-N 2.78Å; T125-E128 WeakPolarHBondContact OG1-CG 3.33Å; T125-E128 PolarHBondContact OG1-N 2.85Å; T125-E128 PolarHBondContact OG1-OE2 2.77Å; T125-L129 PolarHBondContact O-N 2.92Å
126	L	80.7	Confident	70.1	Confident	138 Å²	138	118.8 Å²	118.8	72%	0.723	64%	0.64	S	S	*	*	H	α-helix	trans	-58	-30.6	177.5	-173.1	146.8	0	0	0	112.1	Q130	L126-Q130 WeakPolarHBondContact O-CB 3.43Å; L126-Q130 PolarHBondContact O-N 2.84Å
127	S	84.7	Confident	72.7	Confident	88 Å²	88	120 Å²	120	62%	0.615	63%	0.626	S	S	*	*	H	α-helix	trans	-66.1	-45.4	174.3	-166.7	0	0	0	0	112.3	T125 Q130 E131	T125-S127 PolarHBondContact O-N 2.8Å; T125-S127 VanDerWaalsContact O-N 3.16Å; S127-Q130 PolarHBondContact O-N 2.87Å; S127-E131 WeakPolarHBondContact O-CB 3.46Å; S127-E131 PolarHBondContact O-N 2.9Å
128	E	86.6	Confident	75.4	Confident	88 Å²	88	118.4 Å²	118.4	41%	0.411	61%	0.608	S	S	.	*	H	α-helix	trans	-67.4	-38.3	178.9	-69.2	160.7	117.7	0	0	111.4	T125 E131 M132	T125-E128 VanDerWaalsContact CB-OE2 3.27Å; T125-E128 WeakPolarHBondContact CB-OE2 3.26Å; T125-E128 WeakPolarHBondContact CG2-OE2 3.5Å; T125-E128 PolarHBondContact N-OE2 3.48Å; T125-E128 PolarHBondContact O-N 2.78Å; T125-E128 WeakPolarHBondContact OG1-CG 3.33Å; T125-E128 PolarHBondContact OG1-N 2.85Å; T125-E128 PolarHBondContact OG1-OE2 2.77Å; E128-E131 PolarHBondContact O-N 3.23Å; E128-M132 WeakPolarHBondContact O-CG 3.27Å; E128-M132 PolarHBondContact O-N 2.85Å
129	L	86.9	Confident	78.1	Confident	107 Å²	107	120.9 Å²	120.9	56%	0.56	60%	0.601	S	S	*	*	H	α-helix	trans	-63.8	-41.5	174.3	-173.1	60.5	0	0	0	111.8	T125 M132 A133	T125-L129 PolarHBondContact O-N 2.92Å; L129-M132 HydrophobicContact CD1-CE 4.18Å; L129-M132 PolarHBondContact O-N 3.27Å; L129-A133 WeakPolarHBondContact O-CB 3.49Å; L129-A133 PolarHBondContact O-N 3.12Å
130	Q	88.6	Confident	80.7	Confident	124 Å²	124	116.8 Å²	116.8	58%	0.579	58%	0.578	S	S	*	*	H	α-helix	trans	-70.3	-32.9	176.5	-171.5	167.8	-3.2	0	0	112.4	L126 S127 T134	L126-Q130 WeakPolarHBondContact O-CB 3.43Å; L126-Q130 PolarHBondContact O-N 2.84Å; S127-Q130 PolarHBondContact O-N 2.87Å; Q130-T134 WeakPolarHBondContact O-CG2 3.3Å; Q130-T134 PolarHBondContact O-N 3.21Å; Q130-T134 PolarHBondContact O-OG1 2.62Å
131	E	90.4	Very high	83.1	Confident	93 Å²	93	111.3 Å²	111.3	44%	0.435	55%	0.553	S	S	.	*	H	α-helix	trans	-69.8	-41	172.8	-158.1	-171.9	167.3	0	0	111.6	S127 E128 T134 R135	S127-E131 WeakPolarHBondContact O-CB 3.46Å; S127-E131 PolarHBondContact O-N 2.9Å; E128-E131 PolarHBondContact O-N 3.23Å; E131-T134 WeakPolarHBondContact CA-OG1 3.3Å; E131-T134 PolarHBondContact O-N 2.84Å; E131-T134 PolarHBondContact O-OG1 2.92Å; E131-R135 WeakPolarHBondContact O-CB 3.45Å; E131-R135 WeakPolarHBondContact O-CD 3.48Å; E131-R135 WeakPolarHBondContact O-CG 3.26Å; E131-R135 PolarHBondContact O-N 2.95Å; E131-R135 IonicContact OE1-CZ 3.25Å; E131-R135 VanDerWaalsContact OE1-CZ 3.25Å; E131-R135 IonicContact OE1-NE 3.94Å; E131-R135 PolarHBondContact OE1-NE 3.06Å; E131-R135 VanDerWaalsContact OE1-NE 3.1Å; E131-R135 IonicContact OE1-NH2 2.65Å; E131-R135 PolarHBondContact OE1-NH2 2.89Å; E131-R135 IonicContact OE2-NH2 3.9Å
132	M	87.5	Confident	85.5	Confident	91 Å²	91	103.4 Å²	103.4	45%	0.448	54%	0.535	S	S	.	.	H	α-helix	trans	-63.1	-42.8	172.4	-72.9	-168.6	-64	0	0	112.1	L124 E128 L129 R135 Q136	L124-M132 HydrophobicContact CD1-CE 4.02Å; E128-M132 WeakPolarHBondContact O-CG 3.27Å; E128-M132 PolarHBondContact O-N 2.85Å; L129-M132 HydrophobicContact CD1-CE 4.18Å; L129-M132 PolarHBondContact O-N 3.27Å; M132-R135 PolarHBondContact O-N 3.34Å; M132-Q136 WeakPolarHBondContact O-CB 3.41Å; M132-Q136 PolarHBondContact O-N 3.11Å
133	A	90.1	Very high	87.4	Confident	52 Å²	52	103.1 Å²	103.1	43%	0.43	53%	0.525	S	S	.	.	H	α-helix	trans	-62.6	-43.2	177.3	0	0	0	0	0	112.2	L129 Q136 Q137	L129-A133 WeakPolarHBondContact O-CB 3.49Å; L129-A133 PolarHBondContact O-N 3.12Å; A133-Q136 PolarHBondContact O-N 3.24Å; A133-Q137 WeakPolarHBondContact O-CB 3.5Å; A133-Q137 PolarHBondContact O-N 2.84Å
134	T	92.6	Very high	89.3	Confident	68 Å²	68	100.9 Å²	100.9	42%	0.417	51%	0.514	S	S	.	.	H	α-helix	trans	-68.7	-38.9	176.4	48.7	0	0	0	0	112.3	Q130 E131 Q137 H138	Q130-T134 WeakPolarHBondContact O-CG2 3.3Å; Q130-T134 PolarHBondContact O-N 3.21Å; Q130-T134 PolarHBondContact O-OG1 2.62Å; E131-T134 WeakPolarHBondContact CA-OG1 3.3Å; E131-T134 PolarHBondContact O-N 2.84Å; E131-T134 PolarHBondContact O-OG1 2.92Å; T134-Q137 PolarHBondContact O-N 2.93Å; T134-H138 PolarHBondContact O-N 3.34Å; T134-H138 PolarHBondContact O-ND1 2.86Å
135	R	93.2	Very high	90.7	Very high	160 Å²	160	102.7 Å²	102.7	60%	0.604	52%	0.52	S	S	*	.	H	α-helix	trans	-61.8	-41.8	171.9	-71.7	168.3	179.4	-150.3	7	112.1	E131 M132 H138 Q139	E131-R135 WeakPolarHBondContact O-CB 3.45Å; E131-R135 WeakPolarHBondContact O-CD 3.48Å; E131-R135 WeakPolarHBondContact O-CG 3.26Å; E131-R135 PolarHBondContact O-N 2.95Å; E131-R135 IonicContact OE1-CZ 3.25Å; E131-R135 VanDerWaalsContact OE1-CZ 3.25Å; E131-R135 IonicContact OE1-NE 3.94Å; E131-R135 PolarHBondContact OE1-NE 3.06Å; E131-R135 VanDerWaalsContact OE1-NE 3.1Å; E131-R135 IonicContact OE1-NH2 2.65Å; E131-R135 PolarHBondContact OE1-NH2 2.89Å; E131-R135 IonicContact OE2-NH2 3.9Å; M132-R135 PolarHBondContact O-N 3.34Å; R135-H138 PolarHBondContact O-N 2.89Å; R135-Q139 PolarHBondContact O-N 3.09Å
136	Q	93.9	Very high	91.4	Very high	121 Å²	121	104.4 Å²	104.4	57%	0.565	53%	0.525	S	S	*	.	H	α-helix	trans	-63.9	-43.4	175.6	-173.5	178.3	18.8	0	0	111.5	M132 A133 Q139 I140	M132-Q136 WeakPolarHBondContact O-CB 3.41Å; M132-Q136 PolarHBondContact O-N 3.11Å; A133-Q136 PolarHBondContact O-N 3.24Å; Q136-Q139 WeakPolarHBondContact O-CB 3.36Å; Q136-Q139 PolarHBondContact O-N 3.44Å; Q136-Q139 VanDerWaalsContact O-N 3.16Å; Q136-I140 HydrophobicContact CG-CD1 4.11Å; Q136-I140 WeakPolarHBondContact O-CG1 3.3Å; Q136-I140 PolarHBondContact O-N 2.91Å
137	Q	94.1	Very high	92.1	Very high	94 Å²	94	103.3 Å²	103.3	44%	0.439	52%	0.519	S	S	.	.	H	α-helix	trans	-59.8	-48	176.3	-177	61.2	26.5	0	0	111.7	A133 T134 Q139 I140 E141	A133-Q137 WeakPolarHBondContact O-CB 3.5Å; A133-Q137 PolarHBondContact O-N 2.84Å; T134-Q137 PolarHBondContact O-N 2.93Å; Q137-Q139 VanDerWaalsContact C-N 3.26Å; Q137-Q139 PolarHBondContact O-N 3.24Å; Q137-I140 PolarHBondContact O-N 2.86Å; Q137-E141 WeakPolarHBondContact CG-OE1 3.47Å; Q137-E141 PolarHBondContact NE2-OE1 3.21Å; Q137-E141 WeakPolarHBondContact O-CG 3.42Å; Q137-E141 PolarHBondContact O-N 2.65Å
138	H	95	Very high	92.6	Very high	128 Å²	128	102.3 Å²	102.3	59%	0.593	51%	0.509	S	S	*	.	H	α-helix	trans	-60.3	-35.2	174.8	-75.4	79.9	0	0	0	112.4	T134 R135 A142	T134-H138 PolarHBondContact O-N 3.34Å; T134-H138 PolarHBondContact O-ND1 2.86Å; R135-H138 PolarHBondContact O-N 2.89Å; H138-A142 VanDerWaalsContact O-CB 3.3Å; H138-A142 WeakPolarHBondContact O-CB 3.49Å; H138-A142 PolarHBondContact O-N 3.41Å
139	Q	94.1	Very high	93	Very high	123 Å²	123	100.8 Å²	100.8	58%	0.575	51%	0.511	S	S	*	.	H	α-helix	trans	-69	-38.7	176.8	-168.4	175.7	18	0	0	112.2	R135 Q136 Q137 Q143	R135-Q139 PolarHBondContact O-N 3.09Å; Q136-Q139 WeakPolarHBondContact O-CB 3.36Å; Q136-Q139 PolarHBondContact O-N 3.44Å; Q136-Q139 VanDerWaalsContact O-N 3.16Å; Q137-Q139 VanDerWaalsContact C-N 3.26Å; Q137-Q139 PolarHBondContact O-N 3.24Å; Q139-Q143 WeakPolarHBondContact O-CG 3.4Å; Q139-Q143 PolarHBondContact O-N 3.09Å
140	I	93.8	Very high	93.3	Very high	83 Å²	83	102 Å²	102	43%	0.426	51%	0.512	S	S	.	.	H	α-helix	trans	-65.4	-45.8	174.2	-68.2	164.4	0	0	0	110.4	Q136 Q137 Q143 Q144	Q136-I140 HydrophobicContact CG-CD1 4.11Å; Q136-I140 WeakPolarHBondContact O-CG1 3.3Å; Q136-I140 PolarHBondContact O-N 2.91Å; Q137-I140 PolarHBondContact O-N 2.86Å; I140-Q143 PolarHBondContact O-N 3.27Å; I140-Q144 WeakPolarHBondContact O-CB 3.38Å; I140-Q144 PolarHBondContact O-N 3.08Å
141	E	94.5	Very high	93.6	Very high	78 Å²	78	99.9 Å²	99.9	36%	0.364	50%	0.502	S	S	.	.	H	α-helix	trans	-62.6	-43	177.8	-72.6	171	-168.4	0	0	112	Q137 Q143 Q144 Q145	Q137-E141 WeakPolarHBondContact CG-OE1 3.47Å; Q137-E141 PolarHBondContact NE2-OE1 3.21Å; Q137-E141 WeakPolarHBondContact O-CG 3.42Å; Q137-E141 PolarHBondContact O-N 2.65Å; E141-Q143 PolarHBondContact O-N 2.89Å; E141-Q144 PolarHBondContact O-N 3.01Å; E141-Q145 WeakPolarHBondContact O-CG 3.05Å; E141-Q145 PolarHBondContact O-N 3.26Å
142	A	95.1	Very high	93.8	Very high	56 Å²	56	101.5 Å²	101.5	46%	0.463	51%	0.51	S	S	.	.	H	α-helix	trans	-63.3	-38.4	174.9	0	0	0	0	0	112.7	H138 M146	H138-A142 VanDerWaalsContact O-CB 3.3Å; H138-A142 WeakPolarHBondContact O-CB 3.49Å; H138-A142 PolarHBondContact O-N 3.41Å; A142-M146 PolarHBondContact O-N 3.14Å; A142-M146 VanDerWaalsContact O-N 3.11Å
143	Q	94.9	Very high	94	Very high	121 Å²	121	104.1 Å²	104.1	57%	0.565	52%	0.515	S	S	*	.	H	α-helix	trans	-66.5	-41.3	173	-75.1	-179.5	7	0	0	111.8	Q139 I140 E141 M146 L147	Q139-Q143 WeakPolarHBondContact O-CG 3.4Å; Q139-Q143 PolarHBondContact O-N 3.09Å; I140-Q143 PolarHBondContact O-N 3.27Å; E141-Q143 PolarHBondContact O-N 2.89Å; Q143-M146 PolarHBondContact O-N 3.45Å; Q143-L147 WeakPolarHBondContact O-CB 3.33Å; Q143-L147 PolarHBondContact O-N 3.47Å
144	Q	94.1	Very high	94.1	Very high	130 Å²	130	107 Å²	107	61%	0.607	52%	0.522	S	S	*	.	H	α-helix	trans	-64.5	-43.7	178	-172.4	173.6	79.9	0	0	111.7	I140 E141 M146 L147 V148	I140-Q144 WeakPolarHBondContact O-CB 3.38Å; I140-Q144 PolarHBondContact O-N 3.08Å; E141-Q144 PolarHBondContact O-N 3.01Å; Q144-M146 VanDerWaalsContact C-N 3.35Å; Q144-M146 PolarHBondContact O-N 3.14Å; Q144-L147 PolarHBondContact O-N 2.9Å; Q144-L147 VanDerWaalsContact O-N 3.16Å; Q144-V148 WeakPolarHBondContact O-CG2 3.38Å; Q144-V148 PolarHBondContact O-N 2.94Å
145	Q	95.2	Very high	94.1	Very high	139 Å²	139	111.8 Å²	111.8	65%	0.65	53%	0.533	S	S	*	.	H	α-helix	trans	-59.7	-43.3	173.4	-71.3	176.8	17	0	0	111.9	E141 L147 V148 A149	E141-Q145 WeakPolarHBondContact O-CG 3.05Å; E141-Q145 PolarHBondContact O-N 3.26Å; Q145-L147 VanDerWaalsContact C-N 3.31Å; Q145-L147 PolarHBondContact O-N 3.43Å; Q145-V148 PolarHBondContact O-N 3.12Å; Q145-A149 WeakPolarHBondContact O-CB 3.4Å; Q145-A149 PolarHBondContact O-N 2.87Å
146	M	94.4	Very high	94.2	Very high	111 Å²	111	110.4 Å²	110.4	55%	0.547	53%	0.528	S	S	.	.	H	α-helix	trans	-63	-37.5	175	-170.3	-169	-63	0	0	112.1	A142 Q143 Q144 K150	A142-M146 PolarHBondContact O-N 3.14Å; A142-M146 VanDerWaalsContact O-N 3.11Å; Q143-M146 PolarHBondContact O-N 3.45Å; Q144-M146 VanDerWaalsContact C-N 3.35Å; Q144-M146 PolarHBondContact O-N 3.14Å; M146-K150 HydrophobicContact CG-CD 4.27Å; M146-K150 WeakPolarHBondContact O-CB 3.28Å; M146-K150 VanDerWaalsContact O-CG 3.32Å; M146-K150 WeakPolarHBondContact O-CG 3.45Å; M146-K150 PolarHBondContact O-N 2.9Å; M146-K150 PolarHBondContact SD-NZ 2.92Å; M146-K150 VanDerWaalsContact SD-NZ 3.38Å
147	L	94.4	Very high	94	Very high	114 Å²	114	108.2 Å²	108.2	60%	0.597	52%	0.52	S	S	*	.	H	α-helix	trans	-68.5	-45	179.1	-162	155.3	0	0	0	111	Q143 Q144 Q145 A149 K150 E151	Q143-L147 WeakPolarHBondContact O-CB 3.33Å; Q143-L147 PolarHBondContact O-N 3.47Å; Q144-L147 PolarHBondContact O-N 2.9Å; Q144-L147 VanDerWaalsContact O-N 3.16Å; Q145-L147 VanDerWaalsContact C-N 3.31Å; Q145-L147 PolarHBondContact O-N 3.43Å; L147-A149 PolarHBondContact O-N 3.03Å; L147-K150 PolarHBondContact O-N 2.95Å; L147-E151 WeakPolarHBondContact O-CB 3.47Å; L147-E151 PolarHBondContact O-N 3.47Å
148	V	96.1	Very high	93.7	Very high	67 Å²	67	110 Å²	110	41%	0.406	53%	0.527	S	S	.	.	H	α-helix	trans	-59.4	-44.2	173.6	172.4	0	0	0	0	111.4	Q144 Q145 K150 E151 Q152	Q144-V148 WeakPolarHBondContact O-CG2 3.38Å; Q144-V148 PolarHBondContact O-N 2.94Å; Q145-V148 PolarHBondContact O-N 3.12Å; V148-K150 PolarHBondContact O-N 3.23Å; V148-E151 PolarHBondContact O-N 2.99Å; V148-Q152 WeakPolarHBondContact O-CG 3.13Å; V148-Q152 PolarHBondContact O-N 2.93Å
149	A	94.1	Very high	93.6	Very high	56 Å²	56	109.3 Å²	109.3	46%	0.463	52%	0.524	S	S	.	.	H	α-helix	trans	-63.3	-39.9	176.8	0	0	0	0	0	112.6	Q145 L147 R153	Q145-A149 WeakPolarHBondContact O-CB 3.4Å; Q145-A149 PolarHBondContact O-N 2.87Å; L147-A149 PolarHBondContact O-N 3.03Å; A149-R153 PolarHBondContact O-N 3.44Å; A149-R153 VanDerWaalsContact O-N 3.08Å
150	K	93.4	Very high	93.3	Very high	133 Å²	133	107.4 Å²	107.4	58%	0.578	52%	0.515	S	S	*	.	H	α-helix	trans	-64.8	-41.3	173.2	-77.2	170.8	176.2	173.8	0	111.9	M146 L147 V148 R153 L154	M146-K150 HydrophobicContact CG-CD 4.27Å; M146-K150 WeakPolarHBondContact O-CB 3.28Å; M146-K150 VanDerWaalsContact O-CG 3.32Å; M146-K150 WeakPolarHBondContact O-CG 3.45Å; M146-K150 PolarHBondContact O-N 2.9Å; M146-K150 PolarHBondContact SD-NZ 2.92Å; M146-K150 VanDerWaalsContact SD-NZ 3.38Å; L147-K150 PolarHBondContact O-N 2.95Å; V148-K150 PolarHBondContact O-N 3.23Å; K150-R153 PolarHBondContact O-N 2.94Å; K150-L154 WeakPolarHBondContact O-CB 3.39Å; K150-L154 PolarHBondContact O-N 2.84Å
151	E	94.1	Very high	93	Very high	79 Å²	79	108.1 Å²	108.1	37%	0.369	52%	0.516	S	S	.	.	H	α-helix	trans	-65.5	-44.6	178.7	-156.5	-153	145.7	0	0	111.6	L147 V148 R153 L154 R155	L147-E151 WeakPolarHBondContact O-CB 3.47Å; L147-E151 PolarHBondContact O-N 3.47Å; V148-E151 PolarHBondContact O-N 2.99Å; E151-R153 VanDerWaalsContact C-N 3.31Å; E151-R153 PolarHBondContact O-N 3Å; E151-L154 PolarHBondContact O-N 3.22Å; E151-R155 WeakPolarHBondContact O-CG 3.43Å; E151-R155 PolarHBondContact O-N 3.14Å; E151-R155 IonicContact OE1-CZ 2.67Å; E151-R155 IonicContact OE1-NE 2.86Å; E151-R155 PolarHBondContact OE1-NE 2.92Å; E151-R155 IonicContact OE1-NH2 2.95Å; E151-R155 PolarHBondContact OE1-NH2 2.81Å
152	Q	94.5	Very high	92.5	Very high	128 Å²	128	112.9 Å²	112.9	60%	0.598	53%	0.531	S	S	*	.	H	α-helix	trans	-58.8	-42.5	173.7	-71.7	177.5	3.9	0	0	111.7	V148 R155 Y156	V148-Q152 WeakPolarHBondContact O-CG 3.13Å; V148-Q152 PolarHBondContact O-N 2.93Å; Q152-R155 PolarHBondContact O-N 3.35Å; Q152-Y156 PolarHBondContact O-N 3.46Å
153	R	93.2	Very high	92	Very high	146 Å²	146	118.8 Å²	118.8	55%	0.551	54%	0.541	S	S	*	.	H	α-helix	trans	-64.6	-39.6	175.6	-176.6	57.4	178.7	176.6	2.4	112.4	A149 K150 E151 Y156 L157	A149-R153 PolarHBondContact O-N 3.44Å; A149-R153 VanDerWaalsContact O-N 3.08Å; K150-R153 PolarHBondContact O-N 2.94Å; E151-R153 VanDerWaalsContact C-N 3.31Å; E151-R153 PolarHBondContact O-N 3Å; R153-Y156 PolarHBondContact O-N 2.92Å; R153-L157 HydrophobicContact CG-CD1 4.21Å; R153-L157 WeakPolarHBondContact O-CG 3.25Å; R153-L157 PolarHBondContact O-N 3.22Å
154	L	92.4	Very high	91.3	Very high	113 Å²	113	118.7 Å²	118.7	59%	0.592	54%	0.54	S	S	*	.	H	α-helix	trans	-66	-43.2	176.2	-177.7	61.6	0	0	0	111.7	K150 E151 Y156 L157 K158	K150-L154 WeakPolarHBondContact O-CB 3.39Å; K150-L154 PolarHBondContact O-N 2.84Å; E151-L154 PolarHBondContact O-N 3.22Å; L154-Y156 VanDerWaalsContact C-N 3.33Å; L154-Y156 PolarHBondContact O-N 3.41Å; L154-L157 PolarHBondContact O-N 2.8Å; L154-K158 WeakPolarHBondContact O-CB 3.45Å; L154-K158 PolarHBondContact O-N 3.42Å
155	R	92.4	Very high	90.6	Very high	168 Å²	168	117.8 Å²	117.8	63%	0.634	54%	0.536	S	S	*	.	H	α-helix	trans	-57.9	-44	174.3	-72	176.3	-178.8	-146.7	7.1	111.5	E151 Q152 Q159	E151-R155 WeakPolarHBondContact O-CG 3.43Å; E151-R155 PolarHBondContact O-N 3.14Å; E151-R155 IonicContact OE1-CZ 2.67Å; E151-R155 IonicContact OE1-NE 2.86Å; E151-R155 PolarHBondContact OE1-NE 2.92Å; E151-R155 IonicContact OE1-NH2 2.95Å; E151-R155 PolarHBondContact OE1-NH2 2.81Å; Q152-R155 PolarHBondContact O-N 3.35Å; R155-Q159 PolarHBondContact O-N 3.39Å; R155-Q159 VanDerWaalsContact O-N 3.09Å
156	Y	93.8	Very high	90.1	Very high	130 Å²	130	116.8 Å²	116.8	51%	0.51	53%	0.532	S	S	.	.	H	α-helix	trans	-61.8	-49.3	175.3	-179.4	-89.1	0	0	0	112.2	Q152 R153 L154 K158 Q159 Q160	Q152-Y156 PolarHBondContact O-N 3.46Å; R153-Y156 PolarHBondContact O-N 2.92Å; L154-Y156 VanDerWaalsContact C-N 3.33Å; L154-Y156 PolarHBondContact O-N 3.41Å; Y156-K158 PolarHBondContact O-N 3.49Å; Y156-Q159 WeakPolarHBondContact O-CB 3.37Å; Y156-Q159 PolarHBondContact O-N 3.08Å; Y156-Q159 VanDerWaalsContact O-N 3.14Å; Y156-Q160 PolarHBondContact O-N 3.01Å
157	L	90.3	Very high	89.5	Confident	75 Å²	75	115.6 Å²	115.6	39%	0.393	53%	0.531	S	S	.	.	H	α-helix	trans	-61.9	-42.9	179.7	-71.3	170.2	0	0	0	111.8	R153 L154 Q159 Q160 E161	R153-L157 HydrophobicContact CG-CD1 4.21Å; R153-L157 WeakPolarHBondContact O-CG 3.25Å; R153-L157 PolarHBondContact O-N 3.22Å; L154-L157 PolarHBondContact O-N 2.8Å; L157-Q159 VanDerWaalsContact C-N 3.26Å; L157-Q159 PolarHBondContact O-N 2.88Å; L157-Q160 WeakPolarHBondContact O-CB 3.41Å; L157-Q160 PolarHBondContact O-N 3.27Å; L157-Q160 VanDerWaalsContact O-N 3.16Å; L157-E161 WeakPolarHBondContact O-CB 3.26Å; L157-E161 PolarHBondContact O-N 3.44Å
158	K	89	Confident	88.8	Confident	133 Å²	133	113.7 Å²	113.7	58%	0.578	52%	0.523	S	S	*	.	H	α-helix	trans	-66.9	-24.1	176.4	-166.3	165.5	-173	168.1	0	113.3	L154 Y156 R162	L154-K158 WeakPolarHBondContact O-CB 3.45Å; L154-K158 PolarHBondContact O-N 3.42Å; Y156-K158 PolarHBondContact O-N 3.49Å; K158-R162 PolarHBondContact O-N 2.72Å
159	Q	91.3	Very high	88.1	Confident	113 Å²	113	112.3 Å²	112.3	53%	0.528	52%	0.517	S	S	.	.	H	α-helix	trans	-78.1	-39.2	170.9	-166.3	-178	29.1	0	0	111.9	R155 Y156 L157 R163	R155-Q159 PolarHBondContact O-N 3.39Å; R155-Q159 VanDerWaalsContact O-N 3.09Å; Y156-Q159 WeakPolarHBondContact O-CB 3.37Å; Y156-Q159 PolarHBondContact O-N 3.08Å; Y156-Q159 VanDerWaalsContact O-N 3.14Å; L157-Q159 VanDerWaalsContact C-N 3.26Å; L157-Q159 PolarHBondContact O-N 2.88Å; Q159-R163 PolarHBondContact O-N 3.3Å
160	Q	88.4	Confident	87.7	Confident	83 Å²	83	113.7 Å²	113.7	39%	0.388	51%	0.514	S	S	.	.	H	α-helix	trans	-64.8	-43.4	174.5	-176.8	177.4	-5.5	0	0	111.6	Y156 L157 R163 Q164	Y156-Q160 PolarHBondContact O-N 3.01Å; L157-Q160 WeakPolarHBondContact O-CB 3.41Å; L157-Q160 PolarHBondContact O-N 3.27Å; L157-Q160 VanDerWaalsContact O-N 3.16Å; Q160-R163 PolarHBondContact O-N 2.69Å; Q160-Q164 PolarHBondContact O-N 2.92Å
161	E	87.6	Confident	87.2	Confident	98 Å²	98	110.5 Å²	110.5	46%	0.458	51%	0.508	S	S	.	.	H	α-helix	trans	-58.4	-50.3	175	178.7	179.6	-142	0	0	111.8	L157 R163 Q164 Q165	L157-E161 WeakPolarHBondContact O-CB 3.26Å; L157-E161 PolarHBondContact O-N 3.44Å; E161-R163 VanDerWaalsContact C-N 3.27Å; E161-R163 PolarHBondContact O-N 2.93Å; E161-Q164 PolarHBondContact O-N 3.1Å; E161-Q165 HydrophobicContact CG-CG 4.43Å; E161-Q165 WeakPolarHBondContact O-CG 3.06Å; E161-Q165 PolarHBondContact O-N 2.96Å
162	R	84	Confident	86.9	Confident	177 Å²	177	110.6 Å²	110.6	67%	0.668	51%	0.509	S	S	*	.	H	α-helix	trans	-59.1	-36.6	176.4	-90.6	-160	-73.1	-172.2	-2.7	113	K158 Q166	K158-R162 PolarHBondContact O-N 2.72Å; R162-Q166 WeakPolarHBondContact O-CB 3.46Å; R162-Q166 PolarHBondContact O-N 3.09Å
163	R	83.8	Confident	86.6	Confident	180 Å²	180	110.7 Å²	110.7	68%	0.679	51%	0.507	S	S	*	.	H	α-helix	trans	-65.2	-42.3	173.8	-72.6	-176.3	179.2	-136.2	1.8	111.6	Q159 Q160 E161 T167	Q159-R163 PolarHBondContact O-N 3.3Å; Q160-R163 PolarHBondContact O-N 2.69Å; E161-R163 VanDerWaalsContact C-N 3.27Å; E161-R163 PolarHBondContact O-N 2.93Å; R163-T167 WeakPolarHBondContact O-CG2 3.43Å; R163-T167 PolarHBondContact O-N 3.15Å; R163-T167 VanDerWaalsContact O-N 3.1Å; R163-T167 PolarHBondContact O-OG1 3.43Å
164	Q	81.1	Confident	86.5	Confident	119 Å²	119	109.3 Å²	109.3	56%	0.556	51%	0.51	S	S	*	.	H	α-helix	trans	-63.7	-51	175.5	-74.7	-173.3	-16.3	0	0	111.8	Q160 E161 Q166 T167 V168	Q160-Q164 PolarHBondContact O-N 2.92Å; E161-Q164 PolarHBondContact O-N 3.1Å; Q164-Q166 VanDerWaalsContact C-N 3.28Å; Q164-Q166 PolarHBondContact O-N 3.35Å; Q164-T167 WeakPolarHBondContact CA-OG1 3.32Å; Q164-T167 PolarHBondContact O-N 3Å; Q164-T167 VanDerWaalsContact O-N 3.09Å; Q164-T167 PolarHBondContact O-OG1 3.4Å; Q164-V168 WeakPolarHBondContact O-CG2 3.36Å; Q164-V168 PolarHBondContact O-N 3.23Å
165	Q	79.8	Confident	86.3	Confident	112 Å²	112	109.4 Å²	109.4	52%	0.523	51%	0.507	S	S	.	.	H	α-helix	trans	-54.8	-42.3	177.2	-72.1	176.7	-6.6	0	0	112.1	E161 V168 S169	E161-Q165 HydrophobicContact CG-CG 4.43Å; E161-Q165 WeakPolarHBondContact O-CG 3.06Å; E161-Q165 PolarHBondContact O-N 2.96Å; Q165-V168 PolarHBondContact O-N 2.87Å; Q165-S169 WeakPolarHBondContact O-CB 3.28Å; Q165-S169 PolarHBondContact O-N 2.88Å
166	Q	83.9	Confident	86.1	Confident	118 Å²	118	108.5 Å²	108.5	55%	0.551	50%	0.504	S	S	*	.	H	α-helix	trans	-61.1	-52	174.8	-177.7	171.6	-8.1	0	0	111.5	R162 Q164 V168 S169 E170	R162-Q166 WeakPolarHBondContact O-CB 3.46Å; R162-Q166 PolarHBondContact O-N 3.09Å; Q164-Q166 VanDerWaalsContact C-N 3.28Å; Q164-Q166 PolarHBondContact O-N 3.35Å; Q166-V168 VanDerWaalsContact C-N 3.31Å; Q166-V168 PolarHBondContact O-N 3.29Å; Q166-S169 PolarHBondContact O-N 3.44Å; Q166-S169 VanDerWaalsContact O-N 3.12Å; Q166-S169 PolarHBondContact O-OG 2.93Å; Q166-E170 VanDerWaalsContact CG-OE1 3.23Å; Q166-E170 WeakPolarHBondContact CG-OE1 3.28Å; Q166-E170 PolarHBondContact NE2-OE1 3.18Å; Q166-E170 WeakPolarHBondContact O-CG 3.2Å; Q166-E170 PolarHBondContact O-N 3.06Å
167	T	82	Confident	86	Confident	85 Å²	85	106.4 Å²	106.4	52%	0.521	50%	0.501	S	S	.	.	H	α-helix	trans	-62.1	-34	180	54.9	0	0	0	0	113.7	R163 Q164 S171	R163-T167 WeakPolarHBondContact O-CG2 3.43Å; R163-T167 PolarHBondContact O-N 3.15Å; R163-T167 VanDerWaalsContact O-N 3.1Å; R163-T167 PolarHBondContact O-OG1 3.43Å; Q164-T167 WeakPolarHBondContact CA-OG1 3.32Å; Q164-T167 PolarHBondContact O-N 3Å; Q164-T167 VanDerWaalsContact O-N 3.09Å; Q164-T167 PolarHBondContact O-OG1 3.4Å; T167-S171 WeakPolarHBondContact O-CB 3.34Å; T167-S171 PolarHBondContact O-N 2.94Å; T167-S171 PolarHBondContact O-OG 3.12Å
168	V	79.6	Confident	86	Confident	74 Å²	74	108.8 Å²	108.8	45%	0.448	51%	0.508	S	S	.	.	H	α-helix	trans	-66.7	-47.5	172.3	173.5	0	0	0	0	110.3	Q164 Q165 Q166 E170 S171 E172	Q164-V168 WeakPolarHBondContact O-CG2 3.36Å; Q164-V168 PolarHBondContact O-N 3.23Å; Q165-V168 PolarHBondContact O-N 2.87Å; Q166-V168 VanDerWaalsContact C-N 3.31Å; Q166-V168 PolarHBondContact O-N 3.29Å; V168-E170 PolarHBondContact O-N 3.4Å; V168-S171 PolarHBondContact O-N 3.03Å; V168-S171 PolarHBondContact O-OG 3.41Å; V168-E172 WeakPolarHBondContact O-CG 3.41Å; V168-E172 PolarHBondContact O-N 3.35Å
169	S	82.1	Confident	86.1	Confident	38 Å²	38	107.2 Å²	107.2	27%	0.266	50%	0.503	S	S	.	.	H	α-helix	trans	-61.7	-31	178.3	88.1	0	0	0	0	112.9	Q165 Q166 K173	Q165-S169 WeakPolarHBondContact O-CB 3.28Å; Q165-S169 PolarHBondContact O-N 2.88Å; Q166-S169 PolarHBondContact O-N 3.44Å; Q166-S169 VanDerWaalsContact O-N 3.12Å; Q166-S169 PolarHBondContact O-OG 2.93Å; S169-K173 WeakPolarHBondContact O-CD 3.46Å; S169-K173 WeakPolarHBondContact O-CE 3.4Å; S169-K173 WeakPolarHBondContact O-CG 3.39Å; S169-K173 PolarHBondContact O-N 3.1Å; S169-K173 PolarHBondContact OG-NZ 3.34Å; S169-K173 VanDerWaalsContact OG-NZ 3.09Å
170	E	85.6	Confident	86.1	Confident	86 Å²	86	109.2 Å²	109.2	40%	0.402	51%	0.506	S	S	.	.	H	α-helix	trans	-77.2	-39.4	177	-73.6	173	-167.1	0	0	111.7	Q166 V168 K173 L174	Q166-E170 VanDerWaalsContact CG-OE1 3.23Å; Q166-E170 WeakPolarHBondContact CG-OE1 3.28Å; Q166-E170 PolarHBondContact NE2-OE1 3.18Å; Q166-E170 WeakPolarHBondContact O-CG 3.2Å; Q166-E170 PolarHBondContact O-N 3.06Å; V168-E170 PolarHBondContact O-N 3.4Å; E170-K173 PolarHBondContact O-N 2.89Å; E170-L174 WeakPolarHBondContact O-CB 3.22Å; E170-L174 WeakPolarHBondContact O-CG 3.44Å; E170-L174 PolarHBondContact O-N 3.26Å
171	S	82.9	Confident	86.4	Confident	65 Å²	65	108.4 Å²	108.4	46%	0.455	51%	0.506	S	S	.	.	H	α-helix	trans	-65.7	-38.9	174.5	72.3	0	0	0	0	112.2	T167 V168 L174 Q175	T167-S171 WeakPolarHBondContact O-CB 3.34Å; T167-S171 PolarHBondContact O-N 2.94Å; T167-S171 PolarHBondContact O-OG 3.12Å; V168-S171 PolarHBondContact O-N 3.03Å; V168-S171 PolarHBondContact O-OG 3.41Å; S171-L174 PolarHBondContact O-N 2.86Å; S171-Q175 WeakPolarHBondContact O-CB 3.49Å; S171-Q175 PolarHBondContact O-N 3.42Å
172	E	87.9	Confident	86.6	Confident	82 Å²	82	108.3 Å²	108.3	38%	0.383	51%	0.506	S	S	.	.	H	α-helix	trans	-62.7	-43.9	172.3	-74.1	-175.4	-156.1	0	0	112.6	V168 L174 Q175 R176	V168-E172 WeakPolarHBondContact O-CG 3.41Å; V168-E172 PolarHBondContact O-N 3.35Å; E172-L174 VanDerWaalsContact C-N 3.31Å; E172-L174 PolarHBondContact O-N 2.95Å; E172-Q175 PolarHBondContact O-N 3.08Å; E172-R176 WeakPolarHBondContact O-CB 3.29Å; E172-R176 VanDerWaalsContact O-CG 3.29Å; E172-R176 WeakPolarHBondContact O-CG 3.23Å; E172-R176 PolarHBondContact O-N 3.32Å; E172-R176 IonicContact OE2-CZ 3.28Å; E172-R176 IonicContact OE2-NH2 3.87Å; E172-R176 PolarHBondContact OE2-NH2 3.33Å
173	K	87.9	Confident	86.9	Confident	129 Å²	129	102.4 Å²	102.4	56%	0.561	49%	0.492	S	S	*	.	H	α-helix	trans	-61.8	-40	176.1	-72.9	159.6	-165.1	154.5	0	111.2	S169 E170 L177	S169-K173 WeakPolarHBondContact O-CD 3.46Å; S169-K173 WeakPolarHBondContact O-CE 3.4Å; S169-K173 WeakPolarHBondContact O-CG 3.39Å; S169-K173 PolarHBondContact O-N 3.1Å; S169-K173 PolarHBondContact OG-NZ 3.34Å; S169-K173 VanDerWaalsContact OG-NZ 3.09Å; E170-K173 PolarHBondContact O-N 2.89Å; K173-L177 WeakPolarHBondContact O-CB 3.38Å; K173-L177 PolarHBondContact O-N 3.05Å
174	L	89.7	Confident	87.2	Confident	117 Å²	117	100.1 Å²	100.1	61%	0.613	49%	0.489	S	S	*	.	H	α-helix	trans	-66.9	-41.9	175	-77.1	164.6	0	0	0	112.2	E170 S171 E172 L177 K178	E170-L174 WeakPolarHBondContact O-CB 3.22Å; E170-L174 WeakPolarHBondContact O-CG 3.44Å; E170-L174 PolarHBondContact O-N 3.26Å; S171-L174 PolarHBondContact O-N 2.86Å; E172-L174 VanDerWaalsContact C-N 3.31Å; E172-L174 PolarHBondContact O-N 2.95Å; L174-L177 WeakPolarHBondContact O-CB 3.42Å; L174-L177 PolarHBondContact O-N 3.42Å; L174-K178 WeakPolarHBondContact O-CB 3.49Å; L174-K178 PolarHBondContact O-N 3.28Å
175	Q	89.3	Confident	87.7	Confident	115 Å²	115	100.6 Å²	100.6	54%	0.537	49%	0.491	S	S	.	.	H	α-helix	trans	-62.4	-50.5	175.2	177.8	171.5	-19.3	0	0	111.3	S171 E172 L177 K178 E179	S171-Q175 WeakPolarHBondContact O-CB 3.49Å; S171-Q175 PolarHBondContact O-N 3.42Å; E172-Q175 PolarHBondContact O-N 3.08Å; Q175-L177 PolarHBondContact O-N 2.98Å; Q175-L177 VanDerWaalsContact O-N 3.15Å; Q175-K178 PolarHBondContact O-N 3.42Å; Q175-E179 HydrophobicContact CG-CG 4.35Å; Q175-E179 WeakPolarHBondContact CG-OE1 3.4Å; Q175-E179 PolarHBondContact NE2-OE1 3.38Å; Q175-E179 WeakPolarHBondContact O-CG 3.23Å; Q175-E179 PolarHBondContact O-N 2.87Å
176	R	88.5	Confident	88.2	Confident	150 Å²	150	98.2 Å²	98.2	57%	0.566	49%	0.49	S	S	*	.	H	α-helix	trans	-63.2	-19.3	176	-65	176.1	-159.6	-178.4	8.7	113.2	E172 R180	E172-R176 WeakPolarHBondContact O-CB 3.29Å; E172-R176 VanDerWaalsContact O-CG 3.29Å; E172-R176 WeakPolarHBondContact O-CG 3.23Å; E172-R176 PolarHBondContact O-N 3.32Å; E172-R176 IonicContact OE2-CZ 3.28Å; E172-R176 IonicContact OE2-NH2 3.87Å; E172-R176 PolarHBondContact OE2-NH2 3.33Å; R176-R180 WeakPolarHBondContact O-CG 3.37Å; R176-R180 PolarHBondContact O-NE 2.92Å
177	L	91.1	Very high	88.5	Confident	85 Å²	85	98.4 Å²	98.4	45%	0.445	49%	0.489	S	S	.	.	H	α-helix	trans	-79.9	-46.9	169.5	-177.3	61.6	0	0	0	111.2	K173 L174 Q175 E179 R180 V181	K173-L177 WeakPolarHBondContact O-CB 3.38Å; K173-L177 PolarHBondContact O-N 3.05Å; L174-L177 WeakPolarHBondContact O-CB 3.42Å; L174-L177 PolarHBondContact O-N 3.42Å; Q175-L177 PolarHBondContact O-N 2.98Å; Q175-L177 VanDerWaalsContact O-N 3.15Å; L177-E179 PolarHBondContact O-N 3Å; L177-R180 PolarHBondContact O-N 2.96Å; L177-V181 WeakPolarHBondContact O-CG2 3.48Å; L177-V181 PolarHBondContact O-N 3.04Å
178	K	90	Very high	89	Confident	126 Å²	126	98.2 Å²	98.2	55%	0.548	49%	0.485	S	S	.	.	H	α-helix	trans	-59.4	-45.5	178	-176.5	173.6	177.7	-67.7	0	112.2	L174 Q175 R180 V181 E182	L174-K178 WeakPolarHBondContact O-CB 3.49Å; L174-K178 PolarHBondContact O-N 3.28Å; Q175-K178 PolarHBondContact O-N 3.42Å; K178-R180 VanDerWaalsContact C-N 3.31Å; K178-R180 PolarHBondContact O-N 2.99Å; K178-V181 PolarHBondContact O-N 3.12Å; K178-V181 VanDerWaalsContact O-N 3.16Å; K178-E182 WeakPolarHBondContact CE-OE1 3.48Å; K178-E182 IonicContact NZ-OE1 2.78Å; K178-E182 PolarHBondContact NZ-OE1 3.39Å; K178-E182 IonicContact NZ-OE2 3.1Å; K178-E182 PolarHBondContact O-N 2.91Å
179	E	91.5	Very high	89.6	Confident	100 Å²	100	102.4 Å²	102.4	47%	0.467	50%	0.497	S	S	.	.	H	α-helix	trans	-61	-37.4	176.1	-70.5	166.7	178	0	0	112.4	Q175 L177 S183	Q175-E179 HydrophobicContact CG-CG 4.35Å; Q175-E179 WeakPolarHBondContact CG-OE1 3.4Å; Q175-E179 PolarHBondContact NE2-OE1 3.38Å; Q175-E179 WeakPolarHBondContact O-CG 3.23Å; Q175-E179 PolarHBondContact O-N 2.87Å; L177-E179 PolarHBondContact O-N 3Å; E179-S183 VanDerWaalsContact O-CB 3.27Å; E179-S183 WeakPolarHBondContact O-CB 3.45Å; E179-S183 PolarHBondContact O-N 2.8Å
180	R	91.7	Very high	90	Very high	154 Å²	154	107.1 Å²	107.1	58%	0.581	51%	0.513	S	S	*	.	H	α-helix	trans	-68.5	-38.6	174.3	-76.5	-175.6	-65.2	156.3	0.9	112.3	R176 L177 K178 Q184	R176-R180 WeakPolarHBondContact O-CG 3.37Å; R176-R180 PolarHBondContact O-NE 2.92Å; L177-R180 PolarHBondContact O-N 2.96Å; K178-R180 VanDerWaalsContact C-N 3.31Å; K178-R180 PolarHBondContact O-N 2.99Å; R180-Q184 WeakPolarHBondContact O-CG 3.26Å; R180-Q184 PolarHBondContact O-N 3.45Å
181	V	94.6	Very high	90.2	Very high	67 Å²	67	107.8 Å²	107.8	41%	0.406	52%	0.518	S	S	.	.	H	α-helix	trans	-64.6	-49.7	174.4	172.7	0	0	0	0	110.5	L177 K178 S183 Q184 E185	L177-V181 WeakPolarHBondContact O-CG2 3.48Å; L177-V181 PolarHBondContact O-N 3.04Å; K178-V181 PolarHBondContact O-N 3.12Å; K178-V181 VanDerWaalsContact O-N 3.16Å; V181-S183 VanDerWaalsContact C-N 3.29Å; V181-S183 PolarHBondContact O-N 3.47Å; V181-Q184 CarbonylContact O-C 2.87Å; V181-Q184 WeakPolarHBondContact O-CA 3.39Å; V181-Q184 WeakPolarHBondContact O-CB 3.29Å; V181-Q184 PolarHBondContact O-N 3.11Å; V181-E185 HydrophobicContact CG1-CG 4.48Å; V181-E185 PolarHBondContact O-N 3.46Å
182	E	91.7	Very high	90.6	Very high	96 Å²	96	113.1 Å²	113.1	45%	0.449	53%	0.528	S	S	.	.	H	α-helix	trans	-61.1	-37.6	177.9	-71.6	174.4	-168	0	0	112	K178 E185 A186	K178-E182 WeakPolarHBondContact CE-OE1 3.48Å; K178-E182 IonicContact NZ-OE1 2.78Å; K178-E182 PolarHBondContact NZ-OE1 3.39Å; K178-E182 IonicContact NZ-OE2 3.1Å; K178-E182 PolarHBondContact O-N 2.91Å; E182-E185 PolarHBondContact O-N 2.83Å; E182-A186 WeakPolarHBondContact O-CB 3.42Å; E182-A186 PolarHBondContact O-N 3.13Å
183	S	90.1	Very high	90.6	Very high	53 Å²	53	112.3 Å²	112.3	37%	0.371	54%	0.535	S	S	.	.	H	α-helix	trans	-63.1	-39.5	171.6	-170.8	0	0	0	0	112.8	E179 V181 K187	E179-S183 VanDerWaalsContact O-CB 3.27Å; E179-S183 WeakPolarHBondContact O-CB 3.45Å; E179-S183 PolarHBondContact O-N 2.8Å; V181-S183 VanDerWaalsContact C-N 3.29Å; V181-S183 PolarHBondContact O-N 3.47Å; S183-K187 WeakPolarHBondContact O-CD 3.48Å; S183-K187 VanDerWaalsContact O-CG 3.23Å; S183-K187 WeakPolarHBondContact O-CG 3.39Å; S183-K187 PolarHBondContact O-N 3.22Å; S183-K187 VanDerWaalsContact O-N 3.08Å
184	Q	90.1	Very high	90.6	Very high	132 Å²	132	110.4 Å²	110.4	62%	0.617	53%	0.529	S	S	*	.	H	α-helix	trans	-69.9	-40.1	175.7	-75.9	179.2	-8	0	0	112.1	R180 V181 K187 L188	R180-Q184 WeakPolarHBondContact O-CG 3.26Å; R180-Q184 PolarHBondContact O-N 3.45Å; V181-Q184 CarbonylContact O-C 2.87Å; V181-Q184 WeakPolarHBondContact O-CA 3.39Å; V181-Q184 WeakPolarHBondContact O-CB 3.29Å; V181-Q184 PolarHBondContact O-N 3.11Å; Q184-K187 PolarHBondContact O-N 3.15Å; Q184-L188 WeakPolarHBondContact O-CB 3.45Å; Q184-L188 PolarHBondContact O-N 3.5Å
185	E	91.9	Very high	90.5	Very high	129 Å²	129	112.8 Å²	112.8	60%	0.603	53%	0.53	S	S	*	.	H	α-helix	trans	-64	-41.7	174.1	-69.6	-162.4	153.1	0	0	112	V181 E182 K187 L188 K189	V181-E185 HydrophobicContact CG1-CG 4.48Å; V181-E185 PolarHBondContact O-N 3.46Å; E182-E185 PolarHBondContact O-N 2.83Å; E185-K187 PolarHBondContact O-N 3.11Å; E185-L188 PolarHBondContact O-N 2.9Å; E185-K189 WeakPolarHBondContact O-CB 3.38Å; E185-K189 PolarHBondContact O-N 3.26Å
186	A	90.2	Very high	90.5	Very high	61 Å²	61	109.3 Å²	109.3	50%	0.504	53%	0.525	S	S	.	.	H	α-helix	trans	-61	-43.2	174.5	0	0	0	0	0	112	E182 K189 K190	E182-A186 WeakPolarHBondContact O-CB 3.42Å; E182-A186 PolarHBondContact O-N 3.13Å; A186-K189 PolarHBondContact O-N 2.93Å; A186-K190 PolarHBondContact O-N 2.9Å
187	K	90.8	Very high	90.2	Very high	122 Å²	122	109 Å²	109	53%	0.53	53%	0.53	S	S	.	.	H	α-helix	trans	-61.7	-46.3	173.3	-71.9	164.3	-172.3	171.4	0	111.5	S183 Q184 E185 K189 K190 I191	S183-K187 WeakPolarHBondContact O-CD 3.48Å; S183-K187 VanDerWaalsContact O-CG 3.23Å; S183-K187 WeakPolarHBondContact O-CG 3.39Å; S183-K187 PolarHBondContact O-N 3.22Å; S183-K187 VanDerWaalsContact O-N 3.08Å; Q184-K187 PolarHBondContact O-N 3.15Å; E185-K187 PolarHBondContact O-N 3.11Å; K187-K189 VanDerWaalsContact C-N 3.31Å; K187-K189 PolarHBondContact O-N 3.41Å; K187-K190 PolarHBondContact O-N 2.87Å; K187-I191 WeakPolarHBondContact O-CG1 3.41Å; K187-I191 PolarHBondContact O-N 3.19Å
188	L	91.3	Very high	90	Very high	81 Å²	81	108.6 Å²	108.6	42%	0.424	53%	0.531	S	S	.	.	H	α-helix	trans	-62.8	-37.5	177.6	-175.1	61.5	0	0	0	112	Q184 E185 I191 R192	Q184-L188 WeakPolarHBondContact O-CB 3.45Å; Q184-L188 PolarHBondContact O-N 3.5Å; E185-L188 PolarHBondContact O-N 2.9Å; L188-I191 PolarHBondContact O-N 2.86Å; L188-R192 WeakPolarHBondContact O-CG 3.35Å; L188-R192 PolarHBondContact O-N 3.25Å
189	K	93.1	Very high	89.9	Confident	163 Å²	163	104.8 Å²	104.8	71%	0.709	52%	0.517	S	S	*	.	H	α-helix	trans	-65.3	-41.5	174.1	-168.3	174.4	-178.3	178.6	0	111.6	E185 A186 K187 R192 A193	E185-K189 WeakPolarHBondContact O-CB 3.38Å; E185-K189 PolarHBondContact O-N 3.26Å; A186-K189 PolarHBondContact O-N 2.93Å; K187-K189 VanDerWaalsContact C-N 3.31Å; K187-K189 PolarHBondContact O-N 3.41Å; K189-R192 PolarHBondContact O-N 3.12Å; K189-A193 PolarHBondContact O-N 2.81Å
190	K	90.9	Very high	89.7	Confident	137 Å²	137	107.7 Å²	107.7	60%	0.596	53%	0.525	S	S	*	.	H	α-helix	trans	-62.1	-45.1	171.8	-171.5	177.1	179.6	-177.7	0	111.4	A186 K187 R192 A193 M194	A186-K190 PolarHBondContact O-N 2.9Å; K187-K190 PolarHBondContact O-N 2.87Å; K190-R192 PolarHBondContact O-N 2.81Å; K190-A193 PolarHBondContact O-N 3.4Å; K190-A193 VanDerWaalsContact O-N 3.17Å; K190-M194 HydrophobicContact CG-CG 4.34Å; K190-M194 HydrophobicContact CG-SD 4.22Å; K190-M194 WeakPolarHBondContact O-CG 3.43Å; K190-M194 PolarHBondContact O-N 3.34Å
191	I	88.8	Confident	89.5	Confident	99 Å²	99	103 Å²	103	51%	0.508	52%	0.515	S	S	.	.	H	α-helix	trans	-60.2	-43.5	177.2	-68.6	164.2	0	0	0	111.4	K187 L188 A193 M194 R195	K187-I191 WeakPolarHBondContact O-CG1 3.41Å; K187-I191 PolarHBondContact O-N 3.19Å; L188-I191 PolarHBondContact O-N 2.86Å; I191-A193 VanDerWaalsContact C-N 3.35Å; I191-A193 PolarHBondContact O-N 3.08Å; I191-M194 PolarHBondContact O-N 2.97Å; I191-R195 WeakPolarHBondContact O-CB 3.45Å; I191-R195 PolarHBondContact O-N 3.26Å
192	R	91	Very high	89.3	Confident	177 Å²	177	105.6 Å²	105.6	67%	0.668	52%	0.521	S	S	*	.	H	α-helix	trans	-61.7	-40.1	174.9	-71.7	176.6	-172.3	-173.1	5	112.3	L188 K189 K190 G196	L188-R192 WeakPolarHBondContact O-CG 3.35Å; L188-R192 PolarHBondContact O-N 3.25Å; K189-R192 PolarHBondContact O-N 3.12Å; K190-R192 PolarHBondContact O-N 2.81Å; R192-G196 PolarHBondContact O-N 3.49Å
193	A	87.5	Confident	89.3	Confident	65 Å²	65	105.2 Å²	105.2	54%	0.537	53%	0.525	S	S	.	.	H	α-helix	trans	-66.4	-47	175.9	0	0	0	0	0	112.3	K189 K190 I191 R195 G196 Q197	K189-A193 PolarHBondContact O-N 2.81Å; K190-A193 PolarHBondContact O-N 3.4Å; K190-A193 VanDerWaalsContact O-N 3.17Å; I191-A193 VanDerWaalsContact C-N 3.35Å; I191-A193 PolarHBondContact O-N 3.08Å; A193-R195 VanDerWaalsContact C-N 3.3Å; A193-R195 PolarHBondContact O-N 3.07Å; A193-G196 PolarHBondContact O-N 3.05Å; A193-G196 VanDerWaalsContact O-N 3.11Å; A193-Q197 PolarHBondContact O-N 2.85Å
194	M	89.1	Confident	89.3	Confident	89 Å²	89	106.4 Å²	106.4	44%	0.438	53%	0.526	S	S	.	.	H	α-helix	trans	-61.9	-36.6	176.5	-65.4	-171.9	-34.9	0	0	111.8	K190 I191 G196 Q197 V198	K190-M194 HydrophobicContact CG-CG 4.34Å; K190-M194 HydrophobicContact CG-SD 4.22Å; K190-M194 WeakPolarHBondContact O-CG 3.43Å; K190-M194 PolarHBondContact O-N 3.34Å; I191-M194 PolarHBondContact O-N 2.97Å; M194-G196 VanDerWaalsContact C-N 3.35Å; M194-G196 PolarHBondContact O-N 3.22Å; M194-Q197 PolarHBondContact O-N 2.97Å; M194-V198 WeakPolarHBondContact O-CB 3.39Å; M194-V198 WeakPolarHBondContact O-CG2 3.43Å; M194-V198 PolarHBondContact O-N 2.77Å
195	R	87	Confident	89.2	Confident	168 Å²	168	104.5 Å²	104.5	63%	0.634	52%	0.52	S	S	*	.	H	α-helix	trans	-60.4	-43.9	173	-164.4	-169.3	-167.4	-87.9	12.6	111.7	I191 A193 Q197 V198 D199	I191-R195 WeakPolarHBondContact O-CB 3.45Å; I191-R195 PolarHBondContact O-N 3.26Å; A193-R195 VanDerWaalsContact C-N 3.3Å; A193-R195 PolarHBondContact O-N 3.07Å; R195-Q197 VanDerWaalsContact C-N 3.33Å; R195-Q197 PolarHBondContact O-N 2.97Å; R195-V198 PolarHBondContact O-N 2.96Å; R195-D199 IonicContact CZ-OD2 2.68Å; R195-D199 IonicContact NH1-OD2 2.8Å; R195-D199 PolarHBondContact NH1-OD2 2.7Å; R195-D199 WeakPolarHBondContact O-CB 3.4Å; R195-D199 VanDerWaalsContact O-CG 3.26Å; R195-D199 PolarHBondContact O-N 2.79Å
196	G	89.4	Confident	89.1	Confident	42 Å²	42	99.9 Å²	99.9	43%	0.433	51%	0.507	S	S	.	.	H	α-helix	trans	-60.3	-40.6	174.8	0	0	0	0	0	113	R192 A193 M194 Y200	R192-G196 PolarHBondContact O-N 3.49Å; A193-G196 PolarHBondContact O-N 3.05Å; A193-G196 VanDerWaalsContact O-N 3.11Å; M194-G196 VanDerWaalsContact C-N 3.35Å; M194-G196 PolarHBondContact O-N 3.22Å; G196-Y200 WeakPolarHBondContact O-CB 3.3Å; G196-Y200 PolarHBondContact O-N 2.94Å
197	Q	81.4	Confident	89.1	Confident	144 Å²	144	101.6 Å²	101.6	67%	0.673	51%	0.508	S	S	*	.	H	α-helix	trans	-67.1	-41.5	175.5	-173.5	177.6	-2.5	0	0	112.5	A193 M194 R195 Y200 S201	A193-Q197 PolarHBondContact O-N 2.85Å; M194-Q197 PolarHBondContact O-N 2.97Å; R195-Q197 VanDerWaalsContact C-N 3.33Å; R195-Q197 PolarHBondContact O-N 2.97Å; Q197-Y200 PolarHBondContact O-N 2.83Å; Q197-S201 WeakPolarHBondContact O-CB 3.46Å; Q197-S201 PolarHBondContact O-N 3.37Å
198	V	87.8	Confident	89	Confident	75 Å²	75	100.1 Å²	100.1	46%	0.455	51%	0.505	S	S	.	.	H	α-helix	trans	-65.4	-41.9	175.3	165.4	0	0	0	0	111.4	M194 R195 S201 K202	M194-V198 WeakPolarHBondContact O-CB 3.39Å; M194-V198 WeakPolarHBondContact O-CG2 3.43Å; M194-V198 PolarHBondContact O-N 2.77Å; R195-V198 PolarHBondContact O-N 2.96Å; V198-S201 PolarHBondContact O-N 3.42Å; V198-K202 WeakPolarHBondContact O-CG 3.44Å; V198-K202 PolarHBondContact O-N 3.37Å
199	D	87.6	Confident	88.9	Confident	46 Å²	46	99 Å²	99	25%	0.246	51%	0.505	C	S	.	.	H	α-helix	trans	-70.4	-33.2	177.8	-66.1	-30	0	0	0	111.9	R195 K202 V203	R195-D199 IonicContact CZ-OD2 2.68Å; R195-D199 IonicContact NH1-OD2 2.8Å; R195-D199 PolarHBondContact NH1-OD2 2.7Å; R195-D199 WeakPolarHBondContact O-CB 3.4Å; R195-D199 VanDerWaalsContact O-CG 3.26Å; R195-D199 PolarHBondContact O-N 2.79Å; D199-K202 PolarHBondContact O-N 2.94Å; D199-K202 IonicContact OD1-NZ 2.86Å; D199-K202 PolarHBondContact OD1-NZ 2.95Å; D199-V203 WeakPolarHBondContact O-CG2 3.34Å; D199-V203 PolarHBondContact O-N 2.89Å
200	Y	88.2	Confident	88.8	Confident	162 Å²	162	93.8 Å²	93.8	64%	0.635	49%	0.492	S	S	*	.	H	α-helix	trans	-65.2	-43.4	169.5	-177.2	-113.2	0	0	0	112.2	G196 Q197 K202 V203 I204	G196-Y200 WeakPolarHBondContact O-CB 3.3Å; G196-Y200 PolarHBondContact O-N 2.94Å; Q197-Y200 PolarHBondContact O-N 2.83Å; Y200-K202 VanDerWaalsContact C-N 3.35Å; Y200-K202 PolarHBondContact O-N 3.36Å; Y200-V203 PolarHBondContact O-N 3.46Å; Y200-I204 HydrophobicContact CD1-CD1 3.9Å; Y200-I204 HydrophobicContact CE1-CD1 3.45Å; Y200-I204 VanDerWaalsContact CE1-CD1 3.45Å; Y200-I204 HydrophobicContact CE2-CD1 4.4Å; Y200-I204 PolarHBondContact O-N 2.87Å
201	S	86.8	Confident	88.8	Confident	54 Å²	54	92.6 Å²	92.6	38%	0.378	49%	0.488	S	S	.	.	H	α-helix	trans	-61.9	-38.7	174.3	172.8	0	0	0	0	112.4	Q197 V198 V203 I204 N205	Q197-S201 WeakPolarHBondContact O-CB 3.46Å; Q197-S201 PolarHBondContact O-N 3.37Å; V198-S201 PolarHBondContact O-N 3.42Å; S201-V203 VanDerWaalsContact C-N 3.32Å; S201-V203 PolarHBondContact O-N 3.3Å; S201-I204 PolarHBondContact O-N 3.5Å; S201-N205 WeakPolarHBondContact O-CB 3.26Å; S201-N205 PolarHBondContact O-N 3.31Å; S201-N205 PolarHBondContact O-OD1 3.23Å
202	K	91.4	Very high	89	Confident	123 Å²	123	92.6 Å²	92.6	54%	0.535	49%	0.488	S	S	.	.	H	α-helix	trans	-60.5	-39.6	172.8	-71.2	169.5	-164.2	157.6	0	112.7	V198 D199 Y200 G206	V198-K202 WeakPolarHBondContact O-CG 3.44Å; V198-K202 PolarHBondContact O-N 3.37Å; D199-K202 PolarHBondContact O-N 2.94Å; D199-K202 IonicContact OD1-NZ 2.86Å; D199-K202 PolarHBondContact OD1-NZ 2.95Å; Y200-K202 VanDerWaalsContact C-N 3.35Å; Y200-K202 PolarHBondContact O-N 3.36Å; K202-G206 PolarHBondContact O-N 3.03Å
203	V	90.8	Very high	89	Confident	87 Å²	87	90.8 Å²	90.8	53%	0.527	49%	0.487	S	S	.	.	H	α-helix	trans	-66.2	-43.8	176.8	172.7	0	0	0	0	110.8	D199 Y200 S201 G206 N207	D199-V203 WeakPolarHBondContact O-CG2 3.34Å; D199-V203 PolarHBondContact O-N 2.89Å; Y200-V203 PolarHBondContact O-N 3.46Å; S201-V203 VanDerWaalsContact C-N 3.32Å; S201-V203 PolarHBondContact O-N 3.3Å; V203-G206 PolarHBondContact O-N 3.16Å; V203-N207 PolarHBondContact O-N 3.39Å; V203-N207 PolarHBondContact O-OD1 3.02Å
204	I	90.7	Very high	89.3	Confident	78 Å²	78	93.8 Å²	93.8	40%	0.4	49%	0.49	S	S	.	.	H	α-helix	trans	-62.1	-48.2	175.6	-69.7	171.5	0	0	0	111.2	Y200 S201 G206 N207 L208	Y200-I204 HydrophobicContact CD1-CD1 3.9Å; Y200-I204 HydrophobicContact CE1-CD1 3.45Å; Y200-I204 VanDerWaalsContact CE1-CD1 3.45Å; Y200-I204 HydrophobicContact CE2-CD1 4.4Å; Y200-I204 PolarHBondContact O-N 2.87Å; S201-I204 PolarHBondContact O-N 3.5Å; I204-G206 VanDerWaalsContact C-N 3.29Å; I204-G206 PolarHBondContact O-N 2.95Å; I204-N207 PolarHBondContact O-N 3.17Å; I204-L208 WeakPolarHBondContact O-CB 3.43Å; I204-L208 PolarHBondContact O-N 3.06Å
205	N	87.6	Confident	89.4	Confident	93 Å²	93	94.1 Å²	94.1	50%	0.497	50%	0.497	S	S	.	.	H	α-helix	trans	-65.8	-33.8	-179.7	-65.8	7	0	0	0	111.6	S201 L208 S209	S201-N205 WeakPolarHBondContact O-CB 3.26Å; S201-N205 PolarHBondContact O-N 3.31Å; S201-N205 PolarHBondContact O-OD1 3.23Å; N205-L208 PolarHBondContact O-N 3.35Å; N205-S209 PolarHBondContact O-N 2.88Å; N205-S209 PolarHBondContact O-OG 3.25Å
206	G	90.8	Very high	89.5	Confident	32 Å²	32	89.3 Å²	89.3	33%	0.33	49%	0.486	S	S	.	.	H	α-helix	trans	-62.7	-48.5	171.5	0	0	0	0	0	112.3	K202 V203 I204 L208 S209 A210	K202-G206 PolarHBondContact O-N 3.03Å; V203-G206 PolarHBondContact O-N 3.16Å; I204-G206 VanDerWaalsContact C-N 3.29Å; I204-G206 PolarHBondContact O-N 2.95Å; G206-L208 PolarHBondContact O-N 2.86Å; G206-S209 WeakPolarHBondContact CA-OG 3.46Å; G206-S209 PolarHBondContact O-N 3.45Å; G206-S209 PolarHBondContact O-OG 2.93Å; G206-A210 PolarHBondContact O-N 3.47Å
207	N	90	Very high	89.6	Confident	96 Å²	96	90.8 Å²	90.8	51%	0.513	49%	0.49	S	S	.	.	H	α-helix	trans	-59.5	-46	174.9	-68.5	-0.5	0	0	0	111.4	V203 I204 S209 A210 E211	V203-N207 PolarHBondContact O-N 3.39Å; V203-N207 PolarHBondContact O-OD1 3.02Å; I204-N207 PolarHBondContact O-N 3.17Å; N207-S209 VanDerWaalsContact C-N 3.32Å; N207-S209 PolarHBondContact O-N 3.45Å; N207-A210 WeakPolarHBondContact O-CB 3.24Å; N207-A210 PolarHBondContact O-N 3.11Å; N207-A210 VanDerWaalsContact O-N 3.1Å; N207-E211 PolarHBondContact O-N 3.32Å
208	L	87.4	Confident	90.1	Very high	91 Å²	91	87.9 Å²	87.9	48%	0.476	48%	0.479	S	S	.	.	H	α-helix	trans	-61.5	-38.6	177.5	-174.5	64.9	0	0	0	112	I204 N205 G206 A210 E211 I212	I204-L208 WeakPolarHBondContact O-CB 3.43Å; I204-L208 PolarHBondContact O-N 3.06Å; N205-L208 PolarHBondContact O-N 3.35Å; G206-L208 PolarHBondContact O-N 2.86Å; L208-A210 VanDerWaalsContact C-N 3.35Å; L208-E211 PolarHBondContact O-N 2.94Å; L208-I212 HydrophobicContact CG-CD1 4.05Å; L208-I212 WeakPolarHBondContact O-CB 3.32Å; L208-I212 VanDerWaalsContact O-CG1 3.26Å; L208-I212 WeakPolarHBondContact O-CG1 3.48Å; L208-I212 PolarHBondContact O-N 2.95Å
209	S	88.9	Confident	90.3	Very high	59 Å²	59	91 Å²	91	41%	0.413	49%	0.487	S	S	.	.	H	α-helix	trans	-64.1	-38.1	173.6	61.9	0	0	0	0	112.7	N205 G206 N207 I212 E213	N205-S209 PolarHBondContact O-N 2.88Å; N205-S209 PolarHBondContact O-OG 3.25Å; G206-S209 WeakPolarHBondContact CA-OG 3.46Å; G206-S209 PolarHBondContact O-N 3.45Å; G206-S209 PolarHBondContact O-OG 2.93Å; N207-S209 VanDerWaalsContact C-N 3.32Å; N207-S209 PolarHBondContact O-N 3.45Å; S209-I212 PolarHBondContact O-N 2.95Å; S209-E213 WeakPolarHBondContact O-CG 3.41Å; S209-E213 PolarHBondContact O-N 3.47Å
210	A	91.4	Very high	90.5	Very high	52 Å²	52	94.7 Å²	94.7	43%	0.43	50%	0.502	S	S	.	.	H	α-helix	trans	-68.5	-36.8	175.2	0	0	0	0	0	112.4	G206 N207 L208 E213 Q214	G206-A210 PolarHBondContact O-N 3.47Å; N207-A210 WeakPolarHBondContact O-CB 3.24Å; N207-A210 PolarHBondContact O-N 3.11Å; N207-A210 VanDerWaalsContact O-N 3.1Å; L208-A210 VanDerWaalsContact C-N 3.35Å; A210-E213 PolarHBondContact O-N 3.39Å; A210-Q214 WeakPolarHBondContact O-CB 3.4Å; A210-Q214 PolarHBondContact O-N 2.84Å
211	E	91.8	Very high	90.6	Very high	113 Å²	113	92.1 Å²	92.1	53%	0.528	50%	0.496	S	S	.	.	H	α-helix	trans	-64.9	-41.3	172.2	-71.9	174.8	-152.8	0	0	111.6	N207 L208 Q214 V215	N207-E211 PolarHBondContact O-N 3.32Å; L208-E211 PolarHBondContact O-N 2.94Å; E211-Q214 PolarHBondContact O-N 3.49Å; E211-V215 WeakPolarHBondContact O-CG2 3.2Å; E211-V215 PolarHBondContact O-N 3.5Å
212	I	91.4	Very high	90.9	Very high	98 Å²	98	94.6 Å²	94.6	50%	0.503	50%	0.5	S	S	.	.	H	α-helix	trans	-64.7	-42.4	174.8	-70	165	0	0	0	111.3	L208 S209 V215 T216	L208-I212 HydrophobicContact CG-CD1 4.05Å; L208-I212 WeakPolarHBondContact O-CB 3.32Å; L208-I212 VanDerWaalsContact O-CG1 3.26Å; L208-I212 WeakPolarHBondContact O-CG1 3.48Å; L208-I212 PolarHBondContact O-N 2.95Å; S209-I212 PolarHBondContact O-N 2.95Å; I212-V215 PolarHBondContact O-N 3.25Å; I212-T216 VanDerWaalsContact O-CB 3.29Å; I212-T216 WeakPolarHBondContact O-CB 3.34Å; I212-T216 PolarHBondContact O-N 3.48Å; I212-T216 PolarHBondContact O-OG1 3.48Å
213	E	91.2	Very high	90.7	Very high	140 Å²	140	93.2 Å²	93.2	65%	0.654	50%	0.495	S	S	*	.	H	α-helix	trans	-62.8	-40.8	173.9	-76.2	-178.6	-178.8	0	0	111.6	S209 A210 T216 S217	S209-E213 WeakPolarHBondContact O-CG 3.41Å; S209-E213 PolarHBondContact O-N 3.47Å; A210-E213 PolarHBondContact O-N 3.39Å; E213-T216 PolarHBondContact O-N 3.34Å; E213-S217 WeakPolarHBondContact O-CB 3.44Å; E213-S217 PolarHBondContact O-N 2.88Å
214	Q	94.3	Very high	90.6	Very high	127 Å²	127	91.5 Å²	91.5	59%	0.593	49%	0.491	S	S	*	.	H	α-helix	trans	-63.7	-45.9	175.7	-174.5	178.2	4.1	0	0	112.1	A210 E211 T216 S217 L218	A210-Q214 WeakPolarHBondContact O-CB 3.4Å; A210-Q214 PolarHBondContact O-N 2.84Å; E211-Q214 PolarHBondContact O-N 3.49Å; Q214-T216 VanDerWaalsContact C-N 3.33Å; Q214-T216 PolarHBondContact O-N 2.92Å; Q214-S217 WeakPolarHBondContact O-CB 3.33Å; Q214-S217 PolarHBondContact O-N 3.41Å; Q214-L218 HydrophobicContact CG-CD1 4.37Å; Q214-L218 WeakPolarHBondContact O-CG 3.33Å; Q214-L218 PolarHBondContact O-N 3.11Å
215	V	90.7	Very high	90.7	Very high	97 Å²	97	91.7 Å²	91.7	59%	0.588	49%	0.49	S	S	*	.	H	α-helix	trans	-64.3	-38.5	175.8	170.7	0	0	0	0	111.2	E211 I212 L218 F219	E211-V215 WeakPolarHBondContact O-CG2 3.2Å; E211-V215 PolarHBondContact O-N 3.5Å; I212-V215 PolarHBondContact O-N 3.25Å; V215-L218 PolarHBondContact O-N 2.93Å; V215-F219 WeakPolarHBondContact O-CB 3.33Å; V215-F219 PolarHBondContact O-N 3.28Å
216	T	90.6	Very high	90.9	Very high	66 Å²	66	92.7 Å²	92.7	41%	0.405	50%	0.495	S	S	.	.	H	α-helix	trans	-64.5	-40.8	175.7	-58.7	0	0	0	0	111.6	I212 E213 Q214 F219 Q220	I212-T216 VanDerWaalsContact O-CB 3.29Å; I212-T216 WeakPolarHBondContact O-CB 3.34Å; I212-T216 PolarHBondContact O-N 3.48Å; I212-T216 PolarHBondContact O-OG1 3.48Å; E213-T216 PolarHBondContact O-N 3.34Å; Q214-T216 VanDerWaalsContact C-N 3.33Å; Q214-T216 PolarHBondContact O-N 2.92Å; T216-F219 PolarHBondContact O-N 3.23Å; T216-Q220 WeakPolarHBondContact O-CG 3.31Å; T216-Q220 PolarHBondContact O-N 3.28Å
217	S	91.8	Very high	90.8	Very high	74 Å²	74	96.5 Å²	96.5	52%	0.517	50%	0.504	S	S	.	.	H	α-helix	trans	-62.8	-47.2	174.4	-170.8	0	0	0	0	111.8	E213 Q214 F219 Q220 E221	E213-S217 WeakPolarHBondContact O-CB 3.44Å; E213-S217 PolarHBondContact O-N 2.88Å; Q214-S217 WeakPolarHBondContact O-CB 3.33Å; Q214-S217 PolarHBondContact O-N 3.41Å; S217-F219 VanDerWaalsContact C-N 3.31Å; S217-F219 PolarHBondContact O-N 3.34Å; S217-Q220 PolarHBondContact O-N 3.03Å; S217-E221 PolarHBondContact O-N 3.35Å
218	L	90.8	Very high	90.8	Very high	83 Å²	83	94.1 Å²	94.1	44%	0.435	50%	0.497	S	S	.	.	H	α-helix	trans	-60.9	-37.7	175.2	-72.4	167.5	0	0	0	112.3	Q214 V215 E221 K222	Q214-L218 HydrophobicContact CG-CD1 4.37Å; Q214-L218 WeakPolarHBondContact O-CG 3.33Å; Q214-L218 PolarHBondContact O-N 3.11Å; V215-L218 PolarHBondContact O-N 2.93Å; L218-E221 PolarHBondContact O-N 3.27Å; L218-K222 WeakPolarHBondContact O-CG 3.19Å; L218-K222 PolarHBondContact O-N 2.86Å
219	F	92.9	Very high	90.9	Very high	141 Å²	141	91.5 Å²	91.5	62%	0.618	49%	0.489	S	S	*	.	H	α-helix	trans	-65.7	-43.7	175	-173.6	-90.6	0	0	0	111.8	V215 T216 S217 E221 K222 Q223	V215-F219 WeakPolarHBondContact O-CB 3.33Å; V215-F219 PolarHBondContact O-N 3.28Å; T216-F219 PolarHBondContact O-N 3.23Å; S217-F219 VanDerWaalsContact C-N 3.31Å; S217-F219 PolarHBondContact O-N 3.34Å; F219-E221 PolarHBondContact O-N 2.99Å; F219-K222 PolarHBondContact O-N 2.6Å; F219-Q223 WeakPolarHBondContact O-CB 3.39Å; F219-Q223 PolarHBondContact O-N 3.49Å
220	Q	90	Very high	91	Very high	123 Å²	123	92.2 Å²	92.2	58%	0.575	49%	0.49	S	S	*	.	H	α-helix	trans	-63.2	-40.1	175.2	-70.9	177.5	28.3	0	0	112.1	T216 S217 Q223 A224	T216-Q220 WeakPolarHBondContact O-CG 3.31Å; T216-Q220 PolarHBondContact O-N 3.28Å; S217-Q220 PolarHBondContact O-N 3.03Å; Q220-Q223 PolarHBondContact O-N 3.07Å; Q220-A224 WeakPolarHBondContact O-CB 3.26Å; Q220-A224 PolarHBondContact O-N 2.81Å
221	E	91.9	Very high	90.9	Very high	107 Å²	107	95 Å²	95	50%	0.5	50%	0.497	S	S	.	.	H	α-helix	trans	-60.1	-48.2	174	-170.3	-165.5	146.7	0	0	111.3	S217 L218 F219 Q223 A224 E225	S217-E221 PolarHBondContact O-N 3.35Å; L218-E221 PolarHBondContact O-N 3.27Å; F219-E221 PolarHBondContact O-N 2.99Å; E221-Q223 PolarHBondContact O-N 2.85Å; E221-A224 PolarHBondContact O-N 2.89Å; E221-E225 PolarHBondContact O-N 2.96Å
222	K	92.5	Very high	90.9	Very high	107 Å²	107	96.5 Å²	96.5	47%	0.465	50%	0.498	S	S	.	.	H	α-helix	trans	-69.5	-31.2	178.8	-64.2	-65.2	143	-159.5	0	112.9	L218 F219 E225 L226	L218-K222 WeakPolarHBondContact O-CG 3.19Å; L218-K222 PolarHBondContact O-N 2.86Å; F219-K222 PolarHBondContact O-N 2.6Å; K222-E225 WeakPolarHBondContact CD-OE2 3.42Å; K222-E225 IonicContact NZ-OE2 2.92Å; K222-E225 PolarHBondContact NZ-OE2 3.43Å; K222-E225 PolarHBondContact O-N 2.81Å; K222-L226 VanDerWaalsContact O-CB 3.3Å; K222-L226 WeakPolarHBondContact O-CB 3.44Å; K222-L226 PolarHBondContact O-N 2.99Å
223	Q	87.8	Confident	90.8	Very high	93 Å²	93	96.1 Å²	96.1	44%	0.435	50%	0.5	S	S	.	.	H	α-helix	trans	-65.3	-41	171.4	-175.4	175.5	-5.9	0	0	111.4	F219 Q220 E221 L226 Q227	F219-Q223 WeakPolarHBondContact O-CB 3.39Å; F219-Q223 PolarHBondContact O-N 3.49Å; Q220-Q223 PolarHBondContact O-N 3.07Å; E221-Q223 PolarHBondContact O-N 2.85Å; Q223-L226 PolarHBondContact O-N 2.97Å; Q223-Q227 WeakPolarHBondContact O-CG 3.49Å; Q223-Q227 PolarHBondContact O-N 2.96Å
224	A	89.1	Confident	90.7	Very high	52 Å²	52	94.4 Å²	94.4	43%	0.43	49%	0.493	S	S	.	.	H	α-helix	trans	-68.1	-40.7	174.5	0	0	0	0	0	112.4	Q220 E221 L226 Q227 A228	Q220-A224 WeakPolarHBondContact O-CB 3.26Å; Q220-A224 PolarHBondContact O-N 2.81Å; E221-A224 PolarHBondContact O-N 2.89Å; A224-L226 VanDerWaalsContact C-N 3.34Å; A224-L226 PolarHBondContact O-N 3.15Å; A224-Q227 PolarHBondContact O-N 3.03Å; A224-A228 WeakPolarHBondContact O-CB 3.46Å; A224-A228 PolarHBondContact O-N 2.76Å
225	E	91.9	Very high	90.4	Very high	81 Å²	81	94 Å²	94	38%	0.379	49%	0.491	S	S	.	.	H	α-helix	trans	-60.2	-43.2	173.6	-170.4	-171.2	152.9	0	0	111.4	E221 K222 A228 A229	E221-E225 PolarHBondContact O-N 2.96Å; K222-E225 WeakPolarHBondContact CD-OE2 3.42Å; K222-E225 IonicContact NZ-OE2 2.92Å; K222-E225 PolarHBondContact NZ-OE2 3.43Å; K222-E225 PolarHBondContact O-N 2.81Å; E225-A228 CarbonylContact O-C 3.41Å; E225-A228 PolarHBondContact O-N 3.11Å; E225-A229 PolarHBondContact O-N 2.94Å
226	L	91.8	Very high	90.1	Very high	115 Å²	115	94.2 Å²	94.2	60%	0.602	49%	0.488	S	S	*	.	H	α-helix	trans	-64	-45.4	176.8	-179.2	61.8	0	0	0	111.9	K222 Q223 A224 A228 A229 V230	K222-L226 VanDerWaalsContact O-CB 3.3Å; K222-L226 WeakPolarHBondContact O-CB 3.44Å; K222-L226 PolarHBondContact O-N 2.99Å; Q223-L226 PolarHBondContact O-N 2.97Å; A224-L226 VanDerWaalsContact C-N 3.34Å; A224-L226 PolarHBondContact O-N 3.15Å; L226-A228 VanDerWaalsContact C-N 3.33Å; L226-A228 PolarHBondContact O-N 3.33Å; L226-A229 WeakPolarHBondContact O-CA 3.39Å; L226-A229 WeakPolarHBondContact O-CB 3.49Å; L226-A229 PolarHBondContact O-N 2.92Å; L226-V230 WeakPolarHBondContact O-CG2 3.46Å; L226-V230 PolarHBondContact O-N 3.36Å
227	Q	89.1	Confident	89.8	Confident	112 Å²	112	93.9 Å²	93.9	52%	0.523	49%	0.488	S	S	.	.	H	α-helix	trans	-60.3	-42.7	174.4	-74.4	174	-13.8	0	0	111.6	Q223 A224 A229 V230 L231	Q223-Q227 WeakPolarHBondContact O-CG 3.49Å; Q223-Q227 PolarHBondContact O-N 2.96Å; A224-Q227 PolarHBondContact O-N 3.03Å; Q227-A229 PolarHBondContact O-N 2.97Å; Q227-V230 PolarHBondContact O-N 3.24Å; Q227-L231 WeakPolarHBondContact O-CG 3.5Å; Q227-L231 PolarHBondContact O-N 3.23Å; Q227-L231 VanDerWaalsContact O-N 3.08Å
228	A	90.1	Very high	89.5	Confident	45 Å²	45	95.6 Å²	95.6	37%	0.372	49%	0.491	S	S	.	.	H	α-helix	trans	-68.3	-18.7	174.4	0	0	0	0	0	113.5	A224 E225 L226 R232	A224-A228 WeakPolarHBondContact O-CB 3.46Å; A224-A228 PolarHBondContact O-N 2.76Å; E225-A228 CarbonylContact O-C 3.41Å; E225-A228 PolarHBondContact O-N 3.11Å; L226-A228 VanDerWaalsContact C-N 3.33Å; L226-A228 PolarHBondContact O-N 3.33Å; A228-R232 PolarHBondContact O-NE 2.85Å; A228-R232 PolarHBondContact O-NH2 3.25Å
229	A	88.4	Confident	88.9	Confident	37 Å²	37	96.7 Å²	96.7	31%	0.306	49%	0.494	S	S	.	.	H	α-helix	trans	-81.2	-44.7	170.6	0	0	0	0	0	111.5	E225 L226 Q227 L231 R232 V233	E225-A229 PolarHBondContact O-N 2.94Å; L226-A229 WeakPolarHBondContact O-CA 3.39Å; L226-A229 WeakPolarHBondContact O-CB 3.49Å; L226-A229 PolarHBondContact O-N 2.92Å; Q227-A229 PolarHBondContact O-N 2.97Å; A229-L231 PolarHBondContact O-N 3.45Å; A229-R232 WeakPolarHBondContact O-CB 3.22Å; A229-R232 PolarHBondContact O-N 2.93Å; A229-R232 VanDerWaalsContact O-N 3.12Å; A229-V233 WeakPolarHBondContact O-CG2 3.34Å; A229-V233 PolarHBondContact O-N 2.97Å
230	V	90.7	Very high	88.2	Confident	73 Å²	73	94.5 Å²	94.5	44%	0.442	49%	0.488	S	S	.	.	H	α-helix	trans	-57.3	-49.1	176.6	172.3	0	0	0	0	111.2	L226 Q227 R232 V233 E234	L226-V230 WeakPolarHBondContact O-CG2 3.46Å; L226-V230 PolarHBondContact O-N 3.36Å; Q227-V230 PolarHBondContact O-N 3.24Å; V230-R232 PolarHBondContact O-N 3.37Å; V230-V233 WeakPolarHBondContact O-CA 3.49Å; V230-V233 WeakPolarHBondContact O-CB 3.49Å; V230-V233 PolarHBondContact O-N 3.22Å; V230-E234 PolarHBondContact O-N 3.41Å
231	L	90.8	Very high	87.7	Confident	110 Å²	110	92.5 Å²	92.5	58%	0.576	48%	0.479	S	S	*	.	H	α-helix	trans	-58.7	-33.6	177.4	-69.8	170.7	0	0	0	113	Q227 A229 Q235	Q227-L231 WeakPolarHBondContact O-CG 3.5Å; Q227-L231 PolarHBondContact O-N 3.23Å; Q227-L231 VanDerWaalsContact O-N 3.08Å; A229-L231 PolarHBondContact O-N 3.45Å; L231-Q235 WeakPolarHBondContact O-CB 3.38Å; L231-Q235 PolarHBondContact O-N 2.97Å
232	R	90.3	Very high	86.9	Confident	145 Å²	145	90.9 Å²	90.9	55%	0.547	47%	0.474	S	S	.	.	H	α-helix	trans	-71.8	-37.4	174	-81.1	179.4	-74.8	164.3	-2.9	112.2	A228 A229 V230 Q235 L236	A228-R232 PolarHBondContact O-NE 2.85Å; A228-R232 PolarHBondContact O-NH2 3.25Å; A229-R232 WeakPolarHBondContact O-CB 3.22Å; A229-R232 PolarHBondContact O-N 2.93Å; A229-R232 VanDerWaalsContact O-N 3.12Å; V230-R232 PolarHBondContact O-N 3.37Å; R232-Q235 PolarHBondContact O-N 3.4Å; R232-L236 WeakPolarHBondContact O-CB 3.39Å; R232-L236 WeakPolarHBondContact O-CD1 3.43Å; R232-L236 VanDerWaalsContact O-CG 3.23Å; R232-L236 WeakPolarHBondContact O-CG 3.33Å; R232-L236 PolarHBondContact O-N 3.5Å
233	V	89.8	Confident	86	Confident	90 Å²	90	91.7 Å²	91.7	55%	0.545	48%	0.483	S	S	.	.	H	α-helix	trans	-66.1	-40.4	174.6	173.4	0	0	0	0	111.2	A229 V230 S237	A229-V233 WeakPolarHBondContact O-CG2 3.34Å; A229-V233 PolarHBondContact O-N 2.97Å; V230-V233 WeakPolarHBondContact O-CA 3.49Å; V230-V233 WeakPolarHBondContact O-CB 3.49Å; V230-V233 PolarHBondContact O-N 3.22Å; V233-S237 VanDerWaalsContact O-CB 3.26Å; V233-S237 WeakPolarHBondContact O-CB 3.24Å; V233-S237 PolarHBondContact O-N 2.89Å; V233-S237 PolarHBondContact O-OG 3.27Å
234	E	88.5	Confident	85.1	Confident	105 Å²	105	97.1 Å²	97.1	49%	0.491	50%	0.499	S	S	.	.	H	α-helix	trans	-62.1	-47.4	172.9	-70.1	179.1	163	0	0	111.4	V230 L236 S237 L238	V230-E234 PolarHBondContact O-N 3.41Å; E234-L236 PolarHBondContact O-N 2.88Å; E234-S237 WeakPolarHBondContact O-CB 3.3Å; E234-S237 PolarHBondContact O-N 3.21Å; E234-S237 VanDerWaalsContact O-N 3.14Å; E234-L238 WeakPolarHBondContact O-CG 3.44Å; E234-L238 PolarHBondContact O-N 2.96Å
235	Q	88.3	Confident	84.4	Confident	119 Å²	119	102.2 Å²	102.2	56%	0.556	51%	0.507	S	S	*	.	H	α-helix	trans	-62.1	-41.3	178.6	-171	172.5	13.2	0	0	112.7	L231 R232 S237 L238 Q239	L231-Q235 WeakPolarHBondContact O-CB 3.38Å; L231-Q235 PolarHBondContact O-N 2.97Å; R232-Q235 PolarHBondContact O-N 3.4Å; Q235-S237 VanDerWaalsContact C-N 3.33Å; Q235-L238 PolarHBondContact O-N 3.12Å; Q235-Q239 WeakPolarHBondContact O-CG 3.47Å; Q235-Q239 PolarHBondContact O-N 2.91Å; Q235-Q239 VanDerWaalsContact O-N 3.08Å
236	L	85.9	Confident	82.8	Confident	100 Å²	100	100.8 Å²	100.8	52%	0.524	52%	0.515	S	S	.	.	H	α-helix	trans	-66.6	-34.8	174.4	-72.8	167.1	0	0	0	112	R232 E234 Q239 L240	R232-L236 WeakPolarHBondContact O-CB 3.39Å; R232-L236 WeakPolarHBondContact O-CD1 3.43Å; R232-L236 VanDerWaalsContact O-CG 3.23Å; R232-L236 WeakPolarHBondContact O-CG 3.33Å; R232-L236 PolarHBondContact O-N 3.5Å; E234-L236 PolarHBondContact O-N 2.88Å; L236-Q239 PolarHBondContact O-N 3.16Å; L236-L240 WeakPolarHBondContact O-CB 3.36Å; L236-L240 PolarHBondContact O-N 2.86Å
237	S	83.7	Confident	81	Confident	60 Å²	60	102.7 Å²	102.7	42%	0.42	52%	0.518	S	S	.	.	H	α-helix	trans	-69.2	-39.8	177.5	-62	0	0	0	0	111.7	V233 E234 Q235 L240 E241	V233-S237 VanDerWaalsContact O-CB 3.26Å; V233-S237 WeakPolarHBondContact O-CB 3.24Å; V233-S237 PolarHBondContact O-N 2.89Å; V233-S237 PolarHBondContact O-OG 3.27Å; E234-S237 WeakPolarHBondContact O-CB 3.3Å; E234-S237 PolarHBondContact O-N 3.21Å; E234-S237 VanDerWaalsContact O-N 3.14Å; Q235-S237 VanDerWaalsContact C-N 3.33Å; S237-L240 PolarHBondContact O-N 3.45Å; S237-E241 PolarHBondContact O-N 2.84Å
238	L	84.7	Confident	79.4	Confident	110 Å²	110	103.9 Å²	103.9	58%	0.576	53%	0.527	S	S	*	.	H	α-helix	trans	-64.2	-40.3	171.6	-71	169.8	0	0	0	112.1	E234 Q235 E241 D242	E234-L238 WeakPolarHBondContact O-CG 3.44Å; E234-L238 PolarHBondContact O-N 2.96Å; Q235-L238 PolarHBondContact O-N 3.12Å; L238-E241 PolarHBondContact O-N 3.14Å; L238-D242 PolarHBondContact O-N 3.31Å
239	Q	79	Confident	77.1	Confident	105 Å²	105	109.7 Å²	109.7	49%	0.491	55%	0.552	S	S	.	*	H	α-helix	trans	-63.5	-40.6	173.8	-73.5	174.5	-17.8	0	0	112.1	Q235 L236 L243	Q235-Q239 WeakPolarHBondContact O-CG 3.47Å; Q235-Q239 PolarHBondContact O-N 2.91Å; Q235-Q239 VanDerWaalsContact O-N 3.08Å; L236-Q239 PolarHBondContact O-N 3.16Å; Q239-L243 WeakPolarHBondContact O-CB 3.42Å; Q239-L243 VanDerWaalsContact O-CG 3.3Å; Q239-L243 WeakPolarHBondContact O-CG 3.28Å; Q239-L243 PolarHBondContact O-N 3.08Å; Q239-L243 VanDerWaalsContact O-N 3.11Å
240	L	77.7	Confident	75	Confident	95 Å²	95	110.8 Å²	110.8	50%	0.497	57%	0.567	S	S	.	*	H	α-helix	trans	-64.6	-36.1	172.4	-85.4	161.4	0	0	0	112.8	L236 S237 R244	L236-L240 WeakPolarHBondContact O-CB 3.36Å; L236-L240 PolarHBondContact O-N 2.86Å; S237-L240 PolarHBondContact O-N 3.45Å; L240-R244 WeakPolarHBondContact O-CB 3.41Å; L240-R244 VanDerWaalsContact O-CG 3.24Å; L240-R244 WeakPolarHBondContact O-CG 3.36Å; L240-R244 PolarHBondContact O-N 2.86Å
241	E	79.7	Confident	72.5	Confident	81 Å²	81	114.6 Å²	114.6	38%	0.379	58%	0.583	S	S	.	*	H	α-helix	trans	-68.4	-45.7	174	-84.9	-134.5	114.4	0	0	113	S237 L238 L243 R244 R245	S237-E241 PolarHBondContact O-N 2.84Å; L238-E241 PolarHBondContact O-N 3.14Å; E241-L243 VanDerWaalsContact C-N 3.28Å; E241-L243 PolarHBondContact O-N 3.4Å; E241-R244 CarbonylContact O-C 3.55Å; E241-R244 PolarHBondContact O-N 3.25Å; E241-R244 VanDerWaalsContact O-N 3.12Å; E241-R245 VanDerWaalsContact CD-NH2 3.25Å; E241-R245 WeakPolarHBondContact O-CB 3.32Å; E241-R245 WeakPolarHBondContact O-CG 3.34Å; E241-R245 PolarHBondContact O-N 3.33Å; E241-R245 IonicContact OE1-CZ 3.48Å; E241-R245 IonicContact OE1-NE 3.45Å; E241-R245 IonicContact OE1-NH2 2.74Å; E241-R245 PolarHBondContact OE1-NH2 3.36Å; E241-R245 IonicContact OE2-CZ 3.67Å; E241-R245 IonicContact OE2-NE 2.72Å; E241-R245 PolarHBondContact OE2-NE 3.38Å; E241-R245 IonicContact OE2-NH2 3.03Å; E241-R245 PolarHBondContact OE2-NH2 2.89Å
242	D	76.3	Confident	69.9	Low	74 Å²	74	117.9 Å²	117.9	40%	0.396	60%	0.596	S	S	.	*	H	α-helix	trans	-64.8	-34	178.7	-104	-27	0	0	0	112	L238 R245 K247	L238-D242 PolarHBondContact O-N 3.31Å; D242-R245 PolarHBondContact O-N 3.13Å; D242-K247 WeakPolarHBondContact OD1-CD 3.43Å; D242-K247 WeakPolarHBondContact OD1-CE 3.42Å; D242-K247 IonicContact OD1-NZ 2.68Å; D242-K247 PolarHBondContact OD1-NZ 3.39Å; D242-K247 IonicContact OD2-NZ 3.66Å
243	L	72.1	Confident	68.4	Low	124 Å²	124	118.5 Å²	118.5	65%	0.649	62%	0.616	S	S	*	*	H	α-helix	trans	-63.7	-46	169.1	-73.7	169.5	0	0	0	111.9	Q239 E241 R245 G246	Q239-L243 WeakPolarHBondContact O-CB 3.42Å; Q239-L243 VanDerWaalsContact O-CG 3.3Å; Q239-L243 WeakPolarHBondContact O-CG 3.28Å; Q239-L243 PolarHBondContact O-N 3.08Å; Q239-L243 VanDerWaalsContact O-N 3.11Å; E241-L243 VanDerWaalsContact C-N 3.28Å; E241-L243 PolarHBondContact O-N 3.4Å; L243-R245 VanDerWaalsContact C-N 3.31Å; L243-R245 PolarHBondContact O-N 3Å; L243-G246 PolarHBondContact O-N 3.38Å
244	R	70.1	Confident	65.8	Low	206 Å²	206	117.1 Å²	117.1	78%	0.777	62%	0.62	S	S	*	*	H	α-helix	trans	-65.9	-30	176.1	-75.8	171.3	178.1	-178.3	0.5	113.3	L240 E241 G246	L240-R244 WeakPolarHBondContact O-CB 3.41Å; L240-R244 VanDerWaalsContact O-CG 3.24Å; L240-R244 WeakPolarHBondContact O-CG 3.36Å; L240-R244 PolarHBondContact O-N 2.86Å; E241-R244 CarbonylContact O-C 3.55Å; E241-R244 PolarHBondContact O-N 3.25Å; E241-R244 VanDerWaalsContact O-N 3.12Å; R244-G246 PolarHBondContact O-N 2.72Å
245	R	73.8	Confident	63.4	Low	159 Å²	159	120.9 Å²	120.9	60%	0.6	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.8	4.8	179	-69.2	168.1	-170.8	-83.5	1.5	113.3	E241 D242 L243 K247	E241-R245 VanDerWaalsContact CD-NH2 3.25Å; E241-R245 WeakPolarHBondContact O-CB 3.32Å; E241-R245 WeakPolarHBondContact O-CG 3.34Å; E241-R245 PolarHBondContact O-N 3.33Å; E241-R245 IonicContact OE1-CZ 3.48Å; E241-R245 IonicContact OE1-NE 3.45Å; E241-R245 IonicContact OE1-NH2 2.74Å; E241-R245 PolarHBondContact OE1-NH2 3.36Å; E241-R245 IonicContact OE2-CZ 3.67Å; E241-R245 IonicContact OE2-NE 2.72Å; E241-R245 PolarHBondContact OE2-NE 3.38Å; E241-R245 IonicContact OE2-NH2 3.03Å; E241-R245 PolarHBondContact OE2-NH2 2.89Å; D242-R245 PolarHBondContact O-N 3.13Å; L243-R245 VanDerWaalsContact C-N 3.31Å; L243-R245 PolarHBondContact O-N 3Å; R245-K247 PolarHBondContact O-N 3.2Å
246	G	58.2	Low	61.3	Low	52 Å²	52	119.4 Å²	119.4	54%	0.536	66%	0.659	S	S	.	*	T	Hydrogen-bonded Turn	trans	76.4	20.8	163.3	0	0	0	0	0	116	L243 R244 L248	L243-G246 PolarHBondContact O-N 3.38Å; R244-G246 PolarHBondContact O-N 2.72Å; G246-L248 PolarHBondContact O-N 3.33Å
247	K	54.2	Low	59.1	Low	155 Å²	155	118.1 Å²	118.1	67%	0.674	67%	0.67	S	S	*	*			trans	-76.2	58.1	175.9	-68.8	-178.8	-172.5	156	0	112.8	D242 R245	D242-K247 WeakPolarHBondContact OD1-CD 3.43Å; D242-K247 WeakPolarHBondContact OD1-CE 3.42Å; D242-K247 IonicContact OD1-NZ 2.68Å; D242-K247 PolarHBondContact OD1-NZ 3.39Å; D242-K247 IonicContact OD2-NZ 3.66Å; R245-K247 PolarHBondContact O-N 3.2Å
248	L	54.4	Low	57.1	Low	136 Å²	136	122.9 Å²	122.9	71%	0.712	69%	0.686	S	S	*	*			trans	-147.3	92.2	171.1	-125.7	171.6	0	0	0	110.6	G246	G246-L248 PolarHBondContact O-N 3.33Å
249	N	43.6	Very low	55.1	Low	167 Å²	167	125.2 Å²	125.2	89%	0.893	70%	0.704	S	S	*	*			trans	-147.5	123.1	173.3	-108.8	-36.2	0	0	0	109.9
250	G	43.2	Very low	53.7	Low	61 Å²	61	124.9 Å²	124.9	63%	0.629	71%	0.71	S	S	*	*			trans	84.8	128.6	-164	0	0	0	0	0	111.3
251	I	37.9	Very low	52.6	Low	152 Å²	152	122.5 Å²	122.5	78%	0.779	71%	0.707	S	S	*	*	S	Bend	cis	-133	131.5	17.7	-71.5	172.3	0	0	0	111.5
252	Q	36.5	Very low	51.6	Low	180 Å²	180	122 Å²	122	84%	0.841	72%	0.718	S	S	*	*			trans	46.2	119.7	156.4	-64.1	171.2	15.4	0	0	121.3
253	T	57.9	Low	50.7	Low	157 Å²	157	122.1 Å²	122.1	96%	0.963	73%	0.729	S	S	*	*			trans	-62.8	127.9	150.1	-18	0	0	0	0	110.2
254	G	36.2	Very low	50.3	Low	62 Å²	62	118.7 Å²	118.7	64%	0.639	72%	0.718	S	S	*	*			trans	-161.6	84.5	-175.3	0	0	0	0	0	116
255	L	37.9	Very low	50.3	Low	184 Å²	184	114 Å²	114	96%	0.963	71%	0.708	S	S	*	*	S	Bend	trans	62.9	154.5	173.4	-68	95.5	0	0	0	117.1
256	G	45.1	Very low	50.4	Low	87 Å²	87	112.5 Å²	112.5	90%	0.897	71%	0.708	S	S	*	*			trans	-75.2	136.8	-164.3	0	0	0	0	0	115
257	G	38.8	Very low	51	Low	74 Å²	74	115.7 Å²	115.7	76%	0.763	71%	0.712	S	S	*	*			trans	-155.5	75.2	-179.9	0	0	0	0	0	112.7
258	Q	40.8	Very low	52.1	Low	160 Å²	160	116.6 Å²	116.6	75%	0.748	71%	0.711	S	S	*	*			trans	28.5	104.4	149.7	-153.7	-178.1	-4	0	0	117.6	T260	Q258-T260 HydrophobicContact CB-CG2 4.06Å; Q258-T260 HydrophobicContact CG-CG2 3.79Å; Q258-T260 WeakPolarHBondContact O-CB 3.37Å; Q258-T260 WeakPolarHBondContact O-CG2 3.33Å; Q258-T260 PolarHBondContact O-N 3.5Å; Q258-T260 PolarHBondContact O-OG1 2.98Å
259	V	43.1	Very low	53.2	Low	159 Å²	159	117.5 Å²	117.5	96%	0.964	71%	0.709	S	S	*	*			trans	-60.3	105.6	169.7	-179.7	0	0	0	0	109.3
260	T	49.5	Very low	54.9	Low	98 Å²	98	114.4 Å²	114.4	60%	0.601	69%	0.692	S	S	*	*			trans	-117.8	111.1	-158.6	21.8	0	0	0	0	113.4	Q258 A262	Q258-T260 HydrophobicContact CB-CG2 4.06Å; Q258-T260 HydrophobicContact CG-CG2 3.79Å; Q258-T260 WeakPolarHBondContact O-CB 3.37Å; Q258-T260 WeakPolarHBondContact O-CG2 3.33Å; Q258-T260 PolarHBondContact O-N 3.5Å; Q258-T260 PolarHBondContact O-OG1 2.98Å; T260-A262 VanDerWaalsContact C-N 3.35Å; T260-A262 PolarHBondContact O-N 3.46Å
261	G	54.8	Low	56.7	Low	44 Å²	44	119.5 Å²	119.5	45%	0.454	69%	0.694	S	S	.	*	S	Bend	trans	69.6	-68.3	152.3	0	0	0	0	0	117.8	A264 L265	G261-A264 PolarHBondContact O-N 3Å; G261-L265 WeakPolarHBondContact O-CG 3.3Å; G261-L265 PolarHBondContact O-N 3.33Å
262	A	58.4	Low	58.8	Low	72 Å²	72	118.2 Å²	118.2	60%	0.595	68%	0.684	S	S	*	*	H	α-helix	trans	-56.9	-61.3	-158.1	0	0	0	0	0	113.9	T260 A264 L265 E266	T260-A262 VanDerWaalsContact C-N 3.35Å; T260-A262 PolarHBondContact O-N 3.46Å; A262-A264 PolarHBondContact O-N 2.8Å; A262-L265 WeakPolarHBondContact O-CB 3.41Å; A262-L265 PolarHBondContact O-N 2.72Å; A262-E266 PolarHBondContact O-N 3.08Å
263	A	58	Low	61.1	Low	76 Å²	76	115.3 Å²	115.3	63%	0.628	67%	0.671	S	S	*	*	H	α-helix	trans	-61.6	-32.1	-178.9	0	0	0	0	0	112.9	L267	A263-L267 WeakPolarHBondContact O-CB 3.24Å; A263-L267 PolarHBondContact O-N 2.9Å
264	A	62.9	Low	62.3	Low	51 Å²	51	112.2 Å²	112.2	42%	0.421	65%	0.648	S	S	.	*	H	α-helix	trans	-75	-23.4	176.6	0	0	0	0	0	113.2	G261 A262 R268	G261-A264 PolarHBondContact O-N 3Å; A262-A264 PolarHBondContact O-N 2.8Å; A264-R268 WeakPolarHBondContact O-CD 3.5Å; A264-R268 VanDerWaalsContact O-CG 3.28Å; A264-R268 WeakPolarHBondContact O-CG 3.48Å
265	L	70.3	Confident	64.5	Low	107 Å²	107	115.5 Å²	115.5	56%	0.56	65%	0.646	S	S	*	*	H	α-helix	trans	-81.6	-38.1	170.7	-74.4	166	0	0	0	111.6	G261 A262 R268 K269	G261-L265 WeakPolarHBondContact O-CG 3.3Å; G261-L265 PolarHBondContact O-N 3.33Å; A262-L265 WeakPolarHBondContact O-CB 3.41Å; A262-L265 PolarHBondContact O-N 2.72Å; L265-R268 PolarHBondContact O-N 3.24Å; L265-K269 PolarHBondContact O-N 2.64Å
266	E	76.7	Confident	66.8	Low	129 Å²	129	112 Å²	112	60%	0.603	63%	0.628	S	S	*	*	H	α-helix	trans	-66.6	-45.1	177.2	-172.7	163.1	-144	0	0	111.9	A262 R268 K269 L270	A262-E266 PolarHBondContact O-N 3.08Å; E266-R268 VanDerWaalsContact C-N 3.28Å; E266-R268 PolarHBondContact O-N 3.16Å; E266-K269 WeakPolarHBondContact O-CB 3.48Å; E266-K269 PolarHBondContact O-N 3.27Å; E266-K269 VanDerWaalsContact O-N 3.15Å; E266-L270 HydrophobicContact CG-CD1 4.46Å; E266-L270 WeakPolarHBondContact O-CG 3.29Å; E266-L270 PolarHBondContact O-N 3.2Å
267	L	71.6	Confident	68.2	Low	119 Å²	119	115.4 Å²	115.4	62%	0.623	61%	0.614	S	S	*	*	H	α-helix	trans	-57.8	-40.6	173	-174.6	65.8	0	0	0	111.9	A263 L270 Y271	A263-L267 WeakPolarHBondContact O-CB 3.24Å; A263-L267 PolarHBondContact O-N 2.9Å; L267-L270 PolarHBondContact O-N 2.92Å; L267-Y271 WeakPolarHBondContact O-CB 3.44Å; L267-Y271 PolarHBondContact O-N 2.6Å
268	R	75.9	Confident	70.4	Confident	174 Å²	174	116.8 Å²	116.8	66%	0.657	60%	0.603	S	S	*	*	H	α-helix	trans	-66.9	-39.2	176	-76.9	173.6	177.7	144.8	-2.3	112.7	A264 L265 E266 Y271 Q272	A264-R268 WeakPolarHBondContact O-CD 3.5Å; A264-R268 VanDerWaalsContact O-CG 3.28Å; A264-R268 WeakPolarHBondContact O-CG 3.48Å; L265-R268 PolarHBondContact O-N 3.24Å; E266-R268 VanDerWaalsContact C-N 3.28Å; E266-R268 PolarHBondContact O-N 3.16Å; R268-Y271 PolarHBondContact O-N 3.41Å; R268-Q272 WeakPolarHBondContact O-CB 3.31Å; R268-Q272 PolarHBondContact O-N 2.81Å
269	K	78.6	Confident	72.7	Confident	154 Å²	154	115.5 Å²	115.5	67%	0.67	60%	0.595	S	S	*	*	H	α-helix	trans	-60.2	-48.9	172.4	-82.7	-172.5	172.4	-174.2	0	111.4	L265 E266 Y271 Q272 E273	L265-K269 PolarHBondContact O-N 2.64Å; E266-K269 WeakPolarHBondContact O-CB 3.48Å; E266-K269 PolarHBondContact O-N 3.27Å; E266-K269 VanDerWaalsContact O-N 3.15Å; K269-Y271 VanDerWaalsContact C-N 3.3Å; K269-Y271 PolarHBondContact O-N 2.68Å; K269-Q272 PolarHBondContact O-N 2.86Å; K269-E273 WeakPolarHBondContact O-CB 2.93Å; K269-E273 PolarHBondContact O-N 3.29Å
270	L	78.3	Confident	74.8	Confident	103 Å²	103	112.3 Å²	112.3	54%	0.539	57%	0.572	S	S	.	*	H	α-helix	trans	-61.7	-38.8	179	-69.5	170	0	0	0	111.9	E266 L267 L274	E266-L270 HydrophobicContact CG-CD1 4.46Å; E266-L270 WeakPolarHBondContact O-CG 3.29Å; E266-L270 PolarHBondContact O-N 3.2Å; L267-L270 PolarHBondContact O-N 2.92Å; L270-L274 VanDerWaalsContact O-CB 3.25Å; L270-L274 WeakPolarHBondContact O-CB 3.49Å; L270-L274 PolarHBondContact O-N 3.39Å
271	Y	80.6	Confident	76.5	Confident	168 Å²	168	111.8 Å²	111.8	66%	0.659	57%	0.566	S	S	*	*	H	α-helix	trans	-64.3	-44.7	175	-141.8	-91.5	0	0	0	112.1	L267 R268 K269 L274 Q275	L267-Y271 WeakPolarHBondContact O-CB 3.44Å; L267-Y271 PolarHBondContact O-N 2.6Å; R268-Y271 PolarHBondContact O-N 3.41Å; K269-Y271 VanDerWaalsContact C-N 3.3Å; K269-Y271 PolarHBondContact O-N 2.68Å; Y271-L274 PolarHBondContact O-N 2.51Å; Y271-Q275 WeakPolarHBondContact O-CB 3.44Å; Y271-Q275 PolarHBondContact O-N 3.48Å
272	Q	82.8	Confident	78.1	Confident	125 Å²	125	116.3 Å²	116.3	58%	0.584	58%	0.575	S	S	*	*	H	α-helix	trans	-68.4	-39.1	179	-170.6	169.9	52.7	0	0	112.2	R268 K269 Q275 I276	R268-Q272 WeakPolarHBondContact O-CB 3.31Å; R268-Q272 PolarHBondContact O-N 2.81Å; K269-Q272 PolarHBondContact O-N 2.86Å; Q272-Q275 PolarHBondContact O-N 3.19Å; Q272-I276 HydrophobicContact CG-CD1 4.29Å; Q272-I276 VanDerWaalsContact O-CG1 3.29Å; Q272-I276 WeakPolarHBondContact O-CG1 3.22Å; Q272-I276 PolarHBondContact O-N 3.44Å
273	E	84.3	Confident	79.5	Confident	118 Å²	118	116.7 Å²	116.7	55%	0.551	57%	0.565	S	S	*	*	H	α-helix	trans	-66.9	-41	174.8	-170.7	174.5	165.8	0	0	111.6	K269 I276 R277	K269-E273 WeakPolarHBondContact O-CB 2.93Å; K269-E273 PolarHBondContact O-N 3.29Å; E273-I276 PolarHBondContact O-N 2.92Å; E273-R277 VanDerWaalsContact O-CB 3.3Å; E273-R277 WeakPolarHBondContact O-CB 3.37Å; E273-R277 PolarHBondContact O-N 2.89Å
274	L	83.4	Confident	80.8	Confident	93 Å²	93	119 Å²	119	49%	0.487	56%	0.562	S	S	.	*	H	α-helix	trans	-61.2	-42.9	172.2	179.2	62.1	0	0	0	111.8	L270 Y271 R277 N278	L270-L274 VanDerWaalsContact O-CB 3.25Å; L270-L274 WeakPolarHBondContact O-CB 3.49Å; L270-L274 PolarHBondContact O-N 3.39Å; Y271-L274 PolarHBondContact O-N 2.51Å; L274-R277 PolarHBondContact O-N 2.95Å; L274-N278 WeakPolarHBondContact O-CB 3.38Å; L274-N278 PolarHBondContact O-N 3.4Å
275	Q	82.5	Confident	81.7	Confident	130 Å²	130	120.8 Å²	120.8	61%	0.607	57%	0.565	S	S	*	*	H	α-helix	trans	-65	-41	178.5	-163.9	174.5	15.5	0	0	111.8	Y271 Q272 K279	Y271-Q275 WeakPolarHBondContact O-CB 3.44Å; Y271-Q275 PolarHBondContact O-N 3.48Å; Q272-Q275 PolarHBondContact O-N 3.19Å; Q275-K279 PolarHBondContact O-N 2.96Å
276	I	86.1	Confident	82.6	Confident	112 Å²	112	118.3 Å²	118.3	57%	0.574	56%	0.557	S	S	*	*	H	α-helix	trans	-64.3	-42.5	172.2	-69.2	164.5	0	0	0	110.9	Q272 E273 K279 L280	Q272-I276 HydrophobicContact CG-CD1 4.29Å; Q272-I276 VanDerWaalsContact O-CG1 3.29Å; Q272-I276 WeakPolarHBondContact O-CG1 3.22Å; Q272-I276 PolarHBondContact O-N 3.44Å; E273-I276 PolarHBondContact O-N 2.92Å; I276-K279 PolarHBondContact O-N 2.86Å; I276-L280 WeakPolarHBondContact O-CB 3.32Å; I276-L280 PolarHBondContact O-N 3.32Å
277	R	75.8	Confident	83.2	Confident	158 Å²	158	117.2 Å²	117.2	60%	0.596	55%	0.55	S	S	*	.	H	α-helix	trans	-65.3	-40.3	179.4	-162.7	176.1	-163.6	149.4	7.9	112	E273 L274 N281	E273-R277 VanDerWaalsContact O-CB 3.3Å; E273-R277 WeakPolarHBondContact O-CB 3.37Å; E273-R277 PolarHBondContact O-N 2.89Å; L274-R277 PolarHBondContact O-N 2.95Å; R277-N281 VanDerWaalsContact O-CB 3.32Å; R277-N281 WeakPolarHBondContact O-CB 3.3Å; R277-N281 PolarHBondContact O-N 3.15Å
278	N	84.4	Confident	83.8	Confident	102 Å²	102	115.3 Å²	115.3	55%	0.545	54%	0.54	S	S	.	.	H	α-helix	trans	-63.8	-46.9	172.4	-85.5	-13.9	0	0	0	111.5	L274 L280 N281 Q282	L274-N278 WeakPolarHBondContact O-CB 3.38Å; L274-N278 PolarHBondContact O-N 3.4Å; N278-L280 PolarHBondContact O-N 2.83Å; N278-N281 WeakPolarHBondContact O-CB 3.36Å; N278-N281 PolarHBondContact O-N 3.34Å; N278-Q282 WeakPolarHBondContact O-CB 3.37Å; N278-Q282 PolarHBondContact O-N 3.33Å
279	K	89.1	Confident	84.4	Confident	133 Å²	133	111.2 Å²	111.2	58%	0.578	53%	0.528	S	S	*	.	H	α-helix	trans	-60.6	-43.3	177	-175.6	168.9	-178.2	169	0	112.3	Q275 I276 N281 Q282 E283	Q275-K279 PolarHBondContact O-N 2.96Å; I276-K279 PolarHBondContact O-N 2.86Å; K279-N281 VanDerWaalsContact C-N 3.34Å; K279-N281 PolarHBondContact O-N 2.84Å; K279-Q282 PolarHBondContact O-N 3.34Å; K279-E283 PolarHBondContact O-N 2.91Å
280	L	87.3	Confident	85.1	Confident	93 Å²	93	109.9 Å²	109.9	49%	0.487	52%	0.524	S	S	.	.	H	α-helix	trans	-65.2	-37.3	176.4	-176.2	61.6	0	0	0	112.1	I276 N278 E283 Q284	I276-L280 WeakPolarHBondContact O-CB 3.32Å; I276-L280 PolarHBondContact O-N 3.32Å; N278-L280 PolarHBondContact O-N 2.83Å; L280-E283 PolarHBondContact O-N 3.45Å; L280-Q284 WeakPolarHBondContact O-CG 3.44Å; L280-Q284 PolarHBondContact O-N 2.92Å
281	N	85.6	Confident	85.6	Confident	87 Å²	87	111.4 Å²	111.4	47%	0.465	53%	0.529	S	S	.	.	H	α-helix	trans	-65	-42.5	174	-171.4	-70.4	0	0	0	111.6	R277 N278 K279 Q284 N285	R277-N281 VanDerWaalsContact O-CB 3.32Å; R277-N281 WeakPolarHBondContact O-CB 3.3Å; R277-N281 PolarHBondContact O-N 3.15Å; N278-N281 WeakPolarHBondContact O-CB 3.36Å; N278-N281 PolarHBondContact O-N 3.34Å; K279-N281 VanDerWaalsContact C-N 3.34Å; K279-N281 PolarHBondContact O-N 2.84Å; N281-Q284 PolarHBondContact O-N 3.39Å; N281-N285 WeakPolarHBondContact O-CB 3.19Å; N281-N285 PolarHBondContact O-N 2.76Å; N281-N285 PolarHBondContact O-ND2 2.88Å; N281-N285 PolarHBondContact OD1-ND2 3.3Å
282	Q	87.8	Confident	86	Confident	139 Å²	139	109 Å²	109	65%	0.65	52%	0.522	S	S	*	.	H	α-helix	trans	-64.4	-39.3	175.3	-164.4	179.4	24.5	0	0	112	N278 K279 S286	N278-Q282 WeakPolarHBondContact O-CB 3.37Å; N278-Q282 PolarHBondContact O-N 3.33Å; K279-Q282 PolarHBondContact O-N 3.34Å; Q282-S286 WeakPolarHBondContact O-CB 3.43Å; Q282-S286 PolarHBondContact O-N 2.86Å; Q282-S286 PolarHBondContact O-OG 2.88Å
283	E	87.4	Confident	86.5	Confident	80 Å²	80	108.2 Å²	108.2	37%	0.374	52%	0.518	S	S	.	.	H	α-helix	trans	-66.1	-35	171	-81.4	-166.4	-141.6	0	0	113.5	K279 L280 S286 K287	K279-E283 PolarHBondContact O-N 2.91Å; L280-E283 PolarHBondContact O-N 3.45Å; E283-S286 WeakPolarHBondContact CA-OG 3.34Å; E283-S286 PolarHBondContact O-OG 2.82Å; E283-K287 WeakPolarHBondContact O-CB 3.46Å; E283-K287 VanDerWaalsContact O-CD 3.27Å; E283-K287 WeakPolarHBondContact O-CD 3.47Å; E283-K287 WeakPolarHBondContact O-CG 3.47Å; E283-K287 PolarHBondContact O-N 3.43Å; E283-K287 VanDerWaalsContact O-N 3.14Å; E283-K287 IonicContact OE2-NZ 2.7Å; E283-K287 PolarHBondContact OE2-NZ 2.96Å
284	Q	86.4	Confident	86.9	Confident	123 Å²	123	107.6 Å²	107.6	58%	0.575	52%	0.518	S	S	*	.	H	α-helix	trans	-72.7	-42.7	174.5	-77.7	-174.9	-24.7	0	0	111.7	L280 N281 K287 L288	L280-Q284 WeakPolarHBondContact O-CG 3.44Å; L280-Q284 PolarHBondContact O-N 2.92Å; N281-Q284 PolarHBondContact O-N 3.39Å; Q284-K287 PolarHBondContact O-N 3.2Å; Q284-L288 WeakPolarHBondContact O-CB 3.48Å; Q284-L288 PolarHBondContact O-N 2.91Å
285	N	82	Confident	87.1	Confident	90 Å²	90	108.2 Å²	108.2	48%	0.481	52%	0.521	S	S	.	.	H	α-helix	trans	-64.5	-41.9	176.5	-93.8	-57.2	0	0	0	112	N281 L288 Q289	N281-N285 WeakPolarHBondContact O-CB 3.19Å; N281-N285 PolarHBondContact O-N 2.76Å; N281-N285 PolarHBondContact O-ND2 2.88Å; N281-N285 PolarHBondContact OD1-ND2 3.3Å; N285-L288 PolarHBondContact O-N 3.24Å; N285-Q289 VanDerWaalsContact O-CB 3.3Å; N285-Q289 WeakPolarHBondContact O-CB 3.47Å; N285-Q289 PolarHBondContact O-N 2.83Å
286	S	88.6	Confident	87.5	Confident	55 Å²	55	106.9 Å²	106.9	39%	0.385	52%	0.518	S	S	.	.	H	α-helix	trans	-66.1	-39.9	174.8	51.1	0	0	0	0	112.8	Q282 E283 Q289 Q290	Q282-S286 WeakPolarHBondContact O-CB 3.43Å; Q282-S286 PolarHBondContact O-N 2.86Å; Q282-S286 PolarHBondContact O-OG 2.88Å; E283-S286 WeakPolarHBondContact CA-OG 3.34Å; E283-S286 PolarHBondContact O-OG 2.82Å; S286-Q289 PolarHBondContact O-N 3.34Å; S286-Q290 WeakPolarHBondContact O-CG 3.36Å; S286-Q290 PolarHBondContact O-N 2.88Å
287	K	87.8	Confident	87.9	Confident	106 Å²	106	109.1 Å²	109.1	46%	0.461	52%	0.524	S	S	.	.	H	α-helix	trans	-63.3	-41.1	172.3	-74.7	164.4	-171.1	146.6	0	112.1	E283 Q284 Q290 Q291	E283-K287 WeakPolarHBondContact O-CB 3.46Å; E283-K287 VanDerWaalsContact O-CD 3.27Å; E283-K287 WeakPolarHBondContact O-CD 3.47Å; E283-K287 WeakPolarHBondContact O-CG 3.47Å; E283-K287 PolarHBondContact O-N 3.43Å; E283-K287 VanDerWaalsContact O-N 3.14Å; E283-K287 IonicContact OE2-NZ 2.7Å; E283-K287 PolarHBondContact OE2-NZ 2.96Å; Q284-K287 PolarHBondContact O-N 3.2Å; K287-Q290 PolarHBondContact O-N 3Å; K287-Q291 WeakPolarHBondContact O-CG 3.23Å; K287-Q291 PolarHBondContact O-N 3.48Å
288	L	85.9	Confident	88.6	Confident	78 Å²	78	108.8 Å²	108.8	41%	0.408	52%	0.522	S	S	.	.	H	α-helix	trans	-65.6	-39	175.4	-177	64.6	0	0	0	111.8	Q284 N285 Q291 K292	Q284-L288 WeakPolarHBondContact O-CB 3.48Å; Q284-L288 PolarHBondContact O-N 2.91Å; N285-L288 PolarHBondContact O-N 3.24Å; L288-Q291 PolarHBondContact O-N 3.48Å; L288-K292 WeakPolarHBondContact O-CG 3.48Å; L288-K292 PolarHBondContact O-N 3.04Å
289	Q	88.3	Confident	88.8	Confident	88 Å²	88	108.1 Å²	108.1	41%	0.411	52%	0.519	S	S	.	.	H	α-helix	trans	-66.1	-44.8	176	-177.4	59.8	19.9	0	0	111.6	N285 S286 Q291 K292 E293	N285-Q289 VanDerWaalsContact O-CB 3.3Å; N285-Q289 WeakPolarHBondContact O-CB 3.47Å; N285-Q289 PolarHBondContact O-N 2.83Å; S286-Q289 PolarHBondContact O-N 3.34Å; Q289-Q291 VanDerWaalsContact C-N 3.29Å; Q289-Q291 PolarHBondContact O-N 2.8Å; Q289-K292 WeakPolarHBondContact O-CB 3.32Å; Q289-K292 PolarHBondContact O-N 3.43Å; Q289-K292 VanDerWaalsContact O-N 3.15Å; Q289-E293 WeakPolarHBondContact CG-OE1 3.45Å; Q289-E293 PolarHBondContact NE2-OE1 3.42Å; Q289-E293 WeakPolarHBondContact O-CG 3.48Å; Q289-E293 PolarHBondContact O-N 3.33Å
290	Q	92.1	Very high	88.9	Confident	126 Å²	126	107.1 Å²	107.1	59%	0.589	52%	0.517	S	S	*	.	H	α-helix	trans	-59.2	-39.1	172.4	-73.1	173.5	5.4	0	0	112.1	S286 K287 E293 L294	S286-Q290 WeakPolarHBondContact O-CG 3.36Å; S286-Q290 PolarHBondContact O-N 2.88Å; K287-Q290 PolarHBondContact O-N 3Å; Q290-E293 PolarHBondContact O-N 2.89Å; Q290-L294 VanDerWaalsContact O-CB 3.29Å; Q290-L294 WeakPolarHBondContact O-CB 3.25Å; Q290-L294 PolarHBondContact O-N 3.36Å
291	Q	89	Confident	89.1	Confident	135 Å²	135	108.2 Å²	108.2	63%	0.631	52%	0.52	S	S	*	.	H	α-helix	trans	-65.7	-42.2	173.8	-75.7	-178.6	-12.1	0	0	112.4	K287 L288 Q289 L294 L295	K287-Q291 WeakPolarHBondContact O-CG 3.23Å; K287-Q291 PolarHBondContact O-N 3.48Å; L288-Q291 PolarHBondContact O-N 3.48Å; Q289-Q291 VanDerWaalsContact C-N 3.29Å; Q289-Q291 PolarHBondContact O-N 2.8Å; Q291-L294 PolarHBondContact O-N 2.91Å; Q291-L295 VanDerWaalsContact O-CB 3.31Å; Q291-L295 WeakPolarHBondContact O-CB 3.37Å; Q291-L295 PolarHBondContact O-N 2.79Å
292	K	90.2	Very high	89.3	Confident	119 Å²	119	107.7 Å²	107.7	52%	0.517	52%	0.52	S	S	.	.	H	α-helix	trans	-60.6	-43.7	173.9	-74.8	173.5	178.8	177.4	0	111.9	L288 Q289 L295 N296	L288-K292 WeakPolarHBondContact O-CG 3.48Å; L288-K292 PolarHBondContact O-N 3.04Å; Q289-K292 WeakPolarHBondContact O-CB 3.32Å; Q289-K292 PolarHBondContact O-N 3.43Å; Q289-K292 VanDerWaalsContact O-N 3.15Å; K292-L295 PolarHBondContact O-N 3.08Å; K292-N296 WeakPolarHBondContact O-CB 3.47Å; K292-N296 PolarHBondContact O-N 3.26Å
293	E	92.2	Very high	89.5	Confident	107 Å²	107	105.2 Å²	105.2	50%	0.5	52%	0.515	S	S	.	.	H	α-helix	trans	-67	-40.6	178.4	-74.6	168.2	-162.9	0	0	112.2	Q289 Q290 N296 K297	Q289-E293 WeakPolarHBondContact CG-OE1 3.45Å; Q289-E293 PolarHBondContact NE2-OE1 3.42Å; Q289-E293 WeakPolarHBondContact O-CG 3.48Å; Q289-E293 PolarHBondContact O-N 3.33Å; Q290-E293 PolarHBondContact O-N 2.89Å; E293-N296 PolarHBondContact O-N 3.26Å; E293-K297 WeakPolarHBondContact O-CB 3.3Å; E293-K297 PolarHBondContact O-N 3.22Å
294	L	92.3	Very high	89.8	Confident	106 Å²	106	106.8 Å²	106.8	56%	0.555	53%	0.525	S	S	*	.	H	α-helix	trans	-68.7	-35.3	176.7	-159.1	154.1	0	0	0	111.6	Q290 Q291 R298	Q290-L294 VanDerWaalsContact O-CB 3.29Å; Q290-L294 WeakPolarHBondContact O-CB 3.25Å; Q290-L294 PolarHBondContact O-N 3.36Å; Q291-L294 PolarHBondContact O-N 2.91Å; L294-R298 HydrophobicContact CD2-CG 4.5Å; L294-R298 WeakPolarHBondContact O-CG 3.28Å; L294-R298 PolarHBondContact O-N 3.2Å
295	L	87.5	Confident	89.9	Confident	105 Å²	105	106.1 Å²	106.1	55%	0.55	52%	0.523	S	S	.	.	H	α-helix	trans	-67.5	-43.2	170.7	-178	62.2	0	0	0	112	Q291 K292 K297 R298 N299	Q291-L295 VanDerWaalsContact O-CB 3.31Å; Q291-L295 WeakPolarHBondContact O-CB 3.37Å; Q291-L295 PolarHBondContact O-N 2.79Å; K292-L295 PolarHBondContact O-N 3.08Å; L295-K297 VanDerWaalsContact C-N 3.31Å; L295-K297 PolarHBondContact O-N 3.23Å; L295-R298 WeakPolarHBondContact O-CB 3.38Å; L295-R298 PolarHBondContact O-N 2.89Å; L295-R298 VanDerWaalsContact O-N 3.17Å; L295-N299 PolarHBondContact O-N 3.01Å; L295-N299 PolarHBondContact O-OD1 2.87Å
296	N	91.8	Very high	90.3	Very high	102 Å²	102	105.9 Å²	105.9	55%	0.545	52%	0.522	S	S	.	.	H	α-helix	trans	-62.3	-40.2	175.9	-166.3	6.3	0	0	0	111.1	K292 E293 R298 N299 M300	K292-N296 WeakPolarHBondContact O-CB 3.47Å; K292-N296 PolarHBondContact O-N 3.26Å; E293-N296 PolarHBondContact O-N 3.26Å; N296-R298 PolarHBondContact O-N 3.46Å; N296-N299 PolarHBondContact O-N 3.34Å; N296-M300 PolarHBondContact O-N 3.33Å
297	K	94.8	Very high	90.6	Very high	159 Å²	159	109.4 Å²	109.4	69%	0.691	53%	0.53	S	S	*	.	H	α-helix	trans	-61.5	-41.4	172.7	-171.5	176.6	-178.5	176.3	0	112.6	E293 L295 M300 E301	E293-K297 WeakPolarHBondContact O-CB 3.3Å; E293-K297 PolarHBondContact O-N 3.22Å; L295-K297 VanDerWaalsContact C-N 3.31Å; L295-K297 PolarHBondContact O-N 3.23Å; K297-M300 PolarHBondContact O-N 2.88Å; K297-E301 PolarHBondContact O-N 3.35Å
298	R	90.9	Very high	90.9	Very high	152 Å²	152	112.9 Å²	112.9	57%	0.574	54%	0.54	S	S	*	.	H	α-helix	trans	-61.6	-44.9	172.4	-77	-85.7	-171.2	74.6	0.1	111.7	L294 L295 N296 M300 E301 V302	L294-R298 HydrophobicContact CD2-CG 4.5Å; L294-R298 WeakPolarHBondContact O-CG 3.28Å; L294-R298 PolarHBondContact O-N 3.2Å; L295-R298 WeakPolarHBondContact O-CB 3.38Å; L295-R298 PolarHBondContact O-N 2.89Å; L295-R298 VanDerWaalsContact O-N 3.17Å; N296-R298 PolarHBondContact O-N 3.46Å; R298-M300 VanDerWaalsContact C-N 3.35Å; R298-M300 PolarHBondContact O-N 3.33Å; R298-E301 WeakPolarHBondContact O-CB 3.36Å; R298-E301 PolarHBondContact O-N 3.29Å; R298-V302 WeakPolarHBondContact O-CG2 3.45Å; R298-V302 PolarHBondContact O-N 3.12Å
299	N	87.7	Confident	91.3	Very high	88 Å²	88	112.5 Å²	112.5	47%	0.471	54%	0.538	S	S	.	.	H	α-helix	trans	-62.9	-41.7	178	-71.8	3	0	0	0	111.5	L295 N296 E301 V302 T303	L295-N299 PolarHBondContact O-N 3.01Å; L295-N299 PolarHBondContact O-OD1 2.87Å; N296-N299 PolarHBondContact O-N 3.34Å; N299-E301 VanDerWaalsContact C-N 3.34Å; N299-E301 PolarHBondContact O-N 2.83Å; N299-V302 PolarHBondContact O-N 2.87Å; N299-T303 PolarHBondContact O-N 3.31Å; N299-T303 PolarHBondContact O-OG1 2.9Å
300	M	91.9	Very high	91.4	Very high	111 Å²	111	111.7 Å²	111.7	55%	0.547	54%	0.542	S	S	.	.	H	α-helix	trans	-61.5	-40.2	174.2	-169.3	64.2	63	0	0	112.3	N296 K297 R298 T303 L304	N296-M300 PolarHBondContact O-N 3.33Å; K297-M300 PolarHBondContact O-N 2.88Å; R298-M300 VanDerWaalsContact C-N 3.35Å; R298-M300 PolarHBondContact O-N 3.33Å; M300-T303 PolarHBondContact O-N 3.45Å; M300-L304 VanDerWaalsContact O-CG 3.31Å; M300-L304 WeakPolarHBondContact O-CG 3.44Å; M300-L304 PolarHBondContact O-N 3.44Å
301	E	91.1	Very high	91.5	Very high	116 Å²	116	108.9 Å²	108.9	54%	0.542	53%	0.529	S	S	.	.	H	α-helix	trans	-64.3	-42.3	175	-173.3	172	-162.8	0	0	111.9	K297 R298 N299 L304 M305	K297-E301 PolarHBondContact O-N 3.35Å; R298-E301 WeakPolarHBondContact O-CB 3.36Å; R298-E301 PolarHBondContact O-N 3.29Å; N299-E301 VanDerWaalsContact C-N 3.34Å; N299-E301 PolarHBondContact O-N 2.83Å; E301-L304 PolarHBondContact O-N 3.36Å; E301-M305 WeakPolarHBondContact O-CG 3.02Å; E301-M305 PolarHBondContact O-N 2.91Å
302	V	89.9	Confident	91.7	Very high	76 Å²	76	106.8 Å²	106.8	46%	0.461	52%	0.522	S	S	.	.	H	α-helix	trans	-62.5	-47.3	173	172.2	0	0	0	0	111.2	R298 N299 L304 M305 D306	R298-V302 WeakPolarHBondContact O-CG2 3.45Å; R298-V302 PolarHBondContact O-N 3.12Å; N299-V302 PolarHBondContact O-N 2.87Å; V302-L304 VanDerWaalsContact C-N 3.27Å; V302-L304 PolarHBondContact O-N 3.5Å; V302-M305 CarbonylContact O-C 3.55Å; V302-M305 WeakPolarHBondContact O-CA 3.26Å; V302-M305 WeakPolarHBondContact O-CB 3.05Å; V302-M305 PolarHBondContact O-N 3.35Å; V302-D306 WeakPolarHBondContact CG1-OD2 3.49Å; V302-D306 PolarHBondContact O-N 2.9Å
303	T	92.6	Very high	91.8	Very high	88 Å²	88	109 Å²	109	54%	0.54	53%	0.527	S	S	.	.	H	α-helix	trans	-58.1	-38.1	176.7	-56	0	0	0	0	112.3	N299 M300 K307	N299-T303 PolarHBondContact O-N 3.31Å; N299-T303 PolarHBondContact O-OG1 2.9Å; M300-T303 PolarHBondContact O-N 3.45Å; T303-K307 WeakPolarHBondContact O-CB 3.16Å; T303-K307 PolarHBondContact O-N 3.32Å
304	L	93.2	Very high	91.8	Very high	113 Å²	113	110.2 Å²	110.2	59%	0.592	53%	0.532	S	S	*	.	H	α-helix	trans	-69.2	-34.3	173.9	-71.9	168.9	0	0	0	112.6	M300 E301 V302 R308	M300-L304 VanDerWaalsContact O-CG 3.31Å; M300-L304 WeakPolarHBondContact O-CG 3.44Å; M300-L304 PolarHBondContact O-N 3.44Å; E301-L304 PolarHBondContact O-N 3.36Å; V302-L304 VanDerWaalsContact C-N 3.27Å; V302-L304 PolarHBondContact O-N 3.5Å; L304-R308 WeakPolarHBondContact O-CB 3.1Å; L304-R308 PolarHBondContact O-N 2.88Å; L304-R308 VanDerWaalsContact O-N 3.1Å
305	M	88.8	Confident	91.8	Very high	109 Å²	109	112.5 Å²	112.5	54%	0.537	53%	0.534	S	S	.	.	H	α-helix	trans	-66.9	-45.4	171.9	-74.3	-178.3	54.7	0	0	112	E301 V302 R308 I309	E301-M305 WeakPolarHBondContact O-CG 3.02Å; E301-M305 PolarHBondContact O-N 2.91Å; V302-M305 CarbonylContact O-C 3.55Å; V302-M305 WeakPolarHBondContact O-CA 3.26Å; V302-M305 WeakPolarHBondContact O-CB 3.05Å; V302-M305 PolarHBondContact O-N 3.35Å; M305-R308 CarbonylContact O-C 3.49Å; M305-R308 WeakPolarHBondContact O-CA 3.4Å; M305-R308 WeakPolarHBondContact O-CB 3.15Å; M305-R308 PolarHBondContact O-N 3.35Å; M305-R308 VanDerWaalsContact O-N 3.1Å; M305-I309 WeakPolarHBondContact O-CG1 3.46Å; M305-I309 PolarHBondContact O-N 3.14Å
306	D	89.4	Confident	92	Very high	85 Å²	85	113.2 Å²	113.2	46%	0.455	54%	0.537	S	S	.	.	H	α-helix	trans	-67.1	-37.9	-180	-69.3	-37.1	0	0	0	112.4	V302 R308 I309 S310	V302-D306 WeakPolarHBondContact CG1-OD2 3.49Å; V302-D306 PolarHBondContact O-N 2.9Å; D306-R308 VanDerWaalsContact C-N 3.34Å; D306-R308 PolarHBondContact O-N 2.98Å; D306-I309 PolarHBondContact O-N 3.17Å; D306-S310 WeakPolarHBondContact O-CB 3.33Å; D306-S310 PolarHBondContact O-N 3.2Å; D306-S310 PolarHBondContact O-OG 3.04Å
307	K	95.1	Very high	91.9	Very high	128 Å²	128	116.4 Å²	116.4	56%	0.557	54%	0.543	S	S	*	.	H	α-helix	trans	-58.2	-46.5	167.9	-178.2	175.5	177.1	177.2	0	111.3	T303 I309 S310 E311	T303-K307 WeakPolarHBondContact O-CB 3.16Å; T303-K307 PolarHBondContact O-N 3.32Å; K307-I309 PolarHBondContact O-N 2.75Å; K307-S310 WeakPolarHBondContact O-CB 3.23Å; K307-S310 PolarHBondContact O-N 3.38Å; K307-S310 VanDerWaalsContact O-N 3.15Å; K307-E311 WeakPolarHBondContact CE-OE1 3.32Å; K307-E311 PolarHBondContact O-N 3.01Å
308	R	93.8	Very high	91.7	Very high	180 Å²	180	115 Å²	115	68%	0.679	54%	0.537	S	S	*	.	H	α-helix	trans	-65.8	-35.9	178.9	-172.3	179.2	-178.5	-172.2	0.9	112.7	L304 M305 D306 S310 L312	L304-R308 WeakPolarHBondContact O-CB 3.1Å; L304-R308 PolarHBondContact O-N 2.88Å; L304-R308 VanDerWaalsContact O-N 3.1Å; M305-R308 CarbonylContact O-C 3.49Å; M305-R308 WeakPolarHBondContact O-CA 3.4Å; M305-R308 WeakPolarHBondContact O-CB 3.15Å; M305-R308 PolarHBondContact O-N 3.35Å; M305-R308 VanDerWaalsContact O-N 3.1Å; D306-R308 VanDerWaalsContact C-N 3.34Å; D306-R308 PolarHBondContact O-N 2.98Å; R308-S310 VanDerWaalsContact C-N 3.33Å; R308-L312 HydrophobicContact CG-CD1 4.38Å; R308-L312 WeakPolarHBondContact O-CB 3.48Å; R308-L312 VanDerWaalsContact O-CG 3.23Å; R308-L312 WeakPolarHBondContact O-CG 3.17Å; R308-L312 PolarHBondContact O-N 3.37Å
309	I	94.5	Very high	91.7	Very high	70 Å²	70	114.8 Å²	114.8	36%	0.359	54%	0.54	S	S	.	.	H	α-helix	trans	-64.4	-41	172.2	-71.1	163.6	0	0	0	109.9	M305 D306 K307 L312 R313	M305-I309 WeakPolarHBondContact O-CG1 3.46Å; M305-I309 PolarHBondContact O-N 3.14Å; D306-I309 PolarHBondContact O-N 3.17Å; K307-I309 PolarHBondContact O-N 2.75Å; I309-L312 PolarHBondContact O-N 3.38Å; I309-R313 HydrophobicContact CG2-CG 4.46Å; I309-R313 WeakPolarHBondContact O-CG 3.1Å; I309-R313 PolarHBondContact O-N 2.87Å
310	S	90.8	Very high	91.7	Very high	71 Å²	71	116.9 Å²	116.9	50%	0.497	55%	0.545	S	S	.	.	H	α-helix	trans	-64.5	-47.2	177.1	-56.3	0	0	0	0	111.8	D306 K307 R308 L312 R313 E314	D306-S310 WeakPolarHBondContact O-CB 3.33Å; D306-S310 PolarHBondContact O-N 3.2Å; D306-S310 PolarHBondContact O-OG 3.04Å; K307-S310 WeakPolarHBondContact O-CB 3.23Å; K307-S310 PolarHBondContact O-N 3.38Å; K307-S310 VanDerWaalsContact O-N 3.15Å; R308-S310 VanDerWaalsContact C-N 3.33Å; S310-L312 VanDerWaalsContact C-N 3.27Å; S310-L312 PolarHBondContact O-N 3.39Å; S310-R313 PolarHBondContact O-N 3.3Å; S310-E314 PolarHBondContact O-N 2.79Å
311	E	94.1	Very high	91.1	Very high	66 Å²	66	114.1 Å²	114.1	31%	0.308	54%	0.54	S	S	.	.	H	α-helix	trans	-59.2	-35.7	172.9	-71.4	-179.3	-150.1	0	0	112.7	K307 R315	K307-E311 WeakPolarHBondContact CE-OE1 3.32Å; K307-E311 PolarHBondContact O-N 3.01Å; E311-R315 WeakPolarHBondContact O-CB 3.5Å; E311-R315 WeakPolarHBondContact O-CD 3.43Å; E311-R315 WeakPolarHBondContact O-CG 3.44Å; E311-R315 PolarHBondContact O-N 2.62Å; E311-R315 IonicContact OE2-NH2 2.71Å; E311-R315 PolarHBondContact OE2-NH2 2.89Å
312	L	92.8	Very high	90.5	Very high	91 Å²	91	113 Å²	113	48%	0.476	53%	0.534	S	S	.	.	H	α-helix	trans	-72.5	-38.8	175.9	-73.9	169.1	0	0	0	112.3	R308 I309 S310 L316	R308-L312 HydrophobicContact CG-CD1 4.38Å; R308-L312 WeakPolarHBondContact O-CB 3.48Å; R308-L312 VanDerWaalsContact O-CG 3.23Å; R308-L312 WeakPolarHBondContact O-CG 3.17Å; R308-L312 PolarHBondContact O-N 3.37Å; I309-L312 PolarHBondContact O-N 3.38Å; S310-L312 VanDerWaalsContact C-N 3.27Å; S310-L312 PolarHBondContact O-N 3.39Å; L312-L316 WeakPolarHBondContact O-CB 3.37Å; L312-L316 WeakPolarHBondContact O-CG 3.25Å; L312-L316 PolarHBondContact O-N 3.43Å
313	R	91.8	Very high	89.6	Confident	165 Å²	165	112.1 Å²	112.1	62%	0.623	54%	0.535	S	S	*	.	H	α-helix	trans	-62.6	-46.9	172.6	-75.1	174.7	176.5	-162.9	-0.6	110.9	I309 S310 R315 L316 Y317	I309-R313 HydrophobicContact CG2-CG 4.46Å; I309-R313 WeakPolarHBondContact O-CG 3.1Å; I309-R313 PolarHBondContact O-N 2.87Å; S310-R313 PolarHBondContact O-N 3.3Å; R313-R315 PolarHBondContact O-N 2.99Å; R313-L316 WeakPolarHBondContact O-CB 3.45Å; R313-L316 PolarHBondContact O-N 3.06Å; R313-Y317 WeakPolarHBondContact O-CD2 3.43Å; R313-Y317 PolarHBondContact O-N 3.47Å
314	E	93.4	Very high	88.3	Confident	133 Å²	133	116 Å²	116	62%	0.621	54%	0.54	S	S	*	.	H	α-helix	trans	-59.8	-46.5	176.7	-166.8	-159.7	157.2	0	0	111.4	S310 L316 Y317 K318	S310-E314 PolarHBondContact O-N 2.79Å; E314-L316 VanDerWaalsContact C-N 3.3Å; E314-L316 PolarHBondContact O-N 2.91Å; E314-Y317 PolarHBondContact O-N 2.95Å; E314-K318 WeakPolarHBondContact O-CB 3.44Å; E314-K318 PolarHBondContact O-N 3.17Å
315	R	92.8	Very high	86.8	Confident	155 Å²	155	117.2 Å²	117.2	59%	0.585	54%	0.543	S	S	*	.	H	α-helix	trans	-62.5	-34.4	175.6	-71.3	171.6	-158.1	-170	12.2	112.7	E311 R313 K319	E311-R315 WeakPolarHBondContact O-CB 3.5Å; E311-R315 WeakPolarHBondContact O-CD 3.43Å; E311-R315 WeakPolarHBondContact O-CG 3.44Å; E311-R315 PolarHBondContact O-N 2.62Å; E311-R315 IonicContact OE2-NH2 2.71Å; E311-R315 PolarHBondContact OE2-NH2 2.89Å; R313-R315 PolarHBondContact O-N 2.99Å; R315-K319 WeakPolarHBondContact O-CB 3.3Å; R315-K319 PolarHBondContact O-N 3.43Å
316	L	90.3	Very high	85.4	Confident	120 Å²	120	120.5 Å²	120.5	63%	0.628	55%	0.554	S	S	*	*	H	α-helix	trans	-68.6	-44.9	173	-80.5	167	0	0	0	111.9	L312 R313 E314 K319 K320	L312-L316 WeakPolarHBondContact O-CB 3.37Å; L312-L316 WeakPolarHBondContact O-CG 3.25Å; L312-L316 PolarHBondContact O-N 3.43Å; R313-L316 WeakPolarHBondContact O-CB 3.45Å; R313-L316 PolarHBondContact O-N 3.06Å; E314-L316 VanDerWaalsContact C-N 3.3Å; E314-L316 PolarHBondContact O-N 2.91Å; L316-K319 PolarHBondContact O-N 3.37Å; L316-K320 WeakPolarHBondContact O-CB 3.38Å; L316-K320 PolarHBondContact O-N 3Å
317	Y	89.4	Confident	83.7	Confident	169 Å²	169	123.6 Å²	123.6	66%	0.663	57%	0.566	S	S	*	*	H	α-helix	trans	-61.3	-47.6	174.9	-89.1	-68.8	0	0	0	111.9	R313 E314 K319 K320 A321	R313-Y317 WeakPolarHBondContact O-CD2 3.43Å; R313-Y317 PolarHBondContact O-N 3.47Å; E314-Y317 PolarHBondContact O-N 2.95Å; Y317-K319 PolarHBondContact O-N 3.26Å; Y317-K320 WeakPolarHBondContact O-CB 3.43Å; Y317-K320 PolarHBondContact O-N 3.14Å; Y317-K320 VanDerWaalsContact O-N 3.15Å; Y317-A321 PolarHBondContact O-N 2.96Å
318	K	91	Very high	81.4	Confident	128 Å²	128	123.5 Å²	123.5	56%	0.557	57%	0.571	S	S	*	*	H	α-helix	trans	-59.3	-45.1	175.5	-177.2	167.6	-179.3	169.5	0	111.7	E314 K320 A321 E322	E314-K318 WeakPolarHBondContact O-CB 3.44Å; E314-K318 PolarHBondContact O-N 3.17Å; K318-K320 VanDerWaalsContact C-N 3.33Å; K318-K320 PolarHBondContact O-N 2.86Å; K318-A321 PolarHBondContact O-N 3.28Å; K318-E322 WeakPolarHBondContact CE-OE1 3.32Å; K318-E322 HydrophobicContact CG-CG 4.45Å; K318-E322 WeakPolarHBondContact CG-OE1 3.33Å; K318-E322 WeakPolarHBondContact O-CB 3.29Å; K318-E322 WeakPolarHBondContact O-CG 3.39Å; K318-E322 PolarHBondContact O-N 3.48Å
319	K	91.3	Very high	78.9	Confident	148 Å²	148	121.3 Å²	121.3	64%	0.643	57%	0.573	S	S	*	*	H	α-helix	trans	-65.5	-32.7	175.9	-170.1	174.9	-178.4	-178.2	0	113	R315 L316 Y317 A323	R315-K319 WeakPolarHBondContact O-CB 3.3Å; R315-K319 PolarHBondContact O-N 3.43Å; L316-K319 PolarHBondContact O-N 3.37Å; Y317-K319 PolarHBondContact O-N 3.26Å; K319-A323 WeakPolarHBondContact O-CB 3.46Å; K319-A323 PolarHBondContact O-N 3.44Å
320	K	86.8	Confident	76.7	Confident	133 Å²	133	124.1 Å²	124.1	58%	0.578	60%	0.595	S	S	*	*	H	α-helix	trans	-69.4	-37.6	173.5	-170.3	179.1	-179.1	-176.5	0	111.5	L316 Y317 K318 R324	L316-K320 WeakPolarHBondContact O-CB 3.38Å; L316-K320 PolarHBondContact O-N 3Å; Y317-K320 WeakPolarHBondContact O-CB 3.43Å; Y317-K320 PolarHBondContact O-N 3.14Å; Y317-K320 VanDerWaalsContact O-N 3.15Å; K318-K320 VanDerWaalsContact C-N 3.33Å; K318-K320 PolarHBondContact O-N 2.86Å; K320-R324 PolarHBondContact O-N 2.85Å; K320-R324 VanDerWaalsContact O-N 3.12Å
321	A	80.3	Confident	74	Confident	52 Å²	52	129 Å²	129	43%	0.43	62%	0.615	S	S	.	*	H	α-helix	trans	-69.8	-44.8	173	0	0	0	0	0	112.3	Y317 K318 A323 R324 Q325	Y317-A321 PolarHBondContact O-N 2.96Å; K318-A321 PolarHBondContact O-N 3.28Å; A321-A323 VanDerWaalsContact C-N 3.26Å; A321-A323 PolarHBondContact O-N 2.95Å; A321-R324 PolarHBondContact O-N 3.46Å; A321-Q325 PolarHBondContact O-N 3.17Å
322	E	79.2	Confident	71.4	Confident	92 Å²	92	133.3 Å²	133.3	43%	0.43	64%	0.64	S	S	.	*	H	α-helix	trans	-61.1	-33	174.1	-73.7	172	-170.1	0	0	112.3	K318 K326	K318-E322 WeakPolarHBondContact CE-OE1 3.32Å; K318-E322 HydrophobicContact CG-CG 4.45Å; K318-E322 WeakPolarHBondContact CG-OE1 3.33Å; K318-E322 WeakPolarHBondContact O-CB 3.29Å; K318-E322 WeakPolarHBondContact O-CG 3.39Å; K318-E322 PolarHBondContact O-N 3.48Å; E322-K326 WeakPolarHBondContact O-CG 3.4Å; E322-K326 PolarHBondContact O-N 3.43Å; E322-K326 VanDerWaalsContact O-N 3.15Å
323	A	70.6	Confident	68.4	Low	59 Å²	59	140.4 Å²	140.4	49%	0.488	66%	0.661	S	S	.	*	H	α-helix	trans	-66.3	-51	171.4	0	0	0	0	0	111.6	K319 A321 Q325 K326 E327	K319-A323 WeakPolarHBondContact O-CB 3.46Å; K319-A323 PolarHBondContact O-N 3.44Å; A321-A323 VanDerWaalsContact C-N 3.26Å; A321-A323 PolarHBondContact O-N 2.95Å; A323-Q325 VanDerWaalsContact C-N 3.29Å; A323-Q325 PolarHBondContact O-N 3.04Å; A323-K326 PolarHBondContact O-N 2.9Å; A323-K326 VanDerWaalsContact O-N 3.09Å; A323-E327 PolarHBondContact O-N 2.87Å; A323-E327 VanDerWaalsContact O-N 3.13Å
324	R	64.8	Low	65.9	Low	170 Å²	170	136.3 Å²	136.3	64%	0.642	66%	0.662	S	S	*	*	H	α-helix	trans	-61.5	-31.5	175.7	-82.2	-173.5	165	-172	-5.4	113.4	K320 A321 E327 N328	K320-R324 PolarHBondContact O-N 2.85Å; K320-R324 VanDerWaalsContact O-N 3.12Å; A321-R324 PolarHBondContact O-N 3.46Å; R324-E327 WeakPolarHBondContact O-CB 3.46Å; R324-E327 PolarHBondContact O-N 3.22Å; R324-N328 PolarHBondContact O-N 3.12Å; R324-N328 PolarHBondContact O-ND2 3.23Å
325	Q	61	Low	63	Low	137 Å²	137	138 Å²	138	64%	0.64	68%	0.675	S	S	*	*	H	α-helix	trans	-71.4	-34.5	173.4	-77.2	-172.4	-16	0	0	112.6	A321 A323 E327 N328	A321-Q325 PolarHBondContact O-N 3.17Å; A323-Q325 VanDerWaalsContact C-N 3.29Å; A323-Q325 PolarHBondContact O-N 3.04Å; Q325-E327 PolarHBondContact O-N 2.96Å; Q325-N328 PolarHBondContact O-N 2.87Å; Q325-N328 VanDerWaalsContact O-N 3.11Å
326	K	59.9	Low	60.1	Low	178 Å²	178	133.9 Å²	133.9	77%	0.774	68%	0.681	S	S	*	*	H	α-helix	trans	-68.4	-23.1	172.1	-77.9	178	175.6	176.8	0	113.5	E322 A323 N328	E322-K326 WeakPolarHBondContact O-CG 3.4Å; E322-K326 PolarHBondContact O-N 3.43Å; E322-K326 VanDerWaalsContact O-N 3.15Å; A323-K326 PolarHBondContact O-N 2.9Å; A323-K326 VanDerWaalsContact O-N 3.09Å; K326-N328 VanDerWaalsContact C-N 3.28Å
327	E	53.9	Low	57.7	Low	151 Å²	151	134.2 Å²	134.2	71%	0.706	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.9	-14.8	171.8	-159.9	168.6	-158.2	0	0	112.6	A323 R324 Q325	A323-E327 PolarHBondContact O-N 2.87Å; A323-E327 VanDerWaalsContact O-N 3.13Å; R324-E327 WeakPolarHBondContact O-CB 3.46Å; R324-E327 PolarHBondContact O-N 3.22Å; Q325-E327 PolarHBondContact O-N 2.96Å
328	N	47.4	Very low	55.1	Low	126 Å²	126	132.6 Å²	132.6	67%	0.674	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.2	24.6	-172.5	-82.3	-89.5	0	0	0	114.7	R324 Q325 K326	R324-N328 PolarHBondContact O-N 3.12Å; R324-N328 PolarHBondContact O-ND2 3.23Å; Q325-N328 PolarHBondContact O-N 2.87Å; Q325-N328 VanDerWaalsContact O-N 3.11Å; K326-N328 VanDerWaalsContact C-N 3.28Å
329	L	40.2	Very low	52.3	Low	134 Å²	134	131.6 Å²	131.6	70%	0.702	71%	0.709	S	S	*	*	S	Bend	trans	-105.9	123.9	168.8	-100.9	76	0	0	0	111.4	L331	L329-L331 PolarHBondContact O-N 3.17Å
330	P	48.8	Very low	49.7	Very low	129 Å²	129	130.4 Å²	130.4	84%	0.838	72%	0.717	S	S	*	*			trans	-76.6	97.5	-177.5	30.2	-34.7	0	0	0	112.2	N332	P330-N332 PolarHBondContact O-N 2.86Å
331	L	34.5	Very low	46.9	Very low	172 Å²	172	132.6 Å²	132.6	90%	0.901	73%	0.729	S	S	*	*			trans	-91.9	89.1	169.9	-100.6	167.7	0	0	0	110.8	L329 R333	L329-L331 PolarHBondContact O-N 3.17Å; L331-R333 PolarHBondContact O-N 3.49Å
332	N	38.3	Very low	44.6	Very low	158 Å²	158	135.2 Å²	135.2	85%	0.845	74%	0.742	S	S	*	*			trans	-81.3	105.2	178.2	-169.2	-10.3	0	0	0	111.4	P330	P330-N332 PolarHBondContact O-N 2.86Å
333	R	30.9	Very low	42.4	Very low	240 Å²	240	135.5 Å²	135.5	91%	0.906	76%	0.759	S	S	*	*			trans	-150.5	118.1	163.9	-159.3	176.2	-164.3	177.3	5.4	111.6	L331	L331-R333 PolarHBondContact O-N 3.49Å
334	A	38	Very low	40.4	Very low	78 Å²	78	138.9 Å²	138.9	65%	0.645	78%	0.777	S	S	*	*			trans	-83.3	172.3	-179.3	0	0	0	0	0	113.9
335	N	34	Very low	38.9	Very low	170 Å²	170	133.6 Å²	133.6	91%	0.909	78%	0.775	S	S	*	*			trans	79.2	88.4	167.3	-56.9	-8.4	0	0	0	117.3
336	G	32.1	Very low	37.5	Very low	68 Å²	68	133.7 Å²	133.7	70%	0.701	79%	0.785	S	S	*	*			trans	-174.7	136.4	162.3	0	0	0	0	0	109.4
337	P	39	Very low	36	Very low	126 Å²	126	133.8 Å²	133.8	82%	0.818	79%	0.793	S	S	*	*			trans	-79.3	144	-169.4	31	-35.3	0	0	0	113.1	S339	P337-S339 PolarHBondContact O-N 3.18Å
338	P	35.5	Very low	34.8	Very low	135 Å²	135	128.9 Å²	128.9	88%	0.877	78%	0.783	S	S	*	*			trans	-74.9	123.7	173.3	30.5	-32.7	0	0	0	111
339	S	32.2	Very low	34.5	Very low	108 Å²	108	134.6 Å²	134.6	76%	0.755	80%	0.795	S	S	*	*			trans	-108.5	139.6	167.2	-172.5	0	0	0	0	108.2	P337	P337-S339 PolarHBondContact O-N 3.18Å
340	P	36.3	Very low	34	Very low	123 Å²	123	134.9 Å²	134.9	80%	0.799	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-71.3	132.9	-160	26	-34.9	0	0	0	114
341	Q	28.7	Very low	33.1	Very low	179 Å²	179	132.6 Å²	132.6	84%	0.836	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-87	155.6	156.2	-82.4	-87.9	-76.9	0	0	109.6
342	P	32.1	Very low	32.8	Very low	107 Å²	107	129.4 Å²	129.4	70%	0.695	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-80.2	149.4	-161.4	-12.4	29.5	0	0	0	113.8	P344	P342-P344 WeakPolarHBondContact O-CD 3.34Å
343	A	31.3	Very low	32.5	Very low	97 Å²	97	128.2 Å²	128.2	80%	0.802	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-69.6	126.6	167.8	0	0	0	0	0	111.2	G345	A343-G345 PolarHBondContact O-N 2.85Å
344	P	30.2	Very low	32.5	Very low	131 Å²	131	119.7 Å²	119.7	85%	0.851	78%	0.778	S	S	*	*			trans	-84.7	82.9	166.1	34	-30.9	0	0	0	109.6	P342	P342-P344 WeakPolarHBondContact O-CD 3.34Å
345	G	33.5	Very low	32.5	Very low	58 Å²	58	122.3 Å²	122.3	60%	0.598	79%	0.788	S	S	*	*			trans	-68.9	165.1	156.9	0	0	0	0	0	110.8	A343	A343-G345 PolarHBondContact O-N 2.85Å
346	T	30.8	Very low	32.3	Very low	140 Å²	140	123.5 Å²	123.5	86%	0.859	78%	0.781	S	S	*	*			trans	77.8	94.7	175.1	-28.2	0	0	0	0	115.6	G348	T346-G348 PolarHBondContact O-N 3.32Å
347	L	27.8	Very low	32.6	Very low	180 Å²	180	127.3 Å²	127.3	94%	0.942	78%	0.784	S	S	*	*			trans	-76.2	70.7	160.5	-139	174.3	0	0	0	109.8
348	G	29.4	Very low	32.1	Very low	48 Å²	48	129.1 Å²	129.1	50%	0.495	78%	0.781	S	S	.	*			trans	-73.2	130.1	176.4	0	0	0	0	0	111.4	T346 V350	T346-G348 PolarHBondContact O-N 3.32Å; G348-V350 PolarHBondContact O-N 3.27Å
349	R	40.4	Very low	31.9	Very low	246 Å²	246	128.5 Å²	128.5	93%	0.928	78%	0.775	S	S	*	*			trans	-60.4	116.4	178	-59.9	-179.2	-174.4	-163.8	-0.5	111.6
350	V	29.2	Very low	32.3	Very low	140 Å²	140	129 Å²	129	85%	0.848	78%	0.775	S	S	*	*			trans	-133.3	126.1	157.6	-175.9	0	0	0	0	108.4	G348	G348-V350 PolarHBondContact O-N 3.27Å
351	A	30.4	Very low	32.2	Very low	81 Å²	81	129.6 Å²	129.6	67%	0.669	78%	0.776	S	S	*	*			trans	-83.1	138	-177.4	0	0	0	0	0	111.8	V353	A351-V353 HydrophobicContact CB-CG2 4.5Å
352	A	29	Very low	32.7	Very low	105 Å²	105	126.9 Å²	126.9	87%	0.868	77%	0.774	S	S	*	*			trans	-68.9	133.1	151.3	0	0	0	0	0	108.4
353	V	32.5	Very low	32.6	Very low	133 Å²	133	127.5 Å²	127.5	81%	0.806	78%	0.781	S	S	*	*			trans	-112	97	179.8	178.9	0	0	0	0	109.1	A351	A351-V353 HydrophobicContact CB-CG2 4.5Å
354	G	29.2	Very low	32.5	Very low	61 Å²	61	134.3 Å²	134.3	63%	0.629	79%	0.786	S	S	*	*			trans	-101.2	151.2	158.9	0	0	0	0	0	109.8	Y356	G354-Y356 PolarHBondContact O-N 3.02Å
355	P	39.3	Very low	32.6	Very low	132 Å²	132	136.8 Å²	136.8	86%	0.857	79%	0.787	S	S	*	*			trans	-82.3	110.7	-170.7	31.5	-33.3	0	0	0	112
356	Y	28.5	Very low	32.2	Very low	196 Å²	196	142 Å²	142	77%	0.769	80%	0.801	S	S	*	*			trans	-94	128.1	160.1	-155.1	-96.4	0	0	0	109.9	G354 Q358	G354-Y356 PolarHBondContact O-N 3.02Å; Y356-Q358 HydrophobicContact CD1-CB 4.18Å; Y356-Q358 HydrophobicContact CD1-CG 4.32Å; Y356-Q358 HydrophobicContact CE1-CB 4.35Å; Y356-Q358 HydrophobicContact CE1-CG 4.02Å
357	I	38.4	Very low	32.2	Very low	148 Å²	148	139 Å²	139	76%	0.759	80%	0.798	S	S	*	*			trans	-90	124	171.1	-64.4	172.5	0	0	0	106.6
358	Q	30	Very low	32.3	Very low	163 Å²	163	134 Å²	134	76%	0.762	79%	0.79	S	S	*	*			trans	-133.9	125.8	170	-136.4	169.1	31	0	0	110.3	Y356	Y356-Q358 HydrophobicContact CD1-CB 4.18Å; Y356-Q358 HydrophobicContact CD1-CG 4.32Å; Y356-Q358 HydrophobicContact CE1-CB 4.35Å; Y356-Q358 HydrophobicContact CE1-CG 4.02Å
359	V	31.6	Very low	32.3	Very low	122 Å²	122	142.6 Å²	142.6	74%	0.739	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-96	137	-178.7	-177.8	0	0	0	0	108.7
360	P	40.7	Very low	31.7	Very low	119 Å²	119	137.1 Å²	137.1	77%	0.773	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-81.5	137.3	-174.6	-11.5	28.6	0	0	0	113.7
361	V	32.7	Very low	32	Very low	135 Å²	135	138.4 Å²	138.4	82%	0.818	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-103.6	140.4	161.1	177.7	0	0	0	0	108
362	P	39.6	Very low	32.8	Very low	122 Å²	122	140 Å²	140	79%	0.792	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-89.6	129	-153.5	32.4	-35.7	0	0	0	115.5
363	S	29.6	Very low	33.6	Very low	121 Å²	121	140.7 Å²	140.7	85%	0.846	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-77	132.1	168	-38.8	0	0	0	0	111.9
364	R	29.3	Very low	33.5	Very low	239 Å²	239	141.5 Å²	141.5	90%	0.902	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-86.5	133.1	163.5	-109.8	-174.8	174.8	-156.8	-1.6	110.2
365	Q	32.5	Very low	34.2	Very low	184 Å²	184	143.4 Å²	143.4	86%	0.86	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-100	150.2	159.4	-68.6	-178.5	-15.6	0	0	109
366	D	26.5	Very low	33.6	Very low	167 Å²	167	145.2 Å²	145.2	89%	0.893	81%	0.806	S	S	*	*			trans	-151.9	145	151.9	-130.1	-35.3	0	0	0	110.2
367	G	30.1	Very low	33.6	Very low	77 Å²	77	142 Å²	142	79%	0.794	80%	0.796	S	S	*	*			trans	163.7	102.9	-175.3	0	0	0	0	0	113.4
368	G	29.2	Very low	33.5	Very low	76 Å²	76	139.9 Å²	139.9	78%	0.784	79%	0.792	S	S	*	*			trans	-166.9	141.5	178.4	0	0	0	0	0	112.9
369	Y	29.4	Very low	33.5	Very low	228 Å²	228	140.4 Å²	140.4	89%	0.894	79%	0.794	S	S	*	*			trans	-104.6	135.5	-177.3	-90.6	-96.1	0	0	0	112.6
370	T	29.3	Very low	33.7	Very low	130 Å²	130	137.5 Å²	137.5	80%	0.798	78%	0.783	S	S	*	*			trans	38.3	130	147.7	53.8	0	0	0	0	123.6
371	L	34.6	Very low	33.1	Very low	168 Å²	168	139.4 Å²	139.4	88%	0.88	79%	0.786	S	S	*	*			trans	-66.4	-178.7	163.8	-71.7	160.5	0	0	0	113.6
372	P	48.1	Very low	32.9	Very low	113 Å²	113	136.3 Å²	136.3	73%	0.734	78%	0.781	S	S	*	*			cis	-143.3	-151.1	18.9	47.5	-26.6	0	0	0	114.1
373	P	43.8	Very low	32.3	Very low	121 Å²	121	136.7 Å²	136.7	79%	0.786	78%	0.781	S	S	*	*			cis	-126.7	-178.2	-20.9	34.4	-13.5	0	0	0	116.1
374	D	31.8	Very low	32.2	Very low	149 Å²	149	137.5 Å²	137.5	80%	0.797	78%	0.776	S	S	*	*			trans	-81.8	176.9	175	-143.1	19.9	0	0	0	111.8
375	P	42.6	Very low	32.1	Very low	101 Å²	101	132 Å²	132	66%	0.656	76%	0.764	S	S	*	*			cis	-155.8	-175.3	32.2	40.9	-15	0	0	0	121.7
376	L	27.8	Very low	31.8	Very low	171 Å²	171	131.2 Å²	131.2	90%	0.895	76%	0.761	S	S	*	*			trans	97.3	161.6	155	-59.8	-179.5	0	0	0	122.5
377	K	27.5	Very low	31.9	Very low	129 Å²	129	127.4 Å²	127.4	56%	0.561	75%	0.752	S	S	*	*			trans	-146	170.4	-164.3	-123.1	178.1	-177.1	173.3	0	109.4
378	P	37.5	Very low	31.7	Very low	103 Å²	103	130.6 Å²	130.6	67%	0.669	75%	0.751	S	S	*	*				-161.9	-174.7	58.6	45.7	-23.3	0	0	0	120.4
379	Q	30.3	Very low	31.6	Very low	174 Å²	174	136.1 Å²	136.1	81%	0.813	76%	0.757	S	S	*	*			trans	66.5	164.2	153.9	-78.6	176.9	-13	0	0	120.1
380	A	33.9	Very low	31.5	Very low	61 Å²	61	128.5 Å²	128.5	50%	0.504	75%	0.748	S	S	.	*			cis	-156.9	167.6	-29.5	0	0	0	0	0	107.7	K723	A380-K723 PolarHBondContact O-NZ 3.33Å
381	L	29.3	Very low	31.3	Very low	158 Å²	158	131.9 Å²	131.9	83%	0.827	75%	0.746	S	S	*	*			cis	-109.9	-133.6	-2.7	-62.8	160.5	0	0	0	109	K723	L381-K723 WeakPolarHBondContact O-CE 3.43Å
382	G	27.6	Very low	31.4	Very low	70 Å²	70	129 Å²	129	72%	0.722	74%	0.737	S	S	*	*			cis	175.6	168.7	-1.8	0	0	0	0	0	117.6
383	V	28.6	Very low	30.9	Very low	130 Å²	130	133.3 Å²	133.3	79%	0.788	74%	0.744	S	S	*	*			trans	40	113.3	161.6	-166.9	0	0	0	0	123.1
384	N	26	Very low	30.1	Very low	138 Å²	138	132.5 Å²	132.5	74%	0.738	74%	0.741	S	S	*	*			trans	60.5	143.4	151.1	-73.6	0.6	0	0	0	123
385	N	28.1	Very low	29.6	Very low	123 Å²	123	133.2 Å²	133.2	66%	0.658	75%	0.746	S	S	*	*			cis	-155.7	174.7	-29	-143	-6.3	0	0	0	113
386	Q	26.5	Very low	28.7	Very low	168 Å²	168	131.8 Å²	131.8	79%	0.785	75%	0.749	S	S	*	*			trans	-53.6	167.1	-177.3	-61.5	152.7	67.2	0	0	116.1
387	A	26.8	Very low	28.5	Very low	87 Å²	87	129.3 Å²	129.3	72%	0.719	74%	0.74	S	S	*	*			cis	-138	154.2	10.4	0	0	0	0	0	110.9
388	N	27.9	Very low	28.4	Very low	144 Å²	144	131.1 Å²	131.1	77%	0.77	74%	0.744	S	S	*	*				57.7	131.2	59.2	-102.7	-11.4	0	0	0	113.5
389	Q	25.2	Very low	28.2	Very low	192 Å²	192	131.7 Å²	131.7	90%	0.897	74%	0.736	S	S	*	*			cis	-136	173.7	26.7	-50.7	179	20.7	0	0	113.8
390	G	27.4	Very low	29.4	Very low	69 Å²	69	126.2 Å²	126.2	71%	0.711	72%	0.715	S	S	*	*			trans	-164.2	148.4	165.3	0	0	0	0	0	113.5
391	R	26.3	Very low	29.2	Very low	201 Å²	201	128.2 Å²	128.2	76%	0.758	72%	0.723	S	S	*	*			trans	175.3	168.4	175.4	-107.3	-173.7	145.7	-128.1	-11.8	110
392	P	37.4	Very low	29.2	Very low	106 Å²	106	123.5 Å²	123.5	69%	0.688	71%	0.712	S	S	*	*			cis	-130.7	-173.8	-44.3	35.9	-17.2	0	0	0	112.9
393	K	36.7	Very low	30	Very low	204 Å²	204	124.4 Å²	124.4	89%	0.887	71%	0.706	S	S	*	*			trans	-82.5	145.7	173.8	-60.1	178.1	174.6	-175.4	0	113.8
394	S	26.2	Very low	29.9	Very low	104 Å²	104	130 Å²	130	73%	0.727	71%	0.713	S	S	*	*			trans	-178.7	143.5	141.7	51.6	0	0	0	0	115.2
395	D	22.3	Very low	29.9	Very low	165 Å²	165	131.7 Å²	131.7	88%	0.882	71%	0.714	S	S	*	*			trans	67.7	157.6	149.2	-58.9	-8.7	0	0	0	123.1
396	G	23	Very low	29.8	Very low	70 Å²	70	129.9 Å²	129.9	72%	0.722	71%	0.707	S	S	*	*			trans	94	117	177.6	0	0	0	0	0	113.7
397	V	23.6	Very low	30.1	Very low	119 Å²	119	126.7 Å²	126.7	72%	0.721	70%	0.703	S	S	*	*			cis	73.5	111.4	26.5	-172.3	0	0	0	0	115.4
398	R	25.8	Very low	30.3	Very low	167 Å²	167	127.9 Å²	127.9	63%	0.63	70%	0.698	S	S	*	*			trans	64.6	131.1	173.7	-75.3	-173.5	173.3	-157.9	-1.9	114.3	S899	R398-S899 PolarHBondContact NH1-OG 3.04Å
399	K	32.5	Very low	30.5	Very low	116 Å²	116	129.1 Å²	129.1	50%	0.504	70%	0.703	S	S	.	*				72	144.9	70.4	-90.9	-144.4	170.1	-158	0	113.5
400	P	55.3	Low	30.8	Very low	59 Å²	59	125.7 Å²	125.7	38%	0.383	69%	0.691	S	S	.	*			trans	-109.4	-177.1	-133.4	43.1	-37.1	0	0	0	112.8	T902	P400-T902 WeakPolarHBondContact CD-O 3.29Å; P400-T902 WeakPolarHBondContact CG-O 3.49Å
401	P	31	Very low	30.9	Very low	102 Å²	102	129.7 Å²	129.7	66%	0.662	70%	0.695	S	S	*	*				-125.8	176.4	93.9	38.8	-34.2	0	0	0	113.1	T902	P401-T902 HydrophobicContact CB-CG2 4.1Å
402	G	28.3	Very low	30.9	Very low	59 Å²	59	125.6 Å²	125.6	61%	0.608	69%	0.691	S	S	*	*			trans	-86.9	-123.6	147.9	0	0	0	0	0	107.7
403	P	45.2	Very low	30.3	Very low	89 Å²	89	127.1 Å²	127.1	58%	0.578	70%	0.699	S	S	*	*			cis	-132.4	145.2	-44.3	35.5	-22.4	0	0	0	111.3
404	W	25.8	Very low	29.6	Very low	247 Å²	247	123.6 Å²	123.6	94%	0.936	69%	0.69	S	S	*	*			trans	-129.2	118.5	159	-65.9	96.4	0	0	0	105.8
405	K	25.9	Very low	30.3	Very low	175 Å²	175	124.1 Å²	124.1	76%	0.761	69%	0.69	S	S	*	*			cis	59.1	137.2	39.3	-84.9	-146.8	158.8	-150.8	0	111.7
406	V	26.3	Very low	30.6	Very low	85 Å²	85	121.8 Å²	121.8	52%	0.515	68%	0.682	S	S	.	*			cis	-149.3	157.9	-1.1	94.3	0	0	0	0	106.9
407	S	33.9	Very low	32	Very low	101 Å²	101	124 Å²	124	71%	0.706	68%	0.683	S	S	*	*				43.7	155.5	96.2	-44.6	0	0	0	0	114.1
408	D	30.4	Very low	33	Very low	112 Å²	112	124.3 Å²	124.3	60%	0.599	69%	0.688	S	S	*	*			cis	-133	177.1	43.9	-52.4	-45.4	0	0	0	112.1
409	L	32.5	Very low	33.1	Very low	170 Å²	170	121.1 Å²	121.1	89%	0.89	69%	0.691	S	S	*	*				-114	141.2	54.4	-90.4	59.9	0	0	0	115.5
410	D	30.4	Very low	33	Very low	119 Å²	119	125 Å²	125	64%	0.636	71%	0.709	S	S	*	*			trans	-74	175.3	154.8	-69.5	-51	0	0	0	110.3
411	I	29.6	Very low	32.3	Very low	154 Å²	154	127.7 Å²	127.7	79%	0.79	73%	0.726	S	S	*	*			cis	-159.3	119.5	46	-74	174.3	0	0	0	106.2
412	V	26.7	Very low	32.1	Very low	114 Å²	114	131 Å²	131	69%	0.691	73%	0.733	S	S	*	*				60.1	128.1	79.6	-168.1	0	0	0	0	112
413	V	25.9	Very low	32	Very low	139 Å²	139	132.7 Å²	132.7	84%	0.842	74%	0.735	S	S	*	*				-150.6	155.6	52.2	-167.1	0	0	0	0	112.6
414	D	21.8	Very low	31.4	Very low	130 Å²	130	137.3 Å²	137.3	70%	0.695	75%	0.748	S	S	*	*			trans	-50	-179.8	160.9	-96.3	-62.3	0	0	0	117.7
415	P	40.9	Very low	31.9	Very low	114 Å²	114	131.4 Å²	131.4	74%	0.74	74%	0.741	S	S	*	*			cis	-138.4	153.7	8.5	26.3	-1.4	0	0	0	120.6
416	V	28.8	Very low	32	Very low	117 Å²	117	126 Å²	126	71%	0.709	74%	0.736	S	S	*	*				13.1	144	125.5	-177.5	0	0	0	0	120
417	P	52	Low	32.5	Very low	116 Å²	116	128.8 Å²	128.8	75%	0.753	76%	0.756	S	S	*	*			cis	-113.6	-106.8	8	25.6	-0.9	0	0	0	113.8
418	P	45	Very low	32.1	Very low	126 Å²	126	127.7 Å²	127.7	82%	0.818	76%	0.761	S	S	*	*			cis	-110.5	-146	1.4	44.6	-32.5	0	0	0	114.5
419	S	26.8	Very low	32.1	Very low	100 Å²	100	127 Å²	127	70%	0.699	77%	0.771	S	S	*	*			trans	-153.9	150	-176.5	59.9	0	0	0	0	115
420	F	31.2	Very low	31.8	Very low	198 Å²	198	123.6 Å²	123.6	87%	0.868	76%	0.761	S	S	*	*			trans	31.6	150.4	147.1	-70.7	-69	0	0	0	122.1
421	P	40.8	Very low	31.7	Very low	114 Å²	114	129.8 Å²	129.8	74%	0.74	78%	0.775	S	S	*	*				-153.3	-135.4	52.8	45.1	-21.1	0	0	0	117.1
422	E	25.6	Very low	31.5	Very low	173 Å²	173	125.8 Å²	125.8	81%	0.808	77%	0.772	S	S	*	*			trans	-102.3	157.1	-146.4	-61.4	149.9	86.1	0	0	118.6
423	S	27	Very low	31.5	Very low	93 Å²	93	125.6 Å²	125.6	65%	0.65	78%	0.776	S	S	*	*			trans	39.4	125.6	140	71.3	0	0	0	0	124.8
424	H	31.4	Very low	31.5	Very low	187 Å²	187	127.1 Å²	127.1	87%	0.866	78%	0.779	S	S	*	*			trans	65.3	164.3	137.6	-70.6	-44.9	0	0	0	118.9
425	P	36.5	Very low	31.7	Very low	122 Å²	122	124.1 Å²	124.1	79%	0.792	78%	0.779	S	S	*	*			cis	-127.8	-172.5	14.7	43.8	-27.6	0	0	0	116.2
426	G	29.7	Very low	31.1	Very low	63 Å²	63	125.5 Å²	125.5	65%	0.649	79%	0.786	S	S	*	*			trans	-91.3	-174.5	163.7	0	0	0	0	0	112.8
427	P	35.2	Very low	31	Very low	143 Å²	143	124.3 Å²	124.3	93%	0.929	78%	0.782	S	S	*	*				-145.2	179.1	105.2	40.2	-27.1	0	0	0	114.5
428	G	26.9	Very low	30.2	Very low	78 Å²	78	124.3 Å²	124.3	80%	0.804	78%	0.782	S	S	*	*			trans	-156.7	151.4	171.9	0	0	0	0	0	113.8
429	A	28.9	Very low	29.4	Very low	98 Å²	98	125.7 Å²	125.7	81%	0.81	78%	0.783	S	S	*	*			trans	-173.3	156.4	178.6	0	0	0	0	0	109.4
430	S	27.5	Very low	29.2	Very low	97 Å²	97	127.9 Å²	127.9	68%	0.678	79%	0.787	S	S	*	*			cis	-173.8	145.4	-17.3	55.5	0	0	0	0	112.4
431	R	27.4	Very low	29.3	Very low	249 Å²	249	124.4 Å²	124.4	94%	0.94	78%	0.782	S	S	*	*			trans	58.4	141.7	146.2	-64.4	171.2	72.7	-168.1	4.3	121.8
432	G	26.2	Very low	28.6	Very low	70 Å²	70	121.1 Å²	121.1	72%	0.722	77%	0.769	S	S	*	*			trans	111.9	106.2	158.9	0	0	0	0	0	112.9
433	S	26.4	Very low	28.9	Very low	111 Å²	111	125.2 Å²	125.2	78%	0.776	78%	0.777	S	S	*	*			cis	91.9	115.3	39	78.9	0	0	0	0	114.3
434	D	25.6	Very low	29.3	Very low	170 Å²	170	124.7 Å²	124.7	91%	0.909	77%	0.772	S	S	*	*			trans	60	125.2	166.3	-61.7	-15.5	0	0	0	120.7
435	G	25.7	Very low	29.4	Very low	67 Å²	67	122 Å²	122	69%	0.691	77%	0.768	S	S	*	*			trans	126.4	101.7	132	0	0	0	0	0	118.5
436	T	27.9	Very low	29	Very low	144 Å²	144	124 Å²	124	88%	0.883	77%	0.771	S	S	*	*			trans	83.5	113.7	149.8	-27.5	0	0	0	0	118.5
437	S	28.2	Very low	28.9	Very low	92 Å²	92	124.1 Å²	124.1	64%	0.643	77%	0.772	S	S	*	*			trans	-49.1	149.5	159.9	-142.6	0	0	0	0	111.7
438	P	34.1	Very low	28.7	Very low	116 Å²	116	127.7 Å²	127.7	75%	0.753	77%	0.773	S	S	*	*				-149.9	127.8	60.6	36.6	-15.2	0	0	0	117.7
439	N	27.8	Very low	28.7	Very low	155 Å²	155	130 Å²	130	83%	0.829	78%	0.777	S	S	*	*			trans	-167.8	86.6	133.5	-119.1	-7.6	0	0	0	110.8	T441	N439-T441 PolarHBondContact O-N 2.9Å
440	D	23.5	Very low	28.6	Very low	146 Å²	146	128.9 Å²	128.9	78%	0.781	77%	0.774	S	S	*	*			trans	-97.4	78.3	177	-153.2	-20.2	0	0	0	110.5
441	T	34	Very low	28.7	Very low	125 Å²	125	131 Å²	131	77%	0.767	78%	0.783	S	S	*	*			trans	-84.7	102.3	153.8	52.2	0	0	0	0	106.6	N439	N439-T441 PolarHBondContact O-N 2.9Å
442	G	24.8	Very low	28.5	Very low	45 Å²	45	126.1 Å²	126.1	46%	0.464	78%	0.781	S	S	.	*			cis	72.4	87.8	19.1	0	0	0	0	0	110.4
443	W	32.2	Very low	28.6	Very low	258 Å²	258	130.3 Å²	130.3	98%	0.977	79%	0.786	S	S	*	*			trans	-172	147.7	132.3	-104.7	81.8	0	0	0	107.7
444	P	35.8	Very low	28.4	Very low	83 Å²	83	134.7 Å²	134.7	54%	0.539	79%	0.791	S	S	.	*				-143.7	-169.8	-121.6	43.1	-25.3	0	0	0	116.1
445	T	32.8	Very low	28.8	Very low	129 Å²	129	132 Å²	132	79%	0.791	78%	0.783	S	S	*	*			trans	65.9	153.1	157.8	48.2	0	0	0	0	117.4
446	I	28.7	Very low	30.1	Very low	165 Å²	165	134 Å²	134	85%	0.846	78%	0.784	S	S	*	*			cis	-122.1	148.9	6.9	-61.2	173.6	0	0	0	107.5
447	G	28	Very low	29.9	Very low	65 Å²	65	133.8 Å²	133.8	67%	0.67	77%	0.773	S	S	*	*			cis	138.4	105.6	3.8	0	0	0	0	0	110.3
448	K	29.6	Very low	29.8	Very low	219 Å²	219	138.5 Å²	138.5	95%	0.952	78%	0.777	S	S	*	*			trans	-98.2	119.1	176.1	-78.1	-178.4	176.8	176.3	0	111
449	S	27.1	Very low	29.4	Very low	127 Å²	127	143.1 Å²	143.1	89%	0.888	78%	0.779	S	S	*	*			trans	-164.8	153.1	160.5	56.6	0	0	0	0	109.1
450	G	28.4	Very low	29.3	Very low	73 Å²	73	141.5 Å²	141.5	75%	0.753	77%	0.77	S	S	*	*			cis	-167.7	155.9	-7	0	0	0	0	0	109.9
451	T	28	Very low	29.4	Very low	143 Å²	143	140.3 Å²	140.3	88%	0.877	77%	0.774	S	S	*	*			trans	-68.6	137.2	-176.9	46.1	0	0	0	0	113.1
452	T	24.9	Very low	29.1	Very low	145 Å²	145	137.6 Å²	137.6	89%	0.89	77%	0.77	S	S	*	*			trans	-146.8	153.4	156	-68.4	0	0	0	0	110.5
453	L	26.5	Very low	29.4	Very low	158 Å²	158	140 Å²	140	83%	0.827	79%	0.786	S	S	*	*			trans	-82.4	157.7	-161.3	-62.3	157.7	0	0	0	115.2
454	K	22.8	Very low	29.4	Very low	203 Å²	203	134.2 Å²	134.2	88%	0.883	77%	0.774	S	S	*	*			trans	74.3	164.2	152.4	-84.6	-163.1	169.7	-178.2	0	118.9
455	P	34.9	Very low	29.3	Very low	114 Å²	114	135 Å²	135	74%	0.74	78%	0.781	S	S	*	*			trans	-119.9	-138	-159.1	29.7	-4.9	0	0	0	111.4
456	P	52.8	Low	29.1	Very low	109 Å²	109	135.6 Å²	135.6	71%	0.708	78%	0.775	S	S	*	*				-108.8	177.1	-91.8	39	-26.5	0	0	0	112.4
457	E	23.8	Very low	29	Very low	139 Å²	139	131.2 Å²	131.2	65%	0.65	77%	0.771	S	S	*	*			trans	153.5	152.1	135.1	-84.4	-138	101.9	0	0	112.1
458	R	26.2	Very low	29	Very low	192 Å²	192	136.2 Å²	136.2	73%	0.725	77%	0.774	S	S	*	*			trans	47.8	127.2	151	-64	169.6	-156.2	-166.7	14.3	120
459	R	25.1	Very low	28.9	Very low	213 Å²	213	130.4 Å²	130.4	80%	0.804	76%	0.761	S	S	*	*			cis	81.6	126.5	43.6	-172.5	-143.6	-117.1	-94	4.4	113.7
460	D	24.6	Very low	29.7	Very low	120 Å²	120	129.1 Å²	129.1	64%	0.642	75%	0.749	S	S	*	*			trans	89.5	148.2	154	-94.3	-49.3	0	0	0	121.2
461	S	26.2	Very low	29.7	Very low	122 Å²	122	131.6 Å²	131.6	85%	0.853	75%	0.75	S	S	*	*			trans	68.9	132	170.7	-55.8	0	0	0	0	118.7
462	G	27.4	Very low	29.7	Very low	67 Å²	67	130.1 Å²	130.1	69%	0.691	75%	0.745	S	S	*	*			cis	136.5	163.4	-9.8	0	0	0	0	0	114.6
463	A	32.5	Very low	29.9	Very low	96 Å²	96	127 Å²	127	79%	0.793	74%	0.743	S	S	*	*			trans	68.3	147.5	171.7	0	0	0	0	0	116.4
464	D	31.9	Very low	29.9	Very low	137 Å²	137	125.2 Å²	125.2	73%	0.733	74%	0.743	S	S	*	*			cis	-159.2	136.1	-14.3	-128.9	-52.5	0	0	0	108.3
465	S	33.2	Very low	31	Very low	98 Å²	98	121.1 Å²	121.1	69%	0.685	74%	0.737	S	S	*	*				145	169.4	82.1	52.7	0	0	0	0	106.8
466	Q	28.3	Very low	30.7	Very low	143 Å²	143	121.7 Å²	121.7	67%	0.668	74%	0.738	S	S	*	*			cis	-160.6	152.6	-17.7	-112.9	175.4	72.1	0	0	104.9
467	G	27.6	Very low	29.6	Very low	73 Å²	73	122.3 Å²	122.3	75%	0.753	74%	0.74	S	S	*	*			cis	-170.1	-139	3.3	0	0	0	0	0	109.1
468	K	27.5	Very low	30	Very low	170 Å²	170	121.2 Å²	121.2	74%	0.739	75%	0.745	S	S	*	*			cis	-150.2	-98.8	-1.1	-148.9	154.8	-176.9	158.1	0	114.4
469	S	26.4	Very low	30.1	Very low	96 Å²	96	120.3 Å²	120.3	67%	0.671	76%	0.755	S	S	*	*			trans	-169.8	165	-160.5	58.6	0	0	0	0	114.3
470	P	45.3	Very low	30.3	Very low	100 Å²	100	114.2 Å²	114.2	65%	0.649	75%	0.75	S	S	*	*			cis	-147.8	-166.8	-35.2	39.5	-19.2	0	0	0	114.5
471	T	27.8	Very low	30.5	Very low	126 Å²	126	117.6 Å²	117.6	77%	0.773	76%	0.762	S	S	*	*			trans	63.8	161.3	150.8	48.7	0	0	0	0	120.8
472	S	27.7	Very low	30.7	Very low	111 Å²	111	121.6 Å²	121.6	78%	0.776	76%	0.764	S	S	*	*			cis	-176.8	146.8	-34.2	57.5	0	0	0	0	110.9
473	G	28.5	Very low	30.6	Very low	81 Å²	81	125.4 Å²	125.4	84%	0.835	77%	0.773	S	S	*	*			trans	111.9	133	156.4	0	0	0	0	0	117.3
474	S	28	Very low	30.3	Very low	119 Å²	119	127.7 Å²	127.7	83%	0.832	77%	0.772	S	S	*	*			trans	-81.4	167.5	168.2	-32.1	0	0	0	0	110.7
475	P	44.4	Very low	30.7	Very low	118 Å²	118	126.2 Å²	126.2	77%	0.766	76%	0.764	S	S	*	*				-155.9	-170.8	73.9	35.4	-10.7	0	0	0	117.1
476	V	29.2	Very low	30.9	Very low	125 Å²	125	127.4 Å²	127.4	76%	0.758	77%	0.769	S	S	*	*			trans	85.7	112.2	158.3	-175.3	0	0	0	0	119.8
477	T	29.4	Very low	30.8	Very low	123 Å²	123	128.3 Å²	128.3	76%	0.755	77%	0.771	S	S	*	*			trans	23.2	161.4	149.5	68.2	0	0	0	0	123.9
478	P	32.8	Very low	30.9	Very low	115 Å²	115	133 Å²	133	75%	0.747	78%	0.778	S	S	*	*			cis	-116.5	165	-22.6	38.8	-27.7	0	0	0	111.3	A480	P478-A480 PolarHBondContact O-N 3.15Å
479	N	28.5	Very low	30.8	Very low	174 Å²	174	128.5 Å²	128.5	93%	0.93	77%	0.772	S	S	*	*			trans	-99.2	93.9	176.4	-153.3	5	0	0	0	111.7
480	A	29.3	Very low	30.9	Very low	84 Å²	84	130.7 Å²	130.7	69%	0.694	78%	0.781	S	S	*	*			trans	-138.7	167.5	169.6	0	0	0	0	0	108.9	P478	P478-A480 PolarHBondContact O-N 3.15Å
481	E	28.2	Very low	30	Very low	192 Å²	192	131.4 Å²	131.4	90%	0.897	79%	0.788	S	S	*	*	S	Bend	trans	-73.2	158.8	-162.9	-58.8	177.2	102.5	0	0	116.2
482	K	30.4	Very low	29.8	Very low	205 Å²	205	130.4 Å²	130.4	89%	0.891	79%	0.786	S	S	*	*			trans	71.7	125.1	166.7	-85.6	-178.9	171.6	177.8	0	119.2
483	V	26.5	Very low	30.9	Very low	147 Å²	147	130.7 Å²	130.7	89%	0.891	79%	0.786	S	S	*	*			trans	-89.4	154.2	163.7	171.8	0	0	0	0	110.2
484	L	26.1	Very low	30.8	Very low	145 Å²	145	131.1 Å²	131.1	76%	0.759	78%	0.781	S	S	*	*			trans	-122.8	132	-176.2	-89.4	161.7	0	0	0	111.4
485	D	38.7	Very low	30.8	Very low	106 Å²	106	132.5 Å²	132.5	57%	0.567	78%	0.778	S	S	*	*			trans	62.9	166.9	135	-108.4	-29.3	0	0	0	119.3	K487	D485-K487 VanDerWaalsContact OD1-CB 3.3Å; D485-K487 WeakPolarHBondContact OD1-CB 3.39Å; D485-K487 PolarHBondContact OD1-N 2.89Å
486	P	38.8	Very low	30	Very low	123 Å²	123	132.9 Å²	132.9	80%	0.799	78%	0.778	S	S	*	*			cis	-135.6	114.3	40.8	36.6	-15.1	0	0	0	118.2
487	K	26.3	Very low	29.8	Very low	161 Å²	161	136.2 Å²	136.2	70%	0.7	78%	0.782	S	S	*	*				27.3	116.7	106.7	-165.6	179.5	-152.6	163.8	0	121	D485	D485-K487 VanDerWaalsContact OD1-CB 3.3Å; D485-K487 WeakPolarHBondContact OD1-CB 3.39Å; D485-K487 PolarHBondContact OD1-N 2.89Å
488	L	28.2	Very low	30	Very low	173 Å²	173	136.5 Å²	136.5	91%	0.906	79%	0.786	S	S	*	*			trans	-152.8	145.4	130.5	-74.9	-176.1	0	0	0	108.1
489	A	26.3	Very low	29.6	Very low	74 Å²	74	139.7 Å²	139.7	61%	0.612	79%	0.791	S	S	*	*			cis	-167.7	172	-22.6	0	0	0	0	0	109.3
490	V	27.4	Very low	30.7	Very low	143 Å²	143	136.5 Å²	136.5	87%	0.867	78%	0.78	S	S	*	*			trans	73.1	129.7	166.2	-173.8	0	0	0	0	115.5
491	S	27.7	Very low	32.2	Very low	114 Å²	114	137.9 Å²	137.9	80%	0.797	78%	0.782	S	S	*	*			cis	-149.5	169.1	-0.6	-133.8	0	0	0	0	115.6
492	S	23.7	Very low	32.9	Very low	105 Å²	105	133.7 Å²	133.7	73%	0.734	77%	0.771	S	S	*	*			trans	-71.8	-178.5	-178.6	-64.8	0	0	0	0	117.1
493	P	49.8	Very low	32.7	Very low	118 Å²	118	134.7 Å²	134.7	77%	0.766	77%	0.771	S	S	*	*			cis	-145	-178.1	-36.6	38.2	-19.3	0	0	0	116.7
494	A	26.2	Very low	32.9	Very low	89 Å²	89	130.5 Å²	130.5	74%	0.736	76%	0.758	S	S	*	*			trans	77.5	157.1	146.6	0	0	0	0	0	119.3
495	I	29.1	Very low	33.2	Very low	148 Å²	148	128.9 Å²	128.9	76%	0.759	76%	0.759	S	S	*	*			cis	-158.1	158.1	-3.1	-138.7	170.5	0	0	0	114.2
496	T	27.7	Very low	32.9	Very low	126 Å²	126	132 Å²	132	77%	0.773	77%	0.77	S	S	*	*			trans	68.1	139.5	159.4	50	0	0	0	0	126.5
497	K	24.3	Very low	32.5	Very low	195 Å²	195	133.2 Å²	133.2	85%	0.848	77%	0.768	S	S	*	*			trans	-41.3	166.3	146.6	-97.3	175.8	179.8	179.2	0	115.2
498	P	34.3	Very low	32.7	Very low	129 Å²	129	131.1 Å²	131.1	84%	0.838	77%	0.769	S	S	*	*				-152.9	-156.1	55.1	45.3	-23	0	0	0	118.3
499	Q	23.7	Very low	32.6	Very low	183 Å²	183	128.3 Å²	128.3	86%	0.855	76%	0.764	S	S	*	*			trans	-85.1	177.6	-173.3	-107.1	-171.2	-68.7	0	0	114.5
500	P	52.1	Low	32.6	Very low	106 Å²	106	129.3 Å²	129.3	69%	0.688	77%	0.772	S	S	*	*			trans	-95.6	-156.2	-171.3	40.4	-37.9	0	0	0	113.7
501	P	61.7	Low	32.6	Very low	114 Å²	114	130 Å²	130	74%	0.74	77%	0.771	S	S	*	*				-95.4	-175.6	-77.8	40.9	-30.3	0	0	0	111.7
502	P	42.4	Very low	33.9	Very low	104 Å²	104	130 Å²	130	68%	0.675	77%	0.769	S	S	*	*				-155.1	-176.1	110.7	32.5	-10.1	0	0	0	116.6
503	Y	26.7	Very low	34	Very low	225 Å²	225	129 Å²	129	88%	0.882	77%	0.766	S	S	*	*			trans	68.3	129.2	172.4	-61.5	-78.5	0	0	0	118.3
504	G	29.7	Very low	33	Very low	59 Å²	59	128.9 Å²	128.9	61%	0.608	77%	0.769	S	S	*	*			cis	111.5	104.2	-22.3	0	0	0	0	0	118.2
505	S	32.1	Very low	33	Very low	112 Å²	112	130 Å²	130	78%	0.783	77%	0.771	S	S	*	*			trans	-164	132.8	148.7	30.5	0	0	0	0	109.1
506	H	32.2	Very low	33	Very low	172 Å²	172	130.3 Å²	130.3	80%	0.796	77%	0.773	S	S	*	*			cis	79.7	136	49.2	-63	-38.7	0	0	0	111.8
507	L	32	Very low	33.1	Very low	147 Å²	147	130.7 Å²	130.7	77%	0.77	77%	0.766	S	S	*	*			cis	-138.8	-173.5	9.9	-63.2	169.6	0	0	0	109.8
508	T	29.1	Very low	33.3	Very low	118 Å²	118	129.8 Å²	129.8	72%	0.724	76%	0.758	S	S	*	*			cis	-154.6	163.6	7.7	-27.7	0	0	0	0	112.2
509	S	26.8	Very low	33.2	Very low	114 Å²	114	133.9 Å²	133.9	80%	0.797	76%	0.756	S	S	*	*			trans	92.4	145.1	158.9	-61	0	0	0	0	117.2
510	A	26.9	Very low	33.4	Very low	95 Å²	95	132.7 Å²	132.7	79%	0.785	75%	0.748	S	S	*	*			cis	-159.7	171.7	-14.3	0	0	0	0	0	111.7
511	N	25.5	Very low	32.4	Very low	157 Å²	157	134 Å²	134	84%	0.84	75%	0.749	S	S	*	*			trans	-161.5	-170.2	173.2	-133.8	-0.9	0	0	0	107.4
512	P	55.6	Low	31	Very low	115 Å²	115	132.1 Å²	132.1	75%	0.747	74%	0.744	S	S	*	*			cis	-138	167.7	0.9	42.4	-24.8	0	0	0	117.8
513	A	26.5	Very low	31	Very low	82 Å²	82	133 Å²	133	68%	0.678	75%	0.749	S	S	*	*			trans	178.2	119.6	140.4	0	0	0	0	0	108.2
514	S	28	Very low	32.1	Very low	117 Å²	117	128 Å²	128	82%	0.818	74%	0.744	S	S	*	*				69.6	133.4	53.9	78.1	0	0	0	0	114.9
515	S	27.1	Very low	33.4	Very low	113 Å²	113	129.9 Å²	129.9	79%	0.79	75%	0.746	S	S	*	*			cis	-172.5	177.9	-20.2	-165.9	0	0	0	0	107.8
516	L	28.5	Very low	33.9	Very low	153 Å²	153	136 Å²	136	80%	0.801	75%	0.752	S	S	*	*			trans	86.5	139.3	-173.4	-56.8	166.3	0	0	0	113.2
517	E	29.2	Very low	34.2	Very low	134 Å²	134	133.7 Å²	133.7	63%	0.626	75%	0.753	S	S	*	*			cis	-147	133.6	2	-115.1	179.2	148.3	0	0	109.2
518	R	29.2	Very low	34.3	Very low	177 Å²	177	134.3 Å²	134.3	67%	0.668	76%	0.756	S	S	*	*				95.5	106.3	81	175.6	-157.3	-68.9	-98.7	1.9	115
519	R	31.6	Very low	34.9	Very low	214 Å²	214	134.4 Å²	134.4	81%	0.808	76%	0.758	S	S	*	*			trans	67.9	165.9	146.2	-69	-176.2	-179.9	-160	-2.4	116.2
520	K	29.4	Very low	35.1	Very low	159 Å²	159	136.2 Å²	136.2	69%	0.691	76%	0.759	S	S	*	*			cis	-177.5	151.4	-15.9	169.4	174.2	174.5	-179.7	0	105
521	D	29.4	Very low	36.6	Very low	132 Å²	132	137.4 Å²	137.4	71%	0.706	76%	0.759	S	S	*	*			cis	-143.2	177.9	21.8	-139	-12.8	0	0	0	113.1
522	A	33.8	Very low	37.5	Very low	76 Å²	76	135.8 Å²	135.8	63%	0.628	76%	0.757	S	S	*	*			trans	-98.7	-151.6	165.7	0	0	0	0	0	109.9
523	P	41.6	Very low	36.6	Very low	122 Å²	122	135 Å²	135	79%	0.792	76%	0.76	S	S	*	*			cis	-130.2	179.5	13.9	39.1	-18	0	0	0	115.9
524	P	51	Low	37.9	Very low	119 Å²	119	137.3 Å²	137.3	77%	0.773	77%	0.768	S	S	*	*			trans	-119.6	-106	-155.7	24.6	0.9	0	0	0	119.6
525	P	56.5	Low	37.8	Very low	100 Å²	100	135.6 Å²	135.6	65%	0.649	76%	0.761	S	S	*	*				-136.7	161.7	-121.3	42.9	-25.2	0	0	0	119.7
526	R	41.2	Very low	37.7	Very low	239 Å²	239	140.7 Å²	140.7	90%	0.902	76%	0.763	S	S	*	*			trans	67.3	152.4	159.9	-67	176.2	-169.6	-101.2	3.1	115.7
527	P	38.8	Very low	38.8	Very low	125 Å²	125	138.6 Å²	138.6	81%	0.812	76%	0.759	S	S	*	*				-146.1	-159.4	69.8	40.4	-18.3	0	0	0	116
528	L	34.4	Very low	38.7	Very low	160 Å²	160	142.2 Å²	142.2	84%	0.838	77%	0.767	S	S	*	*			trans	-88.9	-169.8	175.9	-39.7	94.7	0	0	0	110.7
529	P	42.8	Very low	38.6	Very low	120 Å²	120	139.3 Å²	139.3	78%	0.779	77%	0.768	S	S	*	*			cis	-136.9	-156.5	-5.6	40.5	-18	0	0	0	114.8
530	N	30.9	Very low	39.2	Very low	151 Å²	151	135 Å²	135	81%	0.807	77%	0.768	S	S	*	*			trans	-65.6	173.4	171	-56.9	-13	0	0	0	113.8
531	P	56.9	Low	39.1	Very low	121 Å²	121	131.8 Å²	131.8	79%	0.786	77%	0.765	S	S	*	*			cis	-123.5	-127.9	-24.2	38.9	-18.7	0	0	0	109.6
532	P	44.4	Very low	39.1	Very low	122 Å²	122	130.8 Å²	130.8	79%	0.792	77%	0.769	S	S	*	*			cis	-121.5	-170.7	-45.8	40	-23.8	0	0	0	113.8
533	A	38.4	Very low	38.8	Very low	98 Å²	98	133.5 Å²	133.5	81%	0.81	78%	0.778	S	S	*	*			trans	-156	141.6	173.3	0	0	0	0	0	116.9
534	P	52.8	Low	38	Very low	132 Å²	132	131.4 Å²	131.4	86%	0.857	78%	0.779	S	S	*	*			trans	-128.1	-164.5	167.6	45.7	-31.9	0	0	0	112.2
535	A	26.1	Very low	36.9	Very low	81 Å²	81	131.3 Å²	131.3	67%	0.669	78%	0.781	S	S	*	*			cis	-158.6	147.1	5	0	0	0	0	0	114.7
536	W	24.8	Very low	35.6	Very low	219 Å²	219	131.6 Å²	131.6	83%	0.83	79%	0.785	S	S	*	*				9.7	155	129.1	-66.6	82.5	0	0	0	122
537	P	50.9	Low	35.1	Very low	109 Å²	109	124.6 Å²	124.6	71%	0.708	77%	0.773	S	S	*	*			cis	-154.3	150.5	44.3	40.4	-17.5	0	0	0	123.7
538	R	27.7	Very low	34.7	Very low	211 Å²	211	127.5 Å²	127.5	80%	0.796	78%	0.776	S	S	*	*			trans	72.1	113.1	134.7	-67.7	177.4	-163.6	-96.1	0.3	125.3
539	V	27.2	Very low	34.5	Very low	115 Å²	115	127.6 Å²	127.6	70%	0.697	77%	0.772	S	S	*	*				9.4	148.4	119.2	-101.2	0	0	0	0	121.1
540	P	43.7	Very low	34.1	Very low	124 Å²	124	128.8 Å²	128.8	81%	0.805	77%	0.77	S	S	*	*				-143.1	-166.5	69.4	38.9	-20.3	0	0	0	116.7
541	S	28.8	Very low	34	Very low	91 Å²	91	129.1 Å²	129.1	64%	0.636	77%	0.767	S	S	*	*				-176.1	157.2	-81.2	54.5	0	0	0	0	114.1
542	S	29.2	Very low	32.9	Very low	112 Å²	112	130.5 Å²	130.5	78%	0.783	76%	0.763	S	S	*	*			trans	77.1	160.4	167.8	80.8	0	0	0	0	117.7
543	T	27.1	Very low	32.3	Very low	132 Å²	132	134.1 Å²	134.1	81%	0.81	76%	0.761	S	S	*	*			cis	-147	152	14.5	30.1	0	0	0	0	114.8
544	G	25.4	Very low	31.9	Very low	79 Å²	79	136.2 Å²	136.2	81%	0.814	76%	0.757	S	S	*	*			trans	69.1	179.1	146.9	0	0	0	0	0	120.8
545	S	27.3	Very low	30.6	Very low	117 Å²	117	135.2 Å²	135.2	82%	0.818	75%	0.753	S	S	*	*			cis	-169.7	141.3	-37.2	-166.3	0	0	0	0	112.5
546	S	28.6	Very low	30.8	Very low	106 Å²	106	137.9 Å²	137.9	74%	0.741	76%	0.76	S	S	*	*			trans	43.8	124.7	151.2	-154.6	0	0	0	0	124.2
547	S	30.3	Very low	31.9	Very low	92 Å²	92	132.9 Å²	132.9	64%	0.643	76%	0.756	S	S	*	*			trans	38.2	130.4	132.1	-164.7	0	0	0	0	123
548	Q	30.1	Very low	32	Very low	185 Å²	185	133.2 Å²	133.2	86%	0.864	76%	0.759	S	S	*	*				-172.1	174.9	116.9	-107.2	169.9	86.2	0	0	115.7
549	Q	32	Very low	32.3	Very low	162 Å²	162	128.4 Å²	128.4	76%	0.757	76%	0.757	S	S	*	*			trans	-110.3	163.6	-177.1	-55.4	156.3	-91.2	0	0	111.8
550	I	32.9	Very low	33.3	Very low	146 Å²	146	129.1 Å²	129.1	75%	0.749	76%	0.764	S	S	*	*			trans	151.2	125.7	144.1	-84.5	157.7	0	0	0	108
551	Q	30.2	Very low	32.7	Very low	158 Å²	158	129.2 Å²	129.2	74%	0.738	76%	0.763	S	S	*	*			cis	108.7	146.6	29.1	-91.4	-161.2	11.7	0	0	112.7
552	Q	32.8	Very low	32.6	Very low	149 Å²	149	134.7 Å²	134.7	70%	0.696	78%	0.776	S	S	*	*			trans	102.9	143.1	166.1	-59.7	-162.1	88.3	0	0	116.9
553	R	31.2	Very low	32.8	Very low	198 Å²	198	137.5 Å²	137.5	75%	0.747	78%	0.776	S	S	*	*			cis	-173.6	168	-20.7	-173.8	-166.7	-75.7	-101.5	6.3	107.6
554	I	30.1	Very low	33.9	Very low	142 Å²	142	135.7 Å²	135.7	73%	0.728	77%	0.767	S	S	*	*			trans	118.4	114.8	146.7	-62	168.4	0	0	0	118.5
555	S	25.6	Very low	33.8	Very low	112 Å²	112	139.1 Å²	139.1	78%	0.783	77%	0.767	S	S	*	*			trans	67.8	157.5	144.3	-62.1	0	0	0	0	126.7
556	V	30.5	Very low	34.1	Very low	136 Å²	136	140.2 Å²	140.2	82%	0.824	77%	0.768	S	S	*	*			trans	-154.9	175.6	176.2	-119.2	0	0	0	0	106.1
557	P	48.7	Very low	35.2	Very low	114 Å²	114	140.6 Å²	140.6	74%	0.74	77%	0.768	S	S	*	*			cis	-123.5	-139.5	-15.8	39.8	-18.6	0	0	0	109.1
558	P	53.5	Low	35	Very low	117 Å²	117	144.2 Å²	144.2	76%	0.76	78%	0.779	S	S	*	*			cis	-133.6	-173.9	-18.4	40.1	-20.8	0	0	0	116
559	S	32.8	Very low	35	Very low	110 Å²	110	144.6 Å²	144.6	77%	0.769	78%	0.778	S	S	*	*			trans	-87.7	176.6	174	-36	0	0	0	0	114.6
560	P	48.4	Very low	36.5	Very low	129 Å²	129	142 Å²	142	84%	0.838	78%	0.776	S	S	*	*			trans	-138.3	171.5	131	39.2	-27.6	0	0	0	115.8
561	T	30.7	Very low	37	Very low	127 Å²	127	141.4 Å²	141.4	78%	0.779	78%	0.781	S	S	*	*			trans	-109.8	156.4	-173	-42.2	0	0	0	0	112.1
562	F	27.8	Very low	36.8	Very low	206 Å²	206	138.1 Å²	138.1	90%	0.904	78%	0.781	S	S	*	*			trans	-161.9	152.6	151.2	-107.2	-69.4	0	0	0	115.8
563	Q	31.8	Very low	36.5	Very low	171 Å²	171	138.9 Å²	138.9	80%	0.799	79%	0.789	S	S	*	*			trans	-160.5	178.9	170	-92.6	-143	15	0	0	107.1
564	P	50.2	Low	36.3	Very low	94 Å²	94	134.4 Å²	134.4	61%	0.61	79%	0.788	S	S	*	*			cis	-132.6	-171.6	-2.7	38.4	-18.8	0	0	0	114.2
565	N	24.4	Very low	36.1	Very low	151 Å²	151	134 Å²	134	81%	0.807	78%	0.783	S	S	*	*				168.2	154.4	125.1	-98.9	-5	0	0	0	116.7
566	V	33	Very low	36.2	Very low	139 Å²	139	137.9 Å²	137.9	84%	0.842	78%	0.78	S	S	*	*			trans	-167.8	169.9	173.4	-110.1	0	0	0	0	108.9
567	P	52.7	Low	36.1	Very low	114 Å²	114	137.8 Å²	137.8	74%	0.74	78%	0.775	S	S	*	*			cis	-126.6	-165.4	-14.2	42.4	-26.5	0	0	0	112.4
568	L	26.5	Very low	34.9	Very low	169 Å²	169	138.6 Å²	138.6	89%	0.885	77%	0.773	S	S	*	*			trans	-171.9	160.3	152.2	-106.5	161.7	0	0	0	114.1
569	F	29.6	Very low	33.9	Very low	193 Å²	193	141.3 Å²	141.3	85%	0.846	78%	0.775	S	S	*	*			trans	-148.3	174.1	176.6	-92.6	-76.2	0	0	0	107.7
570	P	63.4	Low	35.2	Very low	108 Å²	108	141 Å²	141	70%	0.701	77%	0.77	S	S	*	*			cis	-115.5	-167.2	-47.3	39.2	-23.5	0	0	0	110.8
571	P	42.3	Very low	35.1	Very low	132 Å²	132	140.4 Å²	140.4	86%	0.857	77%	0.766	S	S	*	*				-148.9	-156.9	94.3	39	-18.8	0	0	0	114.2
572	A	26.3	Very low	35.1	Very low	89 Å²	89	138.4 Å²	138.4	74%	0.736	76%	0.763	S	S	*	*			trans	-140.2	-174.4	-162.3	0	0	0	0	0	115.9
573	L	28	Very low	35.2	Very low	165 Å²	165	135.5 Å²	135.5	86%	0.864	76%	0.761	S	S	*	*			trans	78.8	141.6	175.8	-50.8	170.2	0	0	0	115.2
574	S	26.4	Very low	35	Very low	104 Å²	104	130.9 Å²	130.9	73%	0.727	75%	0.753	S	S	*	*			cis	-163.8	-172	-14.8	-81.1	0	0	0	0	107.4
575	E	25.7	Very low	34	Very low	134 Å²	134	133.2 Å²	133.2	63%	0.626	77%	0.765	S	S	*	*			cis	-146.5	172.3	5.8	-129.2	-158.2	166.2	0	0	107.7
576	R	27.2	Very low	34.4	Very low	193 Å²	193	137.1 Å²	137.1	73%	0.728	77%	0.768	S	S	*	*				47.6	147.8	86.4	-157	-172.6	171.8	-164.7	-5.3	114.6
577	L	28.2	Very low	35.3	Very low	135 Å²	135	136 Å²	136	71%	0.707	76%	0.764	S	S	*	*			cis	-103.3	-162.2	6.9	-66.1	67.2	0	0	0	110.9
578	D	25	Very low	33.8	Very low	131 Å²	131	139.8 Å²	139.8	70%	0.701	77%	0.769	S	S	*	*			cis	-148.3	147.3	-0.6	-152.8	-15.8	0	0	0	111.5
579	H	31.8	Very low	34	Very low	173 Å²	173	138.7 Å²	138.7	80%	0.801	76%	0.762	S	S	*	*			trans	-175.8	170.3	-172.8	-98.5	74.6	0	0	0	108.8
580	P	59.8	Low	35.2	Very low	104 Å²	104	135.2 Å²	135.2	68%	0.675	76%	0.759	S	S	*	*			cis	-112.4	-120.7	11.2	37.1	-17	0	0	0	110
581	P	47.5	Very low	33.5	Very low	116 Å²	116	136.6 Å²	136.6	75%	0.753	76%	0.761	S	S	*	*			cis	-64	173.2	-8.7	-25.5	39.4	0	0	0	115.9
582	A	30.4	Very low	32.9	Very low	85 Å²	85	140.9 Å²	140.9	70%	0.702	76%	0.76	S	S	*	*			cis	78.6	125	20.6	0	0	0	0	0	115
583	V	28.6	Very low	33.1	Very low	145 Å²	145	140.3 Å²	140.3	88%	0.879	76%	0.763	S	S	*	*			cis	-152.4	153.7	43.5	158.9	0	0	0	0	109.4
584	A	29.3	Very low	33.4	Very low	75 Å²	75	139.2 Å²	139.2	62%	0.62	76%	0.763	S	S	*	*			cis	-166.2	132.5	-23.5	0	0	0	0	0	108.3
585	V	27.6	Very low	33.7	Very low	143 Å²	143	146.1 Å²	146.1	87%	0.867	77%	0.773	S	S	*	*				87	136.1	103.7	174.3	0	0	0	0	116.6
586	R	32.4	Very low	34.6	Very low	233 Å²	233	144.4 Å²	144.4	88%	0.879	77%	0.774	S	S	*	*			trans	-103.5	-160.3	175.5	-56.8	164.7	150.2	168	-10	109.3
587	P	51.8	Low	34.8	Very low	115 Å²	115	143.3 Å²	143.3	75%	0.747	78%	0.777	S	S	*	*			cis	-127	-165.6	-42	24.9	-1.4	0	0	0	112.6
588	F	23.2	Very low	35	Very low	194 Å²	194	141.9 Å²	141.9	85%	0.851	78%	0.778	S	S	*	*			trans	98.5	152.7	135.4	-138.6	-127.6	0	0	0	121.5
589	I	29.2	Very low	36.2	Very low	145 Å²	145	140.3 Å²	140.3	74%	0.744	78%	0.775	S	S	*	*			trans	83.2	135.5	168.3	-52.4	-169.1	0	0	0	119.1
590	P	55.2	Low	36.3	Very low	120 Å²	120	142.3 Å²	142.3	78%	0.779	78%	0.775	S	S	*	*			trans	-117.3	175.3	-179.4	43.7	-34.5	0	0	0	115.4
591	D	27.1	Very low	35.1	Very low	137 Å²	137	146.5 Å²	146.5	73%	0.733	78%	0.783	S	S	*	*			trans	-159.3	170.5	146.7	-147.3	3	0	0	0	116.1
592	R	29.7	Very low	34.3	Very low	223 Å²	223	144.2 Å²	144.2	84%	0.842	78%	0.78	S	S	*	*			trans	-32.3	159.5	-177.3	-70	142.9	-161.2	-80.6	-6.1	122.8
593	G	31.7	Very low	35.3	Very low	77 Å²	77	146 Å²	146	79%	0.794	78%	0.784	S	S	*	*			trans	177.4	88.6	146.2	0	0	0	0	0	116.6
594	T	32.8	Very low	36	Very low	142 Å²	142	144.2 Å²	144.2	87%	0.871	78%	0.776	S	S	*	*			trans	-127.3	132.1	172.7	43.9	0	0	0	0	113.2
595	R	33.6	Very low	36.1	Very low	248 Å²	248	146.2 Å²	146.2	94%	0.936	78%	0.781	S	S	*	*			trans	-160.9	159.9	154.1	-100.8	-124	152.7	162.2	-5	112.6
596	P	44.5	Very low	36.4	Very low	98 Å²	98	145.6 Å²	145.6	64%	0.636	78%	0.777	S	S	*	*			trans	-138.1	-166.1	-147.4	45	-27.6	0	0	0	115.1
597	Q	31.1	Very low	36.2	Very low	171 Å²	171	140.9 Å²	140.9	80%	0.799	77%	0.769	S	S	*	*			trans	68.3	158.1	158.7	-69.4	-80.2	-7.7	0	0	115.4
598	S	32	Very low	35.1	Very low	104 Å²	104	139.9 Å²	139.9	73%	0.727	77%	0.765	S	S	*	*			cis	-147.7	171.9	9.2	80.6	0	0	0	0	112.2
599	P	50.2	Low	35.6	Very low	98 Å²	98	135.9 Å²	135.9	64%	0.636	76%	0.761	S	S	*	*			trans	-106.2	175.7	-173.6	40.8	-35.1	0	0	0	114.3
600	R	34.8	Very low	35.7	Very low	216 Å²	216	134.6 Å²	134.6	82%	0.815	77%	0.765	S	S	*	*			trans	-179.6	145.2	132.3	-100	157.1	-174.5	-148.6	2.7	115.3
601	K	33.7	Very low	35	Very low	192 Å²	192	135.6 Å²	135.6	84%	0.835	76%	0.762	S	S	*	*			trans	32.1	137.2	137.3	-56.5	176.1	-179.2	-169.2	0	119.5
602	G	30.9	Very low	35.2	Very low	67 Å²	67	139.5 Å²	139.5	69%	0.691	77%	0.768	S	S	*	*			cis	178.9	-171.9	6.7	0	0	0	0	0	113.4
603	P	52	Low	35.2	Very low	122 Å²	122	136.8 Å²	136.8	79%	0.792	77%	0.765	S	S	*	*			trans	-85	162.9	-172.5	36.7	-37.7	0	0	0	113.6
604	P	42.4	Very low	35.1	Very low	109 Å²	109	138.6 Å²	138.6	71%	0.708	75%	0.754	S	S	*	*				-143.5	129.8	101.4	37.4	-22.1	0	0	0	114.2
605	T	33.3	Very low	35.2	Very low	116 Å²	116	139.8 Å²	139.8	71%	0.712	74%	0.744	S	S	*	*				69.4	143.8	99.4	72.8	0	0	0	0	118.5
606	V	32	Very low	35.7	Very low	131 Å²	131	136.5 Å²	136.5	79%	0.794	74%	0.744	S	S	*	*			trans	59.5	148.8	159.5	-66	0	0	0	0	119.9
607	N	28.1	Very low	35	Very low	134 Å²	134	138.1 Å²	138.1	72%	0.717	74%	0.743	S	S	*	*			cis	-157.7	174.3	-20.4	54.1	19.6	0	0	0	111.9
608	S	28.8	Very low	35	Very low	94 Å²	94	137.9 Å²	137.9	66%	0.657	74%	0.741	S	S	*	*			trans	-10.1	131.4	158.3	58.8	0	0	0	0	119.9
609	S	34.1	Very low	34.7	Very low	109 Å²	109	137.3 Å²	137.3	76%	0.762	74%	0.743	S	S	*	*				152.2	153.4	91.1	61.2	0	0	0	0	116.1
610	S	31.7	Very low	34.4	Very low	118 Å²	118	136.9 Å²	136.9	83%	0.825	75%	0.748	S	S	*	*			trans	68.7	151	151.2	-141.8	0	0	0	0	121
611	I	40.8	Very low	34.6	Very low	142 Å²	142	131.9 Å²	131.9	73%	0.728	74%	0.743	S	S	*	*			trans	-118.6	151.2	-179.5	-46.8	177.1	0	0	0	108
612	Y	30.4	Very low	34.4	Very low	219 Å²	219	132 Å²	132	86%	0.859	74%	0.743	S	S	*	*			trans	70.7	101.2	178.6	-71.3	-76.8	0	0	0	116.7
613	H	30.2	Very low	34.3	Very low	165 Å²	165	133.2 Å²	133.2	76%	0.764	74%	0.742	S	S	*	*			trans	-137	154.7	141.8	-135.5	-103.3	0	0	0	110.5
614	M	29.1	Very low	33.6	Very low	115 Å²	115	135 Å²	135	57%	0.567	74%	0.74	S	S	*	*			trans	10.4	120.2	165.8	-68.1	156.8	49	0	0	117.2
615	Y	35.2	Very low	33.8	Very low	167 Å²	167	135.2 Å²	135.2	66%	0.655	74%	0.741	S	S	*	*				-157.3	123.7	65.3	-106.1	-78.4	0	0	0	113.9	Q617	Y615-Q617 HydrophobicContact CD1-CB 4.05Å; Y615-Q617 WeakPolarHBondContact CD1-O 3.42Å; Y615-Q617 HydrophobicContact CE1-CB 4.25Å
616	L	44.9	Very low	34.7	Very low	180 Å²	180	134.6 Å²	134.6	94%	0.942	74%	0.739	S	S	*	*			trans	-130.4	61.6	159.7	-159.9	81.8	0	0	0	109.2
617	Q	30.6	Very low	34.5	Very low	131 Å²	131	137.7 Å²	137.7	61%	0.612	74%	0.742	S	S	*	*			trans	-163.3	122.2	-172.3	-117	171.9	-6.1	0	0	107.5	Y615	Y615-Q617 HydrophobicContact CD1-CB 4.05Å; Y615-Q617 WeakPolarHBondContact CD1-O 3.42Å; Y615-Q617 HydrophobicContact CE1-CB 4.25Å
618	H	30.1	Very low	35.1	Very low	167 Å²	167	137 Å²	137	77%	0.773	75%	0.745	S	S	*	*				-155.2	175	51.8	-102.7	-84.3	0	0	0	112.6
619	A	26.5	Very low	35.2	Very low	92 Å²	92	137 Å²	137	76%	0.76	75%	0.75	S	S	*	*			trans	-102	168.7	-176.7	0	0	0	0	0	113.9
620	A	42.8	Very low	35.1	Very low	89 Å²	89	137.8 Å²	137.8	74%	0.736	75%	0.75	S	S	*	*			trans	-62.8	-179.2	154.4	0	0	0	0	0	110.7
621	P	39.9	Very low	34.8	Very low	110 Å²	110	137.9 Å²	137.9	71%	0.714	74%	0.735	S	S	*	*			cis	-145.4	179.6	12.1	44.2	-25.4	0	0	0	117.4
622	K	29.5	Very low	34.2	Very low	194 Å²	194	132.8 Å²	132.8	84%	0.843	71%	0.714	S	S	*	*			trans	-130.8	133	134.6	-72.4	-177.7	179.6	176.3	0	106.5
623	S	28.3	Very low	34.1	Very low	94 Å²	94	126.5 Å²	126.5	66%	0.657	70%	0.699	S	S	*	*	S	Bend	cis	-174.5	155.1	3.5	43.3	0	0	0	0	108.4
624	Q	37.4	Very low	33.9	Very low	160 Å²	160	128.9 Å²	128.9	75%	0.748	70%	0.702	S	S	*	*			cis	179.2	174.3	-5.5	-107.6	160.1	-114.3	0	0	107
625	P	45.6	Very low	33.7	Very low	113 Å²	113	127 Å²	127	73%	0.734	71%	0.712	S	S	*	*			cis	-127.7	-132.4	-19.3	32	-6.5	0	0	0	111.7
626	P	52.8	Low	34	Very low	102 Å²	102	129 Å²	129	66%	0.662	72%	0.724	S	S	*	*				-138	176.3	-112.5	42.8	-22.6	0	0	0	120.1
627	K	28.6	Very low	33.9	Very low	197 Å²	197	126 Å²	126	86%	0.857	72%	0.716	S	S	*	*			trans	87.6	166.4	164.3	-49.9	178.7	-179.1	178.4	0	116.6
628	P	41	Very low	34	Very low	120 Å²	120	125.7 Å²	125.7	78%	0.779	72%	0.723	S	S	*	*				-141.4	163.6	-71.1	41.9	-25.1	0	0	0	117.7
629	A	30.8	Very low	33.9	Very low	93 Å²	93	125.5 Å²	125.5	77%	0.769	73%	0.726	S	S	*	*			trans	68.1	164.4	160.8	0	0	0	0	0	117.9
630	V	30.2	Very low	33.7	Very low	125 Å²	125	125.6 Å²	125.6	76%	0.758	72%	0.721	S	S	*	*			cis	-144.1	-167.3	8.3	-142	0	0	0	0	112.5
631	K	26.1	Very low	32.8	Very low	120 Å²	120	126.5 Å²	126.5	52%	0.522	72%	0.723	S	S	.	*			trans	-29.3	172.4	151.4	-66.9	172.4	175.2	174	0	114.5	T739 E740 P741	K631-T739 PolarHBondContact NZ-OG1 2.87Å; K631-E740 CarbonylContact C-O 3.54Å; K631-E740 VanDerWaalsContact CB-O 3.26Å; K631-E740 WeakPolarHBondContact CB-O 3.23Å; K631-E740 CarbonylContact O-C 3.53Å; K631-P741 CarbonylContact C-O 3.49Å; K631-P741 CarbonylContact O-C 3.49Å; K631-P741 WeakPolarHBondContact O-CD 3.35Å
632	A	29.5	Very low	32.2	Very low	35 Å²	35	127.1 Å²	127.1	29%	0.289	73%	0.729	S	S	.	*			cis	171.6	175.4	-19.9	0	0	0	0	0	110.9	E740 P741 E742	A632-E740 VanDerWaalsContact N-C 3.27Å; A632-E740 PolarHBondContact N-O 3.47Å; A632-E740 CarbonylContact O-C 3.48Å; A632-E740 WeakPolarHBondContact O-CA 2.79Å; A632-E740 VanDerWaalsContact O-CB 3.3Å; A632-E740 WeakPolarHBondContact O-CB 3.3Å; A632-P741 VanDerWaalsContact N-N 3.12Å; A632-P741 PolarHBondContact N-O 3.45Å; A632-P741 CarbonylContact O-C 3.57Å; A632-P741 WeakPolarHBondContact O-CA 3.23Å; A632-E742 CarbonylContact C-O 3.52Å; A632-E742 WeakPolarHBondContact CA-O 3.48Å; A632-E742 PolarHBondContact N-O 3.35Å; A632-E742 PolarHBondContact O-N 2.96Å
633	V	26.9	Very low	32.1	Very low	88 Å²	88	123.3 Å²	123.3	53%	0.533	73%	0.727	S	S	.	*			trans	82.7	164.9	160	-171.4	0	0	0	0	120.6	T739 E740	V633-T739 WeakPolarHBondContact CG2-O 3.21Å; V633-E740 HydrophobicContact CB-CB 3.85Å; V633-E740 HydrophobicContact CB-CG 3.88Å; V633-E740 HydrophobicContact CG1-CB 4.38Å; V633-E740 HydrophobicContact CG1-CG 3.85Å
634	Y	26.1	Very low	32.3	Very low	214 Å²	214	125.1 Å²	125.1	84%	0.839	73%	0.734	S	S	*	*			trans	-54.8	166.7	178.5	-82.7	-129	0	0	0	116.8
635	G	26.1	Very low	32.9	Very low	75 Å²	75	123.4 Å²	123.4	77%	0.773	74%	0.737	S	S	*	*			trans	173.4	90.2	153.4	0	0	0	0	0	117.8
636	K	41.4	Very low	32	Very low	209 Å²	209	122 Å²	122	91%	0.909	74%	0.735	S	S	*	*			trans	-90.7	136.1	150.4	-79.3	-165.8	177.1	-172	0	107
637	P	40.8	Very low	31	Very low	117 Å²	117	122.3 Å²	122.3	76%	0.76	74%	0.74	S	S	*	*				-149.3	153.1	92.5	38.6	-21.9	0	0	0	117.6
638	V	33.8	Very low	32	Very low	125 Å²	125	119 Å²	119	76%	0.758	74%	0.738	S	S	*	*			trans	-2.9	124.9	140.9	-170	0	0	0	0	117.6
639	L	27.5	Very low	31.4	Very low	163 Å²	163	120.4 Å²	120.4	85%	0.853	74%	0.739	S	S	*	*				-170.5	178.5	117.7	-101.3	175.4	0	0	0	112.8
640	S	22.5	Very low	32.2	Very low	94 Å²	94	121.4 Å²	121.4	66%	0.657	74%	0.737	S	S	*	*			trans	-107.9	158.8	-147.4	-37.6	0	0	0	0	117.4
641	S	24.5	Very low	32.1	Very low	109 Å²	109	125 Å²	125	76%	0.762	74%	0.739	S	S	*	*			trans	80.2	135.1	138.8	-60.5	0	0	0	0	123.2
642	S	26.9	Very low	32.2	Very low	122 Å²	122	123.9 Å²	123.9	85%	0.853	74%	0.742	S	S	*	*			trans	70.7	145.2	160.2	72.5	0	0	0	0	117.2
643	S	27.6	Very low	32.1	Very low	114 Å²	114	130.5 Å²	130.5	80%	0.797	77%	0.766	S	S	*	*			cis	-150	-177.1	32.5	50.4	0	0	0	0	115.8
644	T	33.1	Very low	32.2	Very low	132 Å²	132	131.1 Å²	131.1	81%	0.81	78%	0.781	S	S	*	*			trans	-77.8	-178.9	-176.1	39.1	0	0	0	0	113.8
645	P	48.4	Very low	32.1	Very low	124 Å²	124	124.9 Å²	124.9	81%	0.805	78%	0.781	S	S	*	*			cis	-138.3	-163.5	19.2	47.5	-27.3	0	0	0	114.5
646	A	28.1	Very low	32	Very low	83 Å²	83	125.2 Å²	125.2	69%	0.686	79%	0.785	S	S	*	*			cis	-153.7	154.9	6	0	0	0	0	0	113.4
647	S	31	Very low	31.4	Very low	109 Å²	109	120 Å²	120	76%	0.762	78%	0.781	S	S	*	*			trans	31.8	152.9	135.5	-65.1	0	0	0	0	123.7
648	P	50.1	Low	30.8	Very low	128 Å²	128	124.2 Å²	124.2	83%	0.831	79%	0.788	S	S	*	*			cis	-132.5	163.6	25.9	40	-22.8	0	0	0	119.6
649	L	28.6	Very low	30.9	Very low	150 Å²	150	124 Å²	124	79%	0.785	79%	0.788	S	S	*	*			trans	-48.3	164.9	168.6	-74.1	165.6	0	0	0	115.4
650	P	47	Very low	30.7	Very low	114 Å²	114	120.3 Å²	120.3	74%	0.74	78%	0.782	S	S	*	*			cis	-134.6	-168.5	29	47	-29.8	0	0	0	114.4
651	Y	27.5	Very low	30.7	Very low	201 Å²	201	123.7 Å²	123.7	79%	0.788	79%	0.792	S	S	*	*			cis	-142.3	-116.9	7.7	-164.2	-140.4	0	0	0	115.3
652	V	28.6	Very low	30.7	Very low	96 Å²	96	125.7 Å²	125.7	58%	0.582	79%	0.789	S	S	*	*			trans	-160	152.7	-151.2	142.6	0	0	0	0	109.2
653	Q	28.1	Very low	30.6	Very low	173 Å²	173	123.3 Å²	123.3	81%	0.808	78%	0.784	S	S	*	*			cis	-174	164.2	-20.3	-174.5	168.9	-109.3	0	0	109.2
654	A	27.8	Very low	30.5	Very low	101 Å²	101	126.1 Å²	126.1	84%	0.835	79%	0.789	S	S	*	*			trans	73.7	150.3	168.3	0	0	0	0	0	117.7
655	G	25.4	Very low	30.2	Very low	83 Å²	83	124.7 Å²	124.7	86%	0.856	79%	0.79	S	S	*	*			cis	151.4	128.2	-10.1	0	0	0	0	0	113
656	G	24.4	Very low	29.2	Very low	83 Å²	83	121.2 Å²	121.2	86%	0.856	78%	0.777	S	S	*	*			trans	169.1	166.2	179.8	0	0	0	0	0	115
657	A	26.8	Very low	29.3	Very low	98 Å²	98	121.2 Å²	121.2	81%	0.81	77%	0.772	S	S	*	*			trans	-92.4	175.8	-175.5	0	0	0	0	0	113.9
658	F	29	Very low	29.1	Very low	207 Å²	207	121.9 Å²	121.9	91%	0.908	77%	0.767	S	S	*	*			trans	-49.6	142.7	155	-81.3	-73.9	0	0	0	110.3
659	P	36.7	Very low	28.2	Very low	119 Å²	119	122 Å²	122	77%	0.773	76%	0.761	S	S	*	*				-141.5	-169.1	65.1	41.5	-24.5	0	0	0	115.1
660	A	23.8	Very low	28.5	Very low	86 Å²	86	119.4 Å²	119.4	71%	0.711	76%	0.755	S	S	*	*			trans	-77.7	161.1	169.4	0	0	0	0	0	112.3
661	L	21.8	Very low	28.6	Very low	166 Å²	166	120.9 Å²	120.9	87%	0.869	76%	0.762	S	S	*	*			trans	-169	157.6	136.9	-107.4	157.4	0	0	0	114.4
662	Q	23.1	Very low	28.8	Very low	151 Å²	151	119.7 Å²	119.7	71%	0.706	77%	0.769	S	S	*	*			trans	-39.1	154.7	167.6	-130	89.8	-6.4	0	0	115.7	E691	Q662-E691 PolarHBondContact NE2-OE1 2.8Å
663	G	25	Very low	29.2	Very low	72 Å²	72	118 Å²	118	74%	0.742	77%	0.772	S	S	*	*			trans	-170.3	55.8	176.7	0	0	0	0	0	120
664	L	25.6	Very low	29.9	Very low	172 Å²	172	118.6 Å²	118.6	90%	0.901	77%	0.774	S	S	*	*			trans	57.1	111.4	144.7	-64.1	166.1	0	0	0	123.2
665	A	27.2	Very low	30.2	Very low	102 Å²	102	121.3 Å²	121.3	84%	0.843	77%	0.774	S	S	*	*				81.1	135.6	113.1	0	0	0	0	0	124.8
666	G	27.2	Very low	30.8	Very low	52 Å²	52	124.4 Å²	124.4	54%	0.536	77%	0.771	S	S	.	*			trans	111.2	142.1	152.8	0	0	0	0	0	117.1	P688	G666-P688 WeakPolarHBondContact O-CD 2.94Å
667	S	30.2	Very low	31.1	Very low	82 Å²	82	127.7 Å²	127.7	57%	0.573	77%	0.769	S	S	*	*			cis	-167.5	113.2	-17.4	48.8	0	0	0	0	112.7	P686	S667-P686 CarbonylContact O-C 3.59Å
668	D	26.9	Very low	31.7	Very low	123 Å²	123	128.5 Å²	128.5	66%	0.658	77%	0.766	S	S	*	*			trans	71.7	148.5	154.7	-100.8	-40.3	0	0	0	127	P687	D668-P687 CarbonylContact C-O 3.38Å; D668-P687 VanDerWaalsContact CA-O 3.25Å; D668-P687 WeakPolarHBondContact CA-O 3.33Å; D668-P687 VanDerWaalsContact N-C 3.34Å; D668-P687 PolarHBondContact N-O 3.49Å; D668-P687 CarbonylContact O-C 3.49Å
669	D	30.8	Very low	32.1	Very low	131 Å²	131	127.3 Å²	127.3	70%	0.701	76%	0.763	S	S	*	*			trans	78	152.4	159.9	-118.9	40	0	0	0	122
670	S	35.8	Very low	31.6	Very low	95 Å²	95	127 Å²	127	66%	0.664	76%	0.764	S	S	*	*			cis	-173	-174.9	-45.8	-89.9	0	0	0	0	108.5
671	V	49.2	Very low	31.9	Very low	145 Å²	145	132.1 Å²	132.1	88%	0.879	77%	0.77	S	S	*	*			trans	-126.5	138.4	179	-68.6	0	0	0	0	113.6
672	D	30.6	Very low	32.4	Very low	176 Å²	176	132.7 Å²	132.7	94%	0.941	77%	0.769	S	S	*	*			trans	-157.1	178.3	148.4	-146.6	-16.3	0	0	0	110.3
673	G	38.4	Very low	33.8	Very low	62 Å²	62	130.9 Å²	130.9	64%	0.639	77%	0.77	S	S	*	*			trans	-133.8	-175.2	-168.4	0	0	0	0	0	118.7
674	E	41.3	Very low	34	Very low	185 Å²	185	133.4 Å²	133.4	86%	0.864	78%	0.776	S	S	*	*			trans	50.2	97.4	162.1	-162.4	179.3	135.7	0	0	119.9
675	L	35.7	Very low	34.3	Very low	158 Å²	158	129.9 Å²	129.9	83%	0.827	77%	0.772	S	S	*	*			trans	-167.7	176.5	130.3	-132.7	71.7	0	0	0	113.7
676	D	38	Very low	35.6	Very low	148 Å²	148	129.6 Å²	129.6	79%	0.791	76%	0.761	S	S	*	*			trans	-69.2	167.3	179.6	-63.1	-101	0	0	0	116.4
677	D	29.8	Very low	36.9	Very low	152 Å²	152	130.2 Å²	130.2	81%	0.813	76%	0.756	S	S	*	*			trans	-71.4	137.9	177.9	-168.9	-99.8	0	0	0	113.2
678	P	40.4	Very low	38	Very low	114 Å²	114	129.7 Å²	129.7	74%	0.74	75%	0.751	S	S	*	*				-147.8	170.3	114.7	37.6	-21.2	0	0	0	116.1
679	E	35.8	Very low	38.6	Very low	182 Å²	182	129 Å²	129	85%	0.85	76%	0.756	S	S	*	*			trans	-55.2	132.4	-178	-57.7	175.6	75.2	0	0	116.7
680	S	27	Very low	38.7	Very low	113 Å²	113	129.4 Å²	129.4	79%	0.79	76%	0.762	S	S	*	*				171.4	137.4	122.6	44.2	0	0	0	0	117.5
681	F	30.2	Very low	38.7	Very low	194 Å²	194	131 Å²	131	85%	0.851	76%	0.759	S	S	*	*			trans	16.7	111.2	157.5	-64	-94.3	0	0	0	124.8
682	Q	31	Very low	37.7	Very low	178 Å²	178	130.3 Å²	130.3	83%	0.832	75%	0.751	S	S	*	*			trans	52.4	162.2	135.6	-69	-169.4	-30.4	0	0	123.1
683	P	53.7	Low	38	Very low	112 Å²	112	128.3 Å²	128.3	73%	0.727	74%	0.738	S	S	*	*			cis	-141	-175.8	-36.6	41.3	-22.9	0	0	0	116.5
684	S	28.7	Very low	38.5	Very low	126 Å²	126	131.2 Å²	131.2	88%	0.881	75%	0.746	S	S	*	*			trans	96	177.7	162.3	77.8	0	0	0	0	121.9
685	A	32.8	Very low	38.3	Very low	98 Å²	98	133.5 Å²	133.5	81%	0.81	75%	0.747	S	S	*	*			trans	-152.9	-171.4	-146.3	0	0	0	0	0	119
686	P	54.5	Low	38.8	Very low	95 Å²	95	131.3 Å²	131.3	62%	0.617	74%	0.742	S	S	*	*			trans	-122	0	-132.9	37.8	-11	0	0	0	114.8	S667	S667-P686 CarbonylContact O-C 3.59Å
687	P	54.3	Low	38.3	Very low	65 Å²	65	132.3 Å²	132.3	42%	0.422	75%	0.747	S	S	.	*				0	-79	0	25.3	3.5	0	0	0	127.7	D668	D668-P687 CarbonylContact C-O 3.38Å; D668-P687 VanDerWaalsContact CA-O 3.25Å; D668-P687 WeakPolarHBondContact CA-O 3.33Å; D668-P687 VanDerWaalsContact N-C 3.34Å; D668-P687 PolarHBondContact N-O 3.49Å; D668-P687 CarbonylContact O-C 3.49Å
688	P	53.2	Low	39.1	Very low	72 Å²	72	130 Å²	130	47%	0.468	74%	0.743	S	S	.	*			trans	-141.1	176.1	-140.2	44.8	-25.2	0	0	0	123.2	G666	G666-P688 WeakPolarHBondContact O-CD 2.94Å
689	S	38.4	Very low	39.5	Very low	109 Å²	109	129.8 Å²	129.8	76%	0.762	74%	0.741	S	S	*	*			trans	95.4	-177.7	155.4	-46.5	0	0	0	0	119.4
690	V	34	Very low	39.2	Very low	138 Å²	138	126.6 Å²	126.6	84%	0.836	73%	0.734	S	S	*	*			cis	-155.6	176.6	12	-127.9	0	0	0	0	109.3
691	E	35.1	Very low	39.4	Very low	128 Å²	128	130 Å²	130	60%	0.598	74%	0.735	S	S	*	*			cis	-133.8	-103.7	-4.6	-165.9	-164.3	-124.2	0	0	111.5	Q662	Q662-E691 PolarHBondContact NE2-OE1 2.8Å
692	N	29.4	Very low	39.2	Very low	131 Å²	131	128.7 Å²	128.7	70%	0.701	74%	0.736	S	S	*	*			cis	-155.9	161.3	-11.9	-177.2	-121.2	0	0	0	111.9
693	I	36.5	Very low	39.7	Very low	134 Å²	134	126.3 Å²	126.3	69%	0.687	73%	0.733	S	S	*	*			trans	-155.4	166	-170.8	-27.4	175.7	0	0	0	111.9
694	P	48.5	Very low	38.9	Very low	124 Å²	124	126.7 Å²	126.7	81%	0.805	74%	0.736	S	S	*	*				-156.3	-178.4	103.6	40.3	-20.2	0	0	0	118.9
695	R	37.4	Very low	38.9	Very low	232 Å²	232	127.6 Å²	127.6	88%	0.875	73%	0.728	S	S	*	*			trans	-93.1	-176.6	175.1	-68	-171.6	-177.7	-162.5	3	111.3
696	P	45.5	Very low	38.9	Very low	113 Å²	113	129.7 Å²	129.7	73%	0.734	73%	0.731	S	S	*	*			cis	-163.1	-168.8	43	47	-21.6	0	0	0	121.8
697	L	28.1	Very low	37.8	Very low	168 Å²	168	132.1 Å²	132.1	88%	0.88	73%	0.733	S	S	*	*			trans	78.6	141.3	156.8	-65	177.8	0	0	0	123
698	S	46.6	Very low	36.6	Very low	104 Å²	104	134.9 Å²	134.9	73%	0.727	76%	0.755	S	S	*	*			trans	-116.8	173.7	158.7	62.3	0	0	0	0	107.7
699	P	49.8	Very low	36	Very low	109 Å²	109	136.7 Å²	136.7	71%	0.708	77%	0.766	S	S	*	*			cis	-146.1	-166.9	18.9	36.8	-12.3	0	0	0	117
700	T	29	Very low	36.1	Very low	115 Å²	115	139.9 Å²	139.9	71%	0.706	77%	0.774	S	S	*	*			trans	98.7	128.6	150.8	-40.3	0	0	0	0	119.8
701	K	29.8	Very low	36.7	Very low	184 Å²	184	144.8 Å²	144.8	80%	0.8	78%	0.777	S	S	*	*			trans	21.7	127.5	157.9	-57.4	173.1	179.1	177.8	0	118.3
702	L	27.3	Very low	37.2	Very low	167 Å²	167	149.3 Å²	149.3	87%	0.874	79%	0.79	S	S	*	*				-167.1	148.2	73.9	-88	168.5	0	0	0	111.7
703	T	41.2	Very low	37.7	Very low	128 Å²	128	152.3 Å²	152.3	79%	0.785	80%	0.8	S	S	*	*			trans	-103.2	148.9	165.5	51.4	0	0	0	0	110.3
704	P	37.6	Very low	38.4	Very low	120 Å²	120	149.8 Å²	149.8	78%	0.779	79%	0.794	S	S	*	*				-142.6	130.7	102.8	35.4	-20.9	0	0	0	116.1
705	M	28.4	Very low	38.2	Very low	145 Å²	145	149.4 Å²	149.4	71%	0.714	79%	0.785	S	S	*	*			trans	26.9	120	135.6	-58.9	169.6	66.3	0	0	120.8
706	V	31.8	Very low	39	Very low	143 Å²	143	141.9 Å²	141.9	87%	0.867	77%	0.773	S	S	*	*				-129.1	150.7	119.9	-178.3	0	0	0	0	107.6
707	H	32.9	Very low	39.5	Very low	145 Å²	145	142.1 Å²	142.1	67%	0.671	77%	0.768	S	S	*	*			trans	-128.3	152	176.7	-73.8	6.6	0	0	0	110.4
708	S	27.5	Very low	40.9	Very low	124 Å²	124	139 Å²	139	87%	0.867	75%	0.752	S	S	*	*			trans	-157.9	147.9	135.7	-87.7	0	0	0	0	112.6
709	P	41.7	Very low	41.4	Very low	109 Å²	109	138 Å²	138	71%	0.708	74%	0.736	S	S	*	*			trans	-137.9	135.6	-146.1	35.9	-15.4	0	0	0	116.1
710	L	39.3	Very low	42	Very low	177 Å²	177	137.2 Å²	137.2	93%	0.927	73%	0.728	S	S	*	*			trans	-160.5	37.4	170.4	-115.7	153.8	0	0	0	116.3
711	R	47.5	Very low	43.2	Very low	241 Å²	241	137.6 Å²	137.6	91%	0.909	73%	0.726	S	S	*	*			trans	-144.5	60.3	172.6	-72.8	-163.9	-175.7	171.7	2.7	114.2
712	Y	44.6	Very low	44.4	Very low	223 Å²	223	136.1 Å²	136.1	88%	0.875	72%	0.715	S	S	*	*			trans	-150.9	98.4	169	-96.9	-78.9	0	0	0	110.3
713	Q	40.8	Very low	45.6	Very low	193 Å²	193	132.7 Å²	132.7	90%	0.902	69%	0.693	S	S	*	*			trans	-162.2	35.8	175.3	-138.3	167.5	16.5	0	0	115.7
714	S	50.5	Low	46.4	Very low	81 Å²	81	135.2 Å²	135.2	57%	0.566	69%	0.693	S	S	*	*	S	Bend	trans	-131.7	-27.5	-178.9	55.3	0	0	0	0	116.3	A716	S714-A716 VanDerWaalsContact C-N 3.34Å; S714-A716 PolarHBondContact O-N 3.1Å
715	D	45.3	Very low	47.1	Very low	116 Å²	116	136.9 Å²	136.9	62%	0.62	70%	0.695	S	S	*	*	H	α-helix	trans	-81.5	-11	-172.3	-62.4	-36.7	0	0	0	114.4
716	A	53.3	Low	47.5	Very low	74 Å²	74	133 Å²	133	61%	0.612	69%	0.686	S	S	*	*	H	α-helix	trans	-70.7	-42.7	-177.7	0	0	0	0	0	113.1	S714	S714-A716 VanDerWaalsContact C-N 3.34Å; S714-A716 PolarHBondContact O-N 3.1Å
717	D	57.4	Low	48	Very low	118 Å²	118	133.4 Å²	133.4	63%	0.631	68%	0.683	S	S	*	*	H	α-helix	trans	-75.7	-29.1	-170.6	-64.2	-45.8	0	0	0	113.3	E719 V720 L721	D717-E719 VanDerWaalsContact C-N 3.29Å; D717-E719 PolarHBondContact O-N 3.1Å; D717-V720 PolarHBondContact O-N 2.98Å; D717-L721 PolarHBondContact O-N 3.01Å
718	L	57.7	Low	48.4	Very low	102 Å²	102	130.3 Å²	130.3	53%	0.534	68%	0.683	S	S	.	*	H	α-helix	trans	-65.1	-30.4	179.2	-79.5	168.4	0	0	0	113
719	E	55.5	Low	49	Very low	84 Å²	84	129.7 Å²	129.7	39%	0.393	68%	0.676	S	S	.	*	H	α-helix	trans	-85	-23.6	178.9	-164.4	51.9	-149.9	0	0	113	D717 L721 R722 K723	D717-E719 VanDerWaalsContact C-N 3.29Å; D717-E719 PolarHBondContact O-N 3.1Å; E719-L721 VanDerWaalsContact C-N 3.3Å; E719-L721 PolarHBondContact O-N 3.01Å; E719-R722 PolarHBondContact O-N 2.84Å; E719-R722 IonicContact OE2-NH1 3.89Å; E719-K723 PolarHBondContact O-N 3.43Å
720	V	63.1	Low	49.6	Very low	92 Å²	92	135.7 Å²	135.7	56%	0.558	68%	0.684	S	S	*	*	H	α-helix	trans	-61	-41.9	168.3	178.2	0	0	0	0	110.4	D717 K723 K724	D717-V720 PolarHBondContact O-N 2.98Å; V720-K723 WeakPolarHBondContact O-CB 3.46Å; V720-K723 PolarHBondContact O-N 3.11Å; V720-K724 PolarHBondContact O-N 3.35Å
721	L	55.2	Low	49.4	Very low	124 Å²	124	131.5 Å²	131.5	65%	0.649	67%	0.668	S	S	*	*	H	α-helix	trans	-64.7	-43.9	179.8	-131.4	71.4	0	0	0	112.5	D717 E719 K723 K724	D717-L721 PolarHBondContact O-N 3.01Å; E719-L721 VanDerWaalsContact C-N 3.3Å; E719-L721 PolarHBondContact O-N 3.01Å; L721-K723 PolarHBondContact O-N 3.37Å; L721-K724 PolarHBondContact O-N 3.02Å
722	R	54.5	Low	48.7	Very low	152 Å²	152	128.1 Å²	128.1	57%	0.574	67%	0.667	S	S	*	*	H	α-helix	trans	-67.3	-18.4	177.6	-69.2	-166.1	-177	92.5	1.6	114.4	E719	E719-R722 PolarHBondContact O-N 2.84Å; E719-R722 IonicContact OE2-NH1 3.89Å
723	K	52.2	Low	48.6	Very low	95 Å²	95	126.9 Å²	126.9	41%	0.413	67%	0.666	S	S	.	*	H	α-helix	trans	-79.7	-35.3	174.6	-136.1	167.6	-170.8	167.5	0	111.7	A380 L381 E719 V720 L721 L725	A380-K723 PolarHBondContact O-NZ 3.33Å; L381-K723 WeakPolarHBondContact O-CE 3.43Å; E719-K723 PolarHBondContact O-N 3.43Å; V720-K723 WeakPolarHBondContact O-CB 3.46Å; V720-K723 PolarHBondContact O-N 3.11Å; L721-K723 PolarHBondContact O-N 3.37Å; K723-L725 PolarHBondContact O-N 2.84Å
724	K	57.1	Low	48.2	Very low	181 Å²	181	127.7 Å²	127.7	79%	0.787	67%	0.666	S	S	*	*	H	α-helix	trans	-72.5	-26.2	-172.7	-145	169.9	-173.2	176.6	0	114.2	V720 L721	V720-K724 PolarHBondContact O-N 3.35Å; L721-K724 PolarHBondContact O-N 3.02Å
725	L	52.2	Low	47.4	Very low	155 Å²	155	134.1 Å²	134.1	81%	0.812	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.2	-8.4	179.6	-117.9	78.5	0	0	0	115.3	K723	K723-L725 PolarHBondContact O-N 2.84Å
726	A	36.7	Very low	46.6	Very low	64 Å²	64	133.9 Å²	133.9	53%	0.529	69%	0.686	S	S	.	*	T	Hydrogen-bonded Turn	trans	-80.5	-25.7	-165.4	0	0	0	0	0	115.4
727	N	43.4	Very low	45.4	Very low	151 Å²	151	134.7 Å²	134.7	81%	0.807	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.9	13.1	-167	-76.2	-1.1	0	0	0	115.1	P729	N727-P729 WeakPolarHBondContact O-CD 3.5Å
728	A	41.4	Very low	44.2	Very low	81 Å²	81	136.2 Å²	136.2	67%	0.669	69%	0.694	S	S	*	*	S	Bend	trans	-69.9	120.9	168.6	0	0	0	0	0	109.7	R730	A728-R730 PolarHBondContact O-N 3.19Å
729	P	39	Very low	43	Very low	111 Å²	111	135.2 Å²	135.2	72%	0.721	69%	0.692	S	S	*	*	P	Polyproline II helix	trans	-68.8	120.5	-173.9	26.3	-33.8	0	0	0	111.3	N727 P731	N727-P729 WeakPolarHBondContact O-CD 3.5Å; P729-P731 WeakPolarHBondContact O-CD 3.49Å
730	R	55.3	Low	41.9	Very low	234 Å²	234	136.3 Å²	136.3	88%	0.883	70%	0.697	S	S	*	*	P	Polyproline II helix	trans	-64.2	123.5	171.5	-61.8	-176.4	-175.3	-143.6	1.1	109.1	A728 L732	A728-R730 PolarHBondContact O-N 3.19Å; R730-L732 PolarHBondContact O-N 3.34Å
731	P	35.3	Very low	40.9	Very low	90 Å²	90	135.2 Å²	135.2	58%	0.584	69%	0.692	S	S	*	*			trans	-62.4	114.3	173.7	-23	34.6	0	0	0	110.4	P729	P729-P731 WeakPolarHBondContact O-CD 3.49Å
732	L	32	Very low	39.6	Very low	169 Å²	169	136.9 Å²	136.9	89%	0.885	70%	0.696	S	S	*	*	P	Polyproline II helix	trans	-63.1	135.6	-179.1	-78.6	165	0	0	0	111.1	R730 K734	R730-L732 PolarHBondContact O-N 3.34Å; L732-K734 PolarHBondContact O-N 2.82Å
733	K	43.3	Very low	38.4	Very low	198 Å²	198	132.8 Å²	132.8	86%	0.861	70%	0.702	S	S	*	*	P	Polyproline II helix	trans	-60	120.5	167.1	-75.6	176.9	172.7	176.8	0	109.1	R735	K733-R735 PolarHBondContact O-N 3.22Å
734	K	32.4	Very low	37.8	Very low	209 Å²	209	134.3 Å²	134.3	91%	0.909	72%	0.721	S	S	*	*	P	Polyproline II helix	trans	-73.1	117.9	145.6	-92.1	-165.2	172.4	-176	0	107.8	L732	L732-K734 PolarHBondContact O-N 2.82Å
735	R	33.6	Very low	36.9	Very low	217 Å²	217	132 Å²	132	82%	0.819	73%	0.728	S	S	*	*	P	Polyproline II helix	trans	-65.2	142.9	164.8	-71.5	172.4	162.2	-128.1	2.8	109.1	K733	K733-R735 PolarHBondContact O-N 3.22Å
736	S	27.4	Very low	36	Very low	110 Å²	110	128 Å²	128	77%	0.769	72%	0.723	S	S	*	*				-155.1	123.8	99.9	-75.2	0	0	0	0	106.6
737	S	27.9	Very low	36.1	Very low	92 Å²	92	131.2 Å²	131.2	64%	0.643	74%	0.739	S	S	*	*				58.2	107.7	58.8	75.1	0	0	0	0	113.9
738	I	33.9	Very low	35.9	Very low	150 Å²	150	129.1 Å²	129.1	77%	0.769	73%	0.728	S	S	*	*				-168.2	117	125.8	-166.8	160.2	0	0	0	113.6
739	T	31.1	Very low	35.8	Very low	80 Å²	80	132 Å²	132	49%	0.491	73%	0.73	S	S	.	*			trans	69.8	143.8	155.2	55	0	0	0	0	124.1	K631 V633	K631-T739 PolarHBondContact NZ-OG1 2.87Å; V633-T739 WeakPolarHBondContact CG2-O 3.21Å
740	E	32.2	Very low	35.6	Very low	107 Å²	107	134.9 Å²	134.9	50%	0.5	73%	0.734	S	S	.	*			trans	-110.4	-145	178.7	-39.2	-172.5	141.3	0	0	110	K631 A632 V633	K631-E740 CarbonylContact C-O 3.54Å; K631-E740 VanDerWaalsContact CB-O 3.26Å; K631-E740 WeakPolarHBondContact CB-O 3.23Å; K631-E740 CarbonylContact O-C 3.53Å; A632-E740 VanDerWaalsContact N-C 3.27Å; A632-E740 PolarHBondContact N-O 3.47Å; A632-E740 CarbonylContact O-C 3.48Å; A632-E740 WeakPolarHBondContact O-CA 2.79Å; A632-E740 VanDerWaalsContact O-CB 3.3Å; A632-E740 WeakPolarHBondContact O-CB 3.3Å; V633-E740 HydrophobicContact CB-CB 3.85Å; V633-E740 HydrophobicContact CB-CG 3.88Å; V633-E740 HydrophobicContact CG1-CB 4.38Å; V633-E740 HydrophobicContact CG1-CG 3.85Å
741	P	43.7	Very low	34.9	Very low	70 Å²	70	132 Å²	132	46%	0.455	73%	0.729	S	S	.	*			cis	-107.5	141.4	-25.7	38.7	-37.9	0	0	0	118.7	K631 A632	K631-P741 CarbonylContact C-O 3.49Å; K631-P741 CarbonylContact O-C 3.49Å; K631-P741 WeakPolarHBondContact O-CD 3.35Å; A632-P741 VanDerWaalsContact N-N 3.12Å; A632-P741 PolarHBondContact N-O 3.45Å; A632-P741 CarbonylContact O-C 3.57Å; A632-P741 WeakPolarHBondContact O-CA 3.23Å
742	E	27.9	Very low	35.3	Very low	158 Å²	158	134.9 Å²	134.9	74%	0.738	74%	0.738	S	S	*	*			trans	71.6	176.7	164.3	-56.1	171.3	92.5	0	0	117.2	A632	A632-E742 CarbonylContact C-O 3.52Å; A632-E742 WeakPolarHBondContact CA-O 3.48Å; A632-E742 PolarHBondContact N-O 3.35Å; A632-E742 PolarHBondContact O-N 2.96Å
743	G	27.8	Very low	35.6	Very low	67 Å²	67	134.3 Å²	134.3	69%	0.691	74%	0.735	S	S	*	*			cis	-155.1	-167.1	8.4	0	0	0	0	0	115.1
744	P	40	Very low	35.5	Very low	127 Å²	127	135.3 Å²	135.3	83%	0.825	74%	0.735	S	S	*	*			trans	-116.2	128.7	-142.4	38.1	-30.7	0	0	0	118.2
745	S	37.6	Very low	35.8	Very low	132 Å²	132	133.6 Å²	133.6	92%	0.923	73%	0.73	S	S	*	*			trans	-179.7	125	136.7	43.3	0	0	0	0	112
746	G	34.6	Very low	35.8	Very low	70 Å²	70	134.7 Å²	134.7	72%	0.722	73%	0.734	S	S	*	*			trans	-173.2	135.2	176	0	0	0	0	0	109.9
747	P	37.7	Very low	35.7	Very low	132 Å²	132	138.5 Å²	138.5	86%	0.857	74%	0.737	S	S	*	*			trans	-74.8	151.5	-159	26.8	-34.5	0	0	0	115.4
748	N	39	Very low	35.8	Very low	107 Å²	107	140.6 Å²	140.6	57%	0.572	74%	0.741	S	S	*	*			trans	-86.6	108.1	-170.5	-178.8	-11.7	0	0	0	112.4	Q750 K751	N748-Q750 VanDerWaalsContact C-N 3.27Å; N748-Q750 PolarHBondContact O-N 3.42Å; N748-Q750 WeakPolarHBondContact OD1-CA 3.46Å; N748-Q750 WeakPolarHBondContact OD1-CB 3.36Å; N748-Q750 PolarHBondContact OD1-N 3.15Å; N748-K751 PolarHBondContact O-N 2.81Å
749	I	40.3	Very low	35.7	Very low	141 Å²	141	140.3 Å²	140.3	72%	0.723	75%	0.747	S	S	*	*	G	3₁₀ helix	trans	-69.6	-20.7	180	-60.2	175.9	0	0	0	112.5	K751 L752	I749-K751 PolarHBondContact O-N 3.04Å; I749-K751 VanDerWaalsContact O-N 3.08Å; I749-L752 PolarHBondContact O-N 3.05Å
750	Q	34.8	Very low	35.9	Very low	172 Å²	172	144.6 Å²	144.6	80%	0.804	77%	0.766	S	S	*	*	G	3₁₀ helix	trans	-71	1.2	175.2	-62.3	-175.4	-76	0	0	113.9	N748	N748-Q750 VanDerWaalsContact C-N 3.27Å; N748-Q750 PolarHBondContact O-N 3.42Å; N748-Q750 WeakPolarHBondContact OD1-CA 3.46Å; N748-Q750 WeakPolarHBondContact OD1-CB 3.36Å; N748-Q750 PolarHBondContact OD1-N 3.15Å
751	K	41.1	Very low	35.8	Very low	175 Å²	175	144.4 Å²	144.4	76%	0.761	78%	0.782	S	S	*	*	G	3₁₀ helix	trans	-91.9	-5.8	170.2	-101.1	-164.1	173.2	-168.3	0	115.7	N748 I749	N748-K751 PolarHBondContact O-N 2.81Å; I749-K751 PolarHBondContact O-N 3.04Å; I749-K751 VanDerWaalsContact O-N 3.08Å
752	L	42.4	Very low	35.1	Very low	150 Å²	150	145 Å²	145	79%	0.785	80%	0.801	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.2	-15	-178.1	-157.3	64.9	0	0	0	114.6	I749	I749-L752 PolarHBondContact O-N 3.05Å
753	L	39.7	Very low	35.2	Very low	156 Å²	156	140.9 Å²	140.9	82%	0.817	80%	0.801	S	S	*	*	S	Bend	trans	-114.4	29.1	-177.8	-66.2	176.2	0	0	0	113.7
754	Y	40	Very low	35.4	Very low	219 Å²	219	145 Å²	145	86%	0.859	81%	0.805	S	S	*	*	S	Bend	trans	-141.4	37.1	170.5	-143.6	-96.8	0	0	0	112.9
755	Q	38.7	Very low	35	Very low	173 Å²	173	147.7 Å²	147.7	81%	0.808	81%	0.807	S	S	*	*	S	Bend	trans	-137	43.2	178.5	-156.4	-172.1	-14.7	0	0	113.5
756	R	33.6	Very low	34.6	Very low	241 Å²	241	145 Å²	145	91%	0.909	80%	0.801	S	S	*	*	S	Bend	trans	-152.1	18.1	163.8	-130.7	-172.5	-171.1	-152.3	0.8	120.2
757	F	25.4	Very low	34.3	Very low	190 Å²	190	149.7 Å²	149.7	83%	0.833	81%	0.809	S	S	*	*	S	Bend	trans	-152.5	72.6	164.6	-136.5	-85.8	0	0	0	115.5
758	N	31.3	Very low	33.7	Very low	135 Å²	135	146.9 Å²	146.9	72%	0.722	80%	0.804	S	S	*	*				167.5	119.1	124.5	-90.2	-24.6	0	0	0	112.2
759	T	30.2	Very low	33.2	Very low	145 Å²	145	145.4 Å²	145.4	89%	0.89	82%	0.815	S	S	*	*			trans	-137.1	131.5	146.9	-58.7	0	0	0	0	106.1
760	L	35.2	Very low	32.6	Very low	170 Å²	170	145.3 Å²	145.3	89%	0.89	83%	0.826	S	S	*	*			trans	-84.2	164.8	-171.6	-156.2	67.4	0	0	0	111.8
761	A	31.4	Very low	32.2	Very low	102 Å²	102	140.5 Å²	140.5	84%	0.843	82%	0.823	S	S	*	*			trans	-74.7	159.1	-178.8	0	0	0	0	0	114.4
762	G	28.8	Very low	31.7	Very low	83 Å²	83	138.4 Å²	138.4	86%	0.856	83%	0.83	S	S	*	*			trans	147.7	131.6	159.5	0	0	0	0	0	114.7
763	G	29.4	Very low	30.9	Very low	71 Å²	71	135.5 Å²	135.5	73%	0.732	84%	0.837	S	S	*	*			trans	147.4	51.9	160.6	0	0	0	0	0	121.7
764	I	31.9	Very low	30.3	Very low	153 Å²	153	131.7 Å²	131.7	79%	0.785	84%	0.835	S	S	*	*			trans	36.9	144.7	141.1	19.8	175.3	0	0	0	125
765	E	31.4	Very low	29.8	Very low	184 Å²	184	126.2 Å²	126.2	86%	0.86	83%	0.829	S	S	*	*			trans	74.9	148.7	152.8	-69.3	169	-140.9	0	0	120.7
766	G	29.7	Very low	29.2	Very low	76 Å²	76	125.6 Å²	125.6	78%	0.784	83%	0.831	S	S	*	*			trans	-179.1	-63.2	-178.1	0	0	0	0	0	119.5
767	N	27.7	Very low	28.9	Very low	168 Å²	168	117.6 Å²	117.6	90%	0.898	82%	0.824	S	S	*	*			trans	61.1	113.5	174.8	-174.2	72.1	0	0	0	120.8
768	G	26.4	Very low	29	Very low	74 Å²	74	114 Å²	114	76%	0.763	83%	0.829	S	S	*	*			trans	102.8	136.5	135.4	0	0	0	0	0	121.5
769	G	27.2	Very low	28.8	Very low	76 Å²	76	111 Å²	111	78%	0.784	83%	0.831	S	S	*	*			trans	107	97.7	137.3	0	0	0	0	0	121.5
770	S	29	Very low	28.7	Very low	138 Å²	138	112 Å²	112	97%	0.965	83%	0.83	S	S	*	*			trans	37.2	132.8	132.8	-52.5	0	0	0	0	124.2
771	G	26.1	Very low	28.2	Very low	72 Å²	72	106.6 Å²	106.6	74%	0.742	82%	0.816	S	S	*	*			trans	130.1	119.4	159.7	0	0	0	0	0	112.4
772	S	29.6	Very low	28.1	Very low	131 Å²	131	108.4 Å²	108.4	92%	0.916	82%	0.816	S	S	*	*			cis	80.8	111.4	48	-66.5	0	0	0	0	115.6
773	G	25.5	Very low	28.8	Very low	89 Å²	89	109.8 Å²	109.8	92%	0.918	81%	0.811	S	S	*	*			trans	90.4	145.8	172.5	0	0	0	0	0	115.1
774	G	27.5	Very low	28.4	Very low	76 Å²	76	115.9 Å²	115.9	78%	0.784	82%	0.817	S	S	*	*			cis	168	132.9	-9.9	0	0	0	0	0	113.9
775	S	29	Very low	28.2	Very low	104 Å²	104	118.9 Å²	118.9	73%	0.727	82%	0.82	S	S	*	*			trans	44	108.9	157.4	-143.9	0	0	0	0	121.1
776	N	27.6	Very low	27.9	Very low	159 Å²	159	118 Å²	118	85%	0.85	82%	0.816	S	S	*	*				161.4	149	109.4	-83.3	-28	0	0	0	114.2
777	G	26.5	Very low	28.1	Very low	74 Å²	74	119.9 Å²	119.9	76%	0.763	82%	0.815	S	S	*	*			trans	119.8	83.6	139	0	0	0	0	0	119.9
778	A	28.3	Very low	27.9	Very low	113 Å²	113	116.5 Å²	116.5	93%	0.934	81%	0.81	S	S	*	*			trans	58.7	132.9	145.6	0	0	0	0	0	121.7
779	G	27.7	Very low	27.9	Very low	74 Å²	74	121 Å²	121	76%	0.763	82%	0.815	S	S	*	*			trans	162	89.2	165.6	0	0	0	0	0	114.9
780	N	27.1	Very low	29	Very low	164 Å²	164	122.7 Å²	122.7	88%	0.877	81%	0.812	S	S	*	*			trans	-69.7	157.6	165.4	-64.5	3.9	0	0	0	109.7
781	G	25.6	Very low	29.4	Very low	57 Å²	57	122.4 Å²	122.4	59%	0.588	81%	0.807	S	S	*	*			cis	105	137.1	7.6	0	0	0	0	0	112.8
782	T	28.9	Very low	29.3	Very low	140 Å²	140	122.2 Å²	122.2	86%	0.859	81%	0.805	S	S	*	*			trans	70.7	165	177.7	80	0	0	0	0	116.6
783	P	41.8	Very low	29.2	Very low	113 Å²	113	126.5 Å²	126.5	73%	0.734	80%	0.802	S	S	*	*			cis	-125.5	161.7	-11.8	19.4	3.8	0	0	0	115.4
784	F	22.8	Very low	29.2	Very low	199 Å²	199	129.5 Å²	129.5	87%	0.873	80%	0.796	S	S	*	*			trans	-113.3	141.6	156.4	-171.9	-86.5	0	0	0	106.6
785	Y	26.5	Very low	29.2	Very low	215 Å²	215	129.4 Å²	129.4	84%	0.843	80%	0.796	S	S	*	*			trans	-154.9	146.5	-178.1	-134.9	-91.9	0	0	0	114
786	Q	25	Very low	29.1	Very low	166 Å²	166	128 Å²	128	78%	0.776	80%	0.797	S	S	*	*			trans	-133.9	174.3	175.1	-117.3	-148.3	-26.4	0	0	110.2
787	P	34.7	Very low	29.1	Very low	116 Å²	116	128 Å²	128	75%	0.753	80%	0.798	S	S	*	*			trans	-91.8	169	-146.2	37.6	-40.4	0	0	0	116.3
788	A	23.4	Very low	29.3	Very low	97 Å²	97	129 Å²	129	80%	0.802	79%	0.792	S	S	*	*			trans	-159.8	123.8	165.4	0	0	0	0	0	113.6
789	I	26.3	Very low	29.4	Very low	168 Å²	168	131.6 Å²	131.6	86%	0.862	79%	0.79	S	S	*	*			trans	-159.7	143.6	164.6	-51.7	-178.3	0	0	0	107.5
790	P	50.9	Low	29.4	Very low	112 Å²	112	131.5 Å²	131.5	73%	0.727	78%	0.782	S	S	*	*			cis	-120	177.1	-31.6	40.8	-25.7	0	0	0	111.9
791	P	36.3	Very low	29.4	Very low	132 Å²	132	130.8 Å²	130.8	86%	0.857	78%	0.778	S	S	*	*				-135.2	-171.8	82.3	13	12.2	0	0	0	112.8
792	G	25.2	Very low	29.7	Very low	67 Å²	67	133.4 Å²	133.4	69%	0.691	78%	0.783	S	S	*	*			cis	136.6	131.2	-8	0	0	0	0	0	114.6
793	Y	26.1	Very low	29.6	Very low	222 Å²	222	132.8 Å²	132.8	87%	0.871	77%	0.774	S	S	*	*			trans	64.8	147.6	176.2	-92.7	-150.2	0	0	0	116.8
794	L	27.2	Very low	29	Very low	151 Å²	151	134.5 Å²	134.5	79%	0.791	78%	0.777	S	S	*	*			cis	-158	160.6	0.2	-131.4	177.9	0	0	0	112
795	G	26.1	Very low	29.2	Very low	75 Å²	75	127.9 Å²	127.9	77%	0.773	77%	0.765	S	S	*	*			trans	103.6	161.2	165.4	0	0	0	0	0	117
796	G	27.9	Very low	29.3	Very low	73 Å²	73	125 Å²	125	75%	0.753	76%	0.764	S	S	*	*			cis	167	143.8	-9.7	0	0	0	0	0	114.9
797	D	27.5	Very low	29.5	Very low	161 Å²	161	124.3 Å²	124.3	86%	0.861	77%	0.765	S	S	*	*			trans	55.9	143	163.8	-82.2	-45.8	0	0	0	122.8
798	S	30.8	Very low	29	Very low	93 Å²	93	126.3 Å²	126.3	65%	0.65	77%	0.769	S	S	*	*			cis	-165.4	171.1	-13.2	-135.3	0	0	0	0	112.9
799	L	29.8	Very low	29.9	Very low	169 Å²	169	126.9 Å²	126.9	89%	0.885	76%	0.764	S	S	*	*			trans	68.1	140.1	168.7	-72.7	158.6	0	0	0	118.1
800	A	28.6	Very low	29.8	Very low	72 Å²	72	126.6 Å²	126.6	60%	0.595	76%	0.759	S	S	*	*			cis	-152.6	165.9	0.4	0	0	0	0	0	113.2
801	D	26.1	Very low	28.5	Very low	149 Å²	149	125.7 Å²	125.7	80%	0.797	75%	0.752	S	S	*	*			trans	61.7	136.9	162.3	-64.9	-39.5	0	0	0	120
802	T	31.5	Very low	27.9	Very low	112 Å²	112	128 Å²	128	69%	0.687	75%	0.751	S	S	*	*			cis	-147.6	150.9	4.1	-11.5	0	0	0	0	112.6
803	N	26.4	Very low	27.9	Very low	127 Å²	127	132.3 Å²	132.3	68%	0.679	76%	0.758	S	S	*	*			trans	13.2	149.9	147.8	-63.3	-15.5	0	0	0	121.1
804	N	29.5	Very low	28.7	Very low	148 Å²	148	127.2 Å²	127.2	79%	0.791	75%	0.752	S	S	*	*			cis	-171.7	150.9	-12.4	-101.6	-22.6	0	0	0	105.8
805	G	28.4	Very low	29.6	Very low	61 Å²	61	125.6 Å²	125.6	63%	0.629	75%	0.75	S	S	*	*			cis	162.4	175.4	-4.5	0	0	0	0	0	109.9
806	N	28.5	Very low	30.8	Very low	154 Å²	154	127.4 Å²	127.4	82%	0.824	75%	0.748	S	S	*	*			trans	55.4	131.3	146.3	-93.3	11.6	0	0	0	120.4
807	L	27.5	Very low	31.4	Very low	151 Å²	151	130.2 Å²	130.2	79%	0.791	75%	0.753	S	S	*	*			cis	-151	167	17.2	-89.3	169.5	0	0	0	112.2
808	L	25	Very low	31.4	Very low	158 Å²	158	126.3 Å²	126.3	83%	0.827	75%	0.751	S	S	*	*			trans	-95.1	177.7	158.6	-64.5	169.9	0	0	0	109.2
809	P	41.8	Very low	31.2	Very low	109 Å²	109	125.5 Å²	125.5	71%	0.708	76%	0.757	S	S	*	*			cis	-136.5	-150.3	5.4	28.7	-1.5	0	0	0	113.2
810	E	24.2	Very low	31	Very low	162 Å²	162	127 Å²	127	76%	0.757	76%	0.759	S	S	*	*			trans	94.5	113.6	150.1	-67	-130.5	65.9	0	0	122.3
811	T	24.3	Very low	31	Very low	93 Å²	93	131.5 Å²	131.5	57%	0.571	77%	0.768	S	S	*	*				76.1	115.1	112.8	-54.5	0	0	0	0	122.7
812	Q	23.3	Very low	31.6	Very low	181 Å²	181	130.3 Å²	130.3	85%	0.846	77%	0.769	S	S	*	*			trans	77.5	160.8	149.6	-72.8	171.2	40.8	0	0	122.3
813	L	25.8	Very low	31.2	Very low	158 Å²	158	127.7 Å²	127.7	83%	0.827	76%	0.764	S	S	*	*			trans	-84.2	-171.7	178.8	-50	96.3	0	0	0	111.7
814	P	42.7	Very low	31.3	Very low	115 Å²	115	127.9 Å²	127.9	75%	0.747	78%	0.775	S	S	*	*				-113.9	-136.5	-75.5	37.8	-18.1	0	0	0	107.8
815	P	44.8	Very low	31.1	Very low	116 Å²	116	130.7 Å²	130.7	75%	0.753	78%	0.784	S	S	*	*			cis	-119.7	-146.8	-30.8	46.2	-28.5	0	0	0	110.3
816	P	52.9	Low	30.9	Very low	113 Å²	113	132.5 Å²	132.5	73%	0.734	79%	0.793	S	S	*	*			trans	-100.7	-175.1	-167.9	45.6	-41.2	0	0	0	115
817	P	40.1	Very low	30.8	Very low	133 Å²	133	130.8 Å²	130.8	86%	0.864	79%	0.793	S	S	*	*				-139.6	-166.4	83	39.2	-22.4	0	0	0	114.1
818	G	27.2	Very low	30.6	Very low	79 Å²	79	128.4 Å²	128.4	81%	0.814	79%	0.789	S	S	*	*			trans	-145.7	-168.3	-178.4	0	0	0	0	0	115.2
819	G	27.6	Very low	30.6	Very low	75 Å²	75	127.2 Å²	127.2	77%	0.773	79%	0.788	S	S	*	*			trans	118.6	144.6	-168.4	0	0	0	0	0	110.4
820	E	25.3	Very low	29.9	Very low	200 Å²	200	128.7 Å²	128.7	94%	0.935	79%	0.79	S	S	*	*			cis	-145.3	177.3	16.9	-66.2	-177.7	122.6	0	0	113.5
821	E	27.7	Very low	30.2	Very low	168 Å²	168	128.2 Å²	128.2	79%	0.785	79%	0.793	S	S	*	*			trans	-56	178	166.7	-93.8	-82.3	114.1	0	0	114.1	G823	E821-G823 PolarHBondContact OE2-N 3.06Å
822	P	38.5	Very low	30.7	Very low	123 Å²	123	127.7 Å²	127.7	80%	0.799	80%	0.798	S	S	*	*			cis	-142.3	170.4	23.9	42.3	-23.2	0	0	0	120.1
823	G	24	Very low	31	Very low	57 Å²	57	126.4 Å²	126.4	59%	0.588	80%	0.797	S	S	*	*			trans	179	70.9	161.3	0	0	0	0	0	123.2	E821	E821-G823 PolarHBondContact OE2-N 3.06Å
824	S	28.1	Very low	31.1	Very low	132 Å²	132	122.1 Å²	122.1	92%	0.923	78%	0.784	S	S	*	*			trans	79.1	134.5	152.8	-49.4	0	0	0	0	120.9
825	E	24.8	Very low	30.4	Very low	206 Å²	206	123.6 Å²	123.6	96%	0.963	79%	0.786	S	S	*	*			trans	-103.4	179.1	-178.5	-66.6	-172.4	104.2	0	0	114.9
826	A	25.9	Very low	29.6	Very low	100 Å²	100	126.8 Å²	126.8	83%	0.826	79%	0.791	S	S	*	*			trans	-95.6	174.6	-173	0	0	0	0	0	115.2
827	S	25	Very low	29.3	Very low	117 Å²	117	126.2 Å²	126.2	82%	0.818	79%	0.787	S	S	*	*				167.8	179.5	120.7	-164.1	0	0	0	0	113.3
828	S	23.4	Very low	28.6	Very low	102 Å²	102	129.9 Å²	129.9	71%	0.713	79%	0.79	S	S	*	*			trans	82.5	144.9	166	84.7	0	0	0	0	117.3
829	T	25.5	Very low	28.4	Very low	132 Å²	132	130.2 Å²	130.2	81%	0.81	79%	0.785	S	S	*	*			cis	-160.2	-174.8	-7.6	5	0	0	0	0	113.1
830	N	27.5	Very low	29.3	Very low	140 Å²	140	131.5 Å²	131.5	75%	0.749	78%	0.779	S	S	*	*			trans	-104.1	-174.1	-161.4	-60.5	-27	0	0	0	118.2
831	D	30.3	Very low	29.3	Very low	152 Å²	152	131.1 Å²	131.1	81%	0.813	78%	0.778	S	S	*	*			trans	86	143.7	143.1	-69	-46.7	0	0	0	119.4
832	A	34.5	Very low	29.2	Very low	82 Å²	82	126.4 Å²	126.4	68%	0.678	77%	0.774	S	S	*	*			cis	-160.8	-162.2	-14.1	0	0	0	0	0	107.5
833	N	30.4	Very low	28.6	Very low	154 Å²	154	125.6 Å²	125.6	82%	0.824	78%	0.777	S	S	*	*			cis	-165.3	-170.8	5.2	-145.7	-12.1	0	0	0	106.8
834	A	27.1	Very low	28.7	Very low	68 Å²	68	127.8 Å²	127.8	56%	0.562	79%	0.79	S	S	*	*			cis	-163.8	173.7	0.2	0	0	0	0	0	112.1
835	N	28.7	Very low	28.6	Very low	147 Å²	147	128.7 Å²	128.7	79%	0.786	79%	0.785	S	S	*	*			trans	57.3	97.6	149.8	-68	11.6	0	0	0	124.1
836	E	27.5	Very low	29.4	Very low	183 Å²	183	124.3 Å²	124.3	86%	0.855	77%	0.774	S	S	*	*				74	159.8	117.1	-83.7	-138.6	104.4	0	0	123.6
837	P	45.7	Very low	29.4	Very low	101 Å²	101	122.1 Å²	122.1	66%	0.656	76%	0.761	S	S	*	*			trans	-132.3	177.1	-131.1	46.3	-34.3	0	0	0	117.7
838	K	25.1	Very low	29.5	Very low	210 Å²	210	125.6 Å²	125.6	91%	0.913	76%	0.764	S	S	*	*			trans	-172.1	164.9	145	-111.5	164.9	-173.7	176.5	0	116
839	A	23.2	Very low	29.7	Very low	86 Å²	86	128.9 Å²	128.9	71%	0.711	77%	0.769	S	S	*	*			trans	-135.3	-171.1	163.5	0	0	0	0	0	107.1
840	P	46.4	Very low	29.8	Very low	102 Å²	102	131.3 Å²	131.3	66%	0.662	77%	0.771	S	S	*	*			cis	-136.5	-153.7	-1.8	41.1	-19.2	0	0	0	113.7
841	E	25.3	Very low	29.8	Very low	192 Å²	192	133.4 Å²	133.4	90%	0.897	78%	0.776	S	S	*	*			trans	68.4	152.8	162.7	-69.8	164.3	-160.4	0	0	118.3
842	G	27.1	Very low	30.6	Very low	68 Å²	68	130.6 Å²	130.6	70%	0.701	77%	0.766	S	S	*	*			cis	-168.6	139.2	-7.8	0	0	0	0	0	108.9
843	A	25.6	Very low	30.4	Very low	106 Å²	106	134.9 Å²	134.9	88%	0.876	77%	0.772	S	S	*	*				92.3	150.7	82.7	0	0	0	0	0	114.7
844	A	26.3	Very low	30.3	Very low	104 Å²	104	134.2 Å²	134.2	86%	0.86	77%	0.768	S	S	*	*			trans	84.9	98.2	171.9	0	0	0	0	0	120.7
845	D	25.8	Very low	30.4	Very low	151 Å²	151	136.8 Å²	136.8	81%	0.807	77%	0.773	S	S	*	*			trans	-61.2	170.2	137.2	-151.1	40.5	0	0	0	109.6
846	P	40.9	Very low	30.5	Very low	113 Å²	113	135.1 Å²	135.1	73%	0.734	76%	0.764	S	S	*	*			cis	-150.7	171.4	31.8	44.5	-23.3	0	0	0	120.7
847	G	26.1	Very low	30.6	Very low	54 Å²	54	132 Å²	132	56%	0.557	75%	0.753	S	S	*	*				86.7	129.5	119.4	0	0	0	0	0	121.9
848	E	28.1	Very low	29.9	Very low	190 Å²	190	133.6 Å²	133.6	89%	0.888	76%	0.756	S	S	*	*				55.9	152.7	129.5	-65.9	164.8	-163.7	0	0	121.3
849	E	27.2	Very low	29.9	Very low	172 Å²	172	129.9 Å²	129.9	80%	0.804	75%	0.746	S	S	*	*			cis	-164.7	170.6	-32.1	-155.4	165.9	-139.2	0	0	108.8
850	E	26.7	Very low	30.1	Very low	182 Å²	182	132.3 Å²	132.3	85%	0.85	75%	0.752	S	S	*	*			trans	68.1	158.3	164.3	-56.9	-144.3	117.2	0	0	123.2
851	E	27	Very low	29.1	Very low	185 Å²	185	131 Å²	131	86%	0.864	76%	0.757	S	S	*	*			trans	-97.5	-149.9	169.3	-61.8	-162.9	133	0	0	109
852	P	48.8	Very low	29.1	Very low	92 Å²	92	125.1 Å²	125.1	60%	0.597	75%	0.748	S	S	*	*			cis	-139	-161.8	-11.1	43.1	-22.3	0	0	0	115.6
853	E	29.4	Very low	29	Very low	172 Å²	172	127.3 Å²	127.3	80%	0.804	75%	0.752	S	S	*	*			trans	72.7	144	153	-81.3	166.5	-152.1	0	0	118.5
854	D	28	Very low	29	Very low	140 Å²	140	131.5 Å²	131.5	75%	0.749	75%	0.754	S	S	*	*			cis	-157.6	-164.7	-10.3	-155.1	-15.2	0	0	0	110.1
855	D	29.6	Very low	28.9	Very low	123 Å²	123	130.3 Å²	130.3	66%	0.658	74%	0.744	S	S	*	*			trans	111.5	103.3	134.3	-123.9	40.7	0	0	0	121.2
856	N	30.7	Very low	28.8	Very low	111 Å²	111	129 Å²	129	59%	0.594	75%	0.747	S	S	*	*				81.3	113.8	125.3	-87.1	-37.2	0	0	0	126.3
857	N	29.8	Very low	28.1	Very low	118 Å²	118	131.5 Å²	131.5	63%	0.631	75%	0.753	S	S	*	*				84.7	122.8	123.3	-89.1	-38.7	0	0	0	125.9
858	N	30.3	Very low	28.6	Very low	135 Å²	135	134.9 Å²	134.9	72%	0.722	77%	0.765	S	S	*	*			trans	62.7	163.1	133.9	-70.6	-32.6	0	0	0	123.1
859	N	26	Very low	28.5	Very low	132 Å²	132	130.9 Å²	130.9	71%	0.706	76%	0.758	S	S	*	*			cis	-175	164.2	-37.7	-167.7	4.7	0	0	0	109.5
860	V	27	Very low	29.3	Very low	136 Å²	136	128.4 Å²	128.4	82%	0.824	76%	0.757	S	S	*	*			trans	72.6	139.8	165.6	-167.1	0	0	0	0	117.1
861	G	25.2	Very low	29.6	Very low	76 Å²	76	126 Å²	126	78%	0.784	75%	0.754	S	S	*	*			trans	-167.7	-20.3	-179.3	0	0	0	0	0	122.5
862	G	24.5	Very low	30.3	Very low	68 Å²	68	122.2 Å²	122.2	70%	0.701	75%	0.746	S	S	*	*			trans	68.4	107.9	161	0	0	0	0	0	122.2
863	S	26.2	Very low	29.2	Very low	113 Å²	113	126.6 Å²	126.6	79%	0.79	76%	0.759	S	S	*	*				62.3	124.9	127.4	-56.7	0	0	0	0	124.7
864	Q	25	Very low	29.1	Very low	194 Å²	194	124.4 Å²	124.4	91%	0.907	76%	0.757	S	S	*	*			trans	66.9	156	142	-67.4	-174.9	-8	0	0	119.8
865	A	24.8	Very low	28.9	Very low	80 Å²	80	123.4 Å²	123.4	66%	0.661	76%	0.76	S	S	*	*			cis	-169.6	168	-26.5	0	0	0	0	0	110.8
866	S	23.4	Very low	28.8	Very low	123 Å²	123	122.7 Å²	122.7	86%	0.86	77%	0.765	S	S	*	*			trans	85	137.6	153.7	-50.5	0	0	0	0	121.7
867	L	26.9	Very low	29.6	Very low	166 Å²	166	122.7 Å²	122.7	87%	0.869	77%	0.771	S	S	*	*			trans	-68.7	173	165.4	-70.8	166.7	0	0	0	111.7
868	P	35.5	Very low	29.5	Very low	125 Å²	125	125.4 Å²	125.4	81%	0.812	78%	0.78	S	S	*	*			cis	-152.2	-169.1	35.6	44.1	-20.8	0	0	0	119.6
869	S	27	Very low	29.5	Very low	105 Å²	105	126.3 Å²	126.3	73%	0.734	78%	0.78	S	S	*	*			trans	-73.3	174.3	169.1	-128.6	0	0	0	0	112.8
870	P	43.3	Very low	29.7	Very low	121 Å²	121	124.4 Å²	124.4	79%	0.786	78%	0.777	S	S	*	*			cis	-148	-172.8	47.4	42.3	-20	0	0	0	118.7
871	V	32	Very low	29.7	Very low	130 Å²	130	121.2 Å²	121.2	79%	0.788	77%	0.772	S	S	*	*			trans	-77.7	171.7	173.7	-121.6	0	0	0	0	112.8
872	P	42.7	Very low	29.6	Very low	107 Å²	107	124.9 Å²	124.9	70%	0.695	78%	0.779	S	S	*	*				-156.7	-170.5	57.5	44.6	-21.7	0	0	0	120.1
873	E	25	Very low	29.8	Very low	184 Å²	184	126 Å²	126	86%	0.86	78%	0.782	S	S	*	*			trans	100.8	163.7	148	-101.1	173.1	141.4	0	0	123.4
874	V	28.4	Very low	29.8	Very low	125 Å²	125	127.8 Å²	127.8	76%	0.758	79%	0.787	S	S	*	*			trans	-151.3	155.8	-139	165.5	0	0	0	0	112.2
875	S	24.4	Very low	30	Very low	119 Å²	119	123.3 Å²	123.3	83%	0.832	78%	0.778	S	S	*	*			trans	-164.7	147	150.1	-87.7	0	0	0	0	115.5
876	S	26.2	Very low	30.2	Very low	108 Å²	108	127.7 Å²	127.7	76%	0.755	79%	0.785	S	S	*	*			trans	-162.9	148.3	176.3	-50.3	0	0	0	0	110.3
877	P	48.3	Very low	30.4	Very low	112 Å²	112	130 Å²	130	73%	0.727	78%	0.782	S	S	*	*				-119.6	-140.7	97.4	11.5	9.9	0	0	0	111.4
878	E	27.2	Very low	30.6	Very low	174 Å²	174	129 Å²	129	81%	0.813	78%	0.776	S	S	*	*			cis	-157.2	156.6	15	-79.4	177.8	-157.7	0	0	109
879	E	31.2	Very low	30.3	Very low	155 Å²	155	130.7 Å²	130.7	72%	0.724	77%	0.774	S	S	*	*			cis	-160.5	179.8	-18.8	-120.3	-67.2	74.2	0	0	112.7
880	S	29.5	Very low	31	Very low	91 Å²	91	134.6 Å²	134.6	64%	0.636	78%	0.777	S	S	*	*			trans	-48.2	173.7	172	65.1	0	0	0	0	121.4
881	G	26.8	Very low	31	Very low	69 Å²	69	139.2 Å²	139.2	71%	0.711	78%	0.779	S	S	*	*			cis	147.4	133.6	-15.1	0	0	0	0	0	116.4
882	T	23.9	Very low	31.4	Very low	154 Å²	154	138.8 Å²	138.8	95%	0.945	78%	0.777	S	S	*	*			trans	-147.3	151.8	168.1	-40.6	0	0	0	0	110.3
883	A	28.6	Very low	31.2	Very low	91 Å²	91	141.5 Å²	141.5	75%	0.752	79%	0.785	S	S	*	*			trans	-131.1	161	-177.3	0	0	0	0	0	113.1
884	V	26.7	Very low	31.9	Very low	150 Å²	150	139.8 Å²	139.8	91%	0.909	78%	0.781	S	S	*	*			trans	-161.1	146.8	141.3	135.5	0	0	0	0	111.9
885	S	27.8	Very low	32.9	Very low	101 Å²	101	142 Å²	142	71%	0.706	78%	0.781	S	S	*	*			trans	-73	-173.8	-167.9	-166.7	0	0	0	0	117.4
886	Q	28.9	Very low	34.2	Very low	172 Å²	172	145 Å²	145	80%	0.804	78%	0.779	S	S	*	*			trans	78.7	152.5	161.9	-61	177.5	18.9	0	0	119
887	Q	27.5	Very low	35	Very low	172 Å²	172	145.3 Å²	145.3	80%	0.804	78%	0.778	S	S	*	*			cis	-158.3	152.4	-42	-141.8	179.4	8.9	0	0	110.6
888	L	31.6	Very low	34.8	Very low	143 Å²	143	147 Å²	147	75%	0.749	78%	0.781	S	S	*	*			trans	15.1	118.8	152	-169.7	81.6	0	0	0	120.2
889	E	28.7	Very low	35.7	Very low	162 Å²	162	142.1 Å²	142.1	76%	0.757	77%	0.766	S	S	*	*				-157.6	161.5	129.9	-127.3	-178.5	-141.9	0	0	113.8
890	K	43	Very low	36.5	Very low	186 Å²	186	143.5 Å²	143.5	81%	0.809	77%	0.773	S	S	*	*			trans	-116.3	129.8	-176	-63.3	174.4	-178	174.2	0	110.5
891	R	43.4	Very low	37.2	Very low	218 Å²	218	148 Å²	148	82%	0.823	78%	0.776	S	S	*	*			trans	-128.6	105.6	171.4	-71.8	-171.7	177.1	-178.6	-1.1	113.2
892	T	40	Very low	38.2	Very low	121 Å²	121	148.5 Å²	148.5	74%	0.742	77%	0.765	S	S	*	*			trans	-0.5	127.4	151.1	52.8	0	0	0	0	118.3	L894	T892-L894 PolarHBondContact O-N 3.17Å
893	N	38.3	Very low	39.2	Very low	164 Å²	164	143.3 Å²	143.3	88%	0.877	74%	0.742	S	S	*	*			trans	-74.8	52.8	164.2	-87.3	-57.4	0	0	0	113
894	L	39.3	Very low	40.1	Very low	148 Å²	148	145.3 Å²	145.3	78%	0.775	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-76.3	147.7	158.4	-172.9	62.6	0	0	0	108	T892 K896	T892-L894 PolarHBondContact O-N 3.17Å; L894-K896 PolarHBondContact O-N 2.89Å
895	K	50.3	Low	41.3	Very low	173 Å²	173	140.9 Å²	140.9	75%	0.752	72%	0.721	S	S	*	*	P	Polyproline II helix	trans	-57.1	130.7	175	-85.2	102.3	164.2	-171.4	0	109.9
896	K	52	Low	42.7	Very low	180 Å²	180	145.6 Å²	145.6	78%	0.783	73%	0.728	S	S	*	*	P	Polyproline II helix	trans	-77.5	147	144.8	-71.5	-169.8	175.2	-173.4	0	108.3	L894	L894-K896 PolarHBondContact O-N 2.89Å
897	P	41.4	Very low	45.1	Very low	115 Å²	115	147.9 Å²	147.9	75%	0.747	73%	0.73	S	S	*	*	S	Bend	trans	-72	-39	-169.8	-12.6	27.5	0	0	0	112.8	S899	P897-S899 PolarHBondContact O-N 3.06Å
898	D	45.2	Very low	47.7	Very low	147 Å²	147	145.4 Å²	145.4	79%	0.786	73%	0.726	S	S	*	*			trans	-107.4	43.9	-155	-37.8	-78.6	0	0	0	113.7
899	S	45.8	Very low	50	Low	72 Å²	72	147.6 Å²	147.6	50%	0.503	73%	0.73	S	S	.	*			trans	-105.3	105.5	178.2	168.1	0	0	0	0	110.5	R398 P897	R398-S899 PolarHBondContact NH1-OG 3.04Å; P897-S899 PolarHBondContact O-N 3.06Å
900	E	47.8	Very low	52.9	Low	185 Å²	185	146.6 Å²	146.6	86%	0.864	72%	0.723	S	S	*	*			trans	-59.7	155.7	-177.7	-70.1	-164.9	107.1	0	0	114.3
901	R	45.1	Very low	55.3	Low	185 Å²	185	142.5 Å²	142.5	70%	0.698	71%	0.71	S	S	*	*			trans	-105.3	71.7	-163.5	-175.8	-166.4	162.9	142.1	-4.9	111.5	G903 H904	R901-G903 PolarHBondContact O-N 2.82Å; R901-H904 PolarHBondContact NH2-NE2 3.5Å
902	T	46.6	Very low	57.8	Low	80 Å²	80	134 Å²	134	49%	0.491	68%	0.683	S	S	.	*			trans	-56.9	132.1	178.4	-45.9	0	0	0	0	112.8	P400 P401	P400-T902 WeakPolarHBondContact CD-O 3.29Å; P400-T902 WeakPolarHBondContact CG-O 3.49Å; P401-T902 HydrophobicContact CB-CG2 4.1Å
903	G	44.6	Very low	60.4	Low	44 Å²	44	129.9 Å²	129.9	45%	0.454	66%	0.656	S	S	.	*			trans	54.5	111.5	152	0	0	0	0	0	119.9	R901 G905	R901-G903 PolarHBondContact O-N 2.82Å; G903-G905 PolarHBondContact O-N 3.33Å
904	H	48.5	Very low	63.1	Low	134 Å²	134	124.4 Å²	124.4	62%	0.62	63%	0.634	S	S	*	*			trans	-86.2	60.4	148.8	-79.8	-88.7	0	0	0	109.4	R901	R901-H904 PolarHBondContact NH2-NE2 3.5Å
905	G	52.4	Low	65.8	Low	57 Å²	57	119.3 Å²	119.3	59%	0.588	61%	0.607	S	S	*	*			trans	-64.8	-60	-163.1	0	0	0	0	0	115.4	G903	G903-G905 PolarHBondContact O-N 3.33Å
906	F	57	Low	68	Low	199 Å²	199	111 Å²	111	87%	0.873	57%	0.571	S	S	*	*			trans	-133.6	124.2	-178.1	-64.3	-81.1	0	0	0	110.7
907	R	78.1	Confident	70.2	Confident	220 Å²	220	103.5 Å²	103.5	83%	0.83	54%	0.54	S	S	*	.			trans	-131.5	144	164.5	-86.6	-177.7	153.5	-163.3	-11.5	106.5	K909	R907-K909 PolarHBondContact O-N 2.91Å
908	V	82.4	Confident	72.9	Confident	120 Å²	120	102.5 Å²	102.5	73%	0.727	53%	0.528	S	S	*	.			trans	-58.7	123.1	165.1	-179.8	0	0	0	0	107.3	F910	V908-F910 HydrophobicContact CG1-CE1 4.34Å; V908-F910 HydrophobicContact CG1-CE2 4.18Å; V908-F910 HydrophobicContact CG1-CZ 4.06Å
909	K	80.8	Confident	75.4	Confident	189 Å²	189	95.5 Å²	95.5	82%	0.822	49%	0.491	S	S	*	.			trans	-104.9	128	167.1	-69.7	-169.4	176.3	-166.7	0	107.1	R907	R907-K909 PolarHBondContact O-N 2.91Å
910	F	89.8	Confident	77.9	Confident	142 Å²	142	92.1 Å²	92.1	62%	0.623	47%	0.467	S	S	*	.			trans	-84.9	166.9	168	-62.1	-83	0	0	0	109.5	V908 L915	V908-F910 HydrophobicContact CG1-CE1 4.34Å; V908-F910 HydrophobicContact CG1-CE2 4.18Å; V908-F910 HydrophobicContact CG1-CZ 4.06Å; F910-L915 HydrophobicContact CB-CD1 4.01Å; F910-L915 HydrophobicContact CB-CD2 3.98Å; F910-L915 HydrophobicContact CB-CG 3.77Å; F910-L915 HydrophobicContact CD2-CD2 4.15Å; F910-L915 HydrophobicContact CG-CD2 4.36Å
911	N	92.9	Very high	80.3	Confident	100 Å²	100	86.7 Å²	86.7	54%	0.535	44%	0.443	S	S	.	.			trans	-61.2	130.2	171	179.7	-31.6	0	0	0	108.9	L913 A914 L915	N911-L913 PolarHBondContact O-N 3.06Å; N911-L913 WeakPolarHBondContact OD1-CB 3.49Å; N911-L913 PolarHBondContact OD1-N 3.1Å; N911-A914 HydrophobicContact CB-CB 4.1Å; N911-A914 PolarHBondContact O-N 3.24Å; N911-A914 VanDerWaalsContact O-N 3.14Å; N911-L915 PolarHBondContact O-N 3.39Å
912	P	94.9	Very high	82.8	Confident	40 Å²	40	84.6 Å²	84.6	26%	0.26	44%	0.441	S	S	.	.	H	α-helix	trans	-61.8	-29.5	-177.7	26.5	-36	0	0	0	112.9	L915 L916 I931 E934 V935	P912-L915 PolarHBondContact O-N 3.35Å; P912-L916 WeakPolarHBondContact O-CB 3.43Å; P912-L916 PolarHBondContact O-N 2.87Å; P912-I931 HydrophobicContact CB-CD1 3.82Å; P912-I931 HydrophobicContact CB-CG1 3.97Å; P912-I931 WeakPolarHBondContact O-CG1 3.41Å; P912-E934 HydrophobicContact CB-CB 4Å; P912-V935 HydrophobicContact CB-CG2 3.85Å; P912-V935 HydrophobicContact CG-CG2 4.47Å; P912-V935 VanDerWaalsContact O-CG2 3.26Å; P912-V935 WeakPolarHBondContact O-CG2 3.35Å
913	L	94.5	Very high	85.2	Confident	33 Å²	33	81.8 Å²	81.8	17%	0.173	43%	0.428	C	S	.	.	H	α-helix	trans	-68.9	-43.2	175	178.1	60.4	0	0	0	111.4	N911 L915 L916 L917 V935 T940	N911-L913 PolarHBondContact O-N 3.06Å; N911-L913 WeakPolarHBondContact OD1-CB 3.49Å; N911-L913 PolarHBondContact OD1-N 3.1Å; L913-L915 VanDerWaalsContact C-N 3.31Å; L913-L915 PolarHBondContact O-N 2.92Å; L913-L916 PolarHBondContact O-N 3.4Å; L913-L916 VanDerWaalsContact O-N 3.14Å; L913-L917 HydrophobicContact CD1-CD1 4.36Å; L913-L917 HydrophobicContact CD1-CG 4.42Å; L913-L917 HydrophobicContact CG-CD1 4.09Å; L913-L917 WeakPolarHBondContact O-CG 3.43Å; L913-L917 PolarHBondContact O-N 2.7Å; L913-V935 HydrophobicContact CB-CG1 4.4Å; L913-V935 HydrophobicContact CB-CG2 4.49Å; L913-V935 HydrophobicContact CD1-CG1 4.08Å; L913-T940 VanDerWaalsContact CD1-OG1 3.29Å; L913-T940 WeakPolarHBondContact CD1-OG1 3.42Å; L913-T940 VanDerWaalsContact CD2-OG1 3.23Å; L913-T940 WeakPolarHBondContact CD2-OG1 3.37Å
914	A	95.5	Very high	87.7	Confident	50 Å²	50	85 Å²	85	41%	0.413	43%	0.432	S	S	.	.	H	α-helix	trans	-61.5	-41.8	175.1	0	0	0	0	0	111.1	N911 L917 D918	N911-A914 HydrophobicContact CB-CB 4.1Å; N911-A914 PolarHBondContact O-N 3.24Å; N911-A914 VanDerWaalsContact O-N 3.14Å; A914-L917 PolarHBondContact O-N 3.44Å; A914-D918 WeakPolarHBondContact O-CB 3.29Å; A914-D918 PolarHBondContact O-N 3.15Å
915	L	96.2	Very high	90	Very high	40 Å²	40	81.3 Å²	81.3	21%	0.209	41%	0.414	C	S	.	.	H	α-helix	trans	-63.9	-36.5	172.9	-73	173	0	0	0	113	F910 N911 P912 L913 A919 I931	F910-L915 HydrophobicContact CB-CD1 4.01Å; F910-L915 HydrophobicContact CB-CD2 3.98Å; F910-L915 HydrophobicContact CB-CG 3.77Å; F910-L915 HydrophobicContact CD2-CD2 4.15Å; F910-L915 HydrophobicContact CG-CD2 4.36Å; N911-L915 PolarHBondContact O-N 3.39Å; P912-L915 PolarHBondContact O-N 3.35Å; L913-L915 VanDerWaalsContact C-N 3.31Å; L913-L915 PolarHBondContact O-N 2.92Å; L915-A919 WeakPolarHBondContact O-CB 3.39Å; L915-A919 PolarHBondContact O-N 3.47Å; L915-I931 HydrophobicContact CB-CD1 4.27Å; L915-I931 HydrophobicContact CB-CG1 3.87Å; L915-I931 HydrophobicContact CD1-CD1 3.89Å; L915-I931 HydrophobicContact CD1-CG1 4.42Å
916	L	97.6	Very high	92.1	Very high	0 Å²	0	84.2 Å²	84.2	0%	0	42%	0.416	C	S	.	.	H	α-helix	trans	-69.1	-41.1	176.9	-177.5	61.2	0	0	0	111.7	P912 L913 S920 V928 I931 I932 V935 P938 P948	P912-L916 WeakPolarHBondContact O-CB 3.43Å; P912-L916 PolarHBondContact O-N 2.87Å; L913-L916 PolarHBondContact O-N 3.4Å; L913-L916 VanDerWaalsContact O-N 3.14Å; L916-S920 WeakPolarHBondContact O-CB 3.43Å; L916-S920 PolarHBondContact O-N 3.13Å; L916-S920 VanDerWaalsContact O-N 3.1Å; L916-S920 PolarHBondContact O-OG 3.03Å; L916-V928 HydrophobicContact CD1-CB 4.46Å; L916-V928 HydrophobicContact CD1-CG1 3.89Å; L916-I931 HydrophobicContact CB-CG2 3.88Å; L916-I931 HydrophobicContact CD1-CG2 3.75Å; L916-I931 HydrophobicContact CG-CG2 4.39Å; L916-I932 HydrophobicContact CD1-CB 4.16Å; L916-I932 HydrophobicContact CD1-CG1 4.5Å; L916-I932 HydrophobicContact CD2-CG1 4.36Å; L916-V935 HydrophobicContact CB-CG2 3.96Å; L916-V935 HydrophobicContact CD2-CB 4.2Å; L916-V935 HydrophobicContact CD2-CG1 4.28Å; L916-V935 HydrophobicContact CD2-CG2 3.84Å; L916-P938 HydrophobicContact CD2-CB 3.97Å; L916-P948 HydrophobicContact CB-CG 4.43Å; L916-P948 HydrophobicContact CD2-CB 4.32Å; L916-P948 HydrophobicContact CD2-CG 3.76Å; L916-P948 HydrophobicContact CG-CB 3.93Å; L916-P948 HydrophobicContact CG-CG 3.68Å
917	L	97.5	Very high	94	Very high	22 Å²	22	76.5 Å²	76.5	12%	0.115	38%	0.384	C	S	.	.	H	α-helix	trans	-62.3	-51	174.9	-74.3	161.9	0	0	0	111.3	L913 A914 S920 L921 N942 P948 N951	L913-L917 HydrophobicContact CD1-CD1 4.36Å; L913-L917 HydrophobicContact CD1-CG 4.42Å; L913-L917 HydrophobicContact CG-CD1 4.09Å; L913-L917 WeakPolarHBondContact O-CG 3.43Å; L913-L917 PolarHBondContact O-N 2.7Å; A914-L917 PolarHBondContact O-N 3.44Å; L917-S920 PolarHBondContact O-N 3.21Å; L917-L921 PolarHBondContact O-N 3.38Å; L917-L921 VanDerWaalsContact O-N 3.15Å; L917-N942 HydrophobicContact CD1-CB 4.06Å; L917-P948 HydrophobicContact CD2-CG 3.89Å; L917-P948 HydrophobicContact CG-CG 4.16Å; L917-N951 PolarHBondContact O-ND2 3.17Å
918	D	97.4	Very high	94.9	Very high	93 Å²	93	66 Å²	66	50%	0.497	34%	0.344	S	S	.	.	H	α-helix	trans	-63.3	-51.4	-179	-171.2	65.4	0	0	0	111.6	A914 S920 L921 E922	A914-D918 WeakPolarHBondContact O-CB 3.29Å; A914-D918 PolarHBondContact O-N 3.15Å; D918-S920 PolarHBondContact O-N 2.89Å; D918-L921 WeakPolarHBondContact O-CB 3.44Å; D918-L921 PolarHBondContact O-N 3.45Å; D918-E922 PolarHBondContact O-N 3.23Å
919	A	97.6	Very high	95.5	Very high	1 Å²	1	64 Å²	64	1%	0.008	33%	0.327	C	S	.	.	H	α-helix	trans	-61.9	-30.3	176.8	0	0	0	0	0	113.3	L915 L921 G923 E924 L927 V928	L915-A919 WeakPolarHBondContact O-CB 3.39Å; L915-A919 PolarHBondContact O-N 3.47Å; A919-L921 VanDerWaalsContact C-N 3.35Å; A919-G923 PolarHBondContact O-N 2.86Å; A919-E924 HydrophobicContact CB-CB 4.08Å; A919-E924 PolarHBondContact O-N 3.35Å; A919-L927 HydrophobicContact CB-CB 4.1Å; A919-L927 HydrophobicContact CB-CD2 3.9Å; A919-L927 HydrophobicContact CB-CG 3.95Å; A919-V928 HydrophobicContact CB-CG2 3.68Å
920	S	98.1	Very high	96.2	Very high	0 Å²	0	61.8 Å²	61.8	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-76.7	-21	175.7	-58.8	0	0	0	0	113.2	L916 L917 D918 P948 A952 H957	L916-S920 WeakPolarHBondContact O-CB 3.43Å; L916-S920 PolarHBondContact O-N 3.13Å; L916-S920 VanDerWaalsContact O-N 3.1Å; L916-S920 PolarHBondContact O-OG 3.03Å; L917-S920 PolarHBondContact O-N 3.21Å; D918-S920 PolarHBondContact O-N 2.89Å; S920-P948 WeakPolarHBondContact CB-O 3.35Å; S920-A952 VanDerWaalsContact O-CA 3.3Å; S920-A952 WeakPolarHBondContact O-CA 3.18Å; S920-A952 PolarHBondContact O-N 3.44Å; S920-H957 PolarHBondContact O-CD2 2.85Å
921	L	97.9	Very high	96.4	Very high	72 Å²	72	55.3 Å²	55.3	38%	0.377	29%	0.285	S	S	.	.	H	α-helix	trans	-85.8	-47.3	174.9	-171.3	68.7	0	0	0	111.5	L917 D918 A919 G923 N951 A955 H957	L917-L921 PolarHBondContact O-N 3.38Å; L917-L921 VanDerWaalsContact O-N 3.15Å; D918-L921 WeakPolarHBondContact O-CB 3.44Å; D918-L921 PolarHBondContact O-N 3.45Å; A919-L921 VanDerWaalsContact C-N 3.35Å; L921-G923 VanDerWaalsContact C-N 3.31Å; L921-G923 PolarHBondContact O-N 3.41Å; L921-N951 HydrophobicContact CB-CB 3.97Å; L921-N951 HydrophobicContact CD1-CB 4Å; L921-A955 HydrophobicContact CD1-CB 4.34Å; L921-A955 WeakPolarHBondContact O-CB 3.46Å; L921-H957 PolarHBondContact O-CD2 2.9Å; L921-H957 PolarHBondContact O-NE2 2.86Å
922	E	97.7	Very high	96.5	Very high	140 Å²	140	50.6 Å²	50.6	65%	0.654	26%	0.26	S	S	*	.	H	α-helix	trans	-77	-15.1	-177.3	-68.8	-64.9	122.1	0	0	113.6	D918	D918-E922 PolarHBondContact O-N 3.23Å
923	G	97.1	Very high	96.4	Very high	21 Å²	21	53.2 Å²	53.2	22%	0.216	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	91.6	16.2	177.8	0	0	0	0	0	114.8	A919 L921 F925 H957	A919-G923 PolarHBondContact O-N 2.86Å; L921-G923 VanDerWaalsContact C-N 3.31Å; L921-G923 PolarHBondContact O-N 3.41Å; G923-F925 PolarHBondContact O-N 3.33Å; G923-H957 WeakPolarHBondContact CA-NE2 3.25Å; G923-H957 PolarHBondContact N-NE2 3.29Å
924	E	97.5	Very high	96.3	Very high	113 Å²	113	57.4 Å²	57.4	53%	0.528	28%	0.284	S	S	.	.			trans	-75.6	68.8	179.1	-67.3	-151.4	161.8	0	0	112.1	A919 D926 L927 V928	A919-E924 HydrophobicContact CB-CB 4.08Å; A919-E924 PolarHBondContact O-N 3.35Å; E924-D926 VanDerWaalsContact C-N 3.3Å; E924-D926 PolarHBondContact O-N 3.01Å; E924-L927 HydrophobicContact CB-CB 3.87Å; E924-L927 WeakPolarHBondContact O-CA 3.35Å; E924-L927 WeakPolarHBondContact O-CB 3.48Å; E924-L927 PolarHBondContact O-N 3.4Å; E924-L927 VanDerWaalsContact OE2-CD2 3.26Å; E924-L927 WeakPolarHBondContact OE2-CD2 3.41Å; E924-V928 PolarHBondContact O-N 2.94Å
925	F	97.8	Very high	96.2	Very high	56 Å²	56	55.2 Å²	55.2	25%	0.246	27%	0.265	C	S	.	.	H	α-helix	trans	-50.5	-44.9	-179.7	-176.4	-108.4	0	0	0	113.4	G923 L927 V928 Q929 H959 I960 F963	G923-F925 PolarHBondContact O-N 3.33Å; F925-L927 PolarHBondContact O-N 3.22Å; F925-V928 PolarHBondContact O-N 3.43Å; F925-Q929 HydrophobicContact CD1-CG 4.28Å; F925-Q929 HydrophobicContact CD2-CG 4.44Å; F925-Q929 VanDerWaalsContact CE1-CD 3.41Å; F925-Q929 HydrophobicContact CE1-CG 4.02Å; F925-Q929 VanDerWaalsContact CE1-NE2 3.32Å; F925-Q929 HydrophobicContact CE2-CG 4.2Å; F925-Q929 HydrophobicContact CZ-CG 3.99Å; F925-Q929 WeakPolarHBondContact O-CB 3.29Å; F925-Q929 WeakPolarHBondContact O-CG 3.45Å; F925-Q929 PolarHBondContact O-N 3.34Å; F925-H959 AromaticContact CD2-CD2 3.77Å; F925-H959 WeakPolarHBondContact CE2-O 3.26Å; F925-H959 AromaticContact CG-CD2 3.95Å; F925-I960 HydrophobicContact CB-CG1 4.17Å; F925-I960 HydrophobicContact CD2-CG1 3.76Å; F925-I960 HydrophobicContact CG-CG1 4.48Å; F925-F963 HydrophobicContact CE2-CB 3.72Å; F925-F963 HydrophobicContact CE2-CG 4.1Å; F925-F963 HydrophobicContact CZ-CB 4.4Å
926	D	96.4	Very high	95.8	Very high	118 Å²	118	61.5 Å²	61.5	63%	0.631	29%	0.293	S	S	*	.	H	α-helix	trans	-63.3	-20.6	176.6	-76.2	-2.3	0	0	0	113.7	E924 R930	E924-D926 VanDerWaalsContact C-N 3.3Å; E924-D926 PolarHBondContact O-N 3.01Å; D926-R930 VanDerWaalsContact O-CZ 3.28Å; D926-R930 PolarHBondContact O-NH1 2.87Å; D926-R930 PolarHBondContact O-NH2 3.37Å
927	L	95.6	Very high	95.5	Very high	36 Å²	36	65.2 Å²	65.2	19%	0.188	31%	0.314	C	S	.	.	H	α-helix	trans	-89.2	-45.8	172.6	-178.3	55.5	0	0	0	110.6	A919 E924 F925 Q929 R930 I931	A919-L927 HydrophobicContact CB-CB 4.1Å; A919-L927 HydrophobicContact CB-CD2 3.9Å; A919-L927 HydrophobicContact CB-CG 3.95Å; E924-L927 HydrophobicContact CB-CB 3.87Å; E924-L927 WeakPolarHBondContact O-CA 3.35Å; E924-L927 WeakPolarHBondContact O-CB 3.48Å; E924-L927 PolarHBondContact O-N 3.4Å; E924-L927 VanDerWaalsContact OE2-CD2 3.26Å; E924-L927 WeakPolarHBondContact OE2-CD2 3.41Å; F925-L927 PolarHBondContact O-N 3.22Å; L927-Q929 VanDerWaalsContact C-N 3.33Å; L927-Q929 PolarHBondContact O-N 3.14Å; L927-R930 PolarHBondContact O-N 3.35Å; L927-I931 HydrophobicContact CD1-CB 4.41Å; L927-I931 WeakPolarHBondContact O-CG2 3.31Å; L927-I931 PolarHBondContact O-N 3.37Å
928	V	97.4	Very high	95.4	Very high	0 Å²	0	64.9 Å²	64.9	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-51.3	-50.8	173.9	173.7	0	0	0	0	111	L916 A919 E924 F925 R930 I931 I932 I960 F963 L964	L916-V928 HydrophobicContact CD1-CB 4.46Å; L916-V928 HydrophobicContact CD1-CG1 3.89Å; A919-V928 HydrophobicContact CB-CG2 3.68Å; E924-V928 PolarHBondContact O-N 2.94Å; F925-V928 PolarHBondContact O-N 3.43Å; V928-R930 PolarHBondContact O-N 3.26Å; V928-I931 PolarHBondContact O-N 2.96Å; V928-I932 WeakPolarHBondContact O-CB 3.41Å; V928-I932 WeakPolarHBondContact O-CG2 3.37Å; V928-I932 PolarHBondContact O-N 3.13Å; V928-I932 VanDerWaalsContact O-N 3.13Å; V928-I960 HydrophobicContact CG1-CG2 4.26Å; V928-I960 HydrophobicContact CG2-CD1 4.2Å; V928-I960 HydrophobicContact CG2-CG2 4.38Å; V928-F963 HydrophobicContact CG1-CD1 4.02Å; V928-F963 HydrophobicContact CG1-CE1 4.08Å; V928-L964 HydrophobicContact CG1-CD2 4.14Å
929	Q	95.9	Very high	95.2	Very high	78 Å²	78	61.8 Å²	61.8	36%	0.364	30%	0.298	S	S	.	.	H	α-helix	trans	-58.7	-22.3	179.2	-74.3	-161.5	-37.7	0	0	114.4	F925 L927 Y933 F963	F925-Q929 HydrophobicContact CD1-CG 4.28Å; F925-Q929 HydrophobicContact CD2-CG 4.44Å; F925-Q929 VanDerWaalsContact CE1-CD 3.41Å; F925-Q929 HydrophobicContact CE1-CG 4.02Å; F925-Q929 VanDerWaalsContact CE1-NE2 3.32Å; F925-Q929 HydrophobicContact CE2-CG 4.2Å; F925-Q929 HydrophobicContact CZ-CG 3.99Å; F925-Q929 WeakPolarHBondContact O-CB 3.29Å; F925-Q929 WeakPolarHBondContact O-CG 3.45Å; F925-Q929 PolarHBondContact O-N 3.34Å; L927-Q929 VanDerWaalsContact C-N 3.33Å; L927-Q929 PolarHBondContact O-N 3.14Å; Q929-Y933 WeakPolarHBondContact O-CD2 3.27Å; Q929-Y933 WeakPolarHBondContact O-CE2 3.2Å; Q929-F963 HydrophobicContact CB-CE1 4.48Å; Q929-F963 HydrophobicContact CB-CZ 4.22Å; Q929-F963 HydrophobicContact CG-CD1 4.34Å; Q929-F963 HydrophobicContact CG-CD2 4.28Å; Q929-F963 HydrophobicContact CG-CE1 4.04Å; Q929-F963 HydrophobicContact CG-CE2 3.97Å; Q929-F963 HydrophobicContact CG-CG 4.45Å; Q929-F963 HydrophobicContact CG-CZ 3.85Å
930	R	94.7	Very high	95.1	Very high	142 Å²	142	64 Å²	64	54%	0.536	31%	0.312	S	S	.	.	H	α-helix	trans	-94.7	-52.1	179.1	-169.6	-174.3	-52.1	98	17.3	111.4	D926 L927 V928 I932 Y933	D926-R930 VanDerWaalsContact O-CZ 3.28Å; D926-R930 PolarHBondContact O-NH1 2.87Å; D926-R930 PolarHBondContact O-NH2 3.37Å; L927-R930 PolarHBondContact O-N 3.35Å; V928-R930 PolarHBondContact O-N 3.26Å; R930-I932 VanDerWaalsContact C-N 3.3Å; R930-I932 PolarHBondContact O-N 3.09Å; R930-Y933 PolarHBondContact O-N 3Å
931	I	95.2	Very high	95	Very high	7 Å²	7	67 Å²	67	4%	0.036	33%	0.331	C	S	.	.	H	α-helix	trans	-71.8	-24.6	-170.5	-159.9	71.7	0	0	0	112.4	P912 L915 L916 L927 V928 Y933 E934 V935	P912-I931 HydrophobicContact CB-CD1 3.82Å; P912-I931 HydrophobicContact CB-CG1 3.97Å; P912-I931 WeakPolarHBondContact O-CG1 3.41Å; L915-I931 HydrophobicContact CB-CD1 4.27Å; L915-I931 HydrophobicContact CB-CG1 3.87Å; L915-I931 HydrophobicContact CD1-CD1 3.89Å; L915-I931 HydrophobicContact CD1-CG1 4.42Å; L916-I931 HydrophobicContact CB-CG2 3.88Å; L916-I931 HydrophobicContact CD1-CG2 3.75Å; L916-I931 HydrophobicContact CG-CG2 4.39Å; L927-I931 HydrophobicContact CD1-CB 4.41Å; L927-I931 WeakPolarHBondContact O-CG2 3.31Å; L927-I931 PolarHBondContact O-N 3.37Å; V928-I931 PolarHBondContact O-N 2.96Å; I931-Y933 PolarHBondContact O-N 3.06Å; I931-Y933 VanDerWaalsContact O-N 3.12Å; I931-E934 HydrophobicContact CD1-CB 4.11Å; I931-E934 HydrophobicContact CD1-CG 4.42Å; I931-E934 WeakPolarHBondContact O-CA 3.36Å; I931-E934 WeakPolarHBondContact O-CB 3.31Å; I931-E934 PolarHBondContact O-N 3.15Å; I931-V935 PolarHBondContact O-N 3.41Å; I931-V935 VanDerWaalsContact O-N 3.14Å
932	I	94.6	Very high	94.8	Very high	1 Å²	1	66 Å²	66	1%	0.005	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-27.8	176.2	-163.2	166.9	0	0	0	113.7	L916 V928 R930 P938 F963 L964 F967	L916-I932 HydrophobicContact CD1-CB 4.16Å; L916-I932 HydrophobicContact CD1-CG1 4.5Å; L916-I932 HydrophobicContact CD2-CG1 4.36Å; V928-I932 WeakPolarHBondContact O-CB 3.41Å; V928-I932 WeakPolarHBondContact O-CG2 3.37Å; V928-I932 PolarHBondContact O-N 3.13Å; V928-I932 VanDerWaalsContact O-N 3.13Å; R930-I932 VanDerWaalsContact C-N 3.3Å; R930-I932 PolarHBondContact O-N 3.09Å; I932-P938 HydrophobicContact CD1-CB 4.13Å; I932-P938 HydrophobicContact CD1-CG 4.23Å; I932-P938 HydrophobicContact CG1-CB 3.76Å; I932-P938 HydrophobicContact CG1-CG 3.46Å; I932-P938 VanDerWaalsContact CG1-CG 3.46Å; I932-F963 HydrophobicContact CD1-CE1 3.9Å; I932-F963 HydrophobicContact CG2-CE1 4.02Å; I932-F963 HydrophobicContact CG2-CZ 4.06Å; I932-L964 HydrophobicContact CD1-CD2 3.69Å; I932-F967 HydrophobicContact CD1-CB 4.14Å; I932-F967 HydrophobicContact CD1-CD1 3.83Å; I932-F967 HydrophobicContact CD1-CD2 3.75Å; I932-F967 HydrophobicContact CD1-CE1 4.12Å; I932-F967 HydrophobicContact CD1-CE2 4.03Å; I932-F967 HydrophobicContact CD1-CG 3.64Å; I932-F967 HydrophobicContact CD1-CZ 4.21Å; I932-F967 HydrophobicContact CG1-CD1 4.28Å; I932-F967 HydrophobicContact CG1-CD2 4.35Å; I932-F967 HydrophobicContact CG1-CE1 4.06Å; I932-F967 HydrophobicContact CG1-CE2 4.11Å; I932-F967 HydrophobicContact CG1-CG 4.43Å; I932-F967 HydrophobicContact CG1-CZ 3.97Å; I932-F967 HydrophobicContact CG2-CD2 4.41Å; I932-F967 HydrophobicContact CG2-CE2 3.91Å; I932-F967 HydrophobicContact CG2-CZ 4.34Å
933	Y	92.8	Very high	94.7	Very high	95 Å²	95	67.8 Å²	67.8	37%	0.373	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.1	-21	175.2	-64.2	-83.9	0	0	0	113.2	Q929 R930 I931 F967 A1114	Q929-Y933 WeakPolarHBondContact O-CD2 3.27Å; Q929-Y933 WeakPolarHBondContact O-CE2 3.2Å; R930-Y933 PolarHBondContact O-N 3Å; I931-Y933 PolarHBondContact O-N 3.06Å; I931-Y933 VanDerWaalsContact O-N 3.12Å; Y933-F967 HydrophobicContact CD1-CE2 4.33Å; Y933-F967 HydrophobicContact CD1-CZ 4.33Å; Y933-F967 AromaticContact CE1-CE2 3.77Å; Y933-F967 HydrophobicContact CE1-CE2 3.77Å; Y933-F967 HydrophobicContact CE1-CZ 4.13Å; Y933-F967 HydrophobicContact CE2-CE2 4.29Å; Y933-F967 AromaticContact CZ-CE2 3.75Å; Y933-A1114 HydrophobicContact CD1-CB 4.26Å; Y933-A1114 HydrophobicContact CE1-CB 4.19Å
934	E	92.4	Very high	94.6	Very high	121 Å²	121	72.3 Å²	72.3	57%	0.565	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.7	-16.2	174.7	-61.8	-173.7	-140.2	0	0	112.7	P912 I931	P912-E934 HydrophobicContact CB-CB 4Å; I931-E934 HydrophobicContact CD1-CB 4.11Å; I931-E934 HydrophobicContact CD1-CG 4.42Å; I931-E934 WeakPolarHBondContact O-CA 3.36Å; I931-E934 WeakPolarHBondContact O-CB 3.31Å; I931-E934 PolarHBondContact O-N 3.15Å
935	V	92.8	Very high	94.5	Very high	3 Å²	3	67.6 Å²	67.6	2%	0.018	34%	0.338	C	S	.	.	S	Bend	trans	-84.6	132.5	175.7	176.9	0	0	0	0	110.9	P912 L913 L916 I931 N937 R1111	P912-V935 HydrophobicContact CB-CG2 3.85Å; P912-V935 HydrophobicContact CG-CG2 4.47Å; P912-V935 VanDerWaalsContact O-CG2 3.26Å; P912-V935 WeakPolarHBondContact O-CG2 3.35Å; L913-V935 HydrophobicContact CB-CG1 4.4Å; L913-V935 HydrophobicContact CB-CG2 4.49Å; L913-V935 HydrophobicContact CD1-CG1 4.08Å; L916-V935 HydrophobicContact CB-CG2 3.96Å; L916-V935 HydrophobicContact CD2-CB 4.2Å; L916-V935 HydrophobicContact CD2-CG1 4.28Å; L916-V935 HydrophobicContact CD2-CG2 3.84Å; I931-V935 PolarHBondContact O-N 3.41Å; I931-V935 VanDerWaalsContact O-N 3.14Å; V935-N937 PolarHBondContact O-N 3.45Å; V935-R1111 PolarHBondContact O-NH2 3.23Å
936	E	89	Confident	94.5	Very high	172 Å²	172	67 Å²	67	80%	0.804	34%	0.336	S	S	*	.	S	Bend	trans	-64.7	-40.3	-176.7	-176.1	165.9	-161.7	0	0	113.6	R1111	E936-R1111 VanDerWaalsContact C-NH2 3.26Å; E936-R1111 VanDerWaalsContact CA-NH2 3.34Å; E936-R1111 PolarHBondContact O-NH1 2.62Å; E936-R1111 PolarHBondContact O-NH2 3.39Å
937	N	91.2	Very high	94.6	Very high	79 Å²	79	61.6 Å²	61.6	42%	0.422	31%	0.308	S	S	.	.			trans	-142.1	106.5	169.9	172.4	5.2	0	0	0	109.1	V935 S939 T940	V935-N937 PolarHBondContact O-N 3.45Å; N937-S939 PolarHBondContact O-N 2.94Å; N937-S939 VanDerWaalsContact OD1-CB 3.3Å; N937-S939 WeakPolarHBondContact OD1-CB 3.46Å; N937-S939 PolarHBondContact OD1-N 2.73Å; N937-S939 PolarHBondContact OD1-OG 2.77Å; N937-T940 HydrophobicContact CB-CG2 3.97Å; N937-T940 PolarHBondContact O-N 2.63Å; N937-T940 PolarHBondContact O-OG1 2.64Å
938	P	93.7	Very high	94.7	Very high	15 Å²	15	59.9 Å²	59.9	10%	0.097	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60	-8.1	179.1	-29.4	38.6	0	0	0	116.2	L916 I932 F967 V969	L916-P938 HydrophobicContact CD2-CB 3.97Å; I932-P938 HydrophobicContact CD1-CB 4.13Å; I932-P938 HydrophobicContact CD1-CG 4.23Å; I932-P938 HydrophobicContact CG1-CB 3.76Å; I932-P938 HydrophobicContact CG1-CG 3.46Å; I932-P938 VanDerWaalsContact CG1-CG 3.46Å; P938-F967 HydrophobicContact CG-CD1 4.46Å; P938-F967 HydrophobicContact CG-CE1 3.97Å; P938-V969 HydrophobicContact CB-CG1 3.88Å
939	S	94.9	Very high	94.8	Very high	28 Å²	28	60 Å²	60	20%	0.196	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.6	0.8	173.9	-47.5	0	0	0	0	113.8	N937 V969 N970	N937-S939 PolarHBondContact O-N 2.94Å; N937-S939 VanDerWaalsContact OD1-CB 3.3Å; N937-S939 WeakPolarHBondContact OD1-CB 3.46Å; N937-S939 PolarHBondContact OD1-N 2.73Å; N937-S939 PolarHBondContact OD1-OG 2.77Å; S939-V969 WeakPolarHBondContact OG-CA 3.42Å; S939-N970 PolarHBondContact OG-N 2.94Å
940	T	94.4	Very high	94.9	Very high	47 Å²	47	56.4 Å²	56.4	29%	0.288	28%	0.283	S	S	.	.			trans	-69.8	137.5	176	48	0	0	0	0	111.1	L913 N937	L913-T940 VanDerWaalsContact CD1-OG1 3.29Å; L913-T940 WeakPolarHBondContact CD1-OG1 3.42Å; L913-T940 VanDerWaalsContact CD2-OG1 3.23Å; L913-T940 WeakPolarHBondContact CD2-OG1 3.37Å; N937-T940 HydrophobicContact CB-CG2 3.97Å; N937-T940 PolarHBondContact O-N 2.63Å; N937-T940 PolarHBondContact O-OG1 2.64Å
941	P	95.7	Very high	95.1	Very high	62 Å²	62	50.8 Å²	50.8	40%	0.403	26%	0.263	S	S	.	.			trans	-82.7	174.4	176.8	35.2	-36.6	0	0	0	113.1	G945 I946 T947	P941-G945 VanDerWaalsContact CB-CA 3.48Å; P941-G945 VanDerWaalsContact CB-O 3.3Å; P941-G945 WeakPolarHBondContact CB-O 3.38Å; P941-I946 CarbonylContact C-O 3.56Å; P941-I946 VanDerWaalsContact CA-O 3.26Å; P941-I946 WeakPolarHBondContact CA-O 3.29Å; P941-T947 HydrophobicContact CB-CG2 4Å
942	N	95.2	Very high	95.2	Very high	51 Å²	51	50.5 Å²	50.5	27%	0.273	26%	0.262	S	S	.	.			trans	-77.8	-174.5	156.3	77.7	-15.5	0	0	0	111.3	L917 E944 G945 I946	L917-N942 HydrophobicContact CD1-CB 4.06Å; N942-E944 PolarHBondContact ND2-OE2 2.87Å; N942-E944 PolarHBondContact O-N 3.46Å; N942-E944 VanDerWaalsContact O-N 3.12Å; N942-E944 WeakPolarHBondContact OD1-CA 3.41Å; N942-E944 WeakPolarHBondContact OD1-CB 3.39Å; N942-E944 PolarHBondContact OD1-N 3.23Å; N942-G945 PolarHBondContact O-N 2.82Å; N942-G945 VanDerWaalsContact O-N 3.08Å; N942-G945 PolarHBondContact OD1-N 3.01Å; N942-I946 PolarHBondContact N-O 2.8Å; N942-I946 WeakPolarHBondContact OD1-CB 3.38Å; N942-I946 PolarHBondContact OD1-N 2.92Å; N942-I946 PolarHBondContact OD1-O 2.9Å
943	D	94.8	Very high	95.4	Very high	179 Å²	179	50.5 Å²	50.5	96%	0.957	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	-11.7	178.9	-56.5	-42.8	0	0	0	114.4
944	E	95.4	Very high	95.6	Very high	116 Å²	116	49.1 Å²	49.1	54%	0.542	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.1	1.9	177.8	-59.4	166.2	141.2	0	0	112.1	N942 I946 S976	N942-E944 PolarHBondContact ND2-OE2 2.87Å; N942-E944 PolarHBondContact O-N 3.46Å; N942-E944 VanDerWaalsContact O-N 3.12Å; N942-E944 WeakPolarHBondContact OD1-CA 3.41Å; N942-E944 WeakPolarHBondContact OD1-CB 3.39Å; N942-E944 PolarHBondContact OD1-N 3.23Å; E944-I946 VanDerWaalsContact C-N 3.3Å; E944-I946 HydrophobicContact CB-CD1 4.12Å; E944-I946 HydrophobicContact CB-CG1 4.07Å; E944-S976 WeakPolarHBondContact O-CB 3.49Å; E944-S976 PolarHBondContact O-N 3.41Å; E944-S976 PolarHBondContact O-OG 2.81Å
945	G	95.5	Very high	95.8	Very high	14 Å²	14	45.4 Å²	45.4	14%	0.144	26%	0.255	C	S	.	.	S	Bend	trans	84	-1.4	-176.2	0	0	0	0	0	114.6	P941 N942	P941-G945 VanDerWaalsContact CB-CA 3.48Å; P941-G945 VanDerWaalsContact CB-O 3.3Å; P941-G945 WeakPolarHBondContact CB-O 3.38Å; N942-G945 PolarHBondContact O-N 2.82Å; N942-G945 VanDerWaalsContact O-N 3.08Å; N942-G945 PolarHBondContact OD1-N 3.01Å
946	I	97.6	Very high	95.9	Very high	43 Å²	43	46.9 Å²	46.9	22%	0.221	27%	0.271	C	S	.	.			trans	-76.7	124.5	-177.8	-53.1	177	0	0	0	110	P941 N942 E944 H950 N951	P941-I946 CarbonylContact C-O 3.56Å; P941-I946 VanDerWaalsContact CA-O 3.26Å; P941-I946 WeakPolarHBondContact CA-O 3.29Å; N942-I946 PolarHBondContact N-O 2.8Å; N942-I946 WeakPolarHBondContact OD1-CB 3.38Å; N942-I946 PolarHBondContact OD1-N 2.92Å; N942-I946 PolarHBondContact OD1-O 2.9Å; E944-I946 VanDerWaalsContact C-N 3.3Å; E944-I946 HydrophobicContact CB-CD1 4.12Å; E944-I946 HydrophobicContact CB-CG1 4.07Å; I946-H950 HydrophobicContact CG2-CB 3.7Å; I946-N951 VanDerWaalsContact CG2-OD1 3.22Å; I946-N951 WeakPolarHBondContact CG2-OD1 3.23Å
947	T	98.1	Very high	96.3	Very high	4 Å²	4	40.6 Å²	40.6	3%	0.025	24%	0.241	C	C	.	.			trans	-102	166.3	178.2	72.8	0	0	0	0	112.1	P941 L949 H950 N951 A973	P941-T947 HydrophobicContact CB-CG2 4Å; T947-L949 PolarHBondContact O-N 2.94Å; T947-L949 VanDerWaalsContact O-N 3.08Å; T947-H950 PolarHBondContact N-ND1 3.39Å; T947-H950 WeakPolarHBondContact O-CB 3.48Å; T947-H950 PolarHBondContact O-N 3.46Å; T947-H950 PolarHBondContact OG1-ND1 3.45Å; T947-N951 PolarHBondContact O-N 3.38Å; T947-A973 HydrophobicContact CG2-CB 3.63Å
948	P	98.1	Very high	96.6	Very high	1 Å²	1	40.1 Å²	40.1	1%	0.006	24%	0.237	C	C	.	.	H	α-helix	trans	-56.2	-28.8	177	-26.8	35.8	0	0	0	114	L916 L917 S920 A952 L964	L916-P948 HydrophobicContact CB-CG 4.43Å; L916-P948 HydrophobicContact CD2-CB 4.32Å; L916-P948 HydrophobicContact CD2-CG 3.76Å; L916-P948 HydrophobicContact CG-CB 3.93Å; L916-P948 HydrophobicContact CG-CG 3.68Å; L917-P948 HydrophobicContact CD2-CG 3.89Å; L917-P948 HydrophobicContact CG-CG 4.16Å; S920-P948 WeakPolarHBondContact CB-O 3.35Å; P948-A952 WeakPolarHBondContact O-CB 3.43Å; P948-A952 PolarHBondContact O-N 3.43Å; P948-L964 HydrophobicContact CB-CD1 4.21Å
949	L	98.5	Very high	96.7	Very high	1 Å²	1	44.3 Å²	44.3	1%	0.005	26%	0.255	C	S	.	.	H	α-helix	trans	-70.7	-36.2	175.6	-177.7	60.4	0	0	0	112.5	T947 V953 V961 L964 L965 V969 P981 L997	T947-L949 PolarHBondContact O-N 2.94Å; T947-L949 VanDerWaalsContact O-N 3.08Å; L949-V953 HydrophobicContact CD1-CG2 4.3Å; L949-V953 WeakPolarHBondContact O-CB 3.44Å; L949-V953 VanDerWaalsContact O-CG2 3.32Å; L949-V953 WeakPolarHBondContact O-CG2 3.43Å; L949-V953 PolarHBondContact O-N 3.47Å; L949-V961 HydrophobicContact CD1-CB 4.49Å; L949-V961 HydrophobicContact CD1-CG1 3.93Å; L949-L964 HydrophobicContact CB-CD1 4.25Å; L949-L964 HydrophobicContact CD1-CB 4.25Å; L949-L964 HydrophobicContact CD1-CD1 4.34Å; L949-L965 HydrophobicContact CD1-CD2 4.36Å; L949-L965 HydrophobicContact CD1-CG 4.26Å; L949-L965 HydrophobicContact CD2-CD2 3.86Å; L949-V969 HydrophobicContact CB-CG2 4.12Å; L949-V969 HydrophobicContact CD2-CG2 3.81Å; L949-V969 HydrophobicContact CG-CG2 4.43Å; L949-P981 HydrophobicContact CB-CG 4.4Å; L949-P981 HydrophobicContact CD2-CB 4.08Å; L949-P981 HydrophobicContact CD2-CG 3.77Å; L949-P981 HydrophobicContact CG-CB 3.99Å; L949-P981 HydrophobicContact CG-CG 3.83Å; L949-L997 HydrophobicContact CD2-CD2 4.49Å
950	H	98.6	Very high	96.9	Very high	4 Å²	4	43 Å²	43	2%	0.019	25%	0.245	C	C	.	.	H	α-helix	trans	-61.8	-51.3	172.9	-68.9	86.3	0	0	0	110.2	I946 T947 A952 V953 C954 W979 P981	I946-H950 HydrophobicContact CG2-CB 3.7Å; T947-H950 PolarHBondContact N-ND1 3.39Å; T947-H950 WeakPolarHBondContact O-CB 3.48Å; T947-H950 PolarHBondContact O-N 3.46Å; T947-H950 PolarHBondContact OG1-ND1 3.45Å; H950-A952 VanDerWaalsContact C-N 3.33Å; H950-A952 PolarHBondContact O-N 3.22Å; H950-V953 PolarHBondContact O-N 2.81Å; H950-V953 VanDerWaalsContact O-N 3.12Å; H950-C954 WeakPolarHBondContact O-CB 3.37Å; H950-C954 PolarHBondContact O-N 2.8Å; H950-C954 PolarHBondContact O-SG 2.89Å; H950-W979 PolarHBondContact NE2-O 2.9Å; H950-P981 WeakPolarHBondContact NE2-CD 3.4Å
951	N	98.2	Very high	97.1	Very high	24 Å²	24	40.8 Å²	40.8	13%	0.128	23%	0.232	C	C	.	.	H	α-helix	trans	-54.5	-47.5	177.2	-75.9	3.7	0	0	0	112.2	L917 L921 I946 T947 V953 C954 A955	L917-N951 PolarHBondContact O-ND2 3.17Å; L921-N951 HydrophobicContact CB-CB 3.97Å; L921-N951 HydrophobicContact CD1-CB 4Å; I946-N951 VanDerWaalsContact CG2-OD1 3.22Å; I946-N951 WeakPolarHBondContact CG2-OD1 3.23Å; T947-N951 PolarHBondContact O-N 3.38Å; N951-V953 VanDerWaalsContact C-N 3.32Å; N951-V953 PolarHBondContact O-N 2.68Å; N951-C954 PolarHBondContact O-N 2.84Å; N951-A955 WeakPolarHBondContact O-CB 3.31Å; N951-A955 PolarHBondContact O-N 2.86Å
952	A	98.4	Very high	97.1	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-64.5	-34	179.6	0	0	0	0	0	113.5	S920 P948 H950 G956 H957 I960 V961 L964	S920-A952 VanDerWaalsContact O-CA 3.3Å; S920-A952 WeakPolarHBondContact O-CA 3.18Å; S920-A952 PolarHBondContact O-N 3.44Å; P948-A952 WeakPolarHBondContact O-CB 3.43Å; P948-A952 PolarHBondContact O-N 3.43Å; H950-A952 VanDerWaalsContact C-N 3.33Å; H950-A952 PolarHBondContact O-N 3.22Å; A952-G956 PolarHBondContact O-N 3.22Å; A952-H957 PolarHBondContact O-N 2.97Å; A952-I960 HydrophobicContact CB-CB 4.08Å; A952-I960 HydrophobicContact CB-CG2 3.49Å; A952-I960 VanDerWaalsContact CB-CG2 3.49Å; A952-V961 VanDerWaalsContact C-CG2 3.43Å; A952-V961 HydrophobicContact CB-CG2 3.66Å; A952-V961 WeakPolarHBondContact O-CG2 3.49Å; A952-L964 HydrophobicContact CB-CD1 4.11Å
953	V	98.3	Very high	97.2	Very high	1 Å²	1	41.6 Å²	41.6	1%	0.006	23%	0.227	C	C	.	.	H	α-helix	trans	-74.5	-50.6	176	168.8	0	0	0	0	111.2	L949 H950 N951 A955 G956 V961 P981 C984 A985 L993 L997	L949-V953 HydrophobicContact CD1-CG2 4.3Å; L949-V953 WeakPolarHBondContact O-CB 3.44Å; L949-V953 VanDerWaalsContact O-CG2 3.32Å; L949-V953 WeakPolarHBondContact O-CG2 3.43Å; L949-V953 PolarHBondContact O-N 3.47Å; H950-V953 PolarHBondContact O-N 2.81Å; H950-V953 VanDerWaalsContact O-N 3.12Å; N951-V953 VanDerWaalsContact C-N 3.32Å; N951-V953 PolarHBondContact O-N 2.68Å; V953-A955 VanDerWaalsContact C-N 3.26Å; V953-A955 PolarHBondContact O-N 2.83Å; V953-G956 PolarHBondContact O-N 3.28Å; V953-V961 HydrophobicContact CB-CG2 4.43Å; V953-V961 HydrophobicContact CG2-CG1 3.96Å; V953-V961 HydrophobicContact CG2-CG2 3.67Å; V953-P981 HydrophobicContact CG2-CB 4.27Å; V953-C984 HydrophobicContact CB-CB 4.47Å; V953-C984 HydrophobicContact CG1-CB 3.76Å; V953-A985 HydrophobicContact CG1-CB 3.7Å; V953-A985 VanDerWaalsContact CG1-N 3.34Å; V953-L993 HydrophobicContact CG1-CD1 4.23Å; V953-L997 HydrophobicContact CG2-CD1 4.28Å
954	C	96.9	Very high	97.3	Very high	67 Å²	67	33.1 Å²	33.1	45%	0.453	18%	0.181	S	C	.	.	H	α-helix	trans	-59.8	-35.2	-179.7	-66.5	0	0	0	0	112.7	H950 N951 G956	H950-C954 WeakPolarHBondContact O-CB 3.37Å; H950-C954 PolarHBondContact O-N 2.8Å; H950-C954 PolarHBondContact O-SG 2.89Å; N951-C954 PolarHBondContact O-N 2.84Å; C954-G956 VanDerWaalsContact C-N 3.34Å
955	A	96.3	Very high	97.4	Very high	43 Å²	43	27.8 Å²	27.8	36%	0.355	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.7	-1.2	175.4	0	0	0	0	0	114	L921 N951 V953 H957	L921-A955 HydrophobicContact CD1-CB 4.34Å; L921-A955 WeakPolarHBondContact O-CB 3.46Å; N951-A955 WeakPolarHBondContact O-CB 3.31Å; N951-A955 PolarHBondContact O-N 2.86Å; V953-A955 VanDerWaalsContact C-N 3.26Å; V953-A955 PolarHBondContact O-N 2.83Å; A955-H957 VanDerWaalsContact C-N 3.34Å; A955-H957 VanDerWaalsContact CB-CD2 3.42Å; A955-H957 WeakPolarHBondContact CB-CD2 3.37Å; A955-H957 WeakPolarHBondContact CB-NE2 3.45Å; A955-H957 PolarHBondContact O-N 2.83Å
956	G	95.7	Very high	97.3	Very high	33 Å²	33	31 Å²	31	34%	0.34	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	72.1	19.2	176.4	0	0	0	0	0	115.2	A952 V953 C954 H958	A952-G956 PolarHBondContact O-N 3.22Å; V953-G956 PolarHBondContact O-N 3.28Å; C954-G956 VanDerWaalsContact C-N 3.34Å; G956-H958 VanDerWaalsContact C-N 3.25Å; G956-H958 PolarHBondContact O-N 3.3Å; G956-H958 PolarHBondContact O-ND1 3.05Å
957	H	97.6	Very high	97.2	Very high	40 Å²	40	30 Å²	30	19%	0.185	17%	0.165	C	C	.	.			trans	-79.6	66.3	-176.5	-63.9	-49.8	0	0	0	112.3	S920 L921 G923 A952 A955 H959 I960 V961	S920-H957 PolarHBondContact O-CD2 2.85Å; L921-H957 PolarHBondContact O-CD2 2.9Å; L921-H957 PolarHBondContact O-NE2 2.86Å; G923-H957 WeakPolarHBondContact CA-NE2 3.25Å; G923-H957 PolarHBondContact N-NE2 3.29Å; A952-H957 PolarHBondContact O-N 2.97Å; A955-H957 VanDerWaalsContact C-N 3.34Å; A955-H957 VanDerWaalsContact CB-CD2 3.42Å; A955-H957 WeakPolarHBondContact CB-CD2 3.37Å; A955-H957 WeakPolarHBondContact CB-NE2 3.45Å; A955-H957 PolarHBondContact O-N 2.83Å; H957-H959 PolarHBondContact O-N 3.34Å; H957-I960 HydrophobicContact CB-CB 3.97Å; H957-I960 HydrophobicContact CB-CD1 3.88Å; H957-I960 HydrophobicContact CB-CG1 4.15Å; H957-I960 WeakPolarHBondContact O-CA 3.34Å; H957-I960 WeakPolarHBondContact O-CB 3.41Å; H957-I960 PolarHBondContact O-N 3.47Å; H957-V961 PolarHBondContact O-N 2.67Å
958	H	96.8	Very high	96.9	Very high	70 Å²	70	30.2 Å²	30.2	32%	0.324	17%	0.167	S	C	.	.	H	α-helix	trans	-43.8	-36.4	-175.5	-69.3	71.9	0	0	0	115.1	G956 K962 H992 L993	G956-H958 VanDerWaalsContact C-N 3.25Å; G956-H958 PolarHBondContact O-N 3.3Å; G956-H958 PolarHBondContact O-ND1 3.05Å; H958-K962 WeakPolarHBondContact O-CB 3.17Å; H958-K962 PolarHBondContact O-N 2.95Å; H958-H992 AromaticContact CD2-CD2 3.55Å; H958-H992 AromaticContact NE2-CD2 3.81Å; H958-L993 HydrophobicContact CB-CD2 4.26Å; H958-L993 VanDerWaalsContact CD2-CD2 3.43Å; H958-L993 WeakPolarHBondContact CD2-CD2 3.41Å
959	H	96.4	Very high	96.8	Very high	103 Å²	103	30.9 Å²	30.9	48%	0.477	17%	0.171	S	C	.	.	H	α-helix	trans	-76.8	-34.9	179.4	49.4	-85.8	0	0	0	112.9	F925 H957 F963	F925-H959 AromaticContact CD2-CD2 3.77Å; F925-H959 WeakPolarHBondContact CE2-O 3.26Å; F925-H959 AromaticContact CG-CD2 3.95Å; H957-H959 PolarHBondContact O-N 3.34Å; H959-F963 WeakPolarHBondContact O-CB 3.48Å; H959-F963 PolarHBondContact O-N 3.33Å; H959-F963 VanDerWaalsContact O-N 3.11Å
960	I	97.9	Very high	96.7	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-67.1	-49.2	167.7	-66.5	173	0	0	0	109.5	F925 V928 A952 H957 K962 F963 L964	F925-I960 HydrophobicContact CB-CG1 4.17Å; F925-I960 HydrophobicContact CD2-CG1 3.76Å; F925-I960 HydrophobicContact CG-CG1 4.48Å; V928-I960 HydrophobicContact CG1-CG2 4.26Å; V928-I960 HydrophobicContact CG2-CD1 4.2Å; V928-I960 HydrophobicContact CG2-CG2 4.38Å; A952-I960 HydrophobicContact CB-CB 4.08Å; A952-I960 HydrophobicContact CB-CG2 3.49Å; A952-I960 VanDerWaalsContact CB-CG2 3.49Å; H957-I960 HydrophobicContact CB-CB 3.97Å; H957-I960 HydrophobicContact CB-CD1 3.88Å; H957-I960 HydrophobicContact CB-CG1 4.15Å; H957-I960 WeakPolarHBondContact O-CA 3.34Å; H957-I960 WeakPolarHBondContact O-CB 3.41Å; H957-I960 PolarHBondContact O-N 3.47Å; I960-K962 VanDerWaalsContact C-N 3.34Å; I960-K962 PolarHBondContact O-N 3.09Å; I960-F963 PolarHBondContact O-N 3.24Å; I960-L964 HydrophobicContact CG2-CD1 3.8Å; I960-L964 HydrophobicContact CG2-CG 4.08Å; I960-L964 WeakPolarHBondContact O-CG 3.35Å; I960-L964 PolarHBondContact O-N 3.04Å
961	V	98.2	Very high	96.7	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-52.1	-52.2	178.1	176.1	0	0	0	0	110.6	L949 A952 V953 H957 F963 L964 L965 L993 L996	L949-V961 HydrophobicContact CD1-CB 4.49Å; L949-V961 HydrophobicContact CD1-CG1 3.93Å; A952-V961 VanDerWaalsContact C-CG2 3.43Å; A952-V961 HydrophobicContact CB-CG2 3.66Å; A952-V961 WeakPolarHBondContact O-CG2 3.49Å; V953-V961 HydrophobicContact CB-CG2 4.43Å; V953-V961 HydrophobicContact CG2-CG1 3.96Å; V953-V961 HydrophobicContact CG2-CG2 3.67Å; H957-V961 PolarHBondContact O-N 2.67Å; V961-F963 PolarHBondContact O-N 3.03Å; V961-L964 PolarHBondContact O-N 3.23Å; V961-L965 HydrophobicContact CG1-CD1 3.8Å; V961-L965 VanDerWaalsContact O-CG 3.28Å; V961-L965 WeakPolarHBondContact O-CG 3.18Å; V961-L965 PolarHBondContact O-N 2.92Å; V961-L993 HydrophobicContact CB-CD2 4.2Å; V961-L993 HydrophobicContact CG1-CD2 4.09Å; V961-L993 HydrophobicContact CG2-CD2 4.18Å; V961-L996 HydrophobicContact CG1-CD2 4.09Å
962	K	96.9	Very high	96.7	Very high	97 Å²	97	32.7 Å²	32.7	42%	0.422	18%	0.181	S	C	.	.	H	α-helix	trans	-61.2	-43	177.7	-165.9	-169.7	-175.8	-60.7	0	112.3	H958 I960 L964 L965 D966 L996	H958-K962 WeakPolarHBondContact O-CB 3.17Å; H958-K962 PolarHBondContact O-N 2.95Å; I960-K962 VanDerWaalsContact C-N 3.34Å; I960-K962 PolarHBondContact O-N 3.09Å; K962-L964 PolarHBondContact O-N 2.98Å; K962-L965 PolarHBondContact O-N 3.06Å; K962-D966 IonicContact NZ-OD1 3.71Å; K962-D966 PolarHBondContact NZ-OD1 3.45Å; K962-D966 IonicContact NZ-OD2 3.38Å; K962-D966 PolarHBondContact NZ-OD2 2.85Å; K962-D966 WeakPolarHBondContact O-CB 3.42Å; K962-D966 PolarHBondContact O-N 2.86Å; K962-L996 HydrophobicContact CB-CD2 4.03Å; K962-L996 HydrophobicContact CG-CD1 4.35Å; K962-L996 HydrophobicContact CG-CD2 4.4Å
963	F	97.3	Very high	96.6	Very high	34 Å²	34	33 Å²	33	15%	0.149	18%	0.184	C	C	.	.	H	α-helix	trans	-63.8	-39.4	179.3	172.1	-99.4	0	0	0	112.9	F925 V928 Q929 I932 H959 I960 V961 D966 F967	F925-F963 HydrophobicContact CE2-CB 3.72Å; F925-F963 HydrophobicContact CE2-CG 4.1Å; F925-F963 HydrophobicContact CZ-CB 4.4Å; V928-F963 HydrophobicContact CG1-CD1 4.02Å; V928-F963 HydrophobicContact CG1-CE1 4.08Å; Q929-F963 HydrophobicContact CB-CE1 4.48Å; Q929-F963 HydrophobicContact CB-CZ 4.22Å; Q929-F963 HydrophobicContact CG-CD1 4.34Å; Q929-F963 HydrophobicContact CG-CD2 4.28Å; Q929-F963 HydrophobicContact CG-CE1 4.04Å; Q929-F963 HydrophobicContact CG-CE2 3.97Å; Q929-F963 HydrophobicContact CG-CG 4.45Å; Q929-F963 HydrophobicContact CG-CZ 3.85Å; I932-F963 HydrophobicContact CD1-CE1 3.9Å; I932-F963 HydrophobicContact CG2-CE1 4.02Å; I932-F963 HydrophobicContact CG2-CZ 4.06Å; H959-F963 WeakPolarHBondContact O-CB 3.48Å; H959-F963 PolarHBondContact O-N 3.33Å; H959-F963 VanDerWaalsContact O-N 3.11Å; I960-F963 PolarHBondContact O-N 3.24Å; V961-F963 PolarHBondContact O-N 3.03Å; F963-D966 PolarHBondContact O-N 2.72Å; F963-F967 HydrophobicContact CZ-CD2 4.31Å; F963-F967 WeakPolarHBondContact O-CB 3.4Å; F963-F967 PolarHBondContact O-N 2.93Å
964	L	96.9	Very high	96.6	Very high	1 Å²	1	35.7 Å²	35.7	1%	0.005	21%	0.206	C	C	.	.	H	α-helix	trans	-65.2	-41.2	175.1	-66.5	177.9	0	0	0	111.3	V928 I932 P948 L949 A952 I960 V961 K962 F967 G968 V969	V928-L964 HydrophobicContact CG1-CD2 4.14Å; I932-L964 HydrophobicContact CD1-CD2 3.69Å; P948-L964 HydrophobicContact CB-CD1 4.21Å; L949-L964 HydrophobicContact CB-CD1 4.25Å; L949-L964 HydrophobicContact CD1-CB 4.25Å; L949-L964 HydrophobicContact CD1-CD1 4.34Å; A952-L964 HydrophobicContact CB-CD1 4.11Å; I960-L964 HydrophobicContact CG2-CD1 3.8Å; I960-L964 HydrophobicContact CG2-CG 4.08Å; I960-L964 WeakPolarHBondContact O-CG 3.35Å; I960-L964 PolarHBondContact O-N 3.04Å; V961-L964 PolarHBondContact O-N 3.23Å; K962-L964 PolarHBondContact O-N 2.98Å; L964-F967 WeakPolarHBondContact O-CB 3.48Å; L964-F967 PolarHBondContact O-N 3.38Å; L964-G968 PolarHBondContact O-N 2.92Å; L964-V969 HydrophobicContact CB-CG1 4.35Å; L964-V969 HydrophobicContact CB-CG2 3.94Å; L964-V969 HydrophobicContact CD2-CG1 4.45Å; L964-V969 WeakPolarHBondContact O-CG2 3.12Å; L964-V969 PolarHBondContact O-N 2.79Å
965	L	96.6	Very high	96.6	Very high	4 Å²	4	34 Å²	34	2%	0.021	19%	0.193	C	C	.	.	H	α-helix	trans	-67.1	-44	175	-65.5	168.3	0	0	0	112	L949 V961 K962 F967 G968 V971 L996 L997 I1106	L949-L965 HydrophobicContact CD1-CD2 4.36Å; L949-L965 HydrophobicContact CD1-CG 4.26Å; L949-L965 HydrophobicContact CD2-CD2 3.86Å; V961-L965 HydrophobicContact CG1-CD1 3.8Å; V961-L965 VanDerWaalsContact O-CG 3.28Å; V961-L965 WeakPolarHBondContact O-CG 3.18Å; V961-L965 PolarHBondContact O-N 2.92Å; K962-L965 PolarHBondContact O-N 3.06Å; L965-F967 PolarHBondContact O-N 2.71Å; L965-G968 WeakPolarHBondContact O-CA 3.34Å; L965-G968 PolarHBondContact O-N 3.3Å; L965-V971 HydrophobicContact CD2-CB 3.85Å; L965-V971 HydrophobicContact CD2-CG2 3.73Å; L965-L996 HydrophobicContact CD1-CD2 4.12Å; L965-L996 HydrophobicContact CD1-CG 3.84Å; L965-L997 HydrophobicContact CD1-CD2 3.92Å; L965-L997 HydrophobicContact CD2-CD2 4.13Å; L965-I1106 HydrophobicContact CB-CD1 4.23Å; L965-I1106 WeakPolarHBondContact O-CD1 3.36Å; L965-I1106 WeakPolarHBondContact O-CG2 3.43Å
966	D	94.9	Very high	96.5	Very high	82 Å²	82	35.9 Å²	35.9	44%	0.439	20%	0.203	S	C	.	.	H	α-helix	trans	-62.8	-20.4	173.4	-71.8	-16.8	0	0	0	112.7	K962 F963	K962-D966 IonicContact NZ-OD1 3.71Å; K962-D966 PolarHBondContact NZ-OD1 3.45Å; K962-D966 IonicContact NZ-OD2 3.38Å; K962-D966 PolarHBondContact NZ-OD2 2.85Å; K962-D966 WeakPolarHBondContact O-CB 3.42Å; K962-D966 PolarHBondContact O-N 2.86Å; F963-D966 PolarHBondContact O-N 2.72Å
967	F	94.3	Very high	96.5	Very high	22 Å²	22	38 Å²	38	10%	0.096	21%	0.207	C	C	.	.	H	α-helix	trans	-83	-17.3	171.6	-157.2	-86.7	0	0	0	112.5	I932 Y933 P938 F963 L964 L965 R1109	I932-F967 HydrophobicContact CD1-CB 4.14Å; I932-F967 HydrophobicContact CD1-CD1 3.83Å; I932-F967 HydrophobicContact CD1-CD2 3.75Å; I932-F967 HydrophobicContact CD1-CE1 4.12Å; I932-F967 HydrophobicContact CD1-CE2 4.03Å; I932-F967 HydrophobicContact CD1-CG 3.64Å; I932-F967 HydrophobicContact CD1-CZ 4.21Å; I932-F967 HydrophobicContact CG1-CD1 4.28Å; I932-F967 HydrophobicContact CG1-CD2 4.35Å; I932-F967 HydrophobicContact CG1-CE1 4.06Å; I932-F967 HydrophobicContact CG1-CE2 4.11Å; I932-F967 HydrophobicContact CG1-CG 4.43Å; I932-F967 HydrophobicContact CG1-CZ 3.97Å; I932-F967 HydrophobicContact CG2-CD2 4.41Å; I932-F967 HydrophobicContact CG2-CE2 3.91Å; I932-F967 HydrophobicContact CG2-CZ 4.34Å; Y933-F967 HydrophobicContact CD1-CE2 4.33Å; Y933-F967 HydrophobicContact CD1-CZ 4.33Å; Y933-F967 AromaticContact CE1-CE2 3.77Å; Y933-F967 HydrophobicContact CE1-CE2 3.77Å; Y933-F967 HydrophobicContact CE1-CZ 4.13Å; Y933-F967 HydrophobicContact CE2-CE2 4.29Å; Y933-F967 AromaticContact CZ-CE2 3.75Å; P938-F967 HydrophobicContact CG-CD1 4.46Å; P938-F967 HydrophobicContact CG-CE1 3.97Å; F963-F967 HydrophobicContact CZ-CD2 4.31Å; F963-F967 WeakPolarHBondContact O-CB 3.4Å; F963-F967 PolarHBondContact O-N 2.93Å; L964-F967 WeakPolarHBondContact O-CB 3.48Å; L964-F967 PolarHBondContact O-N 3.38Å; L965-F967 PolarHBondContact O-N 2.71Å; F967-R1109 PolarHBondContact O-N 3.18Å
968	G	93.1	Very high	96.5	Very high	8 Å²	8	36.4 Å²	36.4	8%	0.082	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	76.6	43.6	-177.1	0	0	0	0	0	113.7	L964 L965 I1106 P1108	L964-G968 PolarHBondContact O-N 2.92Å; L965-G968 WeakPolarHBondContact O-CA 3.34Å; L965-G968 PolarHBondContact O-N 3.3Å; G968-I1106 WeakPolarHBondContact CA-O 3.25Å; G968-P1108 WeakPolarHBondContact O-CA 3.27Å; G968-P1108 WeakPolarHBondContact O-CB 3.46Å
969	V	96	Very high	96.6	Very high	14 Å²	14	36.1 Å²	36.1	9%	0.085	20%	0.197	C	C	.	.			trans	-70.1	161.3	165.6	-52	0	0	0	0	111.3	P938 S939 L949 L964 V971	P938-V969 HydrophobicContact CB-CG1 3.88Å; S939-V969 WeakPolarHBondContact OG-CA 3.42Å; L949-V969 HydrophobicContact CB-CG2 4.12Å; L949-V969 HydrophobicContact CD2-CG2 3.81Å; L949-V969 HydrophobicContact CG-CG2 4.43Å; L964-V969 HydrophobicContact CB-CG1 4.35Å; L964-V969 HydrophobicContact CB-CG2 3.94Å; L964-V969 HydrophobicContact CD2-CG1 4.45Å; L964-V969 WeakPolarHBondContact O-CG2 3.12Å; L964-V969 PolarHBondContact O-N 2.79Å; V969-V971 PolarHBondContact O-N 3.34Å
970	N	96.3	Very high	96.7	Very high	55 Å²	55	31.4 Å²	31.4	29%	0.294	18%	0.175	S	C	.	.			trans	-65.1	96.8	177.9	-175.5	11.7	0	0	0	112.1	S939 N972 A973 R1105	S939-N970 PolarHBondContact OG-N 2.94Å; N970-N972 PolarHBondContact ND2-O 2.74Å; N970-N972 PolarHBondContact O-N 3.15Å; N970-N972 WeakPolarHBondContact OD1-CA 3.36Å; N970-N972 PolarHBondContact OD1-N 2.84Å; N970-N972 PolarHBondContact OD1-O 3.3Å; N970-A973 HydrophobicContact CB-CB 4.3Å; N970-A973 VanDerWaalsContact CG-N 3.25Å; N970-A973 WeakPolarHBondContact ND2-CA 3.45Å; N970-A973 PolarHBondContact ND2-N 2.87Å; N970-A973 WeakPolarHBondContact O-CB 3.4Å; N970-A973 PolarHBondContact O-N 2.91Å; N970-A973 VanDerWaalsContact O-N 3.12Å; N970-A973 PolarHBondContact OD1-N 3.24Å; N970-R1105 PolarHBondContact OD1-NH1 2.8Å
971	V	97.7	Very high	96.7	Very high	4 Å²	4	31.4 Å²	31.4	2%	0.024	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-23.8	173.2	66	0	0	0	0	113.5	L965 V969 P981 L997 G1001 A1002 R1105	L965-V971 HydrophobicContact CD2-CB 3.85Å; L965-V971 HydrophobicContact CD2-CG2 3.73Å; V969-V971 PolarHBondContact O-N 3.34Å; V971-P981 WeakPolarHBondContact O-CD 3.33Å; V971-L997 HydrophobicContact CG2-CB 4.49Å; V971-L997 HydrophobicContact CG2-CD2 3.75Å; V971-G1001 WeakPolarHBondContact CG1-O 3.48Å; V971-A1002 HydrophobicContact CG2-CB 4.07Å; V971-R1105 HydrophobicContact CG1-CG 4.46Å
972	N	97.9	Very high	96.7	Very high	8 Å²	8	31.5 Å²	31.5	4%	0.043	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-113.2	39.1	176.4	-56.5	-46.7	0	0	0	111	N970 G1001 A1002 A1003 W1052 R1105	N970-N972 PolarHBondContact ND2-O 2.74Å; N970-N972 PolarHBondContact O-N 3.15Å; N970-N972 WeakPolarHBondContact OD1-CA 3.36Å; N970-N972 PolarHBondContact OD1-N 2.84Å; N970-N972 PolarHBondContact OD1-O 3.3Å; N972-G1001 PolarHBondContact ND2-O 3.33Å; N972-A1002 VanDerWaalsContact OD1-CA 3.26Å; N972-A1002 WeakPolarHBondContact OD1-CA 3.39Å; N972-A1003 PolarHBondContact OD1-N 3.38Å; N972-W1052 HydrophobicContact CB-CH2 3.74Å; N972-W1052 HydrophobicContact CB-CZ2 3.77Å; N972-R1105 PolarHBondContact ND2-NH2 2.88Å
973	A	97.5	Very high	96.8	Very high	8 Å²	8	26.9 Å²	26.9	7%	0.066	16%	0.156	C	C	.	.			trans	-63.8	144	159.6	0	0	0	0	0	108.3	T947 N970 T980 P981	T947-A973 HydrophobicContact CG2-CB 3.63Å; N970-A973 HydrophobicContact CB-CB 4.3Å; N970-A973 VanDerWaalsContact CG-N 3.25Å; N970-A973 WeakPolarHBondContact ND2-CA 3.45Å; N970-A973 PolarHBondContact ND2-N 2.87Å; N970-A973 WeakPolarHBondContact O-CB 3.4Å; N970-A973 PolarHBondContact O-N 2.91Å; N970-A973 VanDerWaalsContact O-N 3.12Å; N970-A973 PolarHBondContact OD1-N 3.24Å; A973-T980 WeakPolarHBondContact O-CA 3.49Å; A973-T980 WeakPolarHBondContact O-CB 3.43Å; A973-P981 VanDerWaalsContact O-CD 3.31Å; A973-P981 WeakPolarHBondContact O-CD 3.45Å
974	A	97.1	Very high	96.8	Very high	57 Å²	57	25.7 Å²	25.7	47%	0.471	15%	0.151	S	C	.	.			trans	-123	138.6	177.3	0	0	0	0	0	109.3	W979 T980	A974-W979 CarbonylContact C-O 3.56Å; A974-W979 VanDerWaalsContact CA-O 3.24Å; A974-W979 WeakPolarHBondContact CA-O 3.43Å; A974-T980 HydrophobicContact CB-CG2 4.32Å
975	D	96.8	Very high	96.9	Very high	32 Å²	32	25.6 Å²	25.6	17%	0.171	15%	0.151	C	C	.	.			trans	-82.8	-172.2	177.1	81.1	-2.9	0	0	0	113	D977 G978 W979	D975-D977 PolarHBondContact O-N 3.05Å; D975-D977 WeakPolarHBondContact OD1-CA 3.41Å; D975-D977 PolarHBondContact OD1-N 3.43Å; D975-G978 PolarHBondContact O-N 3.47Å; D975-G978 PolarHBondContact OD1-N 2.81Å; D975-W979 PolarHBondContact N-O 2.95Å; D975-W979 PolarHBondContact OD1-N 3.18Å
976	S	95.7	Very high	97	Very high	82 Å²	82	25.4 Å²	25.4	57%	0.573	15%	0.15	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-24.3	179.7	58.3	0	0	0	0	115.3	E944	E944-S976 WeakPolarHBondContact O-CB 3.49Å; E944-S976 PolarHBondContact O-N 3.41Å; E944-S976 PolarHBondContact O-OG 2.81Å
977	D	95.6	Very high	97.1	Very high	78 Å²	78	23.1 Å²	23.1	42%	0.417	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.5	2.5	176.2	-84	-62.2	0	0	0	112.2	D975 I1009	D975-D977 PolarHBondContact O-N 3.05Å; D975-D977 WeakPolarHBondContact OD1-CA 3.41Å; D975-D977 PolarHBondContact OD1-N 3.43Å; D977-I1009 PolarHBondContact O-N 2.94Å
978	G	96.7	Very high	97.2	Very high	5 Å²	5	25.3 Å²	25.3	5%	0.052	16%	0.157	C	C	.	.			trans	83.8	9	-179.2	0	0	0	0	0	114.6	D975	D975-G978 PolarHBondContact O-N 3.47Å; D975-G978 PolarHBondContact OD1-N 2.81Å
979	W	98.3	Very high	97.5	Very high	64 Å²	64	25.2 Å²	25.2	24%	0.242	16%	0.155	C	C	.	.			trans	-66.3	138.3	174	-71.3	64.6	0	0	0	109.5	H950 A974 D975 H983 T1008 K1018	H950-W979 PolarHBondContact NE2-O 2.9Å; A974-W979 CarbonylContact C-O 3.56Å; A974-W979 VanDerWaalsContact CA-O 3.24Å; A974-W979 WeakPolarHBondContact CA-O 3.43Å; D975-W979 PolarHBondContact N-O 2.95Å; D975-W979 PolarHBondContact OD1-N 3.18Å; W979-H983 HydrophobicContact CB-CB 4.34Å; W979-H983 HydrophobicContact CD2-CB 4.11Å; W979-H983 HydrophobicContact CE3-CB 3.55Å; W979-H983 HydrophobicContact CG-CB 4.48Å; W979-H983 HydrophobicContact CZ3-CB 4.17Å; W979-T1008 HydrophobicContact CD2-CG2 4.29Å; W979-T1008 HydrophobicContact CG-CG2 3.92Å; W979-K1018 HydrophobicContact CH2-CB 4.37Å; W979-K1018 HydrophobicContact CH2-CD 3.95Å; W979-K1018 HydrophobicContact CH2-CG 4.11Å; W979-K1018 HydrophobicContact CZ2-CD 4Å; W979-K1018 HydrophobicContact CZ2-CG 4.48Å; W979-K1018 HydrophobicContact CZ3-CB 4.45Å; W979-K1018 HydrophobicContact CZ3-CG 4.32Å
980	T	98.4	Very high	97.5	Very high	5 Å²	5	25.7 Å²	25.7	3%	0.031	16%	0.159	C	C	.	.			trans	-111.1	166.6	171.6	73.4	0	0	0	0	109.8	A973 A974 L982 H983 C984 A1006	A973-T980 WeakPolarHBondContact O-CA 3.49Å; A973-T980 WeakPolarHBondContact O-CB 3.43Å; A974-T980 HydrophobicContact CB-CG2 4.32Å; T980-L982 PolarHBondContact O-N 3.29Å; T980-L982 PolarHBondContact OG1-N 3.48Å; T980-H983 PolarHBondContact N-ND1 2.74Å; T980-H983 WeakPolarHBondContact O-CA 3.4Å; T980-H983 WeakPolarHBondContact O-CB 3.13Å; T980-H983 PolarHBondContact O-N 3.47Å; T980-H983 PolarHBondContact OG1-ND1 3.28Å; T980-C984 PolarHBondContact O-N 3.44Å; T980-C984 VanDerWaalsContact O-N 3.11Å; T980-C984 PolarHBondContact O-SG 3.37Å; T980-A1006 HydrophobicContact CG2-CB 4.23Å
981	P	98.6	Very high	97.6	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-53.5	-25.7	174.2	-28.6	36.9	0	0	0	114	L949 H950 V953 V971 A973 A985 L997	L949-P981 HydrophobicContact CB-CG 4.4Å; L949-P981 HydrophobicContact CD2-CB 4.08Å; L949-P981 HydrophobicContact CD2-CG 3.77Å; L949-P981 HydrophobicContact CG-CB 3.99Å; L949-P981 HydrophobicContact CG-CG 3.83Å; H950-P981 WeakPolarHBondContact NE2-CD 3.4Å; V953-P981 HydrophobicContact CG2-CB 4.27Å; V971-P981 WeakPolarHBondContact O-CD 3.33Å; A973-P981 VanDerWaalsContact O-CD 3.31Å; A973-P981 WeakPolarHBondContact O-CD 3.45Å; P981-A985 WeakPolarHBondContact O-CB 3.33Å; P981-A985 PolarHBondContact O-N 3.31Å; P981-L997 HydrophobicContact CB-CD1 4.35Å; P981-L997 HydrophobicContact CB-CD2 4.1Å; P981-L997 WeakPolarHBondContact O-CD1 3.37Å
982	L	98.7	Very high	97.6	Very high	1 Å²	1	29.8 Å²	29.8	1%	0.005	18%	0.177	C	C	.	.	H	α-helix	trans	-71.2	-37.9	174	-168.9	66.3	0	0	0	112.6	T980 A985 A986 C994 L997 V998 A1002 A1015 L1033	T980-L982 PolarHBondContact O-N 3.29Å; T980-L982 PolarHBondContact OG1-N 3.48Å; L982-A985 PolarHBondContact O-N 2.94Å; L982-A986 WeakPolarHBondContact O-CB 3.4Å; L982-A986 PolarHBondContact O-N 3.44Å; L982-C994 HydrophobicContact CD1-CB 4.22Å; L982-L997 HydrophobicContact CD1-CB 3.96Å; L982-L997 HydrophobicContact CD1-CD1 4.31Å; L982-V998 HydrophobicContact CD1-CG2 3.98Å; L982-V998 HydrophobicContact CD2-CG2 4.38Å; L982-A1002 HydrophobicContact CB-CB 4.27Å; L982-A1002 HydrophobicContact CD1-CB 4.35Å; L982-A1002 HydrophobicContact CD2-CB 4.01Å; L982-A1002 HydrophobicContact CG-CB 4.44Å; L982-A1015 HydrophobicContact CB-CB 4.16Å; L982-A1015 HydrophobicContact CD2-CB 3.91Å; L982-A1015 HydrophobicContact CG-CB 3.67Å; L982-L1033 HydrophobicContact CD1-CD2 4.16Å; L982-L1033 HydrophobicContact CD2-CD2 4.48Å; L982-L1033 HydrophobicContact CG-CD2 4.47Å
983	H	98.6	Very high	97.6	Very high	1 Å²	1	29.4 Å²	29.4	1%	0.005	18%	0.176	C	C	.	.	H	α-helix	trans	-64.7	-44.5	173.4	-63.1	80.4	0	0	0	110.5	W979 T980 A985 A986 S987 A1006 E1013 A1015 K1018	W979-H983 HydrophobicContact CB-CB 4.34Å; W979-H983 HydrophobicContact CD2-CB 4.11Å; W979-H983 HydrophobicContact CE3-CB 3.55Å; W979-H983 HydrophobicContact CG-CB 4.48Å; W979-H983 HydrophobicContact CZ3-CB 4.17Å; T980-H983 PolarHBondContact N-ND1 2.74Å; T980-H983 WeakPolarHBondContact O-CA 3.4Å; T980-H983 WeakPolarHBondContact O-CB 3.13Å; T980-H983 PolarHBondContact O-N 3.47Å; T980-H983 PolarHBondContact OG1-ND1 3.28Å; H983-A985 PolarHBondContact O-N 3.28Å; H983-A986 WeakPolarHBondContact O-CB 3.46Å; H983-A986 PolarHBondContact O-N 3.42Å; H983-S987 PolarHBondContact O-N 3.22Å; H983-S987 PolarHBondContact O-OG 3.39Å; H983-A1006 PolarHBondContact CE1-O 3.37Å; H983-A1006 PolarHBondContact NE2-O 3.43Å; H983-E1013 PolarHBondContact NE2-O 3.45Å; H983-A1015 PolarHBondContact CD2-N 3.29Å; H983-A1015 VanDerWaalsContact CD2-N 3.34Å; H983-A1015 PolarHBondContact NE2-N 2.85Å; H983-K1018 HydrophobicContact CB-CG 4.43Å
984	C	98.2	Very high	97.6	Very high	8 Å²	8	29 Å²	29	5%	0.054	17%	0.172	C	C	.	.	H	α-helix	trans	-59.5	-44.6	175.4	-58.1	0	0	0	0	112.5	V953 T980 A986 S987 C988	V953-C984 HydrophobicContact CB-CB 4.47Å; V953-C984 HydrophobicContact CG1-CB 3.76Å; T980-C984 PolarHBondContact O-N 3.44Å; T980-C984 VanDerWaalsContact O-N 3.11Å; T980-C984 PolarHBondContact O-SG 3.37Å; C984-A986 VanDerWaalsContact C-N 3.27Å; C984-A986 PolarHBondContact O-N 3.46Å; C984-S987 PolarHBondContact O-N 2.73Å; C984-S987 PolarHBondContact O-OG 2.65Å; C984-C988 PolarHBondContact O-N 3.41Å; C984-C988 PolarHBondContact O-SG 3.08Å; C984-C988 VanDerWaalsContact O-SG 3.4Å
985	A	98.4	Very high	97.6	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-62.9	-36	177.3	0	0	0	0	0	112	V953 P981 L982 H983 N989 S990 L993 C994 L997	V953-A985 HydrophobicContact CG1-CB 3.7Å; V953-A985 VanDerWaalsContact CG1-N 3.34Å; P981-A985 WeakPolarHBondContact O-CB 3.33Å; P981-A985 PolarHBondContact O-N 3.31Å; L982-A985 PolarHBondContact O-N 2.94Å; H983-A985 PolarHBondContact O-N 3.28Å; A985-N989 PolarHBondContact O-N 2.88Å; A985-S990 PolarHBondContact O-N 3.41Å; A985-L993 HydrophobicContact CB-CB 3.85Å; A985-C994 VanDerWaalsContact CB-SG 3.6Å; A985-L997 HydrophobicContact CB-CD1 3.67Å
986	A	98.4	Very high	97.7	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-73	-40	179.4	0	0	0	0	0	113.4	L982 H983 C984 C988 N989 A1015 L1033	L982-A986 WeakPolarHBondContact O-CB 3.4Å; L982-A986 PolarHBondContact O-N 3.44Å; H983-A986 WeakPolarHBondContact O-CB 3.46Å; H983-A986 PolarHBondContact O-N 3.42Å; C984-A986 VanDerWaalsContact C-N 3.27Å; C984-A986 PolarHBondContact O-N 3.46Å; A986-C988 PolarHBondContact O-N 3Å; A986-N989 WeakPolarHBondContact O-CA 3.19Å; A986-N989 PolarHBondContact O-N 3.49Å; A986-N989 PolarHBondContact O-OD1 3.19Å; A986-A1015 HydrophobicContact CB-CB 4.39Å; A986-A1015 WeakPolarHBondContact CB-O 3.38Å; A986-L1033 HydrophobicContact CB-CD1 3.59Å
987	S	97.9	Very high	97.8	Very high	34 Å²	34	26.3 Å²	26.3	24%	0.238	14%	0.139	C	C	.	.	H	α-helix	trans	-65.4	-25	173.7	56.6	0	0	0	0	113.2	H983 C984 N989 K1018	H983-S987 PolarHBondContact O-N 3.22Å; H983-S987 PolarHBondContact O-OG 3.39Å; C984-S987 PolarHBondContact O-N 2.73Å; C984-S987 PolarHBondContact O-OG 2.65Å; S987-N989 VanDerWaalsContact C-N 3.27Å; S987-K1018 WeakPolarHBondContact CA-O 3.49Å; S987-K1018 PolarHBondContact N-O 2.92Å
988	C	96.3	Very high	97.9	Very high	67 Å²	67	22.7 Å²	22.7	45%	0.453	12%	0.12	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.8	9.8	169.1	-59.9	0	0	0	0	113.2	C984 A986 S990	C984-C988 PolarHBondContact O-N 3.41Å; C984-C988 PolarHBondContact O-SG 3.08Å; C984-C988 VanDerWaalsContact O-SG 3.4Å; A986-C988 PolarHBondContact O-N 3Å; C988-S990 PolarHBondContact O-N 3.36Å
989	N	97.8	Very high	97.9	Very high	7 Å²	7	28.6 Å²	28.6	4%	0.037	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	47.9	24.3	-173.4	-74.4	-25.4	0	0	0	114.6	A985 A986 S987 V991 E1020 E1023 E1024 Y1026 C1029	A985-N989 PolarHBondContact O-N 2.88Å; A986-N989 WeakPolarHBondContact O-CA 3.19Å; A986-N989 PolarHBondContact O-N 3.49Å; A986-N989 PolarHBondContact O-OD1 3.19Å; S987-N989 VanDerWaalsContact C-N 3.27Å; N989-V991 VanDerWaalsContact C-N 3.35Å; N989-V991 PolarHBondContact O-N 3.05Å; N989-E1020 PolarHBondContact ND2-O 2.9Å; N989-E1020 PolarHBondContact OD1-N 2.97Å; N989-E1020 VanDerWaalsContact OD1-N 3.13Å; N989-E1023 WeakPolarHBondContact ND2-CB 3.49Å; N989-E1023 PolarHBondContact ND2-O 3.35Å; N989-E1024 WeakPolarHBondContact CB-O 3.46Å; N989-E1024 PolarHBondContact ND2-O 3.34Å; N989-Y1026 WeakPolarHBondContact ND2-CA 3.49Å; N989-Y1026 PolarHBondContact ND2-N 3.28Å; N989-C1029 VanDerWaalsContact C-SG 3.58Å; N989-C1029 HydrophobicContact CB-CB 4.3Å; N989-C1029 WeakPolarHBondContact O-CB 3.49Å
990	S	97.2	Very high	97.9	Very high	23 Å²	23	25.9 Å²	25.9	16%	0.161	14%	0.137	C	C	.	.			trans	-86	76.2	-168.3	-171.2	0	0	0	0	111.2	A985 C988 H992 L993 C994	A985-S990 PolarHBondContact O-N 3.41Å; C988-S990 PolarHBondContact O-N 3.36Å; S990-H992 PolarHBondContact O-N 3.2Å; S990-L993 PolarHBondContact O-N 3.19Å; S990-L993 WeakPolarHBondContact OG-CG 3.46Å; S990-C994 PolarHBondContact O-N 2.88Å; S990-C994 PolarHBondContact O-SG 3.17Å; S990-C994 VanDerWaalsContact O-SG 3.36Å
991	V	97.4	Very high	97.8	Very high	24 Å²	24	25.7 Å²	25.7	15%	0.145	14%	0.136	C	C	.	.	H	α-helix	trans	-51.6	-26.9	178.7	68.1	0	0	0	0	113.4	N989 K995 Q1028 C1029 F1032	N989-V991 VanDerWaalsContact C-N 3.35Å; N989-V991 PolarHBondContact O-N 3.05Å; V991-K995 HydrophobicContact CG2-CD 4.33Å; V991-K995 WeakPolarHBondContact O-CB 3.39Å; V991-K995 WeakPolarHBondContact O-CD 3.43Å; V991-K995 VanDerWaalsContact O-CG 3.26Å; V991-K995 WeakPolarHBondContact O-CG 3.32Å; V991-K995 PolarHBondContact O-N 3.11Å; V991-Q1028 HydrophobicContact CG1-CB 4.35Å; V991-Q1028 VanDerWaalsContact CG2-O 3.3Å; V991-Q1028 WeakPolarHBondContact CG2-O 3.35Å; V991-C1029 HydrophobicContact CB-CB 4.27Å; V991-F1032 HydrophobicContact CG2-CB 3.83Å; V991-F1032 HydrophobicContact CG2-CD1 4.24Å; V991-F1032 HydrophobicContact CG2-CG 4.08Å
992	H	97.4	Very high	97.8	Very high	121 Å²	121	25.7 Å²	25.7	56%	0.56	14%	0.136	S	C	*	.	H	α-helix	trans	-74.4	-42.7	175.9	-170.3	22.7	0	0	0	112.8	H958 S990 L996	H958-H992 AromaticContact CD2-CD2 3.55Å; H958-H992 AromaticContact NE2-CD2 3.81Å; S990-H992 PolarHBondContact O-N 3.2Å; H992-L996 PolarHBondContact O-N 2.88Å; H992-L996 VanDerWaalsContact O-N 3.09Å
993	L	97.9	Very high	97.7	Very high	1 Å²	1	25.7 Å²	25.7	1%	0.005	14%	0.136	C	C	.	.	H	α-helix	trans	-68	-41.5	172.8	-66.5	177.9	0	0	0	111	V953 H958 V961 A985 S990 K995 L996 L997	V953-L993 HydrophobicContact CG1-CD1 4.23Å; H958-L993 HydrophobicContact CB-CD2 4.26Å; H958-L993 VanDerWaalsContact CD2-CD2 3.43Å; H958-L993 WeakPolarHBondContact CD2-CD2 3.41Å; V961-L993 HydrophobicContact CB-CD2 4.2Å; V961-L993 HydrophobicContact CG1-CD2 4.09Å; V961-L993 HydrophobicContact CG2-CD2 4.18Å; A985-L993 HydrophobicContact CB-CB 3.85Å; S990-L993 PolarHBondContact O-N 3.19Å; S990-L993 WeakPolarHBondContact OG-CG 3.46Å; L993-K995 VanDerWaalsContact C-N 3.34Å; L993-K995 PolarHBondContact O-N 3.22Å; L993-L996 PolarHBondContact O-N 3.47Å; L993-L997 WeakPolarHBondContact O-CB 3.37Å; L993-L997 WeakPolarHBondContact O-CD1 3.46Å; L993-L997 VanDerWaalsContact O-CG 3.24Å; L993-L997 WeakPolarHBondContact O-CG 3.46Å; L993-L997 PolarHBondContact O-N 3.32Å
994	C	98.3	Very high	97.6	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-56	-47.1	174.2	-64.4	0	0	0	0	111.6	L982 A985 S990 L997 V998 F1032 L1033	L982-C994 HydrophobicContact CD1-CB 4.22Å; A985-C994 VanDerWaalsContact CB-SG 3.6Å; S990-C994 PolarHBondContact O-N 2.88Å; S990-C994 PolarHBondContact O-SG 3.17Å; S990-C994 VanDerWaalsContact O-SG 3.36Å; C994-L997 PolarHBondContact O-N 3.35Å; C994-V998 WeakPolarHBondContact O-CB 3.48Å; C994-V998 WeakPolarHBondContact O-CG2 3.27Å; C994-V998 PolarHBondContact O-N 3.16Å; C994-F1032 HydrophobicContact CB-CD1 4.06Å; C994-F1032 HydrophobicContact CB-CE1 3.96Å; C994-L1033 HydrophobicContact CB-CD2 4.09Å
995	K	97.9	Very high	97.5	Very high	81 Å²	81	26.2 Å²	26.2	35%	0.352	14%	0.138	S	C	.	.	H	α-helix	trans	-58.9	-50.6	174.9	-78.7	166.4	-177.8	168.9	0	112.3	V991 L993 L997 V998 E999 F1032	V991-K995 HydrophobicContact CG2-CD 4.33Å; V991-K995 WeakPolarHBondContact O-CB 3.39Å; V991-K995 WeakPolarHBondContact O-CD 3.43Å; V991-K995 VanDerWaalsContact O-CG 3.26Å; V991-K995 WeakPolarHBondContact O-CG 3.32Å; V991-K995 PolarHBondContact O-N 3.11Å; L993-K995 VanDerWaalsContact C-N 3.34Å; L993-K995 PolarHBondContact O-N 3.22Å; K995-L997 VanDerWaalsContact C-N 3.3Å; K995-L997 PolarHBondContact O-N 2.94Å; K995-V998 PolarHBondContact O-N 2.92Å; K995-E999 WeakPolarHBondContact O-CB 3.48Å; K995-E999 VanDerWaalsContact O-CG 3.28Å; K995-E999 WeakPolarHBondContact O-CG 3.46Å; K995-E999 PolarHBondContact O-N 3.48Å; K995-F1032 HydrophobicContact CB-CE1 4.43Å; K995-F1032 HydrophobicContact CB-CZ 4.2Å; K995-F1032 HydrophobicContact CD-CE2 4.33Å; K995-F1032 HydrophobicContact CD-CZ 4.5Å; K995-F1032 HydrophobicContact CG-CD1 4.14Å; K995-F1032 HydrophobicContact CG-CD2 4.09Å; K995-F1032 HydrophobicContact CG-CE1 3.64Å; K995-F1032 HydrophobicContact CG-CE2 3.57Å; K995-F1032 HydrophobicContact CG-CG 4.36Å; K995-F1032 HydrophobicContact CG-CZ 3.33Å
996	L	98	Very high	97.5	Very high	32 Å²	32	27 Å²	27	17%	0.168	14%	0.144	C	C	.	.	H	α-helix	trans	-58.6	-40.5	179.6	177.6	62.3	0	0	0	112.5	V961 K962 L965 H992 L993 S1000	V961-L996 HydrophobicContact CG1-CD2 4.09Å; K962-L996 HydrophobicContact CB-CD2 4.03Å; K962-L996 HydrophobicContact CG-CD1 4.35Å; K962-L996 HydrophobicContact CG-CD2 4.4Å; L965-L996 HydrophobicContact CD1-CD2 4.12Å; L965-L996 HydrophobicContact CD1-CG 3.84Å; H992-L996 PolarHBondContact O-N 2.88Å; H992-L996 VanDerWaalsContact O-N 3.09Å; L993-L996 PolarHBondContact O-N 3.47Å; L996-S1000 VanDerWaalsContact O-CB 3.32Å; L996-S1000 WeakPolarHBondContact O-CB 3.37Å; L996-S1000 PolarHBondContact O-N 3.35Å; L996-S1000 VanDerWaalsContact O-N 3.09Å; L996-S1000 PolarHBondContact O-OG 3.42Å
997	L	98.3	Very high	97.4	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-69.1	-46	177.6	-69.9	164.7	0	0	0	111.5	L949 V953 L965 V971 P981 L982 A985 L993 C994 K995 E999 S1000 G1001 A1002	L949-L997 HydrophobicContact CD2-CD2 4.49Å; V953-L997 HydrophobicContact CG2-CD1 4.28Å; L965-L997 HydrophobicContact CD1-CD2 3.92Å; L965-L997 HydrophobicContact CD2-CD2 4.13Å; V971-L997 HydrophobicContact CG2-CB 4.49Å; V971-L997 HydrophobicContact CG2-CD2 3.75Å; P981-L997 HydrophobicContact CB-CD1 4.35Å; P981-L997 HydrophobicContact CB-CD2 4.1Å; P981-L997 WeakPolarHBondContact O-CD1 3.37Å; L982-L997 HydrophobicContact CD1-CB 3.96Å; L982-L997 HydrophobicContact CD1-CD1 4.31Å; A985-L997 HydrophobicContact CB-CD1 3.67Å; L993-L997 WeakPolarHBondContact O-CB 3.37Å; L993-L997 WeakPolarHBondContact O-CD1 3.46Å; L993-L997 VanDerWaalsContact O-CG 3.24Å; L993-L997 WeakPolarHBondContact O-CG 3.46Å; L993-L997 PolarHBondContact O-N 3.32Å; C994-L997 PolarHBondContact O-N 3.35Å; K995-L997 VanDerWaalsContact C-N 3.3Å; K995-L997 PolarHBondContact O-N 2.94Å; L997-E999 PolarHBondContact O-N 3.02Å; L997-S1000 CarbonylContact O-C 3.49Å; L997-S1000 WeakPolarHBondContact O-CA 3.03Å; L997-S1000 PolarHBondContact O-N 2.99Å; L997-G1001 PolarHBondContact O-N 3.34Å; L997-A1002 VanDerWaalsContact C-CB 3.49Å; L997-A1002 HydrophobicContact CB-CB 4.05Å; L997-A1002 VanDerWaalsContact O-CB 3.22Å; L997-A1002 WeakPolarHBondContact O-CB 3.23Å; L997-A1002 PolarHBondContact O-N 2.78Å
998	V	97.9	Very high	97.3	Very high	3 Å²	3	27.9 Å²	27.9	2%	0.018	15%	0.15	C	C	.	.	H	α-helix	trans	-59.4	-45	175.5	169.4	0	0	0	0	111.3	L982 C994 K995 S1000 G1001 I1004 F1032 V1036 L1102	L982-V998 HydrophobicContact CD1-CG2 3.98Å; L982-V998 HydrophobicContact CD2-CG2 4.38Å; C994-V998 WeakPolarHBondContact O-CB 3.48Å; C994-V998 WeakPolarHBondContact O-CG2 3.27Å; C994-V998 PolarHBondContact O-N 3.16Å; K995-V998 PolarHBondContact O-N 2.92Å; V998-S1000 PolarHBondContact O-N 2.85Å; V998-G1001 PolarHBondContact O-N 3.01Å; V998-I1004 HydrophobicContact CB-CD1 4.37Å; V998-I1004 HydrophobicContact CG1-CD1 3.98Å; V998-I1004 HydrophobicContact CG2-CD1 3.75Å; V998-F1032 HydrophobicContact CB-CZ 4.37Å; V998-F1032 HydrophobicContact CG1-CZ 4.45Å; V998-F1032 HydrophobicContact CG2-CE1 4.16Å; V998-F1032 HydrophobicContact CG2-CZ 4.31Å; V998-V1036 HydrophobicContact CG1-CG1 4.35Å; V998-L1102 HydrophobicContact CG1-CB 4.13Å; V998-L1102 HydrophobicContact CG1-CD2 4Å
999	E	96.6	Very high	97.2	Very high	128 Å²	128	30.6 Å²	30.6	60%	0.598	16%	0.159	S	C	*	.	H	α-helix	trans	-64.9	-23.5	175.6	-72.2	169	-164	0	0	112.9	K995 L997 C1103	K995-E999 WeakPolarHBondContact O-CB 3.48Å; K995-E999 VanDerWaalsContact O-CG 3.28Å; K995-E999 WeakPolarHBondContact O-CG 3.46Å; K995-E999 PolarHBondContact O-N 3.48Å; L997-E999 PolarHBondContact O-N 3.02Å; E999-C1103 VanDerWaalsContact O-CB 3.27Å; E999-C1103 WeakPolarHBondContact O-CB 3.41Å
1000	S	97	Very high	96.9	Very high	8 Å²	8	33.8 Å²	33.8	6%	0.056	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93	5.7	177.1	-55.5	0	0	0	0	114.3	L996 L997 V998	L996-S1000 VanDerWaalsContact O-CB 3.32Å; L996-S1000 WeakPolarHBondContact O-CB 3.37Å; L996-S1000 PolarHBondContact O-N 3.35Å; L996-S1000 VanDerWaalsContact O-N 3.09Å; L996-S1000 PolarHBondContact O-OG 3.42Å; L997-S1000 CarbonylContact O-C 3.49Å; L997-S1000 WeakPolarHBondContact O-CA 3.03Å; L997-S1000 PolarHBondContact O-N 2.99Å; V998-S1000 PolarHBondContact O-N 2.85Å
1001	G	96.6	Very high	96.7	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	92.7	32.9	178.5	0	0	0	0	0	115.4	V971 N972 L997 V998 L1051 C1103	V971-G1001 WeakPolarHBondContact CG1-O 3.48Å; N972-G1001 PolarHBondContact ND2-O 3.33Å; L997-G1001 PolarHBondContact O-N 3.34Å; V998-G1001 PolarHBondContact O-N 3.01Å; G1001-L1051 WeakPolarHBondContact O-CD1 3.48Å; G1001-L1051 VanDerWaalsContact O-CD2 3.3Å; G1001-L1051 WeakPolarHBondContact O-CD2 3.46Å; G1001-C1103 WeakPolarHBondContact CA-O 3.48Å
1002	A	97.9	Very high	96.6	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	22%	0.217	C	C	.	.			trans	-67	142.9	170.6	0	0	0	0	0	112.6	V971 N972 L982 L997 I1004	V971-A1002 HydrophobicContact CG2-CB 4.07Å; N972-A1002 VanDerWaalsContact OD1-CA 3.26Å; N972-A1002 WeakPolarHBondContact OD1-CA 3.39Å; L982-A1002 HydrophobicContact CB-CB 4.27Å; L982-A1002 HydrophobicContact CD1-CB 4.35Å; L982-A1002 HydrophobicContact CD2-CB 4.01Å; L982-A1002 HydrophobicContact CG-CB 4.44Å; L997-A1002 VanDerWaalsContact C-CB 3.49Å; L997-A1002 HydrophobicContact CB-CB 4.05Å; L997-A1002 VanDerWaalsContact O-CB 3.22Å; L997-A1002 WeakPolarHBondContact O-CB 3.23Å; L997-A1002 PolarHBondContact O-N 2.78Å; A1002-I1004 VanDerWaalsContact O-CD1 3.29Å; A1002-I1004 WeakPolarHBondContact O-CD1 3.48Å; A1002-I1004 PolarHBondContact O-N 2.93Å
1003	A	97.6	Very high	96.6	Very high	1 Å²	1	38.1 Å²	38.1	1%	0.008	21%	0.208	C	C	.	.			trans	-81.1	111.8	178.7	0	0	0	0	0	110.9	N972 F1005 A1006 L1051 W1052	N972-A1003 PolarHBondContact OD1-N 3.38Å; A1003-F1005 PolarHBondContact O-N 2.92Å; A1003-A1006 HydrophobicContact CB-CB 3.9Å; A1003-A1006 PolarHBondContact O-N 2.83Å; A1003-L1051 VanDerWaalsContact CA-CD1 3.49Å; A1003-L1051 HydrophobicContact CB-CD1 3.68Å; A1003-W1052 HydrophobicContact CB-CH2 3.69Å; A1003-W1052 HydrophobicContact CB-CZ3 3.73Å
1004	I	97.1	Very high	96.6	Very high	2 Å²	2	38.9 Å²	38.9	1%	0.01	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.6	-29.3	-169.4	-38.1	-59.6	0	0	0	112.5	V998 A1002 V1036 Q1037 L1040	V998-I1004 HydrophobicContact CB-CD1 4.37Å; V998-I1004 HydrophobicContact CG1-CD1 3.98Å; V998-I1004 HydrophobicContact CG2-CD1 3.75Å; A1002-I1004 VanDerWaalsContact O-CD1 3.29Å; A1002-I1004 WeakPolarHBondContact O-CD1 3.48Å; A1002-I1004 PolarHBondContact O-N 2.93Å; I1004-V1036 HydrophobicContact CD1-CG1 3.99Å; I1004-V1036 HydrophobicContact CG1-CG1 4.07Å; I1004-V1036 HydrophobicContact CG2-CB 4.47Å; I1004-V1036 HydrophobicContact CG2-CG1 3.91Å; I1004-Q1037 HydrophobicContact CG2-CB 4.48Å; I1004-Q1037 HydrophobicContact CG2-CG 3.47Å; I1004-Q1037 VanDerWaalsContact CG2-CG 3.47Å; I1004-Q1037 PolarHBondContact O-NE2 2.8Å; I1004-L1040 HydrophobicContact CB-CD2 4.3Å; I1004-L1040 HydrophobicContact CG1-CD2 3.97Å
1005	F	96.4	Very high	96.5	Very high	19 Å²	19	39 Å²	39	8%	0.083	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.2	26	176.5	-61.3	-71.8	0	0	0	112.1	A1003 Q1037 L1040 W1084 R1097 N1098	A1003-F1005 PolarHBondContact O-N 2.92Å; F1005-Q1037 HydrophobicContact CD1-CG 4.12Å; F1005-Q1037 HydrophobicContact CE1-CB 3.66Å; F1005-Q1037 HydrophobicContact CE1-CG 3.51Å; F1005-Q1037 HydrophobicContact CZ-CB 3.57Å; F1005-Q1037 HydrophobicContact CZ-CG 3.77Å; F1005-L1040 HydrophobicContact CD2-CD2 4.16Å; F1005-L1040 HydrophobicContact CE2-CD2 3.95Å; F1005-W1084 HydrophobicContact CD2-CH2 4.49Å; F1005-W1084 AromaticContact CE2-CH2 3.7Å; F1005-W1084 HydrophobicContact CE2-CH2 3.7Å; F1005-W1084 AromaticContact CE2-CZ2 3.89Å; F1005-W1084 HydrophobicContact CE2-CZ2 3.89Å; F1005-W1084 HydrophobicContact CZ-CH2 4.46Å; F1005-W1084 HydrophobicContact CZ-CZ2 4.36Å; F1005-R1097 HydrophobicContact CB-CG 4.29Å; F1005-R1097 VanDerWaalsContact CD1-NH1 3.29Å; F1005-R1097 HydrophobicContact CD2-CB 4.27Å; F1005-R1097 HydrophobicContact CD2-CG 4.11Å; F1005-R1097 VanDerWaalsContact CE1-NH1 3.26Å; F1005-R1097 HydrophobicContact CG-CG 4.24Å; F1005-N1098 HydrophobicContact CB-CB 4.31Å; F1005-N1098 VanDerWaalsContact O-CB 3.28Å; F1005-N1098 WeakPolarHBondContact O-CB 3.43Å
1006	A	96.6	Very high	96.5	Very high	17 Å²	17	35.2 Å²	35.2	14%	0.14	20%	0.197	C	C	.	.			trans	-66.2	141.2	157.1	0	0	0	0	0	108.5	T980 H983 A1003	T980-A1006 HydrophobicContact CG2-CB 4.23Å; H983-A1006 PolarHBondContact CE1-O 3.37Å; H983-A1006 PolarHBondContact NE2-O 3.43Å; A1003-A1006 HydrophobicContact CB-CB 3.9Å; A1003-A1006 PolarHBondContact O-N 2.83Å
1007	S	96.3	Very high	96.5	Very high	51 Å²	51	36.8 Å²	36.8	36%	0.357	21%	0.206	S	C	.	.	B	Isolated β-bridge	trans	-132.8	149	-179.1	60.3	0	0	0	0	111.6	E1013	S1007-E1013 CarbonylContact C-O 3.57Å; S1007-E1013 WeakPolarHBondContact CA-O 3.34Å; S1007-E1013 WeakPolarHBondContact CB-O 3.28Å
1008	T	96.6	Very high	96.5	Very high	1 Å²	1	37.7 Å²	37.7	1%	0.006	21%	0.21	C	C	.	.			trans	-64.5	150.2	173.4	40.7	0	0	0	0	112.6	W979 D1011 V1012 E1013	W979-T1008 HydrophobicContact CD2-CG2 4.29Å; W979-T1008 HydrophobicContact CG-CG2 3.92Å; T1008-D1011 WeakPolarHBondContact CB-OD1 3.48Å; T1008-D1011 PolarHBondContact OG1-OD1 3.21Å; T1008-V1012 VanDerWaalsContact O-CA 3.23Å; T1008-V1012 WeakPolarHBondContact O-CA 3.31Å; T1008-V1012 PolarHBondContact O-N 3.09Å; T1008-V1012 VanDerWaalsContact O-N 3.11Å; T1008-E1013 PolarHBondContact N-O 3.05Å; T1008-E1013 PolarHBondContact OG1-N 2.97Å; T1008-E1013 PolarHBondContact OG1-O 3.49Å; T1008-E1013 VanDerWaalsContact OG1-O 3.07Å
1009	I	94.3	Very high	96.5	Very high	124 Å²	124	38 Å²	38	64%	0.636	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.5	-31.3	-174.5	-63	166.5	0	0	0	111.7	D977	D977-I1009 PolarHBondContact O-N 2.94Å
1010	S	90.8	Very high	96.5	Very high	74 Å²	74	36.4 Å²	36.4	52%	0.517	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.9	-35.5	-169.7	47.1	0	0	0	0	114.2
1011	D	93.8	Very high	96.4	Very high	73 Å²	73	43 Å²	43	39%	0.39	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-126.6	-7.9	-177.6	42.1	31.9	0	0	0	114.7	T1008 E1013 K1018	T1008-D1011 WeakPolarHBondContact CB-OD1 3.48Å; T1008-D1011 PolarHBondContact OG1-OD1 3.21Å; D1011-E1013 HydrophobicContact CB-CG 4.36Å; D1011-E1013 PolarHBondContact O-N 3.33Å; D1011-K1018 IonicContact OD1-NZ 3.52Å; D1011-K1018 PolarHBondContact OD1-NZ 2.61Å; D1011-K1018 IonicContact OD2-NZ 2.69Å; D1011-K1018 PolarHBondContact OD2-NZ 2.89Å
1012	V	95.6	Very high	96.3	Very high	108 Å²	108	51.2 Å²	51.2	66%	0.655	28%	0.275	S	S	*	.			trans	60.6	31.1	179.7	-155	0	0	0	0	112.8	T1008	T1008-V1012 VanDerWaalsContact O-CA 3.23Å; T1008-V1012 WeakPolarHBondContact O-CA 3.31Å; T1008-V1012 PolarHBondContact O-N 3.09Å; T1008-V1012 VanDerWaalsContact O-N 3.11Å
1013	E	96.6	Very high	96.2	Very high	77 Å²	77	57.3 Å²	57.3	36%	0.36	30%	0.304	S	S	.	.			trans	-89.8	144.2	175.8	-79	174.3	-168	0	0	110.4	H983 S1007 T1008 D1011 D1017 K1018	H983-E1013 PolarHBondContact NE2-O 3.45Å; S1007-E1013 CarbonylContact C-O 3.57Å; S1007-E1013 WeakPolarHBondContact CA-O 3.34Å; S1007-E1013 WeakPolarHBondContact CB-O 3.28Å; T1008-E1013 PolarHBondContact N-O 3.05Å; T1008-E1013 PolarHBondContact OG1-N 2.97Å; T1008-E1013 PolarHBondContact OG1-O 3.49Å; T1008-E1013 VanDerWaalsContact OG1-O 3.07Å; D1011-E1013 HydrophobicContact CB-CG 4.36Å; D1011-E1013 PolarHBondContact O-N 3.33Å; E1013-D1017 HydrophobicContact CB-CB 3.94Å; E1013-D1017 HydrophobicContact CG-CB 4.04Å; E1013-K1018 HydrophobicContact CB-CD 4.3Å; E1013-K1018 WeakPolarHBondContact OE2-CE 3.45Å; E1013-K1018 IonicContact OE2-NZ 3.3Å; E1013-K1018 PolarHBondContact OE2-NZ 3.5Å
1014	T	97.5	Very high	96	Very high	17 Å²	17	65.9 Å²	65.9	10%	0.104	34%	0.343	C	S	.	.	B	Isolated β-bridge	trans	-89.1	171.9	175.2	72.6	0	0	0	0	110.9	A1016 D1017 K1018 Q1037	T1014-A1016 PolarHBondContact O-N 2.9Å; T1014-A1016 VanDerWaalsContact O-N 3.11Å; T1014-A1016 PolarHBondContact OG1-N 3.04Å; T1014-D1017 WeakPolarHBondContact CA-OD2 3.37Å; T1014-D1017 WeakPolarHBondContact CB-OD2 3.32Å; T1014-D1017 PolarHBondContact N-OD2 3.2Å; T1014-D1017 PolarHBondContact O-N 3.15Å; T1014-D1017 PolarHBondContact OG1-OD2 2.89Å; T1014-K1018 PolarHBondContact O-N 3.23Å; T1014-Q1037 PolarHBondContact OG1-NE2 3.23Å
1015	A	97.8	Very high	95.9	Very high	2 Å²	2	67.6 Å²	67.6	2%	0.017	36%	0.362	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-26.5	173.1	0	0	0	0	0	113.7	L982 H983 A986 L1033	L982-A1015 HydrophobicContact CB-CB 4.16Å; L982-A1015 HydrophobicContact CD2-CB 3.91Å; L982-A1015 HydrophobicContact CG-CB 3.67Å; H983-A1015 PolarHBondContact CD2-N 3.29Å; H983-A1015 VanDerWaalsContact CD2-N 3.34Å; H983-A1015 PolarHBondContact NE2-N 2.85Å; A986-A1015 HydrophobicContact CB-CB 4.39Å; A986-A1015 WeakPolarHBondContact CB-O 3.38Å; A1015-L1033 WeakPolarHBondContact O-CD1 3.41Å
1016	A	97.8	Very high	95.9	Very high	2 Å²	2	69.4 Å²	69.4	2%	0.017	37%	0.368	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-35.3	176.3	0	0	0	0	0	112.5	T1014 L1033 Y1034	T1014-A1016 PolarHBondContact O-N 2.9Å; T1014-A1016 VanDerWaalsContact O-N 3.11Å; T1014-A1016 PolarHBondContact OG1-N 3.04Å; A1016-L1033 HydrophobicContact CB-CB 3.69Å; A1016-Y1034 HydrophobicContact CB-CD1 3.59Å; A1016-Y1034 HydrophobicContact CB-CD2 4.28Å; A1016-Y1034 HydrophobicContact CB-CE1 3.49Å; A1016-Y1034 VanDerWaalsContact CB-CE1 3.49Å; A1016-Y1034 HydrophobicContact CB-CE2 4.2Å; A1016-Y1034 HydrophobicContact CB-CG 3.99Å
1017	D	97.8	Very high	96	Very high	65 Å²	65	73.7 Å²	73.7	35%	0.348	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-24.9	-178.4	-48.8	-67.6	0	0	0	111.7	E1013 T1014 C1019 Y1034	E1013-D1017 HydrophobicContact CB-CB 3.94Å; E1013-D1017 HydrophobicContact CG-CB 4.04Å; T1014-D1017 WeakPolarHBondContact CA-OD2 3.37Å; T1014-D1017 WeakPolarHBondContact CB-OD2 3.32Å; T1014-D1017 PolarHBondContact N-OD2 3.2Å; T1014-D1017 PolarHBondContact O-N 3.15Å; T1014-D1017 PolarHBondContact OG1-OD2 2.89Å; D1017-C1019 PolarHBondContact O-N 2.89Å; D1017-Y1034 PolarHBondContact OD1-OH 3.29Å
1018	K	97.8	Very high	96	Very high	19 Å²	19	77.6 Å²	77.6	8%	0.083	40%	0.4	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.8	7.4	175.1	-58.9	-52.7	-174	-170.1	0	114.8	W979 H983 S987 D1011 E1013 T1014	W979-K1018 HydrophobicContact CH2-CB 4.37Å; W979-K1018 HydrophobicContact CH2-CD 3.95Å; W979-K1018 HydrophobicContact CH2-CG 4.11Å; W979-K1018 HydrophobicContact CZ2-CD 4Å; W979-K1018 HydrophobicContact CZ2-CG 4.48Å; W979-K1018 HydrophobicContact CZ3-CB 4.45Å; W979-K1018 HydrophobicContact CZ3-CG 4.32Å; H983-K1018 HydrophobicContact CB-CG 4.43Å; S987-K1018 WeakPolarHBondContact CA-O 3.49Å; S987-K1018 PolarHBondContact N-O 2.92Å; D1011-K1018 IonicContact OD1-NZ 3.52Å; D1011-K1018 PolarHBondContact OD1-NZ 2.61Å; D1011-K1018 IonicContact OD2-NZ 2.69Å; D1011-K1018 PolarHBondContact OD2-NZ 2.89Å; E1013-K1018 HydrophobicContact CB-CD 4.3Å; E1013-K1018 WeakPolarHBondContact OE2-CE 3.45Å; E1013-K1018 IonicContact OE2-NZ 3.3Å; E1013-K1018 PolarHBondContact OE2-NZ 3.5Å; T1014-K1018 PolarHBondContact O-N 3.23Å
1019	C	97.9	Very high	96.1	Very high	10 Å²	10	77.6 Å²	77.6	7%	0.068	40%	0.4	C	S	.	.			trans	-75.1	125.5	175.4	-78.5	0	0	0	0	111.9	D1017 E1021 Y1026	D1017-C1019 PolarHBondContact O-N 2.89Å; C1019-E1021 PolarHBondContact O-N 3.21Å; C1019-Y1026 HydrophobicContact CB-CD2 3.72Å; C1019-Y1026 HydrophobicContact CB-CE2 3.71Å; C1019-Y1026 WeakPolarHBondContact O-CE2 3.43Å
1020	E	96.8	Very high	96.3	Very high	95 Å²	95	72 Å²	72	44%	0.444	37%	0.372	S	S	.	.			trans	-81.5	108	-173	-79.2	-72.5	177.4	0	0	112.2	N989 M1022 E1023	N989-E1020 PolarHBondContact ND2-O 2.9Å; N989-E1020 PolarHBondContact OD1-N 2.97Å; N989-E1020 VanDerWaalsContact OD1-N 3.13Å; E1020-M1022 PolarHBondContact O-N 2.95Å; E1020-M1022 VanDerWaalsContact O-N 3.12Å; E1020-E1023 HydrophobicContact CB-CB 4.14Å; E1020-E1023 HydrophobicContact CB-CG 4.2Å; E1020-E1023 PolarHBondContact O-N 3.12Å
1021	E	95.7	Very high	96.6	Very high	145 Å²	145	75 Å²	75	68%	0.678	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-27.5	-173.1	-55.8	-160.1	129	0	0	115	C1019 Y1026	C1019-E1021 PolarHBondContact O-N 3.21Å; E1021-Y1026 HydrophobicContact CB-CE1 4.43Å; E1021-Y1026 HydrophobicContact CB-CE2 4.4Å; E1021-Y1026 HydrophobicContact CG-CE1 4.27Å; E1021-Y1026 HydrophobicContact CG-CE2 3.91Å; E1021-Y1026 PolarHBondContact OE1-OH 2.93Å
1022	M	94.6	Very high	96.8	Very high	173 Å²	173	73.5 Å²	73.5	85%	0.852	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.8	-10.7	-175.1	-65	-174.5	-64.6	0	0	113.8	E1020	E1020-M1022 PolarHBondContact O-N 2.95Å; E1020-M1022 VanDerWaalsContact O-N 3.12Å
1023	E	95.1	Very high	97	Very high	129 Å²	129	68.5 Å²	68.5	60%	0.603	34%	0.337	S	S	*	.	S	Bend	trans	-98.2	156.3	-175.9	-73.7	-63.6	160.8	0	0	112.2	N989 E1020	N989-E1023 WeakPolarHBondContact ND2-CB 3.49Å; N989-E1023 PolarHBondContact ND2-O 3.35Å; E1020-E1023 HydrophobicContact CB-CB 4.14Å; E1020-E1023 HydrophobicContact CB-CG 4.2Å; E1020-E1023 PolarHBondContact O-N 3.12Å
1024	E	93.5	Very high	97	Very high	181 Å²	181	68.8 Å²	68.8	85%	0.846	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	148.3	179.2	-68.9	-168.4	-177.7	0	0	111.6	N989 Y1026	N989-E1024 WeakPolarHBondContact CB-O 3.46Å; N989-E1024 PolarHBondContact ND2-O 3.34Å; E1024-Y1026 VanDerWaalsContact C-N 3.31Å; E1024-Y1026 PolarHBondContact O-N 2.94Å
1025	G	94.4	Very high	97	Very high	38 Å²	38	68.5 Å²	68.5	39%	0.392	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.8	-13.9	178.2	0	0	0	0	0	116.2	I1027 Q1028 C1029	G1025-I1027 PolarHBondContact O-N 3.45Å; G1025-I1027 VanDerWaalsContact O-N 3.16Å; G1025-Q1028 PolarHBondContact O-N 2.97Å; G1025-C1029 PolarHBondContact O-N 2.79Å; G1025-C1029 VanDerWaalsContact O-N 3.12Å
1026	Y	97.6	Very high	96.9	Very high	57 Å²	57	68.7 Å²	68.7	22%	0.224	34%	0.337	C	S	.	.	H	α-helix	trans	-36.9	-61.4	-177.6	171.7	-112.5	0	0	0	113.7	N989 C1019 E1021 E1024 Q1028 C1029 S1030	N989-Y1026 WeakPolarHBondContact ND2-CA 3.49Å; N989-Y1026 PolarHBondContact ND2-N 3.28Å; C1019-Y1026 HydrophobicContact CB-CD2 3.72Å; C1019-Y1026 HydrophobicContact CB-CE2 3.71Å; C1019-Y1026 WeakPolarHBondContact O-CE2 3.43Å; E1021-Y1026 HydrophobicContact CB-CE1 4.43Å; E1021-Y1026 HydrophobicContact CB-CE2 4.4Å; E1021-Y1026 HydrophobicContact CG-CE1 4.27Å; E1021-Y1026 HydrophobicContact CG-CE2 3.91Å; E1021-Y1026 PolarHBondContact OE1-OH 2.93Å; E1024-Y1026 VanDerWaalsContact C-N 3.31Å; E1024-Y1026 PolarHBondContact O-N 2.94Å; Y1026-Q1028 PolarHBondContact O-N 2.94Å; Y1026-Q1028 VanDerWaalsContact O-N 3.14Å; Y1026-C1029 PolarHBondContact O-N 3.01Å; Y1026-S1030 PolarHBondContact O-N 3.48Å; Y1026-S1030 PolarHBondContact O-OG 2.85Å; Y1026-S1030 VanDerWaalsContact O-OG 3.08Å
1027	I	97.3	Very high	96.8	Very high	107 Å²	107	69.7 Å²	69.7	55%	0.549	34%	0.342	S	S	.	.	H	α-helix	trans	-55.2	-37.9	-175.6	-57.7	176.1	0	0	0	111.7	G1025 Q1031	G1025-I1027 PolarHBondContact O-N 3.45Å; G1025-I1027 VanDerWaalsContact O-N 3.16Å; I1027-Q1031 HydrophobicContact CG2-CG 4.38Å; I1027-Q1031 WeakPolarHBondContact O-CB 3.5Å; I1027-Q1031 WeakPolarHBondContact O-CG 3.41Å; I1027-Q1031 PolarHBondContact O-N 3.19Å
1028	Q	97.8	Very high	96.6	Very high	133 Å²	133	72.6 Å²	72.6	62%	0.621	35%	0.353	S	S	*	.	H	α-helix	trans	-77.6	-31	-179.9	-59.2	-175.2	26.2	0	0	112.3	V991 G1025 Y1026 F1032	V991-Q1028 HydrophobicContact CG1-CB 4.35Å; V991-Q1028 VanDerWaalsContact CG2-O 3.3Å; V991-Q1028 WeakPolarHBondContact CG2-O 3.35Å; G1025-Q1028 PolarHBondContact O-N 2.97Å; Y1026-Q1028 PolarHBondContact O-N 2.94Å; Y1026-Q1028 VanDerWaalsContact O-N 3.14Å; Q1028-F1032 VanDerWaalsContact O-CB 3.24Å; Q1028-F1032 WeakPolarHBondContact O-CB 3.36Å; Q1028-F1032 PolarHBondContact O-N 2.89Å
1029	C	98.1	Very high	96.4	Very high	0 Å²	0	76.7 Å²	76.7	0%	0	37%	0.371	C	S	.	.	H	α-helix	trans	-78.5	-50.7	-179.7	-162.1	0	0	0	0	111.6	N989 V991 G1025 Y1026 F1032 L1033	N989-C1029 VanDerWaalsContact C-SG 3.58Å; N989-C1029 HydrophobicContact CB-CB 4.3Å; N989-C1029 WeakPolarHBondContact O-CB 3.49Å; V991-C1029 HydrophobicContact CB-CB 4.27Å; G1025-C1029 PolarHBondContact O-N 2.79Å; G1025-C1029 VanDerWaalsContact O-N 3.12Å; Y1026-C1029 PolarHBondContact O-N 3.01Å; C1029-F1032 WeakPolarHBondContact O-CB 3.33Å; C1029-F1032 PolarHBondContact O-N 3.09Å; C1029-L1033 WeakPolarHBondContact O-CG 3.36Å; C1029-L1033 PolarHBondContact O-N 3.16Å
1030	S	97.9	Very high	96.1	Very high	7 Å²	7	76.2 Å²	76.2	5%	0.049	37%	0.367	C	S	.	.	H	α-helix	trans	-65.6	-46.7	179.8	61.8	0	0	0	0	111.7	Y1026 F1032 L1033 Y1034	Y1026-S1030 PolarHBondContact O-N 3.48Å; Y1026-S1030 PolarHBondContact O-OG 2.85Å; Y1026-S1030 VanDerWaalsContact O-OG 3.08Å; S1030-F1032 PolarHBondContact O-N 3.32Å; S1030-L1033 PolarHBondContact O-N 2.84Å; S1030-L1033 VanDerWaalsContact O-N 3.16Å; S1030-Y1034 WeakPolarHBondContact O-CB 3.23Å; S1030-Y1034 VanDerWaalsContact O-CD2 3.29Å; S1030-Y1034 WeakPolarHBondContact O-CD2 3.3Å; S1030-Y1034 PolarHBondContact O-N 3.33Å
1031	Q	97.9	Very high	95.9	Very high	136 Å²	136	72 Å²	72	64%	0.636	35%	0.349	S	S	*	.	H	α-helix	trans	-62	-29.5	174.9	-69	178.7	-5.9	0	0	113	I1027 G1035	I1027-Q1031 HydrophobicContact CG2-CG 4.38Å; I1027-Q1031 WeakPolarHBondContact O-CB 3.5Å; I1027-Q1031 WeakPolarHBondContact O-CG 3.41Å; I1027-Q1031 PolarHBondContact O-N 3.19Å; Q1031-G1035 VanDerWaalsContact O-CA 3.31Å; Q1031-G1035 WeakPolarHBondContact O-CA 3.43Å; Q1031-G1035 PolarHBondContact O-N 3.14Å
1032	F	98.5	Very high	95.7	Very high	43 Å²	43	69.5 Å²	69.5	19%	0.189	34%	0.344	C	S	.	.	H	α-helix	trans	-70.3	-50.1	172.2	170.7	-106.9	0	0	0	111.2	V991 C994 K995 V998 Q1028 C1029 S1030 G1035 V1036	V991-F1032 HydrophobicContact CG2-CB 3.83Å; V991-F1032 HydrophobicContact CG2-CD1 4.24Å; V991-F1032 HydrophobicContact CG2-CG 4.08Å; C994-F1032 HydrophobicContact CB-CD1 4.06Å; C994-F1032 HydrophobicContact CB-CE1 3.96Å; K995-F1032 HydrophobicContact CB-CE1 4.43Å; K995-F1032 HydrophobicContact CB-CZ 4.2Å; K995-F1032 HydrophobicContact CD-CE2 4.33Å; K995-F1032 HydrophobicContact CD-CZ 4.5Å; K995-F1032 HydrophobicContact CG-CD1 4.14Å; K995-F1032 HydrophobicContact CG-CD2 4.09Å; K995-F1032 HydrophobicContact CG-CE1 3.64Å; K995-F1032 HydrophobicContact CG-CE2 3.57Å; K995-F1032 HydrophobicContact CG-CG 4.36Å; K995-F1032 HydrophobicContact CG-CZ 3.33Å; V998-F1032 HydrophobicContact CB-CZ 4.37Å; V998-F1032 HydrophobicContact CG1-CZ 4.45Å; V998-F1032 HydrophobicContact CG2-CE1 4.16Å; V998-F1032 HydrophobicContact CG2-CZ 4.31Å; Q1028-F1032 VanDerWaalsContact O-CB 3.24Å; Q1028-F1032 WeakPolarHBondContact O-CB 3.36Å; Q1028-F1032 PolarHBondContact O-N 2.89Å; C1029-F1032 WeakPolarHBondContact O-CB 3.33Å; C1029-F1032 PolarHBondContact O-N 3.09Å; S1030-F1032 PolarHBondContact O-N 3.32Å; F1032-G1035 CarbonylContact O-C 3.5Å; F1032-G1035 PolarHBondContact O-N 3.45Å; F1032-V1036 HydrophobicContact CD2-CG2 4.12Å; F1032-V1036 HydrophobicContact CE1-CG2 4.4Å; F1032-V1036 HydrophobicContact CE2-CG2 3.6Å; F1032-V1036 HydrophobicContact CZ-CG2 3.76Å; F1032-V1036 WeakPolarHBondContact O-CG2 3.47Å; F1032-V1036 PolarHBondContact O-N 2.91Å
1033	L	98.1	Very high	95.4	Very high	2 Å²	2	63.8 Å²	63.8	1%	0.01	32%	0.316	C	S	.	.	H	α-helix	trans	-69.1	-49.7	-175.5	-68.7	173.1	0	0	0	112.4	L982 A986 C994 A1015 A1016 C1029 S1030 G1035 V1036 Q1037	L982-L1033 HydrophobicContact CD1-CD2 4.16Å; L982-L1033 HydrophobicContact CD2-CD2 4.48Å; L982-L1033 HydrophobicContact CG-CD2 4.47Å; A986-L1033 HydrophobicContact CB-CD1 3.59Å; C994-L1033 HydrophobicContact CB-CD2 4.09Å; A1015-L1033 WeakPolarHBondContact O-CD1 3.41Å; A1016-L1033 HydrophobicContact CB-CB 3.69Å; C1029-L1033 WeakPolarHBondContact O-CG 3.36Å; C1029-L1033 PolarHBondContact O-N 3.16Å; S1030-L1033 PolarHBondContact O-N 2.84Å; S1030-L1033 VanDerWaalsContact O-N 3.16Å; L1033-G1035 VanDerWaalsContact C-N 3.29Å; L1033-G1035 PolarHBondContact O-N 3.26Å; L1033-V1036 PolarHBondContact O-N 3.24Å; L1033-V1036 VanDerWaalsContact O-N 3.11Å; L1033-Q1037 WeakPolarHBondContact O-CG 3.29Å; L1033-Q1037 PolarHBondContact O-N 3.01Å
1034	Y	97.9	Very high	95.3	Very high	84 Å²	84	62.5 Å²	62.5	33%	0.329	31%	0.313	S	S	.	.	H	α-helix	trans	-59.3	-42	170.7	-70	-58.3	0	0	0	110.9	A1016 D1017 S1030 V1036 Q1037 E1038	A1016-Y1034 HydrophobicContact CB-CD1 3.59Å; A1016-Y1034 HydrophobicContact CB-CD2 4.28Å; A1016-Y1034 HydrophobicContact CB-CE1 3.49Å; A1016-Y1034 VanDerWaalsContact CB-CE1 3.49Å; A1016-Y1034 HydrophobicContact CB-CE2 4.2Å; A1016-Y1034 HydrophobicContact CB-CG 3.99Å; D1017-Y1034 PolarHBondContact OD1-OH 3.29Å; S1030-Y1034 WeakPolarHBondContact O-CB 3.23Å; S1030-Y1034 VanDerWaalsContact O-CD2 3.29Å; S1030-Y1034 WeakPolarHBondContact O-CD2 3.3Å; S1030-Y1034 PolarHBondContact O-N 3.33Å; Y1034-V1036 PolarHBondContact O-N 3.05Å; Y1034-Q1037 WeakPolarHBondContact O-CB 3.48Å; Y1034-Q1037 PolarHBondContact O-N 2.8Å; Y1034-Q1037 VanDerWaalsContact O-N 3.13Å; Y1034-E1038 WeakPolarHBondContact O-CB 3.45Å; Y1034-E1038 WeakPolarHBondContact O-CG 3.41Å; Y1034-E1038 PolarHBondContact O-N 3.09Å
1035	G	97	Very high	95.2	Very high	10 Å²	10	63.4 Å²	63.4	10%	0.103	31%	0.314	C	S	.	.	H	α-helix	trans	-64.5	-20.5	176.6	0	0	0	0	0	115	Q1031 F1032 L1033 K1039	Q1031-G1035 VanDerWaalsContact O-CA 3.31Å; Q1031-G1035 WeakPolarHBondContact O-CA 3.43Å; Q1031-G1035 PolarHBondContact O-N 3.14Å; F1032-G1035 CarbonylContact O-C 3.5Å; F1032-G1035 PolarHBondContact O-N 3.45Å; L1033-G1035 VanDerWaalsContact C-N 3.29Å; L1033-G1035 PolarHBondContact O-N 3.26Å; G1035-K1039 WeakPolarHBondContact O-CB 3.27Å; G1035-K1039 WeakPolarHBondContact O-CD 3.34Å; G1035-K1039 WeakPolarHBondContact O-CG 3.35Å
1036	V	96.1	Very high	95.2	Very high	7 Å²	7	61.8 Å²	61.8	4%	0.042	30%	0.298	C	S	.	.	H	α-helix	trans	-84.5	-44.6	168.7	172.3	0	0	0	0	110.3	V998 I1004 F1032 L1033 Y1034 E1038 K1039 L1040 L1102	V998-V1036 HydrophobicContact CG1-CG1 4.35Å; I1004-V1036 HydrophobicContact CD1-CG1 3.99Å; I1004-V1036 HydrophobicContact CG1-CG1 4.07Å; I1004-V1036 HydrophobicContact CG2-CB 4.47Å; I1004-V1036 HydrophobicContact CG2-CG1 3.91Å; F1032-V1036 HydrophobicContact CD2-CG2 4.12Å; F1032-V1036 HydrophobicContact CE1-CG2 4.4Å; F1032-V1036 HydrophobicContact CE2-CG2 3.6Å; F1032-V1036 HydrophobicContact CZ-CG2 3.76Å; F1032-V1036 WeakPolarHBondContact O-CG2 3.47Å; F1032-V1036 PolarHBondContact O-N 2.91Å; L1033-V1036 PolarHBondContact O-N 3.24Å; L1033-V1036 VanDerWaalsContact O-N 3.11Å; Y1034-V1036 PolarHBondContact O-N 3.05Å; V1036-E1038 PolarHBondContact O-N 3.1Å; V1036-K1039 CarbonylContact O-C 3.56Å; V1036-K1039 PolarHBondContact O-N 2.78Å; V1036-K1039 VanDerWaalsContact O-N 3.11Å; V1036-L1040 WeakPolarHBondContact O-CB 3.22Å; V1036-L1040 PolarHBondContact O-N 2.93Å; V1036-L1102 HydrophobicContact CG1-CD2 4.37Å
1037	Q	95.1	Very high	95.1	Very high	23 Å²	23	60.8 Å²	60.8	11%	0.107	30%	0.297	C	S	.	.	H	α-helix	trans	-55.3	-50.4	175.2	-73.7	-179.7	-9.2	0	0	112.1	I1004 F1005 T1014 L1033 Y1034 K1039 R1075	I1004-Q1037 HydrophobicContact CG2-CB 4.48Å; I1004-Q1037 HydrophobicContact CG2-CG 3.47Å; I1004-Q1037 VanDerWaalsContact CG2-CG 3.47Å; I1004-Q1037 PolarHBondContact O-NE2 2.8Å; F1005-Q1037 HydrophobicContact CD1-CG 4.12Å; F1005-Q1037 HydrophobicContact CE1-CB 3.66Å; F1005-Q1037 HydrophobicContact CE1-CG 3.51Å; F1005-Q1037 HydrophobicContact CZ-CB 3.57Å; F1005-Q1037 HydrophobicContact CZ-CG 3.77Å; T1014-Q1037 PolarHBondContact OG1-NE2 3.23Å; L1033-Q1037 WeakPolarHBondContact O-CG 3.29Å; L1033-Q1037 PolarHBondContact O-N 3.01Å; Y1034-Q1037 WeakPolarHBondContact O-CB 3.48Å; Y1034-Q1037 PolarHBondContact O-N 2.8Å; Y1034-Q1037 VanDerWaalsContact O-N 3.13Å; Q1037-K1039 PolarHBondContact O-N 3.45Å; Q1037-K1039 VanDerWaalsContact O-N 3.15Å; Q1037-R1075 PolarHBondContact O-NH1 3.24Å
1038	E	93	Very high	95.1	Very high	126 Å²	126	55.7 Å²	55.7	59%	0.589	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-30.5	177.4	-76.8	-177.9	164.3	0	0	113.1	Y1034 V1036 R1075	Y1034-E1038 WeakPolarHBondContact O-CB 3.45Å; Y1034-E1038 WeakPolarHBondContact O-CG 3.41Å; Y1034-E1038 PolarHBondContact O-N 3.09Å; V1036-E1038 PolarHBondContact O-N 3.1Å; E1038-R1075 VanDerWaalsContact O-CZ 3.24Å; E1038-R1075 PolarHBondContact O-NH1 2.66Å; E1038-R1075 PolarHBondContact O-NH2 2.92Å
1039	K	93.3	Very high	95.1	Very high	104 Å²	104	52.8 Å²	52.8	45%	0.452	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.1	-10.2	-168	-63	174.8	-163.1	136.9	0	114.3	G1035 V1036 Q1037 G1041 V1042 M1043	G1035-K1039 WeakPolarHBondContact O-CB 3.27Å; G1035-K1039 WeakPolarHBondContact O-CD 3.34Å; G1035-K1039 WeakPolarHBondContact O-CG 3.35Å; V1036-K1039 CarbonylContact O-C 3.56Å; V1036-K1039 PolarHBondContact O-N 2.78Å; V1036-K1039 VanDerWaalsContact O-N 3.11Å; Q1037-K1039 PolarHBondContact O-N 3.45Å; Q1037-K1039 VanDerWaalsContact O-N 3.15Å; K1039-G1041 PolarHBondContact O-N 3.23Å; K1039-V1042 PolarHBondContact O-N 2.85Å; K1039-M1043 HydrophobicContact CB-CB 4.43Å; K1039-M1043 HydrophobicContact CB-CE 3.45Å; K1039-M1043 VanDerWaalsContact CB-CE 3.45Å; K1039-M1043 WeakPolarHBondContact O-CG 3.37Å; K1039-M1043 PolarHBondContact O-N 3.18Å
1040	L	93.3	Very high	95.1	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	126.1	174.3	-175.6	70.3	0	0	0	109.6	I1004 F1005 V1036 V1042 V1048 R1075 W1084 L1102	I1004-L1040 HydrophobicContact CB-CD2 4.3Å; I1004-L1040 HydrophobicContact CG1-CD2 3.97Å; F1005-L1040 HydrophobicContact CD2-CD2 4.16Å; F1005-L1040 HydrophobicContact CE2-CD2 3.95Å; V1036-L1040 WeakPolarHBondContact O-CB 3.22Å; V1036-L1040 PolarHBondContact O-N 2.93Å; L1040-V1042 VanDerWaalsContact C-N 3.29Å; L1040-V1042 PolarHBondContact O-N 2.86Å; L1040-V1048 HydrophobicContact CD1-CB 4.38Å; L1040-V1048 HydrophobicContact CD1-CG1 3.66Å; L1040-V1048 HydrophobicContact CG-CG1 3.88Å; L1040-R1075 WeakPolarHBondContact O-CD 3.45Å; L1040-R1075 PolarHBondContact O-NH1 3.41Å; L1040-W1084 HydrophobicContact CB-CH2 4.18Å; L1040-W1084 HydrophobicContact CB-CZ3 4.47Å; L1040-W1084 HydrophobicContact CD2-CH2 4.14Å; L1040-W1084 HydrophobicContact CD2-CZ3 4.18Å; L1040-W1084 HydrophobicContact CG-CH2 4.2Å; L1040-W1084 HydrophobicContact CG-CZ3 4.1Å; L1040-W1084 WeakPolarHBondContact O-CH2 3.37Å; L1040-W1084 WeakPolarHBondContact O-CZ3 3.34Å; L1040-L1102 HydrophobicContact CD1-CB 3.88Å; L1040-L1102 HydrophobicContact CD1-CD1 4.17Å
1041	G	90.8	Very high	95.1	Very high	6 Å²	6	52.4 Å²	52.4	6%	0.062	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	76.4	11.4	-172.6	0	0	0	0	0	115.2	K1039 V1048	K1039-G1041 PolarHBondContact O-N 3.23Å; G1041-V1048 VanDerWaalsContact N-CG1 3.32Å
1042	V	91.9	Very high	95.1	Very high	93 Å²	93	50.1 Å²	50.1	56%	0.564	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-128.7	-43.5	170.2	-177.1	0	0	0	0	110.6	K1039 L1040	K1039-V1042 PolarHBondContact O-N 2.85Å; L1040-V1042 VanDerWaalsContact C-N 3.29Å; L1040-V1042 PolarHBondContact O-N 2.86Å
1043	M	89.8	Confident	95	Very high	54 Å²	54	53.3 Å²	53.3	27%	0.266	26%	0.257	S	S	.	.	S	Bend	trans	-64.3	168.8	166.5	76.6	169.8	87.3	0	0	111.1	K1039 K1045 G1046 L1102	K1039-M1043 HydrophobicContact CB-CB 4.43Å; K1039-M1043 HydrophobicContact CB-CE 3.45Å; K1039-M1043 VanDerWaalsContact CB-CE 3.45Å; K1039-M1043 WeakPolarHBondContact O-CG 3.37Å; K1039-M1043 PolarHBondContact O-N 3.18Å; M1043-K1045 PolarHBondContact O-N 3.44Å; M1043-K1045 VanDerWaalsContact O-N 3.11Å; M1043-G1046 PolarHBondContact O-N 3.05Å; M1043-L1102 HydrophobicContact CE-CD1 4.35Å; M1043-L1102 HydrophobicContact CE-CD2 4.22Å; M1043-L1102 HydrophobicContact CG-CD1 3.86Å; M1043-L1102 HydrophobicContact SD-CD1 3.46Å; M1043-L1102 WeakPolarHBondContact SD-CD1 3.13Å; M1043-L1102 HydrophobicContact SD-CD2 3.82Å; M1043-L1102 HydrophobicContact SD-CG 4.3Å
1044	N	91.8	Very high	95	Very high	102 Å²	102	54.6 Å²	54.6	55%	0.545	26%	0.262	S	S	.	.	G	3₁₀ helix	trans	53	34.4	177.6	-59.9	-13.8	0	0	0	114.1	G1046 T1047	N1044-G1046 PolarHBondContact O-N 3.44Å; N1044-T1047 WeakPolarHBondContact O-CB 3.42Å; N1044-T1047 PolarHBondContact O-N 3.25Å; N1044-T1047 PolarHBondContact O-OG1 3.42Å
1045	K	92.6	Very high	95	Very high	200 Å²	200	58.3 Å²	58.3	87%	0.87	28%	0.282	S	S	*	.	G	3₁₀ helix	trans	61.6	25.9	-175	-49.2	175.1	-177.5	173	0	114.3	M1043 T1047	M1043-K1045 PolarHBondContact O-N 3.44Å; M1043-K1045 VanDerWaalsContact O-N 3.11Å; K1045-T1047 VanDerWaalsContact C-N 3.31Å
1046	G	93.7	Very high	94.9	Very high	4 Å²	4	59.4 Å²	59.4	4%	0.041	29%	0.291	C	S	.	.	G	3₁₀ helix	trans	84.7	-2.3	-175.7	0	0	0	0	0	114.4	M1043 N1044 V1048 I1072	M1043-G1046 PolarHBondContact O-N 3.05Å; N1044-G1046 PolarHBondContact O-N 3.44Å; G1046-V1048 PolarHBondContact O-N 3.29Å; G1046-I1072 WeakPolarHBondContact O-CB 3.46Å; G1046-I1072 WeakPolarHBondContact O-CG1 3.45Å; G1046-I1072 PolarHBondContact O-N 2.87Å
1047	T	96.3	Very high	94.9	Very high	36 Å²	36	67 Å²	67	22%	0.221	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	129	179	-54	0	0	0	0	111.7	N1044 K1045 A1069 I1070	N1044-T1047 WeakPolarHBondContact O-CB 3.42Å; N1044-T1047 PolarHBondContact O-N 3.25Å; N1044-T1047 PolarHBondContact O-OG1 3.42Å; K1045-T1047 VanDerWaalsContact C-N 3.31Å; T1047-A1069 HydrophobicContact CG2-CB 4.35Å; T1047-I1070 WeakPolarHBondContact CA-O 3.12Å
1048	V	97.1	Very high	94.8	Very high	0 Å²	0	68.1 Å²	68.1	0%	0	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	172.4	171	-57.2	0	0	0	0	108.9	L1040 G1041 G1046 I1070 I1072 L1100	L1040-V1048 HydrophobicContact CD1-CB 4.38Å; L1040-V1048 HydrophobicContact CD1-CG1 3.66Å; L1040-V1048 HydrophobicContact CG-CG1 3.88Å; G1041-V1048 VanDerWaalsContact N-CG1 3.32Å; G1046-V1048 PolarHBondContact O-N 3.29Å; V1048-I1070 HydrophobicContact CG2-CB 4.2Å; V1048-I1070 PolarHBondContact N-O 2.9Å; V1048-I1070 PolarHBondContact O-N 2.96Å; V1048-I1070 VanDerWaalsContact O-O 3.14Å; V1048-I1072 HydrophobicContact CG1-CG1 3.99Å; V1048-I1072 HydrophobicContact CG2-CD1 3.69Å; V1048-I1072 HydrophobicContact CG2-CG1 3.8Å; V1048-L1100 HydrophobicContact CG2-CB 4.28Å; V1048-L1100 HydrophobicContact CG2-CD1 4.04Å; V1048-L1100 HydrophobicContact CG2-CD2 4.36Å; V1048-L1100 HydrophobicContact CG2-CG 4.46Å
1049	Y	97.6	Very high	94.7	Very high	71 Å²	71	68.9 Å²	68.9	28%	0.278	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	138.2	-179.7	-62.6	-90.6	0	0	0	111.5	L1051 D1068 A1069 L1100 G1101 L1102 P1104	Y1049-L1051 PolarHBondContact O-N 3.03Å; Y1049-D1068 WeakPolarHBondContact CA-O 3.48Å; Y1049-A1069 HydrophobicContact CD1-CB 4.11Å; Y1049-A1069 HydrophobicContact CE1-CB 3.82Å; Y1049-L1100 WeakPolarHBondContact O-CA 3.36Å; Y1049-G1101 PolarHBondContact N-O 3.06Å; Y1049-G1101 PolarHBondContact O-N 2.94Å; Y1049-L1102 WeakPolarHBondContact CD2-O 3.48Å; Y1049-P1104 HydrophobicContact CD1-CB 3.82Å; Y1049-P1104 HydrophobicContact CD1-CG 3.98Å; Y1049-P1104 HydrophobicContact CE1-CB 4.49Å; Y1049-P1104 HydrophobicContact CE1-CG 4.18Å; Y1049-P1104 HydrophobicContact CG-CB 3.94Å; Y1049-P1104 HydrophobicContact CG-CG 4.2Å
1050	A	97.7	Very high	94.7	Very high	0 Å²	0	67.4 Å²	67.4	0%	0	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	127.9	169	0	0	0	0	0	110.6	F1064 K1065 G1067 D1068 I1070	A1050-F1064 HydrophobicContact CB-CD2 3.38Å; A1050-F1064 HydrophobicContact CB-CE2 3.79Å; A1050-F1064 HydrophobicContact CB-CG 4.21Å; A1050-K1065 WeakPolarHBondContact CB-O 3.47Å; A1050-G1067 PolarHBondContact O-N 3.08Å; A1050-D1068 HydrophobicContact CB-CB 4.24Å; A1050-D1068 PolarHBondContact N-O 2.92Å; A1050-I1070 HydrophobicContact CB-CD1 4Å
1051	L	97.4	Very high	94.8	Very high	0 Å²	0	69 Å²	69	0%	0	36%	0.356	C	S	.	.	S	Bend	trans	-102.4	-1.6	178.4	-59.3	179.7	0	0	0	112.8	G1001 A1003 Y1049 L1099 R1105	G1001-L1051 WeakPolarHBondContact O-CD1 3.48Å; G1001-L1051 VanDerWaalsContact O-CD2 3.3Å; G1001-L1051 WeakPolarHBondContact O-CD2 3.46Å; A1003-L1051 VanDerWaalsContact CA-CD1 3.49Å; A1003-L1051 HydrophobicContact CB-CD1 3.68Å; Y1049-L1051 PolarHBondContact O-N 3.03Å; L1051-L1099 WeakPolarHBondContact CB-O 3.19Å; L1051-L1099 PolarHBondContact N-O 3.05Å; L1051-R1105 HydrophobicContact CD2-CG 4.01Å; L1051-R1105 PolarHBondContact O-NE 3.04Å; L1051-R1105 PolarHBondContact O-NH2 2.88Å
1052	W	97.5	Very high	95.1	Very high	88 Å²	88	69.1 Å²	69.1	33%	0.333	36%	0.356	S	S	.	.	S	Bend	trans	-148.6	161.7	173.9	-74.5	-93.1	0	0	0	109.1	N972 A1003 F1064 L1099 R1105	N972-W1052 HydrophobicContact CB-CH2 3.74Å; N972-W1052 HydrophobicContact CB-CZ2 3.77Å; A1003-W1052 HydrophobicContact CB-CH2 3.69Å; A1003-W1052 HydrophobicContact CB-CZ3 3.73Å; W1052-F1064 WeakPolarHBondContact O-CD2 3.49Å; W1052-F1064 WeakPolarHBondContact O-CE2 3.37Å; W1052-L1099 HydrophobicContact CB-CD2 4.42Å; W1052-L1099 HydrophobicContact CD2-CD2 4.04Å; W1052-L1099 HydrophobicContact CE3-CB 4.14Å; W1052-L1099 HydrophobicContact CE3-CD2 3.69Å; W1052-L1099 HydrophobicContact CG-CD2 4.38Å; W1052-L1099 HydrophobicContact CZ3-CD2 4.26Å; W1052-R1105 VanDerWaalsContact CZ2-NH2 3.31Å
1053	D	97.6	Very high	95.3	Very high	109 Å²	109	67.9 Å²	67.9	58%	0.583	35%	0.351	S	S	*	.			trans	-70.6	142.3	162.1	-69.7	-5.3	0	0	0	109.8	K1065 E1066	D1053-K1065 WeakPolarHBondContact OD1-CA 3.49Å; D1053-K1065 WeakPolarHBondContact OD1-CB 3.41Å; D1053-E1066 PolarHBondContact OD1-N 3.47Å
1054	Y	97.6	Very high	95.6	Very high	30 Å²	30	65.7 Å²	65.7	12%	0.118	34%	0.34	C	S	.	.	B	Isolated β-bridge	trans	-145.2	133.1	177.2	174.5	-103.2	0	0	0	110.6	E1061 L1062 S1063 F1064 W1083 P1096 L1099	Y1054-E1061 HydrophobicContact CE1-CB 4.45Å; Y1054-E1061 VanDerWaalsContact OH-CD 3.3Å; Y1054-E1061 PolarHBondContact OH-OE2 2.95Å; Y1054-L1062 VanDerWaalsContact CD1-O 3.27Å; Y1054-L1062 WeakPolarHBondContact CD1-O 3.44Å; Y1054-L1062 WeakPolarHBondContact CE1-O 3.23Å; Y1054-S1063 CarbonylContact O-C 3.02Å; Y1054-S1063 VanDerWaalsContact O-CA 3.26Å; Y1054-S1063 WeakPolarHBondContact O-CA 3.39Å; Y1054-F1064 VanDerWaalsContact CB-CZ 3.46Å; Y1054-F1064 AromaticContact CD1-CD1 3.95Å; Y1054-F1064 HydrophobicContact CD1-CD1 3.95Å; Y1054-F1064 AromaticContact CD1-CE1 3.45Å; Y1054-F1064 HydrophobicContact CD1-CE1 3.45Å; Y1054-F1064 VanDerWaalsContact CD1-CE1 3.45Å; Y1054-F1064 AromaticContact CD1-CZ 3.88Å; Y1054-F1064 HydrophobicContact CD1-CZ 3.88Å; Y1054-F1064 HydrophobicContact CE1-CE1 4.33Å; Y1054-F1064 AromaticContact CG-CE1 3.94Å; Y1054-F1064 HydrophobicContact CG-CE1 3.94Å; Y1054-F1064 HydrophobicContact CG-CE2 4.42Å; Y1054-F1064 AromaticContact CG-CZ 3.87Å; Y1054-F1064 HydrophobicContact CG-CZ 3.87Å; Y1054-F1064 PolarHBondContact N-O 3Å; Y1054-F1064 PolarHBondContact O-N 3.46Å; Y1054-W1083 HydrophobicContact CE1-CZ3 4.43Å; Y1054-W1083 HydrophobicContact CE2-CH2 4.41Å; Y1054-W1083 AromaticContact CZ-CH2 3.98Å; Y1054-W1083 AromaticContact CZ-CZ3 3.97Å; Y1054-W1083 VanDerWaalsContact OH-CH2 3.28Å; Y1054-W1083 WeakPolarHBondContact OH-CH2 3.46Å; Y1054-W1083 WeakPolarHBondContact OH-CZ3 3.43Å; Y1054-P1096 HydrophobicContact CD2-CG 4.47Å; Y1054-P1096 HydrophobicContact CE2-CG 4.43Å; Y1054-L1099 HydrophobicContact CD2-CD1 4.04Å; Y1054-L1099 HydrophobicContact CG-CD1 4.28Å
1055	E	97.4	Very high	95.9	Very high	161 Å²	161	67.2 Å²	67.2	75%	0.752	34%	0.342	S	S	*	.			trans	-110.4	127.2	177.4	-174.3	168.4	-151.7	0	0	109.3
1056	A	95.6	Very high	96.1	Very high	34 Å²	34	61.4 Å²	61.4	28%	0.281	32%	0.318	S	S	.	.			trans	-63.6	130.7	-179.5	0	0	0	0	0	111.9	E1061 S1063	A1056-E1061 HydrophobicContact CB-CB 3.81Å; A1056-E1061 WeakPolarHBondContact CB-O 3.48Å; A1056-S1063 WeakPolarHBondContact CB-OG 3.49Å; A1056-S1063 PolarHBondContact N-OG 3.16Å
1057	Q	95.1	Very high	96.1	Very high	166 Å²	166	62.4 Å²	62.4	78%	0.776	33%	0.328	S	S	*	.	S	Bend	trans	-98.8	-30.7	177.8	-59.7	170.8	47	0	0	110.5	E1061	Q1057-E1061 WeakPolarHBondContact CA-OE2 3.47Å; Q1057-E1061 WeakPolarHBondContact CB-OE2 3.48Å; Q1057-E1061 PolarHBondContact N-OE2 3.38Å
1058	S	93.1	Very high	96.2	Very high	47 Å²	47	63.3 Å²	63.3	33%	0.329	33%	0.331	S	S	.	.	S	Bend	trans	-110.2	151.4	175.8	-45.4	0	0	0	0	111.1	D1060 E1061	S1058-D1060 VanDerWaalsContact CB-OD1 3.25Å; S1058-D1060 WeakPolarHBondContact CB-OD1 3.39Å; S1058-D1060 PolarHBondContact O-N 3.42Å; S1058-D1060 VanDerWaalsContact O-N 3.17Å; S1058-E1061 VanDerWaalsContact CB-CD 3.42Å; S1058-E1061 WeakPolarHBondContact CB-OE1 3.49Å; S1058-E1061 VanDerWaalsContact N-CD 3.33Å; S1058-E1061 PolarHBondContact N-OE2 2.93Å; S1058-E1061 PolarHBondContact O-N 2.75Å; S1058-E1061 PolarHBondContact OG-OE1 2.89Å
1059	P	92.4	Very high	96.1	Very high	141 Å²	141	65.7 Å²	65.7	92%	0.916	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.1	-9.4	-174.7	31.4	-37.5	0	0	0	114.4
1060	D	92.9	Very high	96.1	Very high	73 Å²	73	62.3 Å²	62.3	39%	0.39	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.5	5.4	178.7	52.1	-33.1	0	0	0	113.2	S1058 W1085 G1093 Y1094	S1058-D1060 VanDerWaalsContact CB-OD1 3.25Å; S1058-D1060 WeakPolarHBondContact CB-OD1 3.39Å; S1058-D1060 PolarHBondContact O-N 3.42Å; S1058-D1060 VanDerWaalsContact O-N 3.17Å; D1060-W1085 HydrophobicContact CB-CZ3 4.41Å; D1060-G1093 CarbonylContact O-C 2.95Å; D1060-G1093 WeakPolarHBondContact O-CA 3.43Å; D1060-Y1094 PolarHBondContact O-N 2.89Å
1061	E	95.6	Very high	96.1	Very high	34 Å²	34	64.7 Å²	64.7	16%	0.159	35%	0.353	C	S	.	.	B	Isolated β-bridge	trans	-93.6	147.8	169.3	-69	158.9	-163.4	0	0	110.9	Y1054 A1056 Q1057 S1058 W1083 Y1094	Y1054-E1061 HydrophobicContact CE1-CB 4.45Å; Y1054-E1061 VanDerWaalsContact OH-CD 3.3Å; Y1054-E1061 PolarHBondContact OH-OE2 2.95Å; A1056-E1061 HydrophobicContact CB-CB 3.81Å; A1056-E1061 WeakPolarHBondContact CB-O 3.48Å; Q1057-E1061 WeakPolarHBondContact CA-OE2 3.47Å; Q1057-E1061 WeakPolarHBondContact CB-OE2 3.48Å; Q1057-E1061 PolarHBondContact N-OE2 3.38Å; S1058-E1061 VanDerWaalsContact CB-CD 3.42Å; S1058-E1061 WeakPolarHBondContact CB-OE1 3.49Å; S1058-E1061 VanDerWaalsContact N-CD 3.33Å; S1058-E1061 PolarHBondContact N-OE2 2.93Å; S1058-E1061 PolarHBondContact O-N 2.75Å; S1058-E1061 PolarHBondContact OG-OE1 2.89Å; E1061-W1083 HydrophobicContact CG-CZ3 4.07Å; E1061-Y1094 WeakPolarHBondContact CA-O 3.3Å
1062	L	96	Very high	96	Very high	9 Å²	9	65.2 Å²	65.2	5%	0.047	36%	0.355	C	S	.	.	P	Polyproline II helix	trans	-93.7	124.8	172.8	-73.8	172.9	0	0	0	111.3	Y1054 F1064 S1086 L1088 K1091 Y1094 V1095	Y1054-L1062 VanDerWaalsContact CD1-O 3.27Å; Y1054-L1062 WeakPolarHBondContact CD1-O 3.44Å; Y1054-L1062 WeakPolarHBondContact CE1-O 3.23Å; L1062-F1064 VanDerWaalsContact O-CD1 3.23Å; L1062-F1064 WeakPolarHBondContact O-CD1 3.36Å; L1062-S1086 WeakPolarHBondContact CD1-O 3.34Å; L1062-L1088 HydrophobicContact CD1-CB 4.12Å; L1062-K1091 HydrophobicContact CD2-CB 3.57Å; L1062-Y1094 PolarHBondContact N-O 3.45Å; L1062-V1095 HydrophobicContact CB-CG1 3.8Å; L1062-V1095 HydrophobicContact CD1-CG1 4.19Å
1063	S	96.7	Very high	95.8	Very high	67 Å²	67	64.2 Å²	64.2	47%	0.469	36%	0.356	S	S	.	.	P	Polyproline II helix	trans	-74.6	137.5	162.3	-49.9	0	0	0	0	110.8	Y1054 A1056	Y1054-S1063 CarbonylContact O-C 3.02Å; Y1054-S1063 VanDerWaalsContact O-CA 3.26Å; Y1054-S1063 WeakPolarHBondContact O-CA 3.39Å; A1056-S1063 WeakPolarHBondContact CB-OG 3.49Å; A1056-S1063 PolarHBondContact N-OG 3.16Å
1064	F	96.8	Very high	95.4	Very high	7 Å²	7	64.1 Å²	64.1	3%	0.031	35%	0.348	C	S	.	.	B	Isolated β-bridge	trans	-150.5	169.1	-178.5	56.4	-103	0	0	0	112.2	A1050 W1052 Y1054 L1062 I1070 L1088 V1095 P1096 L1099 L1100	A1050-F1064 HydrophobicContact CB-CD2 3.38Å; A1050-F1064 HydrophobicContact CB-CE2 3.79Å; A1050-F1064 HydrophobicContact CB-CG 4.21Å; W1052-F1064 WeakPolarHBondContact O-CD2 3.49Å; W1052-F1064 WeakPolarHBondContact O-CE2 3.37Å; Y1054-F1064 VanDerWaalsContact CB-CZ 3.46Å; Y1054-F1064 AromaticContact CD1-CD1 3.95Å; Y1054-F1064 HydrophobicContact CD1-CD1 3.95Å; Y1054-F1064 AromaticContact CD1-CE1 3.45Å; Y1054-F1064 HydrophobicContact CD1-CE1 3.45Å; Y1054-F1064 VanDerWaalsContact CD1-CE1 3.45Å; Y1054-F1064 AromaticContact CD1-CZ 3.88Å; Y1054-F1064 HydrophobicContact CD1-CZ 3.88Å; Y1054-F1064 HydrophobicContact CE1-CE1 4.33Å; Y1054-F1064 AromaticContact CG-CE1 3.94Å; Y1054-F1064 HydrophobicContact CG-CE1 3.94Å; Y1054-F1064 HydrophobicContact CG-CE2 4.42Å; Y1054-F1064 AromaticContact CG-CZ 3.87Å; Y1054-F1064 HydrophobicContact CG-CZ 3.87Å; Y1054-F1064 PolarHBondContact N-O 3Å; Y1054-F1064 PolarHBondContact O-N 3.46Å; L1062-F1064 VanDerWaalsContact O-CD1 3.23Å; L1062-F1064 WeakPolarHBondContact O-CD1 3.36Å; F1064-I1070 HydrophobicContact CB-CD1 4.07Å; F1064-I1070 HydrophobicContact CD1-CD1 3.87Å; F1064-I1070 HydrophobicContact CD2-CD1 4.22Å; F1064-I1070 HydrophobicContact CE1-CD1 4.35Å; F1064-I1070 HydrophobicContact CG-CD1 3.8Å; F1064-L1088 HydrophobicContact CB-CD2 3.68Å; F1064-V1095 HydrophobicContact CD1-CB 4.45Å; F1064-V1095 HydrophobicContact CD1-CG1 3.74Å; F1064-V1095 HydrophobicContact CE1-CB 3.78Å; F1064-V1095 HydrophobicContact CE1-CG1 3.55Å; F1064-P1096 HydrophobicContact CZ-CG 4.43Å; F1064-L1099 HydrophobicContact CE2-CB 4.37Å; F1064-L1099 HydrophobicContact CZ-CB 4.21Å; F1064-L1099 HydrophobicContact CZ-CD1 4.27Å; F1064-L1100 HydrophobicContact CZ-CD2 4.49Å
1065	K	96.9	Very high	94.8	Very high	135 Å²	135	65.2 Å²	65.2	59%	0.587	35%	0.352	S	S	*	.			trans	-125.2	160.4	-177.7	-65.7	-169.6	176.2	-171.5	0	113.8	A1050 D1053 G1067 D1068	A1050-K1065 WeakPolarHBondContact CB-O 3.47Å; D1053-K1065 WeakPolarHBondContact OD1-CA 3.49Å; D1053-K1065 WeakPolarHBondContact OD1-CB 3.41Å; K1065-G1067 PolarHBondContact O-N 3.32Å; K1065-G1067 VanDerWaalsContact O-N 3.12Å; K1065-D1068 PolarHBondContact N-OD2 3.16Å; K1065-D1068 WeakPolarHBondContact O-CB 3.48Å; K1065-D1068 PolarHBondContact O-N 3.36Å
1066	E	96.1	Very high	93.3	Very high	77 Å²	77	65.5 Å²	65.5	36%	0.36	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.3	116.4	178	-166.9	-152.6	120.4	0	0	112.2	D1053 R1105	D1053-E1066 PolarHBondContact OD1-N 3.47Å; E1066-R1105 WeakPolarHBondContact OE1-CD 3.36Å
1067	G	95.1	Very high	91.8	Very high	25 Å²	25	65.7 Å²	65.7	26%	0.258	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	96.3	-3.4	-179.1	0	0	0	0	0	115.3	A1050 K1065	A1050-G1067 PolarHBondContact O-N 3.08Å; K1065-G1067 PolarHBondContact O-N 3.32Å; K1065-G1067 VanDerWaalsContact O-N 3.12Å
1068	D	97	Very high	90	Very high	55 Å²	55	67.2 Å²	67.2	29%	0.294	36%	0.356	S	S	.	.			trans	-62	137	174.3	-74.4	-11.9	0	0	0	111.1	Y1049 A1050 K1065 L1088	Y1049-D1068 WeakPolarHBondContact CA-O 3.48Å; A1050-D1068 HydrophobicContact CB-CB 4.24Å; A1050-D1068 PolarHBondContact N-O 2.92Å; K1065-D1068 PolarHBondContact N-OD2 3.16Å; K1065-D1068 WeakPolarHBondContact O-CB 3.48Å; K1065-D1068 PolarHBondContact O-N 3.36Å; D1068-L1088 HydrophobicContact CB-CD1 4.17Å; D1068-L1088 HydrophobicContact CB-CD2 4.4Å
1069	A	96.9	Very high	88.4	Confident	51 Å²	51	72.3 Å²	72.3	42%	0.421	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	104.9	179.6	0	0	0	0	0	110.2	T1047 Y1049	T1047-A1069 HydrophobicContact CG2-CB 4.35Å; Y1049-A1069 HydrophobicContact CD1-CB 4.11Å; Y1049-A1069 HydrophobicContact CE1-CB 3.82Å
1070	I	97.1	Very high	87.6	Confident	0 Å²	0	68.9 Å²	68.9	0%	0	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	135.4	-175.6	-61.3	164.8	0	0	0	108.7	T1047 V1048 A1050 F1064 I1072 L1088 V1095 L1100	T1047-I1070 WeakPolarHBondContact CA-O 3.12Å; V1048-I1070 HydrophobicContact CG2-CB 4.2Å; V1048-I1070 PolarHBondContact N-O 2.9Å; V1048-I1070 PolarHBondContact O-N 2.96Å; V1048-I1070 VanDerWaalsContact O-O 3.14Å; A1050-I1070 HydrophobicContact CB-CD1 4Å; F1064-I1070 HydrophobicContact CB-CD1 4.07Å; F1064-I1070 HydrophobicContact CD1-CD1 3.87Å; F1064-I1070 HydrophobicContact CD2-CD1 4.22Å; F1064-I1070 HydrophobicContact CE1-CD1 4.35Å; F1064-I1070 HydrophobicContact CG-CD1 3.8Å; I1070-I1072 HydrophobicContact CG2-CD1 4.24Å; I1070-L1088 HydrophobicContact CG1-CB 4.5Å; I1070-L1088 HydrophobicContact CG1-CD1 4.22Å; I1070-L1088 HydrophobicContact CG1-CD2 4.48Å; I1070-V1095 HydrophobicContact CD1-CG1 4.4Å; I1070-V1095 HydrophobicContact CG2-CG2 4.37Å; I1070-L1100 HydrophobicContact CD1-CD2 3.95Å
1071	T	97.1	Very high	86.9	Confident	50 Å²	50	70.2 Å²	70.2	31%	0.307	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	111.3	175.3	-57.3	0	0	0	0	109.9	L1073 S1086 R1087	T1071-L1073 HydrophobicContact CG2-CD2 4.49Å; T1071-S1086 CarbonylContact O-C 3.46Å; T1071-S1086 WeakPolarHBondContact O-CA 3.5Å; T1071-R1087 PolarHBondContact N-O 2.92Å; T1071-R1087 PolarHBondContact O-N 2.87Å
1072	I	95.5	Very high	86.6	Confident	10 Å²	10	73.5 Å²	73.5	5%	0.051	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	131.9	176.3	-54.1	-52.1	0	0	0	109.7	G1046 V1048 I1070 R1075 W1084 S1086 V1095 L1100	G1046-I1072 WeakPolarHBondContact O-CB 3.46Å; G1046-I1072 WeakPolarHBondContact O-CG1 3.45Å; G1046-I1072 PolarHBondContact O-N 2.87Å; V1048-I1072 HydrophobicContact CG1-CG1 3.99Å; V1048-I1072 HydrophobicContact CG2-CD1 3.69Å; V1048-I1072 HydrophobicContact CG2-CG1 3.8Å; I1070-I1072 HydrophobicContact CG2-CD1 4.24Å; I1072-R1075 HydrophobicContact CG2-CG 3.53Å; I1072-W1084 HydrophobicContact CD1-CB 4.28Å; I1072-W1084 HydrophobicContact CD1-CE3 3.8Å; I1072-W1084 HydrophobicContact CG1-CE3 3.93Å; I1072-W1084 HydrophobicContact CG1-CZ3 4.39Å; I1072-W1084 HydrophobicContact CG2-CB 4.21Å; I1072-W1084 HydrophobicContact CG2-CE3 4.2Å; I1072-S1086 WeakPolarHBondContact CD1-OG 3.45Å; I1072-V1095 HydrophobicContact CD1-CG2 4.18Å; I1072-L1100 HydrophobicContact CD1-CD1 4.12Å
1073	L	93.2	Very high	86.5	Confident	68 Å²	68	76.7 Å²	76.7	36%	0.356	39%	0.389	S	S	.	.			trans	-108.3	-38.5	178.8	-57.8	179.1	0	0	0	112	T1071 W1085 R1087 E1092	T1071-L1073 HydrophobicContact CG2-CD2 4.49Å; L1073-W1085 WeakPolarHBondContact CA-O 3.32Å; L1073-W1085 WeakPolarHBondContact CB-O 3.45Å; L1073-W1085 PolarHBondContact N-O 3.25Å; L1073-R1087 HydrophobicContact CD1-CB 4.12Å; L1073-R1087 HydrophobicContact CG-CB 4.42Å; L1073-E1092 VanDerWaalsContact CD1-CD 3.4Å; L1073-E1092 HydrophobicContact CD1-CG 4.02Å; L1073-E1092 WeakPolarHBondContact CD1-OE2 3.37Å
1074	R	90.1	Very high	86.4	Confident	107 Å²	107	73.8 Å²	73.8	40%	0.404	37%	0.368	S	S	.	.			trans	-142.5	151	174.7	-61	175.7	-79.3	147.6	-2.6	110.2	D1077 W1084 W1085	R1074-D1077 IonicContact CZ-OD1 2.62Å; R1074-D1077 IonicContact CZ-OD2 2.66Å; R1074-D1077 VanDerWaalsContact NH1-CG 3.27Å; R1074-D1077 IonicContact NH1-OD1 2.79Å; R1074-D1077 PolarHBondContact NH1-OD1 3.11Å; R1074-D1077 IonicContact NH1-OD2 3.23Å; R1074-D1077 PolarHBondContact NH1-OD2 3.44Å; R1074-W1084 CarbonylContact O-C 3.59Å; R1074-W1084 WeakPolarHBondContact O-CA 3.38Å; R1074-W1084 WeakPolarHBondContact O-CB 3.47Å; R1074-W1085 HydrophobicContact CB-CB 4.12Å; R1074-W1085 PolarHBondContact N-O 3.17Å; R1074-W1085 PolarHBondContact O-N 3.06Å; R1074-W1085 VanDerWaalsContact O-N 3.08Å
1075	R	84.8	Confident	86.3	Confident	53 Å²	53	75.9 Å²	75.9	20%	0.2	38%	0.376	C	S	.	.	S	Bend	trans	-130.9	-5.8	179.6	-58	-167.3	-33.6	-178.8	1.1	115.4	Q1037 E1038 L1040 I1072 W1084	Q1037-R1075 PolarHBondContact O-NH1 3.24Å; E1038-R1075 VanDerWaalsContact O-CZ 3.24Å; E1038-R1075 PolarHBondContact O-NH1 2.66Å; E1038-R1075 PolarHBondContact O-NH2 2.92Å; L1040-R1075 WeakPolarHBondContact O-CD 3.45Å; L1040-R1075 PolarHBondContact O-NH1 3.41Å; I1072-R1075 HydrophobicContact CG2-CG 3.53Å; R1075-W1084 HydrophobicContact CB-CD2 4.21Å; R1075-W1084 HydrophobicContact CB-CG 4.08Å; R1075-W1084 HydrophobicContact CG-CD2 3.77Å; R1075-W1084 HydrophobicContact CG-CE3 4.21Å; R1075-W1084 HydrophobicContact CG-CG 3.95Å; R1075-W1084 HydrophobicContact CG-CZ2 4.32Å
1076	Q	65.6	Low	86.2	Confident	167 Å²	167	69.4 Å²	69.4	78%	0.78	35%	0.348	S	S	*	.			trans	-144.5	75.9	-171.3	-77.8	-178.8	-60.1	0	0	107.8
1077	D	63.1	Low	86.2	Confident	37 Å²	37	71 Å²	71	20%	0.198	35%	0.35	C	S	.	.	B	Isolated β-bridge	trans	-90.9	138.6	160.6	-63.9	-69.2	0	0	0	106.5	R1074 N1079 E1080	R1074-D1077 IonicContact CZ-OD1 2.62Å; R1074-D1077 IonicContact CZ-OD2 2.66Å; R1074-D1077 VanDerWaalsContact NH1-CG 3.27Å; R1074-D1077 IonicContact NH1-OD1 2.79Å; R1074-D1077 PolarHBondContact NH1-OD1 3.11Å; R1074-D1077 IonicContact NH1-OD2 3.23Å; R1074-D1077 PolarHBondContact NH1-OD2 3.44Å; D1077-N1079 PolarHBondContact O-N 3.3Å; D1077-E1080 PolarHBondContact O-N 3.46Å
1078	E	58.8	Low	86.3	Confident	199 Å²	199	70.9 Å²	70.9	93%	0.93	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-12.1	-163.9	-64.3	-170.9	156.4	0	0	115.3
1079	N	58.4	Low	86	Confident	153 Å²	153	76.2 Å²	76.2	82%	0.818	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.4	-21.5	-178.2	-59.2	104.4	0	0	0	113.8	D1077	D1077-N1079 PolarHBondContact O-N 3.3Å
1080	E	76.1	Confident	85.8	Confident	69 Å²	69	81.7 Å²	81.7	32%	0.322	39%	0.389	S	S	.	.	B	Isolated β-bridge	trans	-139.8	102.7	-166.9	-71.5	177.6	-147.8	0	0	111	D1077 W1083	D1077-E1080 PolarHBondContact O-N 3.46Å; E1080-W1083 HydrophobicContact CB-CB 4.44Å
1081	T	79.3	Confident	85.7	Confident	101 Å²	101	88.6 Å²	88.6	62%	0.62	42%	0.419	S	S	*	.	S	Bend	trans	-93.1	-14.2	-179.9	51.8	0	0	0	0	113.6
1082	E	88.5	Confident	85.6	Confident	104 Å²	104	90.2 Å²	90.2	49%	0.486	42%	0.423	S	S	.	.	S	Bend	trans	-105.8	-14.1	-174.5	-49.7	-144	97.8	0	0	113.7	R1097	E1082-R1097 WeakPolarHBondContact O-CB 3.37Å; E1082-R1097 WeakPolarHBondContact O-CG 3.49Å; E1082-R1097 PolarHBondContact O-N 3.48Å; E1082-R1097 IonicContact OE1-CZ 2.77Å; E1082-R1097 IonicContact OE1-NE 3.69Å; E1082-R1097 PolarHBondContact OE1-NE 3.37Å; E1082-R1097 IonicContact OE1-NH2 3.78Å; E1082-R1097 PolarHBondContact OE1-NH2 2.92Å
1083	W	93.4	Very high	85.6	Confident	75 Å²	75	89.7 Å²	89.7	28%	0.284	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	133.8	178.5	-64.7	86.8	0	0	0	109.4	Y1054 E1061 E1080 Y1094 V1095 P1096	Y1054-W1083 HydrophobicContact CE1-CZ3 4.43Å; Y1054-W1083 HydrophobicContact CE2-CH2 4.41Å; Y1054-W1083 AromaticContact CZ-CH2 3.98Å; Y1054-W1083 AromaticContact CZ-CZ3 3.97Å; Y1054-W1083 VanDerWaalsContact OH-CH2 3.28Å; Y1054-W1083 WeakPolarHBondContact OH-CH2 3.46Å; Y1054-W1083 WeakPolarHBondContact OH-CZ3 3.43Å; E1061-W1083 HydrophobicContact CG-CZ3 4.07Å; E1080-W1083 HydrophobicContact CB-CB 4.44Å; W1083-Y1094 HydrophobicContact CB-CD1 3.98Å; W1083-Y1094 HydrophobicContact CB-CG 4.28Å; W1083-V1095 WeakPolarHBondContact CA-O 3.41Å; W1083-P1096 HydrophobicContact CD2-CB 4.23Å; W1083-P1096 HydrophobicContact CE3-CB 3.94Å; W1083-P1096 HydrophobicContact CE3-CG 4.42Å; W1083-P1096 HydrophobicContact CH2-CB 3.91Å; W1083-P1096 HydrophobicContact CH2-CG 4.16Å; W1083-P1096 HydrophobicContact CZ2-CB 4.17Å; W1083-P1096 HydrophobicContact CZ3-CB 3.8Å; W1083-P1096 HydrophobicContact CZ3-CG 3.92Å
1084	W	94.3	Very high	85.7	Confident	7 Å²	7	88 Å²	88	3%	0.027	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	120.5	-174.2	-66.7	-10.1	0	0	0	110.3	F1005 L1040 I1072 R1074 R1075 S1086 V1095 R1097 L1100	F1005-W1084 HydrophobicContact CD2-CH2 4.49Å; F1005-W1084 AromaticContact CE2-CH2 3.7Å; F1005-W1084 HydrophobicContact CE2-CH2 3.7Å; F1005-W1084 AromaticContact CE2-CZ2 3.89Å; F1005-W1084 HydrophobicContact CE2-CZ2 3.89Å; F1005-W1084 HydrophobicContact CZ-CH2 4.46Å; F1005-W1084 HydrophobicContact CZ-CZ2 4.36Å; L1040-W1084 HydrophobicContact CB-CH2 4.18Å; L1040-W1084 HydrophobicContact CB-CZ3 4.47Å; L1040-W1084 HydrophobicContact CD2-CH2 4.14Å; L1040-W1084 HydrophobicContact CD2-CZ3 4.18Å; L1040-W1084 HydrophobicContact CG-CH2 4.2Å; L1040-W1084 HydrophobicContact CG-CZ3 4.1Å; L1040-W1084 WeakPolarHBondContact O-CH2 3.37Å; L1040-W1084 WeakPolarHBondContact O-CZ3 3.34Å; I1072-W1084 HydrophobicContact CD1-CB 4.28Å; I1072-W1084 HydrophobicContact CD1-CE3 3.8Å; I1072-W1084 HydrophobicContact CG1-CE3 3.93Å; I1072-W1084 HydrophobicContact CG1-CZ3 4.39Å; I1072-W1084 HydrophobicContact CG2-CB 4.21Å; I1072-W1084 HydrophobicContact CG2-CE3 4.2Å; R1074-W1084 CarbonylContact O-C 3.59Å; R1074-W1084 WeakPolarHBondContact O-CA 3.38Å; R1074-W1084 WeakPolarHBondContact O-CB 3.47Å; R1075-W1084 HydrophobicContact CB-CD2 4.21Å; R1075-W1084 HydrophobicContact CB-CG 4.08Å; R1075-W1084 HydrophobicContact CG-CD2 3.77Å; R1075-W1084 HydrophobicContact CG-CE3 4.21Å; R1075-W1084 HydrophobicContact CG-CG 3.95Å; R1075-W1084 HydrophobicContact CG-CZ2 4.32Å; W1084-S1086 PolarHBondContact O-N 3.33Å; W1084-S1086 PolarHBondContact O-OG 3.47Å; W1084-V1095 PolarHBondContact N-O 3.02Å; W1084-V1095 PolarHBondContact O-N 2.98Å; W1084-V1095 VanDerWaalsContact O-N 3.12Å; W1084-R1097 HydrophobicContact CD2-CB 3.88Å; W1084-R1097 HydrophobicContact CE3-CB 4.23Å; W1084-R1097 HydrophobicContact CG-CB 4.44Å; W1084-R1097 HydrophobicContact CH2-CB 4.28Å; W1084-R1097 HydrophobicContact CZ2-CB 3.87Å; W1084-R1097 HydrophobicContact CZ3-CB 4.42Å; W1084-L1100 HydrophobicContact CE3-CD1 4.06Å; W1084-L1100 HydrophobicContact CZ3-CD1 4.46Å
1085	W	94.4	Very high	86	Confident	50 Å²	50	83 Å²	83	19%	0.189	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	123.6	175.8	-169.2	-92.8	0	0	0	110	D1060 L1073 R1074 E1092 Y1094	D1060-W1085 HydrophobicContact CB-CZ3 4.41Å; L1073-W1085 WeakPolarHBondContact CA-O 3.32Å; L1073-W1085 WeakPolarHBondContact CB-O 3.45Å; L1073-W1085 PolarHBondContact N-O 3.25Å; R1074-W1085 HydrophobicContact CB-CB 4.12Å; R1074-W1085 PolarHBondContact N-O 3.17Å; R1074-W1085 PolarHBondContact O-N 3.06Å; R1074-W1085 VanDerWaalsContact O-N 3.08Å; W1085-E1092 HydrophobicContact CZ2-CB 3.86Å; W1085-E1092 PolarHBondContact NE1-OE2 2.98Å; W1085-Y1094 HydrophobicContact CB-CD1 4.26Å; W1085-Y1094 HydrophobicContact CB-CE1 4.15Å; W1085-Y1094 AromaticContact CE3-CD1 3.95Å; W1085-Y1094 HydrophobicContact CE3-CD1 3.95Å; W1085-Y1094 AromaticContact CE3-CD2 3.82Å; W1085-Y1094 HydrophobicContact CE3-CD2 3.82Å; W1085-Y1094 AromaticContact CE3-CE1 3.91Å; W1085-Y1094 HydrophobicContact CE3-CE1 3.91Å; W1085-Y1094 AromaticContact CE3-CE2 3.81Å; W1085-Y1094 HydrophobicContact CE3-CE2 3.81Å; W1085-Y1094 AromaticContact CE3-CG 3.92Å; W1085-Y1094 HydrophobicContact CE3-CG 3.92Å; W1085-Y1094 AromaticContact CE3-CZ 3.86Å; W1085-Y1094 AromaticContact CZ3-CD2 3.89Å; W1085-Y1094 HydrophobicContact CZ3-CD2 3.89Å; W1085-Y1094 AromaticContact CZ3-CE2 3.92Å; W1085-Y1094 HydrophobicContact CZ3-CE2 3.92Å; W1085-Y1094 HydrophobicContact CZ3-CG 4.36Å
1086	S	95.8	Very high	86.4	Confident	0 Å²	0	80.9 Å²	80.9	0%	0	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	167.5	-162.9	-60.1	0	0	0	0	111.6	L1062 T1071 I1072 W1084 E1092 G1093 V1095	L1062-S1086 WeakPolarHBondContact CD1-O 3.34Å; T1071-S1086 CarbonylContact O-C 3.46Å; T1071-S1086 WeakPolarHBondContact O-CA 3.5Å; I1072-S1086 WeakPolarHBondContact CD1-OG 3.45Å; W1084-S1086 PolarHBondContact O-N 3.33Å; W1084-S1086 PolarHBondContact O-OG 3.47Å; S1086-E1092 VanDerWaalsContact O-CA 3.22Å; S1086-E1092 WeakPolarHBondContact O-CA 3.41Å; S1086-G1093 PolarHBondContact N-O 3.39Å; S1086-G1093 PolarHBondContact O-N 3.46Å; S1086-V1095 WeakPolarHBondContact OG-CG2 3.38Å
1087	R	96.3	Very high	87.8	Confident	109 Å²	109	75.7 Å²	75.7	41%	0.411	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	132.7	172.9	-164	-179.2	-64	143.6	1	111.1	T1071 L1073 E1089 K1091 E1092	T1071-R1087 PolarHBondContact N-O 2.92Å; T1071-R1087 PolarHBondContact O-N 2.87Å; L1073-R1087 HydrophobicContact CD1-CB 4.12Å; L1073-R1087 HydrophobicContact CG-CB 4.42Å; R1087-E1089 WeakPolarHBondContact CD-O 3.33Å; R1087-E1089 WeakPolarHBondContact CG-O 3.38Å; R1087-K1091 CarbonylContact C-O 3.51Å; R1087-K1091 VanDerWaalsContact CA-O 3.27Å; R1087-K1091 WeakPolarHBondContact CA-O 3.42Å; R1087-K1091 VanDerWaalsContact CG-O 3.25Å; R1087-K1091 WeakPolarHBondContact CG-O 3.36Å; R1087-E1092 HydrophobicContact CB-CG 3.96Å; R1087-E1092 HydrophobicContact CG-CG 3.82Å; R1087-E1092 IonicContact CZ-OE1 3.19Å; R1087-E1092 IonicContact NE-OE1 2.89Å; R1087-E1092 PolarHBondContact NE-OE1 3.35Å; R1087-E1092 IonicContact NH2-OE1 3.5Å; R1087-E1092 PolarHBondContact NH2-OE1 3.02Å
1088	L	96.2	Very high	89.3	Confident	24 Å²	24	77.4 Å²	77.4	13%	0.126	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	119.7	167.3	178.7	58.5	0	0	0	107.9	L1062 F1064 D1068 I1070 D1090 K1091	L1062-L1088 HydrophobicContact CD1-CB 4.12Å; F1064-L1088 HydrophobicContact CB-CD2 3.68Å; D1068-L1088 HydrophobicContact CB-CD1 4.17Å; D1068-L1088 HydrophobicContact CB-CD2 4.4Å; I1070-L1088 HydrophobicContact CG1-CB 4.5Å; I1070-L1088 HydrophobicContact CG1-CD1 4.22Å; I1070-L1088 HydrophobicContact CG1-CD2 4.48Å; L1088-D1090 PolarHBondContact O-N 2.92Å; L1088-K1091 PolarHBondContact N-O 3.34Å; L1088-K1091 PolarHBondContact O-N 3.45Å
1089	E	92	Very high	91.1	Very high	166 Å²	166	69.5 Å²	69.5	78%	0.776	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.9	-122.7	-169.2	-54.6	-175.2	139.5	0	0	111.3	R1087	R1087-E1089 WeakPolarHBondContact CD-O 3.33Å; R1087-E1089 WeakPolarHBondContact CG-O 3.38Å
1090	D	92.1	Very high	92.9	Very high	167 Å²	167	62.2 Å²	62.2	89%	0.893	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.4	1.8	177.9	-65	-41.2	0	0	0	113.7	L1088	L1088-D1090 PolarHBondContact O-N 2.92Å
1091	K	94.6	Very high	93.9	Very high	144 Å²	144	58.9 Å²	58.9	63%	0.626	28%	0.276	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.1	143.6	-175.6	-60.4	177.3	-174.8	169.2	0	111.9	L1062 R1087 L1088	L1062-K1091 HydrophobicContact CD2-CB 3.57Å; R1087-K1091 CarbonylContact C-O 3.51Å; R1087-K1091 VanDerWaalsContact CA-O 3.27Å; R1087-K1091 WeakPolarHBondContact CA-O 3.42Å; R1087-K1091 VanDerWaalsContact CG-O 3.25Å; R1087-K1091 WeakPolarHBondContact CG-O 3.36Å; L1088-K1091 PolarHBondContact N-O 3.34Å; L1088-K1091 PolarHBondContact O-N 3.45Å
1092	E	96	Very high	94.7	Very high	84 Å²	84	55.2 Å²	55.2	39%	0.393	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	151.1	170.9	-70.8	-172.8	-157	0	0	112.1	L1073 W1085 S1086 R1087	L1073-E1092 VanDerWaalsContact CD1-CD 3.4Å; L1073-E1092 HydrophobicContact CD1-CG 4.02Å; L1073-E1092 WeakPolarHBondContact CD1-OE2 3.37Å; W1085-E1092 HydrophobicContact CZ2-CB 3.86Å; W1085-E1092 PolarHBondContact NE1-OE2 2.98Å; S1086-E1092 VanDerWaalsContact O-CA 3.22Å; S1086-E1092 WeakPolarHBondContact O-CA 3.41Å; R1087-E1092 HydrophobicContact CB-CG 3.96Å; R1087-E1092 HydrophobicContact CG-CG 3.82Å; R1087-E1092 IonicContact CZ-OE1 3.19Å; R1087-E1092 IonicContact NE-OE1 2.89Å; R1087-E1092 PolarHBondContact NE-OE1 3.35Å; R1087-E1092 IonicContact NH2-OE1 3.5Å; R1087-E1092 PolarHBondContact NH2-OE1 3.02Å
1093	G	94.5	Very high	95.1	Very high	0 Å²	0	52 Å²	52	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	168.7	177.9	179.2	0	0	0	0	0	111.7	D1060 S1086	D1060-G1093 CarbonylContact O-C 2.95Å; D1060-G1093 WeakPolarHBondContact O-CA 3.43Å; S1086-G1093 PolarHBondContact N-O 3.39Å; S1086-G1093 PolarHBondContact O-N 3.46Å
1094	Y	95.1	Very high	95.2	Very high	33 Å²	33	50.9 Å²	50.9	13%	0.129	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75	147.4	175.4	-70.8	-66.8	0	0	0	112.6	D1060 E1061 L1062 W1083 W1085	D1060-Y1094 PolarHBondContact O-N 2.89Å; E1061-Y1094 WeakPolarHBondContact CA-O 3.3Å; L1062-Y1094 PolarHBondContact N-O 3.45Å; W1083-Y1094 HydrophobicContact CB-CD1 3.98Å; W1083-Y1094 HydrophobicContact CB-CG 4.28Å; W1085-Y1094 HydrophobicContact CB-CD1 4.26Å; W1085-Y1094 HydrophobicContact CB-CE1 4.15Å; W1085-Y1094 AromaticContact CE3-CD1 3.95Å; W1085-Y1094 HydrophobicContact CE3-CD1 3.95Å; W1085-Y1094 AromaticContact CE3-CD2 3.82Å; W1085-Y1094 HydrophobicContact CE3-CD2 3.82Å; W1085-Y1094 AromaticContact CE3-CE1 3.91Å; W1085-Y1094 HydrophobicContact CE3-CE1 3.91Å; W1085-Y1094 AromaticContact CE3-CE2 3.81Å; W1085-Y1094 HydrophobicContact CE3-CE2 3.81Å; W1085-Y1094 AromaticContact CE3-CG 3.92Å; W1085-Y1094 HydrophobicContact CE3-CG 3.92Å; W1085-Y1094 AromaticContact CE3-CZ 3.86Å; W1085-Y1094 AromaticContact CZ3-CD2 3.89Å; W1085-Y1094 HydrophobicContact CZ3-CD2 3.89Å; W1085-Y1094 AromaticContact CZ3-CE2 3.92Å; W1085-Y1094 HydrophobicContact CZ3-CE2 3.92Å; W1085-Y1094 HydrophobicContact CZ3-CG 4.36Å
1095	V	96	Very high	95.3	Very high	0 Å²	0	52 Å²	52	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	144.7	167.9	-63.6	0	0	0	0	110.5	L1062 F1064 I1070 I1072 W1083 W1084 S1086 L1100	L1062-V1095 HydrophobicContact CB-CG1 3.8Å; L1062-V1095 HydrophobicContact CD1-CG1 4.19Å; F1064-V1095 HydrophobicContact CD1-CB 4.45Å; F1064-V1095 HydrophobicContact CD1-CG1 3.74Å; F1064-V1095 HydrophobicContact CE1-CB 3.78Å; F1064-V1095 HydrophobicContact CE1-CG1 3.55Å; I1070-V1095 HydrophobicContact CD1-CG1 4.4Å; I1070-V1095 HydrophobicContact CG2-CG2 4.37Å; I1072-V1095 HydrophobicContact CD1-CG2 4.18Å; W1083-V1095 WeakPolarHBondContact CA-O 3.41Å; W1084-V1095 PolarHBondContact N-O 3.02Å; W1084-V1095 PolarHBondContact O-N 2.98Å; W1084-V1095 VanDerWaalsContact O-N 3.12Å; S1086-V1095 WeakPolarHBondContact OG-CG2 3.38Å; V1095-L1100 HydrophobicContact CG2-CD1 3.77Å
1096	P	95.1	Very high	95.2	Very high	9 Å²	9	52.6 Å²	52.6	6%	0.058	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	121.9	-177.5	32	-33.5	0	0	0	111.1	Y1054 F1064 W1083 N1098 L1099	Y1054-P1096 HydrophobicContact CD2-CG 4.47Å; Y1054-P1096 HydrophobicContact CE2-CG 4.43Å; F1064-P1096 HydrophobicContact CZ-CG 4.43Å; W1083-P1096 HydrophobicContact CD2-CB 4.23Å; W1083-P1096 HydrophobicContact CE3-CB 3.94Å; W1083-P1096 HydrophobicContact CE3-CG 4.42Å; W1083-P1096 HydrophobicContact CH2-CB 3.91Å; W1083-P1096 HydrophobicContact CH2-CG 4.16Å; W1083-P1096 HydrophobicContact CZ2-CB 4.17Å; W1083-P1096 HydrophobicContact CZ3-CB 3.8Å; W1083-P1096 HydrophobicContact CZ3-CG 3.92Å; P1096-N1098 PolarHBondContact O-N 2.78Å; P1096-N1098 VanDerWaalsContact O-N 3.09Å; P1096-L1099 HydrophobicContact CG-CB 4.34Å; P1096-L1099 HydrophobicContact CG-CD1 3.74Å; P1096-L1099 HydrophobicContact CG-CG 3.93Å; P1096-L1099 PolarHBondContact O-N 3.31Å; P1096-L1099 VanDerWaalsContact O-N 3.1Å
1097	R	94.3	Very high	94.9	Very high	59 Å²	59	59.6 Å²	59.6	22%	0.223	28%	0.284	C	S	.	.	G	3₁₀ helix	trans	-59.5	-26.5	-169.3	73	-177.9	172.8	137.1	-2.3	114.9	F1005 E1082 W1084 L1099 L1100	F1005-R1097 HydrophobicContact CB-CG 4.29Å; F1005-R1097 VanDerWaalsContact CD1-NH1 3.29Å; F1005-R1097 HydrophobicContact CD2-CB 4.27Å; F1005-R1097 HydrophobicContact CD2-CG 4.11Å; F1005-R1097 VanDerWaalsContact CE1-NH1 3.26Å; F1005-R1097 HydrophobicContact CG-CG 4.24Å; E1082-R1097 WeakPolarHBondContact O-CB 3.37Å; E1082-R1097 WeakPolarHBondContact O-CG 3.49Å; E1082-R1097 PolarHBondContact O-N 3.48Å; E1082-R1097 IonicContact OE1-CZ 2.77Å; E1082-R1097 IonicContact OE1-NE 3.69Å; E1082-R1097 PolarHBondContact OE1-NE 3.37Å; E1082-R1097 IonicContact OE1-NH2 3.78Å; E1082-R1097 PolarHBondContact OE1-NH2 2.92Å; W1084-R1097 HydrophobicContact CD2-CB 3.88Å; W1084-R1097 HydrophobicContact CE3-CB 4.23Å; W1084-R1097 HydrophobicContact CG-CB 4.44Å; W1084-R1097 HydrophobicContact CH2-CB 4.28Å; W1084-R1097 HydrophobicContact CZ2-CB 3.87Å; W1084-R1097 HydrophobicContact CZ3-CB 4.42Å; R1097-L1099 VanDerWaalsContact C-N 3.31Å; R1097-L1100 PolarHBondContact O-N 2.86Å
1098	N	94.8	Very high	94.1	Very high	72 Å²	72	58.9 Å²	58.9	39%	0.385	29%	0.294	S	S	.	.	G	3₁₀ helix	trans	-75	-18.1	-178.3	63.8	-52.4	0	0	0	113.4	F1005 P1096 L1100	F1005-N1098 HydrophobicContact CB-CB 4.31Å; F1005-N1098 VanDerWaalsContact O-CB 3.28Å; F1005-N1098 WeakPolarHBondContact O-CB 3.43Å; P1096-N1098 PolarHBondContact O-N 2.78Å; P1096-N1098 VanDerWaalsContact O-N 3.09Å; N1098-L1100 VanDerWaalsContact C-N 3.29Å
1099	L	96.6	Very high	92.8	Very high	33 Å²	33	64.4 Å²	64.4	17%	0.173	31%	0.313	C	S	.	.	G	3₁₀ helix	trans	-89.2	8.9	174.3	-55.8	-171.6	0	0	0	113.1	L1051 W1052 Y1054 F1064 P1096 R1097	L1051-L1099 WeakPolarHBondContact CB-O 3.19Å; L1051-L1099 PolarHBondContact N-O 3.05Å; W1052-L1099 HydrophobicContact CB-CD2 4.42Å; W1052-L1099 HydrophobicContact CD2-CD2 4.04Å; W1052-L1099 HydrophobicContact CE3-CB 4.14Å; W1052-L1099 HydrophobicContact CE3-CD2 3.69Å; W1052-L1099 HydrophobicContact CG-CD2 4.38Å; W1052-L1099 HydrophobicContact CZ3-CD2 4.26Å; Y1054-L1099 HydrophobicContact CD2-CD1 4.04Å; Y1054-L1099 HydrophobicContact CG-CD1 4.28Å; F1064-L1099 HydrophobicContact CE2-CB 4.37Å; F1064-L1099 HydrophobicContact CZ-CB 4.21Å; F1064-L1099 HydrophobicContact CZ-CD1 4.27Å; P1096-L1099 HydrophobicContact CG-CB 4.34Å; P1096-L1099 HydrophobicContact CG-CD1 3.74Å; P1096-L1099 HydrophobicContact CG-CG 3.93Å; P1096-L1099 PolarHBondContact O-N 3.31Å; P1096-L1099 VanDerWaalsContact O-N 3.1Å; R1097-L1099 VanDerWaalsContact C-N 3.31Å
1100	L	96.6	Very high	91.1	Very high	0 Å²	0	63.8 Å²	63.8	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	146.6	-171	-51.2	176.4	0	0	0	112.7	V1048 Y1049 F1064 I1070 I1072 W1084 V1095 R1097 N1098	V1048-L1100 HydrophobicContact CG2-CB 4.28Å; V1048-L1100 HydrophobicContact CG2-CD1 4.04Å; V1048-L1100 HydrophobicContact CG2-CD2 4.36Å; V1048-L1100 HydrophobicContact CG2-CG 4.46Å; Y1049-L1100 WeakPolarHBondContact O-CA 3.36Å; F1064-L1100 HydrophobicContact CZ-CD2 4.49Å; I1070-L1100 HydrophobicContact CD1-CD2 3.95Å; I1072-L1100 HydrophobicContact CD1-CD1 4.12Å; W1084-L1100 HydrophobicContact CE3-CD1 4.06Å; W1084-L1100 HydrophobicContact CZ3-CD1 4.46Å; V1095-L1100 HydrophobicContact CG2-CD1 3.77Å; R1097-L1100 PolarHBondContact O-N 2.86Å; N1098-L1100 VanDerWaalsContact C-N 3.29Å
1101	G	96.5	Very high	89.3	Confident	0 Å²	0	62.7 Å²	62.7	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	159.9	179	0	0	0	0	0	112.7	Y1049 C1103	Y1049-G1101 PolarHBondContact N-O 3.06Å; Y1049-G1101 PolarHBondContact O-N 2.94Å; G1101-C1103 VanDerWaalsContact C-N 3.31Å
1102	L	96.3	Very high	87	Confident	23 Å²	23	60.2 Å²	60.2	12%	0.12	29%	0.294	C	S	.	.	S	Bend	trans	-71.8	-29.8	175	-177.4	57.8	0	0	0	112.3	V998 V1036 L1040 M1043 Y1049	V998-L1102 HydrophobicContact CG1-CB 4.13Å; V998-L1102 HydrophobicContact CG1-CD2 4Å; V1036-L1102 HydrophobicContact CG1-CD2 4.37Å; L1040-L1102 HydrophobicContact CD1-CB 3.88Å; L1040-L1102 HydrophobicContact CD1-CD1 4.17Å; M1043-L1102 HydrophobicContact CE-CD1 4.35Å; M1043-L1102 HydrophobicContact CE-CD2 4.22Å; M1043-L1102 HydrophobicContact CG-CD1 3.86Å; M1043-L1102 HydrophobicContact SD-CD1 3.46Å; M1043-L1102 WeakPolarHBondContact SD-CD1 3.13Å; M1043-L1102 HydrophobicContact SD-CD2 3.82Å; M1043-L1102 HydrophobicContact SD-CG 4.3Å; Y1049-L1102 WeakPolarHBondContact CD2-O 3.48Å
1103	C	96.3	Very high	84.3	Confident	37 Å²	37	62.7 Å²	62.7	25%	0.25	31%	0.31	C	S	.	.	S	Bend	trans	-126.9	157.7	174.7	-69.6	0	0	0	0	109.3	E999 G1001 G1101	E999-C1103 VanDerWaalsContact O-CB 3.27Å; E999-C1103 WeakPolarHBondContact O-CB 3.41Å; G1001-C1103 WeakPolarHBondContact CA-O 3.48Å; G1101-C1103 VanDerWaalsContact C-N 3.31Å
1104	P	95.8	Very high	81.6	Confident	52 Å²	52	69.1 Å²	69.1	34%	0.338	36%	0.363	S	S	.	.	P	Polyproline II helix	trans	-73.1	162.6	169.7	33.2	-34.2	0	0	0	110.5	Y1049	Y1049-P1104 HydrophobicContact CD1-CB 3.82Å; Y1049-P1104 HydrophobicContact CD1-CG 3.98Å; Y1049-P1104 HydrophobicContact CE1-CB 4.49Å; Y1049-P1104 HydrophobicContact CE1-CG 4.18Å; Y1049-P1104 HydrophobicContact CG-CB 3.94Å; Y1049-P1104 HydrophobicContact CG-CG 4.2Å
1105	R	95.2	Very high	80.9	Confident	29 Å²	29	71 Å²	71	11%	0.109	38%	0.375	C	S	.	.	P	Polyproline II helix	trans	-64	146.2	173.6	-64.8	174.1	-178.8	-103.1	6.2	111.9	N970 V971 N972 L1051 W1052 E1066 K1107	N970-R1105 PolarHBondContact OD1-NH1 2.8Å; V971-R1105 HydrophobicContact CG1-CG 4.46Å; N972-R1105 PolarHBondContact ND2-NH2 2.88Å; L1051-R1105 HydrophobicContact CD2-CG 4.01Å; L1051-R1105 PolarHBondContact O-NE 3.04Å; L1051-R1105 PolarHBondContact O-NH2 2.88Å; W1052-R1105 VanDerWaalsContact CZ2-NH2 3.31Å; E1066-R1105 WeakPolarHBondContact OE1-CD 3.36Å; R1105-K1107 PolarHBondContact O-N 3.39Å
1106	I	94.3	Very high	80.1	Confident	63 Å²	63	74.7 Å²	74.7	32%	0.323	40%	0.395	S	S	.	.	P	Polyproline II helix	trans	-71	118.2	164.5	-56.8	173.4	0	0	0	108.2	L965 G968	L965-I1106 HydrophobicContact CB-CD1 4.23Å; L965-I1106 WeakPolarHBondContact O-CD1 3.36Å; L965-I1106 WeakPolarHBondContact O-CG2 3.43Å; G968-I1106 WeakPolarHBondContact CA-O 3.25Å
1107	K	88	Confident	79.3	Confident	147 Å²	147	78.3 Å²	78.3	64%	0.639	41%	0.413	S	S	*	.	P	Polyproline II helix	trans	-69.4	139	-176.5	-62.3	-163.2	174.7	-163.3	0	111.4	R1105 R1109	R1105-K1107 PolarHBondContact O-N 3.39Å; K1107-R1109 PolarHBondContact O-N 3.16Å
1108	P	79.1	Confident	78.4	Confident	95 Å²	95	79.5 Å²	79.5	62%	0.617	43%	0.425	S	S	*	.	P	Polyproline II helix	trans	-57.6	128.4	-178.3	21.6	-33.1	0	0	0	111.8	G968 Q1110	G968-P1108 WeakPolarHBondContact O-CA 3.27Å; G968-P1108 WeakPolarHBondContact O-CB 3.46Å; P1108-Q1110 PolarHBondContact O-N 3.03Å
1109	R	70	Confident	77.4	Confident	139 Å²	139	79.9 Å²	79.9	53%	0.525	43%	0.427	S	S	.	.			trans	-69.7	111.9	-178.3	-172.4	172.6	179	167.1	-3	110	F967 K1107	F967-R1109 PolarHBondContact O-N 3.18Å; K1107-R1109 PolarHBondContact O-N 3.16Å
1110	Q	55.7	Low	76.1	Confident	153 Å²	153	83.1 Å²	83.1	72%	0.715	44%	0.444	S	S	*	.			trans	-59.6	140.7	-179.9	-68.8	-165.6	-9	0	0	111.7	P1108 S1112	P1108-Q1110 PolarHBondContact O-N 3.03Å; Q1110-S1112 PolarHBondContact O-N 3.1Å
1111	R	55.8	Low	74.6	Confident	144 Å²	144	89 Å²	89	54%	0.543	48%	0.476	S	S	.	.	G	3₁₀ helix	trans	-61.1	-11.5	-178.1	-78.4	-167.4	175.8	101.6	15	115.2	V935 E936 L1113	V935-R1111 PolarHBondContact O-NH2 3.23Å; E936-R1111 VanDerWaalsContact C-NH2 3.26Å; E936-R1111 VanDerWaalsContact CA-NH2 3.34Å; E936-R1111 PolarHBondContact O-NH1 2.62Å; E936-R1111 PolarHBondContact O-NH2 3.39Å; R1111-L1113 PolarHBondContact O-N 2.65Å
1112	S	44.8	Very low	72.9	Confident	92 Å²	92	95.8 Å²	95.8	64%	0.643	51%	0.512	S	S	*	.	G	3₁₀ helix	trans	-70.7	12.2	-174.7	46	0	0	0	0	115.6	Q1110	Q1110-S1112 PolarHBondContact O-N 3.1Å
1113	L	40.7	Very low	71	Confident	136 Å²	136	101.9 Å²	101.9	71%	0.712	55%	0.545	S	S	*	.	G	3₁₀ helix	trans	-133.2	33.3	-177.5	-67.2	175.1	0	0	0	112.7	R1111	R1111-L1113 PolarHBondContact O-N 2.65Å
1114	A	36.3	Very low	68.7	Low	136 Å²	136	107.8 Å²	107.8	100%	1.124	57%	0.572	S	S	*	*			trans	-121.7	0	173.2	0	0	0	0	0	110.6	Y933	Y933-A1114 HydrophobicContact CD1-CB 4.26Å; Y933-A1114 HydrophobicContact CE1-CB 4.19Å

Retrieved 1,114 of 1,114 residues in 935 ms (Link to these results)

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