A0A3Q0KUA2_SCHMA Loading...

SH2 domain-containing protein

AlphaFold DB , UniProt , Accession A0A3Q0KUA2, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,940 aa.

						>A0A3Q0KUA2_SCHMA|A0A3Q0KUA2
MKFKFTLLTSWTLLPTSIPDTDCEDDEAILFAQYLTEYTENKYDLNVFWPRQRGEAFLHNSFNSFEERFLTHSEYALLIVSGQNASCLDYIYPRFLVFFTAKKSWAERILIIFLKQPTCLLNFDLSLLKHPPILFNDDSTNQWINDQESWLKIGELIKHRYIPSINGDLSRHLLTPTEYYISRWMSVTDLRGQPLAVRITSTGQSDSAPASWPDLSGIEPINGMKHVLDPIYPIGQRLSQSASVFEHSPTQSRDSTPNLHLHVNNFNRIRSFSSRCFTRKHQYYNTVFGLDPSWPTLSGNQLNVINNYSGVKCQIDETSHYENLLEKRSKHNVEIDPIYKASQMCIPQKQSKIKSCEFLNESILFCKLSNRINKSTGIINDGSEYSNVITPNHTMKYCQRKIKLSPNKHFIFKEPHHICISSKKLIKLFKFKRKKDTHSVCEKFGTQSQLELAKAVKTLSDVGQSLIEHSGDSVSNLNMLEIQQQQQPSCSYSTTDKFNLSCLSNHADAKEQRVKHTNNDDVNHQSKCSQITPIQSVDFSDSGLWSMSQMATGDCTNSLQRHHTSCSESSVFGYFTNRNNNDCNNSDQTNEIRLQQPITTPINASRFAEIRLSPWSSLKIKDGQQSTEFKLEKSNQTTDATTTIDNNNNNNNNNTSTTTNISNEHGLTCTDNIPLNQKAGMENDTFLLLNCNSEQFVKDQLSNPSVSNVNKFGTNEALKLFNNDDNNNVTHDLNGPMKNQMSCTFNLEPFSSNSTSFEESKNDDESLHSHISKLKQNYPQENSISSTYLSKVHNNNTNSNNASATIGKDFTQLSTFQQNSLISPIVQNNSKLTEYSLPCRISTTCDVLQIHPTIKIYDLNNKPENDLSTVKVTDCKRSIGTHLVNNNDSLKIGPLQLNQDFKGIMTDPTLEQQNPYSSESTPLNTNQTMKIDSQIDINVNCSEDSLLISVECENNSTFNSDIKQNMNSCVMTNKQTLTNSLMELECTTHLPLSLSTDTSADNHYLNKSFSQSLDSNAENLEYLNVVTDHQTNQLQFKNVCLPKQLNEQLTTMPIIEDITELSSTQASTLFKQQKRDPLITPDHAHDVRIDERLSVGSPNGSISDQLENNQSVPSTQVKQISSSNTETSHEDMKPLYLKSDLSNTRNLDDYLLDNSRRNWTLALSSELTNKIDNSSKRKYDFDQLTKEMSNDSEKPSTDLEINKLSTEKKVSSDEISQSLTFLQLHSESVEVSCNKFHTPTKCHNREFSMNDEDISSDVSSTKVDHLQDQHDQLTNSEEPFVASTALSLSSNVNIYHTEGTNFYVIEPLNENTTIDSTNLTRLTEKLSISSNSLNNNDLDADAHFNKVVIKTENDSIDSRVKDLLQRCSLEDMNTLSTIIHIVRSSSIQSLQATDENLLLAKVDRLQYSHNQLTNSEQSFMNTTAESLSSNVNKYCTDGTSISVIEPPSGNPSIDMEKLIQPTAESLNNLSIHSNNTFNIDTRSEFSSQLDVVCKDELIEDNHARTIPLLTAYKEEVCGTMHGINSNSKTVDSLGIESSSLSRLHERNADDDNDYMASDANIITITTTTTTTTTTTTNNNNTPSAAPNDDTIPYDSTISLTFTDKTNILLSSDISDHIELNFNNSLPTPPPGRDNEHLDYSNTTKNSVNISFNNSLELDFNPTISKLSYLMQYEYEFTDNDNNIYWIDPGSLNKDIKTIAQPMRSIAIDNSLEQPERTSSIYNTRSQQLSVVPTTTAATTAIQNPIPPVNEIYIDEDYISHLSLDDKNKKGILGPKIDKNNEEQKSNQRFKFSSGAYSLFTSFFNLATLYVPRHIYWLYGATFTPREQFHRMMAGCGMELYSVELSHPLNVAGIFIGFTLASPYLRTWPYILSGLMNSSEINLFNPLYWIDRPILEHIGCLLYILPSSIRWRSTVIVNSFQQYPWSLANPLELSSSSTSLS
					

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	60.2	Low	90.6	Very high	171 Å²	171	43.2 Å²	43.2	84%	0.842	20%	0.195	S	C	*	.				0	177.2	0	-72.3	70.4	165.2	0	0	109.5
2	K	82	Confident	91	Very high	190 Å²	190	39.6 Å²	39.6	83%	0.826	18%	0.179	S	C	*	.			trans	-98.5	135.7	149.7	-69.8	-175.6	177.4	-176.3	0	107.2
3	F	90.3	Very high	91.3	Very high	45 Å²	45	36.7 Å²	36.7	20%	0.197	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	155.3	173.4	-57.4	-82.7	0	0	0	108.6	N46 F48 H72 S73	F3-N46 WeakPolarHBondContact CA-O 3.4Å; F3-N46 HydrophobicContact CD1-CB 3.96Å; F3-N46 HydrophobicContact CE1-CB 4.34Å; F3-F48 HydrophobicContact CB-CB 4.17Å; F3-F48 HydrophobicContact CD1-CB 3.88Å; F3-F48 HydrophobicContact CD2-CB 3.75Å; F3-F48 HydrophobicContact CD2-CG 4.35Å; F3-F48 HydrophobicContact CE1-CB 4.15Å; F3-F48 HydrophobicContact CE2-CB 4.04Å; F3-F48 HydrophobicContact CE2-CD2 4.2Å; F3-F48 HydrophobicContact CE2-CG 4.23Å; F3-F48 HydrophobicContact CG-CB 3.66Å; F3-F48 HydrophobicContact CZ-CB 4.23Å; F3-F48 HydrophobicContact CZ-CD2 4.08Å; F3-F48 HydrophobicContact CZ-CG 4.45Å; F3-H72 HydrophobicContact CD2-CB 3.87Å; F3-H72 HydrophobicContact CE2-CB 4.34Å; F3-H72 PolarHBondContact N-O 3.25Å; F3-S73 WeakPolarHBondContact O-CA 3.39Å
4	K	90.9	Very high	91.4	Very high	17 Å²	17	34.4 Å²	34.4	7%	0.074	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	-44.5	172.1	-178.8	69.9	-175.7	-174.8	0	110.6	L45 N46 E74 Y75 L156 I157 H159	K4-L45 HydrophobicContact CB-CB 4.45Å; K4-L45 HydrophobicContact CB-CD1 4.2Å; K4-L45 HydrophobicContact CB-CD2 4.45Å; K4-L45 HydrophobicContact CG-CD1 4.11Å; K4-N46 PolarHBondContact N-O 3.37Å; K4-E74 HydrophobicContact CD-CB 4.49Å; K4-E74 IonicContact NZ-OE2 3.25Å; K4-E74 PolarHBondContact NZ-OE2 3.01Å; K4-E74 PolarHBondContact O-N 3.29Å; K4-E74 VanDerWaalsContact O-N 3.14Å; K4-Y75 PolarHBondContact O-N 2.66Å; K4-L156 VanDerWaalsContact CE-O 3.29Å; K4-L156 WeakPolarHBondContact CE-O 3.47Å; K4-L156 PolarHBondContact NZ-O 3.29Å; K4-I157 WeakPolarHBondContact CE-O 3.16Å; K4-I157 PolarHBondContact NZ-O 2.59Å; K4-H159 PolarHBondContact NZ-O 3.02Å
5	F	94.5	Very high	91.5	Very high	3 Å²	3	33.4 Å²	33.4	1%	0.013	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	152.3	-179.1	-53	-84.1	0	0	0	111.4	L7 V47 F48 Y75 L77 L156 I157	F5-L7 HydrophobicContact CB-CD2 4.45Å; F5-V47 HydrophobicContact CB-CG1 4.42Å; F5-V47 HydrophobicContact CB-CG2 4.4Å; F5-V47 HydrophobicContact CD2-CG2 4.11Å; F5-F48 PolarHBondContact O-N 3.36Å; F5-Y75 WeakPolarHBondContact CA-O 3.17Å; F5-Y75 HydrophobicContact CD1-CG 4.49Å; F5-Y75 HydrophobicContact CE1-CD2 4.19Å; F5-Y75 HydrophobicContact CE1-CG 4.28Å; F5-L77 HydrophobicContact CB-CD1 4.26Å; F5-L77 HydrophobicContact CB-CG 4.39Å; F5-L77 HydrophobicContact CD1-CD1 3.73Å; F5-L77 HydrophobicContact CD1-CD2 4.12Å; F5-L77 HydrophobicContact CD1-CG 3.8Å; F5-L77 HydrophobicContact CE1-CD1 4.27Å; F5-L77 HydrophobicContact CE1-CD2 4.44Å; F5-L77 HydrophobicContact CG-CD1 3.95Å; F5-L77 HydrophobicContact CG-CG 4.3Å; F5-L156 HydrophobicContact CE1-CB 4.49Å; F5-I157 HydrophobicContact CE2-CG1 3.61Å; F5-I157 HydrophobicContact CZ-CB 4.45Å; F5-I157 HydrophobicContact CZ-CG1 3.62Å
6	T	97.4	Very high	91.5	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	128.4	152.8	-57.6	0	0	0	0	109.5	L8 F48 F69 L70 S73 Y75 A76 L77	T6-L8 HydrophobicContact CG2-CD2 4.01Å; T6-L8 HydrophobicContact CG2-CG 4.19Å; T6-F48 CarbonylContact C-O 3.17Å; T6-F48 WeakPolarHBondContact CA-O 3.31Å; T6-F48 HydrophobicContact CG2-CD1 3.93Å; T6-F69 WeakPolarHBondContact CB-O 3.41Å; T6-F69 VanDerWaalsContact CG2-O 3.29Å; T6-F69 WeakPolarHBondContact CG2-O 3.49Å; T6-F69 PolarHBondContact OG1-O 3.45Å; T6-L70 HydrophobicContact CG2-CD2 4.49Å; T6-S73 WeakPolarHBondContact OG1-CB 3.07Å; T6-S73 PolarHBondContact OG1-OG 2.98Å; T6-Y75 PolarHBondContact N-O 2.98Å; T6-A76 CarbonylContact O-C 2.96Å; T6-A76 VanDerWaalsContact O-CA 3.24Å; T6-A76 WeakPolarHBondContact O-CA 3.31Å; T6-L77 PolarHBondContact O-N 3.17Å
7	L	97.9	Very high	91.5	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	135.3	168.6	-49.5	-172	0	0	0	109.3	F5 A32 L35 V47 F48 W49 P50 L77 I79	F5-L7 HydrophobicContact CB-CD2 4.45Å; L7-A32 HydrophobicContact CD1-CB 3.99Å; L7-A32 WeakPolarHBondContact CD1-O 3.5Å; L7-L35 HydrophobicContact CD1-CB 4.5Å; L7-L35 HydrophobicContact CD1-CD2 4.12Å; L7-L35 HydrophobicContact CD1-CG 4.4Å; L7-L35 HydrophobicContact CD2-CD2 3.6Å; L7-L35 HydrophobicContact CD2-CG 4.42Å; L7-V47 HydrophobicContact CD1-CG1 3.92Å; L7-V47 HydrophobicContact CD2-CG1 3.84Å; L7-V47 HydrophobicContact CG-CG1 3.49Å; L7-V47 VanDerWaalsContact CG-CG1 3.49Å; L7-F48 PolarHBondContact N-O 2.89Å; L7-W49 HydrophobicContact CB-CB 4.09Å; L7-W49 HydrophobicContact CB-CG 4.03Å; L7-W49 HydrophobicContact CD1-CB 4.44Å; L7-W49 HydrophobicContact CD1-CG 4.45Å; L7-W49 HydrophobicContact CG-CB 4.41Å; L7-P50 WeakPolarHBondContact O-CD 3.3Å; L7-L77 HydrophobicContact CD2-CB 3.96Å; L7-L77 HydrophobicContact CD2-CD1 3.86Å; L7-L77 HydrophobicContact CD2-CG 4.31Å; L7-I79 HydrophobicContact CB-CD1 4.14Å; L7-I79 HydrophobicContact CD1-CD1 4.19Å; L7-I79 HydrophobicContact CD2-CD1 4.25Å; L7-I79 HydrophobicContact CG-CD1 4.41Å
8	L	97.5	Very high	91.4	Very high	0 Å²	0	40 Å²	40	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	113.9	176	-63.4	172.2	0	0	0	107.5	T6 L13 P50 A56 F65 L70 A76 L77 L78 I79	T6-L8 HydrophobicContact CG2-CD2 4.01Å; T6-L8 HydrophobicContact CG2-CG 4.19Å; L8-L13 HydrophobicContact CB-CD1 3.92Å; L8-L13 HydrophobicContact CB-CD2 4.44Å; L8-L13 HydrophobicContact CB-CG 4.09Å; L8-L13 HydrophobicContact CD1-CD1 4.47Å; L8-L13 HydrophobicContact CD1-CD2 4.3Å; L8-L13 HydrophobicContact CD2-CD2 4.21Å; L8-P50 HydrophobicContact CD2-CG 4.09Å; L8-A56 HydrophobicContact CD2-CB 3.78Å; L8-F65 HydrophobicContact CD1-CZ 4.2Å; L8-L70 HydrophobicContact CD1-CD2 4.42Å; L8-A76 HydrophobicContact CD1-CB 4.4Å; L8-L77 PolarHBondContact N-O 3.22Å; L8-L78 HydrophobicContact CB-CD1 4.5Å; L8-L78 CarbonylContact O-C 3.54Å; L8-L78 VanDerWaalsContact O-CA 3.32Å; L8-L78 WeakPolarHBondContact O-CA 3.23Å; L8-L78 WeakPolarHBondContact O-CD1 3.44Å; L8-I79 PolarHBondContact O-N 2.93Å
9	T	97.3	Very high	91.3	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	157.8	170.7	60.4	0	0	0	0	110.4	W11 T12 L13 A28 A32 I79	T9-W11 VanDerWaalsContact C-N 3.27Å; T9-W11 PolarHBondContact O-N 2.83Å; T9-T12 PolarHBondContact N-OG1 2.65Å; T9-T12 PolarHBondContact O-N 3.07Å; T9-T12 PolarHBondContact O-OG1 3.27Å; T9-T12 WeakPolarHBondContact OG1-CG2 3.3Å; T9-L13 PolarHBondContact O-N 3.13Å; T9-L13 VanDerWaalsContact O-N 3.08Å; T9-A28 HydrophobicContact CG2-CB 4.21Å; T9-A32 HydrophobicContact CG2-CB 3.92Å; T9-I79 WeakPolarHBondContact CA-O 3.35Å; T9-I79 HydrophobicContact CG2-CB 4.39Å
10	S	94.7	Very high	91.1	Very high	2 Å²	2	43.4 Å²	43.4	1%	0.014	23%	0.229	C	C	.	.	H	α-helix	trans	-39	-54.3	165.2	47	0	0	0	0	112.5	T12 L13 L14 D25 C87	S10-T12 VanDerWaalsContact C-N 3.28Å; S10-T12 PolarHBondContact O-N 2.7Å; S10-L13 PolarHBondContact O-N 3.22Å; S10-L14 WeakPolarHBondContact O-CB 2.95Å; S10-L14 VanDerWaalsContact O-CG 3.28Å; S10-L14 WeakPolarHBondContact O-CG 3.41Å; S10-L14 PolarHBondContact O-N 3.39Å; S10-D25 WeakPolarHBondContact CB-OD2 3.32Å; S10-D25 WeakPolarHBondContact OG-CB 3.3Å; S10-D25 VanDerWaalsContact OG-CG 3.24Å; S10-D25 PolarHBondContact OG-OD2 3.49Å; S10-C87 WeakPolarHBondContact CB-SG 3.3Å
11	W	94.6	Very high	90.8	Very high	47 Å²	47	46.7 Å²	46.7	18%	0.178	25%	0.251	C	S	.	.	H	α-helix	trans	-49.6	-39.9	174.7	-176.8	-105.5	0	0	0	115	T9 D20 C23 E24 I29 R53 G54	T9-W11 VanDerWaalsContact C-N 3.27Å; T9-W11 PolarHBondContact O-N 2.83Å; W11-D20 WeakPolarHBondContact CH2-OD1 3.28Å; W11-D20 HydrophobicContact CZ3-CB 4.49Å; W11-C23 HydrophobicContact CE3-CB 4.06Å; W11-C23 HydrophobicContact CZ3-CB 4.3Å; W11-E24 HydrophobicContact CZ3-CB 4.31Å; W11-I29 HydrophobicContact CB-CD1 4.13Å; W11-I29 HydrophobicContact CD2-CD1 4.49Å; W11-I29 HydrophobicContact CG-CD1 4.09Å; W11-R53 HydrophobicContact CD2-CB 4.29Å; W11-R53 HydrophobicContact CD2-CG 3.85Å; W11-R53 HydrophobicContact CE3-CG 4.08Å; W11-R53 HydrophobicContact CH2-CB 4.47Å; W11-R53 VanDerWaalsContact CH2-CD 3.45Å; W11-R53 HydrophobicContact CH2-CG 4.03Å; W11-R53 HydrophobicContact CZ2-CB 3.76Å; W11-R53 HydrophobicContact CZ2-CG 3.76Å; W11-R53 HydrophobicContact CZ3-CG 4.17Å; W11-G54 PolarHBondContact O-N 2.89Å
12	T	95.2	Very high	91.9	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-81.6	-24	-179.6	65.2	0	0	0	0	113.3	T9 S10 P50 G54 E55 A56 F57	T9-T12 PolarHBondContact N-OG1 2.65Å; T9-T12 PolarHBondContact O-N 3.07Å; T9-T12 PolarHBondContact O-OG1 3.27Å; T9-T12 WeakPolarHBondContact OG1-CG2 3.3Å; S10-T12 VanDerWaalsContact C-N 3.28Å; S10-T12 PolarHBondContact O-N 2.7Å; T12-P50 HydrophobicContact CG2-CB 4.38Å; T12-P50 HydrophobicContact CG2-CG 4.23Å; T12-P50 WeakPolarHBondContact CG2-O 3.49Å; T12-G54 CarbonylContact O-C 3.56Å; T12-G54 WeakPolarHBondContact O-CA 3.12Å; T12-E55 PolarHBondContact O-N 3.43Å; T12-A56 CarbonylContact O-C 3.54Å; T12-A56 WeakPolarHBondContact O-CA 3.35Å; T12-A56 PolarHBondContact O-N 2.66Å; T12-F57 PolarHBondContact O-N 2.89Å; T12-F57 VanDerWaalsContact O-N 3.16Å
13	L	94.4	Very high	91.7	Very high	2 Å²	2	33.9 Å²	33.9	1%	0.01	20%	0.195	C	C	.	.	H	α-helix	trans	-99.8	-20.1	-175.2	-75.5	-177.4	0	0	0	114.3	L8 T9 S10 A56 F57 F65 L78 I91 F95	L8-L13 HydrophobicContact CB-CD1 3.92Å; L8-L13 HydrophobicContact CB-CD2 4.44Å; L8-L13 HydrophobicContact CB-CG 4.09Å; L8-L13 HydrophobicContact CD1-CD1 4.47Å; L8-L13 HydrophobicContact CD1-CD2 4.3Å; L8-L13 HydrophobicContact CD2-CD2 4.21Å; T9-L13 PolarHBondContact O-N 3.13Å; T9-L13 VanDerWaalsContact O-N 3.08Å; S10-L13 PolarHBondContact O-N 3.22Å; L13-A56 HydrophobicContact CD2-CB 4.06Å; L13-A56 WeakPolarHBondContact CD2-O 3.49Å; L13-F57 WeakPolarHBondContact O-CB 3.29Å; L13-F57 WeakPolarHBondContact O-CD2 3.3Å; L13-F65 HydrophobicContact CD2-CE2 4.04Å; L13-F65 HydrophobicContact CD2-CZ 4.44Å; L13-L78 HydrophobicContact CD1-CD1 3.51Å; L13-L78 HydrophobicContact CD1-CD2 4.32Å; L13-I91 HydrophobicContact CB-CD1 4.44Å; L13-I91 HydrophobicContact CD1-CD1 3.86Å; L13-F95 HydrophobicContact CD1-CE2 4.26Å; L13-F95 HydrophobicContact CD1-CZ 3.86Å; L13-F95 HydrophobicContact CD2-CE2 4.38Å; L13-F95 HydrophobicContact CD2-CZ 4.22Å
14	L	93.4	Very high	91.6	Very high	4 Å²	4	36.6 Å²	36.6	2%	0.021	21%	0.208	C	C	.	.	S	Bend	trans	-81.3	145.7	177.3	-68.3	167.2	0	0	0	111.1	S10 I18 C23 G54 C87 I91	S10-L14 WeakPolarHBondContact O-CB 2.95Å; S10-L14 VanDerWaalsContact O-CG 3.28Å; S10-L14 WeakPolarHBondContact O-CG 3.41Å; S10-L14 PolarHBondContact O-N 3.39Å; L14-I18 HydrophobicContact CD2-CD1 4.06Å; L14-C23 HydrophobicContact CD1-CB 3.86Å; L14-C23 VanDerWaalsContact CD1-SG 3.54Å; L14-G54 WeakPolarHBondContact O-CA 3.49Å; L14-C87 HydrophobicContact CD1-CB 3.92Å; L14-C87 HydrophobicContact CD2-CB 4.17Å; L14-C87 HydrophobicContact CG-CB 4.45Å; L14-I91 HydrophobicContact CD2-CG2 4.21Å
15	P	91.7	Very high	91.7	Very high	20 Å²	20	35.9 Å²	35.9	13%	0.13	21%	0.206	C	C	.	.			trans	-65.8	143.5	173.4	25.2	-31.4	0	0	0	111.6	S17 I18 F57	P15-S17 PolarHBondContact O-N 2.89Å; P15-I18 HydrophobicContact CG-CD1 3.79Å; P15-I18 HydrophobicContact CG-CG1 4.03Å; P15-I18 PolarHBondContact O-N 3.43Å; P15-F57 HydrophobicContact CB-CD1 3.84Å; P15-F57 HydrophobicContact CB-CE1 3.59Å; P15-F57 HydrophobicContact CB-CE2 4.26Å; P15-F57 HydrophobicContact CB-CG 4.28Å; P15-F57 HydrophobicContact CB-CZ 3.76Å; P15-F57 HydrophobicContact CG-CE1 4.24Å; P15-F57 HydrophobicContact CG-CE2 4.12Å; P15-F57 HydrophobicContact CG-CZ 3.88Å
16	T	92.2	Very high	91.7	Very high	84 Å²	84	40.2 Å²	40.2	52%	0.515	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.7	3.8	171.8	52.8	0	0	0	0	114.8	R53	T16-R53 HydrophobicContact CG2-CB 4.23Å; T16-R53 HydrophobicContact CG2-CG 4.18Å; T16-R53 VanDerWaalsContact CG2-O 3.24Å; T16-R53 WeakPolarHBondContact CG2-O 3.31Å
17	S	92	Very high	91.6	Very high	105 Å²	105	42.1 Å²	42.1	73%	0.734	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-97.6	-2.4	176.2	67.6	0	0	0	0	114.3	P15	P15-S17 PolarHBondContact O-N 2.89Å
18	I	90.1	Very high	91.6	Very high	30 Å²	30	42.1 Å²	42.1	15%	0.154	24%	0.238	C	C	.	.	S	Bend	trans	-88.5	150.3	167.8	-64.9	170.7	0	0	0	107.3	L14 P15 D22 C23 R53 Y90	L14-I18 HydrophobicContact CD2-CD1 4.06Å; P15-I18 HydrophobicContact CG-CD1 3.79Å; P15-I18 HydrophobicContact CG-CG1 4.03Å; P15-I18 PolarHBondContact O-N 3.43Å; I18-D22 HydrophobicContact CG2-CB 3.78Å; I18-C23 WeakPolarHBondContact CG2-SG 3.43Å; I18-R53 PolarHBondContact O-NH1 2.91Å; I18-R53 PolarHBondContact O-NH2 3.43Å; I18-Y90 HydrophobicContact CD1-CD1 4.31Å
19	P	89.2	Confident	91.5	Very high	71 Å²	71	43.5 Å²	43.5	46%	0.461	25%	0.245	S	C	.	.			trans	-55.5	148.3	171.7	-26.2	36.6	0	0	0	112.6	T21 D22 C23 R53	P19-T21 VanDerWaalsContact C-N 3.26Å; P19-T21 WeakPolarHBondContact CB-OG1 3.45Å; P19-T21 PolarHBondContact O-N 3.35Å; P19-D22 PolarHBondContact O-N 2.88Å; P19-C23 PolarHBondContact O-SG 3.34Å; P19-C23 VanDerWaalsContact O-SG 3.33Å; P19-R53 PolarHBondContact O-NH2 3.31Å; P19-R53 VanDerWaalsContact O-NH2 3.14Å
20	D	86.4	Confident	91.5	Very high	77 Å²	77	47.6 Å²	47.6	41%	0.412	27%	0.266	S	S	.	.	G	3₁₀ helix	trans	-60.8	-38.2	176.4	-62.9	-92.3	0	0	0	111.2	W11 D22 C23 E24 R53	W11-D20 WeakPolarHBondContact CH2-OD1 3.28Å; W11-D20 HydrophobicContact CZ3-CB 4.49Å; D20-D22 PolarHBondContact O-N 2.98Å; D20-C23 CarbonylContact O-C 3.39Å; D20-C23 PolarHBondContact O-N 2.92Å; D20-E24 WeakPolarHBondContact O-CB 3.45Å; D20-E24 PolarHBondContact O-N 2.81Å; D20-R53 VanDerWaalsContact CG-CZ 3.49Å; D20-R53 WeakPolarHBondContact OD1-CD 3.39Å; D20-R53 IonicContact OD1-CZ 3.64Å; D20-R53 IonicContact OD1-NE 2.84Å; D20-R53 PolarHBondContact OD1-NE 3.14Å; D20-R53 IonicContact OD1-NH1 2.71Å; D20-R53 PolarHBondContact OD1-NH1 3.14Å; D20-R53 IonicContact OD1-NH2 2.67Å; D20-R53 IonicContact OD2-CZ 3.64Å; D20-R53 IonicContact OD2-NH1 2.65Å; D20-R53 PolarHBondContact OD2-NH1 2.85Å
21	T	85.8	Confident	91.6	Very high	113 Å²	113	47.5 Å²	47.5	69%	0.693	27%	0.266	S	S	*	.	G	3₁₀ helix	trans	-53.5	-25.6	175.8	53.9	0	0	0	0	115.1	P19	P19-T21 VanDerWaalsContact C-N 3.26Å; P19-T21 WeakPolarHBondContact CB-OG1 3.45Å; P19-T21 PolarHBondContact O-N 3.35Å
22	D	81.7	Confident	91.7	Very high	90 Å²	90	45.3 Å²	45.3	48%	0.481	26%	0.257	S	S	.	.	G	3₁₀ helix	trans	-103.9	1.1	-175.6	-47.3	-6.9	0	0	0	111.2	I18 P19 D20	I18-D22 HydrophobicContact CG2-CB 3.78Å; P19-D22 PolarHBondContact O-N 2.88Å; D20-D22 PolarHBondContact O-N 2.98Å
23	C	78.2	Confident	91.8	Very high	1 Å²	1	49 Å²	49	1%	0.007	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-124.8	-23.7	-176.2	-63.8	0	0	0	0	113.9	W11 L14 I18 P19 D20 D25 R53	W11-C23 HydrophobicContact CE3-CB 4.06Å; W11-C23 HydrophobicContact CZ3-CB 4.3Å; L14-C23 HydrophobicContact CD1-CB 3.86Å; L14-C23 VanDerWaalsContact CD1-SG 3.54Å; I18-C23 WeakPolarHBondContact CG2-SG 3.43Å; P19-C23 PolarHBondContact O-SG 3.34Å; P19-C23 VanDerWaalsContact O-SG 3.33Å; D20-C23 CarbonylContact O-C 3.39Å; D20-C23 PolarHBondContact O-N 2.92Å; C23-D25 PolarHBondContact O-N 2.77Å; C23-R53 PolarHBondContact SG-NH2 2.94Å
24	E	88.1	Confident	91.9	Very high	102 Å²	102	51.2 Å²	51.2	48%	0.477	28%	0.283	S	S	.	.			trans	-70.1	117.1	-176.6	-165.5	155.8	-123.4	0	0	109.4	W11 D20 N84	W11-E24 HydrophobicContact CZ3-CB 4.31Å; D20-E24 WeakPolarHBondContact O-CB 3.45Å; D20-E24 PolarHBondContact O-N 2.81Å; E24-N84 PolarHBondContact O-ND2 2.63Å
25	D	94	Very high	92	Very high	3 Å²	3	51 Å²	51	2%	0.016	28%	0.282	C	S	.	.			trans	-135	64	-168.8	-164.4	-8.4	0	0	0	108.1	S10 C23 E27 A28 I29 S81 N84	S10-D25 WeakPolarHBondContact CB-OD2 3.32Å; S10-D25 WeakPolarHBondContact OG-CB 3.3Å; S10-D25 VanDerWaalsContact OG-CG 3.24Å; S10-D25 PolarHBondContact OG-OD2 3.49Å; C23-D25 PolarHBondContact O-N 2.77Å; D25-E27 PolarHBondContact O-N 2.69Å; D25-A28 HydrophobicContact CB-CB 4.05Å; D25-A28 WeakPolarHBondContact O-CA 3.35Å; D25-A28 WeakPolarHBondContact O-CB 3.48Å; D25-A28 PolarHBondContact O-N 2.88Å; D25-A28 WeakPolarHBondContact OD1-CB 3.32Å; D25-A28 PolarHBondContact OD1-N 2.88Å; D25-A28 WeakPolarHBondContact OD2-CB 3.43Å; D25-I29 WeakPolarHBondContact O-CG1 3.3Å; D25-I29 PolarHBondContact O-N 3.13Å; D25-S81 WeakPolarHBondContact OD1-CB 3.37Å; D25-S81 PolarHBondContact OD1-N 3.17Å; D25-S81 PolarHBondContact OD1-OG 2.83Å; D25-S81 PolarHBondContact OD2-N 2.94Å; D25-N84 WeakPolarHBondContact CA-ND2 3.37Å; D25-N84 VanDerWaalsContact CB-ND2 3.31Å; D25-N84 WeakPolarHBondContact CB-ND2 3.43Å
26	D	94.7	Very high	92.2	Very high	94 Å²	94	50.8 Å²	50.8	50%	0.503	28%	0.28	S	S	.	.	H	α-helix	trans	-56.9	-36.9	-173.2	-71.4	-30.1	0	0	0	112.1	A28 I29 L30	D26-A28 PolarHBondContact O-N 2.85Å; D26-I29 PolarHBondContact O-N 3.24Å; D26-L30 VanDerWaalsContact O-CB 3.25Å; D26-L30 WeakPolarHBondContact O-CB 2.95Å; D26-L30 WeakPolarHBondContact O-CG 3.07Å; D26-L30 PolarHBondContact O-N 2.94Å
27	E	95.2	Very high	92.4	Very high	39 Å²	39	52.1 Å²	52.1	18%	0.182	28%	0.281	C	S	.	.	H	α-helix	trans	-56.8	-48.2	172	-68.3	-176.6	-174.5	0	0	110.9	D25 F31 S81 L114 K115 W143	D25-E27 PolarHBondContact O-N 2.69Å; E27-F31 VanDerWaalsContact O-CB 3.3Å; E27-F31 WeakPolarHBondContact O-CB 3.46Å; E27-F31 PolarHBondContact O-N 3Å; E27-S81 WeakPolarHBondContact OE2-CB 3.22Å; E27-L114 VanDerWaalsContact C-CD1 3.45Å; E27-L114 HydrophobicContact CB-CD1 4.09Å; E27-L114 VanDerWaalsContact O-CD1 3.26Å; E27-L114 WeakPolarHBondContact O-CD1 3.2Å; E27-K115 IonicContact OE1-NZ 2.72Å; E27-K115 PolarHBondContact OE1-NZ 2.95Å; E27-K115 IonicContact OE2-NZ 3.23Å; E27-W143 WeakPolarHBondContact O-CH2 3.38Å
28	A	96.5	Very high	92.5	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-68.6	-34.4	177.7	0	0	0	0	0	113.5	T9 D25 D26 A32 I79 L114	T9-A28 HydrophobicContact CG2-CB 4.21Å; D25-A28 HydrophobicContact CB-CB 4.05Å; D25-A28 WeakPolarHBondContact O-CA 3.35Å; D25-A28 WeakPolarHBondContact O-CB 3.48Å; D25-A28 PolarHBondContact O-N 2.88Å; D25-A28 WeakPolarHBondContact OD1-CB 3.32Å; D25-A28 PolarHBondContact OD1-N 2.88Å; D25-A28 WeakPolarHBondContact OD2-CB 3.43Å; D26-A28 PolarHBondContact O-N 2.85Å; A28-A32 VanDerWaalsContact O-CB 3.3Å; A28-A32 WeakPolarHBondContact O-CB 2.47Å; A28-A32 PolarHBondContact O-N 2.75Å; A28-I79 HydrophobicContact CB-CG2 3.84Å; A28-L114 HydrophobicContact CB-CD1 4.46Å
29	I	96.4	Very high	92.7	Very high	30 Å²	30	47.4 Å²	47.4	15%	0.154	25%	0.245	C	C	.	.	H	α-helix	trans	-70.4	-44.9	177.6	-67.4	170.2	0	0	0	110.6	W11 D25 D26 A32 Q33 W49	W11-I29 HydrophobicContact CB-CD1 4.13Å; W11-I29 HydrophobicContact CD2-CD1 4.49Å; W11-I29 HydrophobicContact CG-CD1 4.09Å; D25-I29 WeakPolarHBondContact O-CG1 3.3Å; D25-I29 PolarHBondContact O-N 3.13Å; D26-I29 PolarHBondContact O-N 3.24Å; I29-A32 PolarHBondContact O-N 3.12Å; I29-Q33 WeakPolarHBondContact O-CG 3.43Å; I29-Q33 PolarHBondContact O-N 3.48Å; I29-W49 HydrophobicContact CG2-CH2 4.11Å; I29-W49 HydrophobicContact CG2-CZ2 4.19Å
30	L	96.1	Very high	92.9	Very high	86 Å²	86	48.2 Å²	48.2	45%	0.45	24%	0.243	S	C	.	.	H	α-helix	trans	-65.9	-39.2	175.3	-70.1	168.4	0	0	0	111.4	D26 Q33 Y34 W143	D26-L30 VanDerWaalsContact O-CB 3.25Å; D26-L30 WeakPolarHBondContact O-CB 2.95Å; D26-L30 WeakPolarHBondContact O-CG 3.07Å; D26-L30 PolarHBondContact O-N 2.94Å; L30-Q33 PolarHBondContact O-N 2.91Å; L30-Y34 WeakPolarHBondContact O-CB 3.27Å; L30-Y34 PolarHBondContact O-N 3.03Å; L30-W143 HydrophobicContact CB-CH2 4.11Å; L30-W143 HydrophobicContact CB-CZ3 4.34Å
31	F	97.4	Very high	93.4	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-65.6	-38.3	173.2	-172.4	-90.4	0	0	0	112	E27 Y34 L35 I79 I112 L114 F135 W143 W150	E27-F31 VanDerWaalsContact O-CB 3.3Å; E27-F31 WeakPolarHBondContact O-CB 3.46Å; E27-F31 PolarHBondContact O-N 3Å; F31-Y34 PolarHBondContact O-N 2.84Å; F31-L35 HydrophobicContact CD1-CB 4.39Å; F31-L35 HydrophobicContact CE1-CB 4.19Å; F31-L35 HydrophobicContact CE1-CD2 3.97Å; F31-L35 WeakPolarHBondContact O-CB 2.53Å; F31-L35 PolarHBondContact O-N 3.01Å; F31-I79 HydrophobicContact CB-CG2 4.29Å; F31-I79 HydrophobicContact CD1-CD1 4.03Å; F31-I79 HydrophobicContact CD1-CG1 4.23Å; F31-I79 HydrophobicContact CD1-CG2 3.73Å; F31-I79 HydrophobicContact CE1-CD1 4.48Å; F31-I79 HydrophobicContact CG-CG2 4.34Å; F31-I112 HydrophobicContact CE1-CD1 4.1Å; F31-I112 HydrophobicContact CE1-CG2 3.99Å; F31-I112 HydrophobicContact CZ-CG2 4.21Å; F31-L114 HydrophobicContact CB-CD1 3.52Å; F31-L114 HydrophobicContact CB-CD2 4.15Å; F31-L114 HydrophobicContact CB-CG 4.47Å; F31-L114 HydrophobicContact CD1-CD2 4.12Å; F31-L114 HydrophobicContact CD2-CD1 4.4Å; F31-L114 HydrophobicContact CD2-CD2 3.49Å; F31-L114 VanDerWaalsContact CD2-CD2 3.49Å; F31-L114 HydrophobicContact CE1-CD2 4.44Å; F31-L114 HydrophobicContact CE2-CD2 3.87Å; F31-L114 HydrophobicContact CG-CD1 3.99Å; F31-L114 HydrophobicContact CG-CD2 3.64Å; F31-L114 HydrophobicContact CG-CG 4.45Å; F31-L114 HydrophobicContact CZ-CD2 4.34Å; F31-F135 HydrophobicContact CE1-CE2 4.39Å; F31-F135 HydrophobicContact CE2-CD1 4.17Å; F31-F135 AromaticContact CE2-CD2 3.93Å; F31-F135 HydrophobicContact CE2-CD2 3.93Å; F31-F135 HydrophobicContact CE2-CE1 4.05Å; F31-F135 AromaticContact CE2-CE2 3.8Å; F31-F135 HydrophobicContact CE2-CE2 3.8Å; F31-F135 HydrophobicContact CE2-CG 4.12Å; F31-F135 AromaticContact CE2-CZ 3.85Å; F31-F135 HydrophobicContact CE2-CZ 3.85Å; F31-F135 AromaticContact CZ-CD2 3.88Å; F31-F135 HydrophobicContact CZ-CD2 3.88Å; F31-F135 HydrophobicContact CZ-CE1 4.28Å; F31-F135 AromaticContact CZ-CE2 3.39Å; F31-F135 HydrophobicContact CZ-CE2 3.39Å; F31-F135 AromaticContact CZ-CZ 3.62Å; F31-F135 HydrophobicContact CZ-CZ 3.62Å; F31-W143 VanDerWaalsContact CA-CZ3 3.46Å; F31-W143 HydrophobicContact CB-CE3 4.28Å; F31-W143 HydrophobicContact CB-CH2 3.67Å; F31-W143 HydrophobicContact CB-CZ2 4.13Å; F31-W143 HydrophobicContact CB-CZ3 3.74Å; F31-W143 AromaticContact CD2-CD2 3.61Å; F31-W143 HydrophobicContact CD2-CD2 3.61Å; F31-W143 AromaticContact CD2-CE2 3.95Å; F31-W143 AromaticContact CD2-CE3 3.59Å; F31-W143 HydrophobicContact CD2-CE3 3.59Å; F31-W143 HydrophobicContact CD2-CG 4.1Å; F31-W143 HydrophobicContact CD2-CH2 4.29Å; F31-W143 HydrophobicContact CD2-CZ2 4.27Å; F31-W143 AromaticContact CD2-CZ3 3.96Å; F31-W143 HydrophobicContact CD2-CZ3 3.96Å; F31-W143 HydrophobicContact CE2-CD2 4.28Å; F31-W143 HydrophobicContact CE2-CE3 4.45Å; F31-W143 HydrophobicContact CE2-CG 4.3Å; F31-W143 HydrophobicContact CG-CE3 4.4Å; F31-W143 HydrophobicContact CG-CZ3 4.34Å; F31-W150 HydrophobicContact CE2-CH2 4.48Å; F31-W150 HydrophobicContact CE2-CZ2 4.18Å; F31-W150 HydrophobicContact CZ-CH2 4.16Å; F31-W150 HydrophobicContact CZ-CZ2 4.26Å
32	A	97.3	Very high	93.7	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-65.7	-38.2	176	0	0	0	0	0	112.5	L7 T9 A28 I29 T36 W49 I79	L7-A32 HydrophobicContact CD1-CB 3.99Å; L7-A32 WeakPolarHBondContact CD1-O 3.5Å; T9-A32 HydrophobicContact CG2-CB 3.92Å; A28-A32 VanDerWaalsContact O-CB 3.3Å; A28-A32 WeakPolarHBondContact O-CB 2.47Å; A28-A32 PolarHBondContact O-N 2.75Å; I29-A32 PolarHBondContact O-N 3.12Å; A32-T36 WeakPolarHBondContact O-CB 3.39Å; A32-T36 PolarHBondContact O-N 3.37Å; A32-T36 VanDerWaalsContact O-N 3.09Å; A32-T36 PolarHBondContact O-OG1 3.35Å; A32-W49 HydrophobicContact CB-CD2 4.05Å; A32-W49 HydrophobicContact CB-CE3 4.43Å; A32-W49 HydrophobicContact CB-CH2 4.22Å; A32-W49 HydrophobicContact CB-CZ2 3.78Å; A32-I79 HydrophobicContact CB-CD1 3.92Å
33	Q	96.9	Very high	94.3	Very high	79 Å²	79	50.2 Å²	50.2	37%	0.369	24%	0.239	S	C	.	.	H	α-helix	trans	-60.6	-56.5	170	-69.6	171.5	16.6	0	0	110.6	I29 L30 L35 T36 E37 W49	I29-Q33 WeakPolarHBondContact O-CG 3.43Å; I29-Q33 PolarHBondContact O-N 3.48Å; L30-Q33 PolarHBondContact O-N 2.91Å; Q33-L35 VanDerWaalsContact C-N 3.34Å; Q33-L35 PolarHBondContact O-N 3.39Å; Q33-T36 WeakPolarHBondContact O-CB 3.5Å; Q33-T36 PolarHBondContact O-N 3.11Å; Q33-T36 VanDerWaalsContact O-N 3.08Å; Q33-E37 PolarHBondContact O-N 3.14Å; Q33-W49 HydrophobicContact CB-CZ3 4.49Å; Q33-W49 HydrophobicContact CG-CH2 3.63Å; Q33-W49 HydrophobicContact CG-CZ3 3.55Å
34	Y	96.1	Very high	95	Very high	47 Å²	47	56.7 Å²	56.7	18%	0.184	27%	0.274	C	S	.	.	H	α-helix	trans	-57.4	-43.5	-179	-178.8	-92.7	0	0	0	112.8	L30 F31 T36 E37 Y38 I144 W150	L30-Y34 WeakPolarHBondContact O-CB 3.27Å; L30-Y34 PolarHBondContact O-N 3.03Å; F31-Y34 PolarHBondContact O-N 2.84Å; Y34-T36 VanDerWaalsContact C-N 3.34Å; Y34-T36 PolarHBondContact O-N 3.49Å; Y34-E37 PolarHBondContact O-N 2.85Å; Y34-Y38 AromaticContact CE1-CD2 3.94Å; Y34-Y38 HydrophobicContact CE1-CD2 3.94Å; Y34-Y38 HydrophobicContact CE1-CG 4.36Å; Y34-Y38 AromaticContact CZ-CD2 3.94Å; Y34-Y38 WeakPolarHBondContact O-CB 3.47Å; Y34-Y38 PolarHBondContact O-N 3.44Å; Y34-Y38 WeakPolarHBondContact OH-CD2 3.46Å; Y34-I144 HydrophobicContact CE2-CD1 4.35Å; Y34-I144 HydrophobicContact CE2-CG1 4.24Å; Y34-I144 VanDerWaalsContact OH-CG1 3.26Å; Y34-I144 WeakPolarHBondContact OH-CG1 3.5Å; Y34-W150 HydrophobicContact CD1-CH2 4.18Å; Y34-W150 AromaticContact CD1-CZ2 3.93Å; Y34-W150 HydrophobicContact CD1-CZ2 3.93Å; Y34-W150 AromaticContact CE1-CH2 3.98Å; Y34-W150 HydrophobicContact CE1-CH2 3.98Å; Y34-W150 AromaticContact CE1-CZ2 3.53Å; Y34-W150 HydrophobicContact CE1-CZ2 3.53Å
35	L	96.4	Very high	95.2	Very high	1 Å²	1	54.1 Å²	54.1	1%	0.005	26%	0.263	C	S	.	.	H	α-helix	trans	-65.1	-36.9	177.5	176.2	62.7	0	0	0	112.1	L7 F31 Q33 T39 L77 I79 W150 I153	L7-L35 HydrophobicContact CD1-CB 4.5Å; L7-L35 HydrophobicContact CD1-CD2 4.12Å; L7-L35 HydrophobicContact CD1-CG 4.4Å; L7-L35 HydrophobicContact CD2-CD2 3.6Å; L7-L35 HydrophobicContact CD2-CG 4.42Å; F31-L35 HydrophobicContact CD1-CB 4.39Å; F31-L35 HydrophobicContact CE1-CB 4.19Å; F31-L35 HydrophobicContact CE1-CD2 3.97Å; F31-L35 WeakPolarHBondContact O-CB 2.53Å; F31-L35 PolarHBondContact O-N 3.01Å; Q33-L35 VanDerWaalsContact C-N 3.34Å; Q33-L35 PolarHBondContact O-N 3.39Å; L35-T39 HydrophobicContact CD1-CG2 4Å; L35-T39 WeakPolarHBondContact O-CB 2.96Å; L35-T39 WeakPolarHBondContact O-CG2 3.45Å; L35-T39 PolarHBondContact O-N 3.24Å; L35-T39 PolarHBondContact O-OG1 2.8Å; L35-L77 HydrophobicContact CD2-CD1 3.89Å; L35-I79 HydrophobicContact CD2-CD1 4.17Å; L35-W150 HydrophobicContact CD1-CH2 3.71Å; L35-W150 HydrophobicContact CD1-CZ3 3.55Å; L35-I153 HydrophobicContact CD1-CG2 4.4Å
36	T	96.3	Very high	95.2	Very high	14 Å²	14	57.4 Å²	57.4	9%	0.086	28%	0.281	C	S	.	.	H	α-helix	trans	-63.1	-54.7	174.8	-56.1	0	0	0	0	109.6	A32 Q33 Y34 Y38 T39 E40	A32-T36 WeakPolarHBondContact O-CB 3.39Å; A32-T36 PolarHBondContact O-N 3.37Å; A32-T36 VanDerWaalsContact O-N 3.09Å; A32-T36 PolarHBondContact O-OG1 3.35Å; Q33-T36 WeakPolarHBondContact O-CB 3.5Å; Q33-T36 PolarHBondContact O-N 3.11Å; Q33-T36 VanDerWaalsContact O-N 3.08Å; Y34-T36 VanDerWaalsContact C-N 3.34Å; Y34-T36 PolarHBondContact O-N 3.49Å; T36-Y38 VanDerWaalsContact C-N 3.29Å; T36-Y38 PolarHBondContact O-N 2.8Å; T36-T39 PolarHBondContact O-N 3.16Å; T36-T39 VanDerWaalsContact O-N 3.13Å; T36-T39 PolarHBondContact O-OG1 3.3Å; T36-E40 WeakPolarHBondContact O-CG 3.31Å; T36-E40 PolarHBondContact O-N 3.24Å
37	E	95.7	Very high	95.2	Very high	113 Å²	113	53.5 Å²	53.5	53%	0.528	26%	0.261	S	S	.	.	H	α-helix	trans	-58.4	-39.9	177.5	-67.8	178.3	-172.3	0	0	112.3	Q33 Y34 N41	Q33-E37 PolarHBondContact O-N 3.14Å; Y34-E37 PolarHBondContact O-N 2.85Å; E37-N41 WeakPolarHBondContact O-CB 2.96Å; E37-N41 PolarHBondContact O-N 3.32Å; E37-N41 PolarHBondContact O-ND2 3.47Å
38	Y	94.4	Very high	95.3	Very high	35 Å²	35	54.4 Å²	54.4	14%	0.137	26%	0.264	C	S	.	.	H	α-helix	trans	-65.8	-41.1	176.9	-173.5	-88.9	0	0	0	112.3	Y34 T36 K42 Y43 W150	Y34-Y38 AromaticContact CE1-CD2 3.94Å; Y34-Y38 HydrophobicContact CE1-CD2 3.94Å; Y34-Y38 HydrophobicContact CE1-CG 4.36Å; Y34-Y38 AromaticContact CZ-CD2 3.94Å; Y34-Y38 WeakPolarHBondContact O-CB 3.47Å; Y34-Y38 PolarHBondContact O-N 3.44Å; Y34-Y38 WeakPolarHBondContact OH-CD2 3.46Å; T36-Y38 VanDerWaalsContact C-N 3.29Å; T36-Y38 PolarHBondContact O-N 2.8Å; Y38-K42 HydrophobicContact CD1-CD 4.33Å; Y38-K42 HydrophobicContact CE1-CD 3.68Å; Y38-K42 HydrophobicContact CE2-CD 4.12Å; Y38-K42 WeakPolarHBondContact O-CB 3.3Å; Y38-K42 PolarHBondContact O-N 2.73Å; Y38-K42 PolarHBondContact OH-NZ 3.33Å; Y38-Y43 HydrophobicContact CD1-CE2 4.37Å; Y38-Y43 HydrophobicContact CE1-CE2 4.03Å; Y38-W150 AromaticContact CD1-CE3 3.92Å; Y38-W150 HydrophobicContact CD1-CE3 3.92Å; Y38-W150 HydrophobicContact CD1-CH2 4.16Å; Y38-W150 AromaticContact CD1-CZ3 3.56Å; Y38-W150 HydrophobicContact CD1-CZ3 3.56Å; Y38-W150 HydrophobicContact CE1-CD2 4.08Å; Y38-W150 AromaticContact CE1-CE3 3.38Å; Y38-W150 HydrophobicContact CE1-CE3 3.38Å; Y38-W150 HydrophobicContact CE1-CH2 4.4Å; Y38-W150 AromaticContact CE1-CZ3 3.56Å; Y38-W150 HydrophobicContact CE1-CZ3 3.56Å; Y38-W150 HydrophobicContact CE2-CD2 4.35Å; Y38-W150 HydrophobicContact CE2-CE3 4.4Å; Y38-W150 HydrophobicContact CG-CH2 4.24Å; Y38-W150 HydrophobicContact CG-CZ3 4.11Å; Y38-W150 AromaticContact CZ-CD2 3.81Å; Y38-W150 AromaticContact CZ-CE3 3.63Å
39	T	93.8	Very high	95.3	Very high	1 Å²	1	55.8 Å²	55.8	1%	0.006	27%	0.269	C	S	.	.	H	α-helix	trans	-73.6	-34.6	-179.4	45.9	0	0	0	0	112.9	L35 T36 Y43 L45 V47 I157	L35-T39 HydrophobicContact CD1-CG2 4Å; L35-T39 WeakPolarHBondContact O-CB 2.96Å; L35-T39 WeakPolarHBondContact O-CG2 3.45Å; L35-T39 PolarHBondContact O-N 3.24Å; L35-T39 PolarHBondContact O-OG1 2.8Å; T36-T39 PolarHBondContact O-N 3.16Å; T36-T39 VanDerWaalsContact O-N 3.13Å; T36-T39 PolarHBondContact O-OG1 3.3Å; T39-Y43 WeakPolarHBondContact O-CB 3.24Å; T39-Y43 PolarHBondContact O-N 3.3Å; T39-L45 PolarHBondContact O-N 3.17Å; T39-V47 HydrophobicContact CG2-CG2 4.44Å; T39-V47 VanDerWaalsContact OG1-CG2 3.26Å; T39-V47 WeakPolarHBondContact OG1-CG2 3.21Å; T39-I157 HydrophobicContact CG2-CD1 4.07Å
40	E	94.3	Very high	95.2	Very high	87 Å²	87	54.4 Å²	54.4	41%	0.407	26%	0.262	S	S	.	.	H	α-helix	trans	-68.2	-58.1	172.1	-68.9	175.2	175.2	0	0	110.4	T36 K42 D44	T36-E40 WeakPolarHBondContact O-CG 3.31Å; T36-E40 PolarHBondContact O-N 3.24Å; E40-K42 PolarHBondContact O-N 3.42Å; E40-D44 WeakPolarHBondContact O-CA 3.3Å; E40-D44 PolarHBondContact O-N 2.96Å
41	N	95.2	Very high	95.2	Very high	142 Å²	142	58.4 Å²	58.4	76%	0.759	27%	0.271	S	S	*	.	H	α-helix	trans	-64.8	-30.9	-175.8	-72.6	-59.6	0	0	0	114.7	E37	E37-N41 WeakPolarHBondContact O-CB 2.96Å; E37-N41 PolarHBondContact O-N 3.32Å; E37-N41 PolarHBondContact O-ND2 3.47Å
42	K	93.8	Very high	95	Very high	116 Å²	116	65.2 Å²	65.2	50%	0.504	30%	0.303	S	S	.	.	H	α-helix	trans	-99.9	-20.8	-173.6	-169.2	171	175.5	171.1	0	114.6	Y38 E40	Y38-K42 HydrophobicContact CD1-CD 4.33Å; Y38-K42 HydrophobicContact CE1-CD 3.68Å; Y38-K42 HydrophobicContact CE2-CD 4.12Å; Y38-K42 WeakPolarHBondContact O-CB 3.3Å; Y38-K42 PolarHBondContact O-N 2.73Å; Y38-K42 PolarHBondContact OH-NZ 3.33Å; E40-K42 PolarHBondContact O-N 3.42Å
43	Y	92.7	Very high	94.8	Very high	64 Å²	64	67.3 Å²	67.3	25%	0.251	31%	0.311	S	S	.	.	H	α-helix	trans	-134.4	-4.1	-173.5	-58.6	-82	0	0	0	114.8	Y38 T39 L45 I157	Y38-Y43 HydrophobicContact CD1-CE2 4.37Å; Y38-Y43 HydrophobicContact CE1-CE2 4.03Å; T39-Y43 WeakPolarHBondContact O-CB 3.24Å; T39-Y43 PolarHBondContact O-N 3.3Å; Y43-L45 PolarHBondContact O-N 2.88Å; Y43-I157 HydrophobicContact CD1-CG2 3.62Å; Y43-I157 HydrophobicContact CD2-CD1 3.82Å; Y43-I157 HydrophobicContact CD2-CG2 4.23Å; Y43-I157 HydrophobicContact CE1-CG2 3.84Å; Y43-I157 HydrophobicContact CE2-CD1 3.52Å; Y43-I157 HydrophobicContact CE2-CG2 4.44Å; Y43-I157 HydrophobicContact CG-CD1 4.49Å; Y43-I157 HydrophobicContact CG-CG2 3.82Å
44	D	94	Very high	94.6	Very high	137 Å²	137	63.6 Å²	63.6	73%	0.733	29%	0.294	S	S	*	.			trans	53.8	39.9	-171.6	-168.2	29.4	0	0	0	112.2	E40	E40-D44 WeakPolarHBondContact O-CA 3.3Å; E40-D44 PolarHBondContact O-N 2.96Å
45	L	92.7	Very high	94.5	Very high	48 Å²	48	64.5 Å²	64.5	25%	0.251	30%	0.3	S	S	.	.			trans	-112.2	110.7	-176.6	-70.7	180	0	0	0	111.6	K4 T39 Y43 V47 I157	K4-L45 HydrophobicContact CB-CB 4.45Å; K4-L45 HydrophobicContact CB-CD1 4.2Å; K4-L45 HydrophobicContact CB-CD2 4.45Å; K4-L45 HydrophobicContact CG-CD1 4.11Å; T39-L45 PolarHBondContact O-N 3.17Å; Y43-L45 PolarHBondContact O-N 2.88Å; L45-V47 PolarHBondContact O-N 2.84Å; L45-I157 HydrophobicContact CD1-CG2 3.67Å
46	N	93.1	Very high	94.4	Very high	72 Å²	72	64.4 Å²	64.4	39%	0.385	30%	0.3	S	S	.	.			trans	-62.8	129.7	171.5	-72.9	-116	0	0	0	110.1	F3 K4	F3-N46 WeakPolarHBondContact CA-O 3.4Å; F3-N46 HydrophobicContact CD1-CB 3.96Å; F3-N46 HydrophobicContact CE1-CB 4.34Å; K4-N46 PolarHBondContact N-O 3.37Å
47	V	95.3	Very high	94.2	Very high	13 Å²	13	64.8 Å²	64.8	8%	0.079	30%	0.3	C	S	.	.			trans	-116.5	140.2	177.4	169.1	0	0	0	0	109.7	F5 L7 T39 L45	F5-V47 HydrophobicContact CB-CG1 4.42Å; F5-V47 HydrophobicContact CB-CG2 4.4Å; F5-V47 HydrophobicContact CD2-CG2 4.11Å; L7-V47 HydrophobicContact CD1-CG1 3.92Å; L7-V47 HydrophobicContact CD2-CG1 3.84Å; L7-V47 HydrophobicContact CG-CG1 3.49Å; L7-V47 VanDerWaalsContact CG-CG1 3.49Å; T39-V47 HydrophobicContact CG2-CG2 4.44Å; T39-V47 VanDerWaalsContact OG1-CG2 3.26Å; T39-V47 WeakPolarHBondContact OG1-CG2 3.21Å; L45-V47 PolarHBondContact O-N 2.84Å
48	F	96.5	Very high	93.9	Very high	58 Å²	58	59.8 Å²	59.8	25%	0.254	28%	0.277	S	S	.	.	B	Isolated β-bridge	trans	-96.9	129.7	175.5	-174.1	-122.6	0	0	0	110.3	F3 F5 T6 L7 F69	F3-F48 HydrophobicContact CB-CB 4.17Å; F3-F48 HydrophobicContact CD1-CB 3.88Å; F3-F48 HydrophobicContact CD2-CB 3.75Å; F3-F48 HydrophobicContact CD2-CG 4.35Å; F3-F48 HydrophobicContact CE1-CB 4.15Å; F3-F48 HydrophobicContact CE2-CB 4.04Å; F3-F48 HydrophobicContact CE2-CD2 4.2Å; F3-F48 HydrophobicContact CE2-CG 4.23Å; F3-F48 HydrophobicContact CG-CB 3.66Å; F3-F48 HydrophobicContact CZ-CB 4.23Å; F3-F48 HydrophobicContact CZ-CD2 4.08Å; F3-F48 HydrophobicContact CZ-CG 4.45Å; F5-F48 PolarHBondContact O-N 3.36Å; T6-F48 CarbonylContact C-O 3.17Å; T6-F48 WeakPolarHBondContact CA-O 3.31Å; T6-F48 HydrophobicContact CG2-CD1 3.93Å; L7-F48 PolarHBondContact N-O 2.89Å; F48-F69 AromaticContact CE1-CD1 3.84Å; F48-F69 HydrophobicContact CE1-CD1 3.84Å; F48-F69 HydrophobicContact CZ-CD1 4.47Å
49	W	96.4	Very high	93	Very high	28 Å²	28	62.5 Å²	62.5	11%	0.106	29%	0.291	C	S	.	.			trans	-139.8	105.2	177.5	178	33.6	0	0	0	109.1	L7 I29 A32 Q33 R51	L7-W49 HydrophobicContact CB-CB 4.09Å; L7-W49 HydrophobicContact CB-CG 4.03Å; L7-W49 HydrophobicContact CD1-CB 4.44Å; L7-W49 HydrophobicContact CD1-CG 4.45Å; L7-W49 HydrophobicContact CG-CB 4.41Å; I29-W49 HydrophobicContact CG2-CH2 4.11Å; I29-W49 HydrophobicContact CG2-CZ2 4.19Å; A32-W49 HydrophobicContact CB-CD2 4.05Å; A32-W49 HydrophobicContact CB-CE3 4.43Å; A32-W49 HydrophobicContact CB-CH2 4.22Å; A32-W49 HydrophobicContact CB-CZ2 3.78Å; Q33-W49 HydrophobicContact CB-CZ3 4.49Å; Q33-W49 HydrophobicContact CG-CH2 3.63Å; Q33-W49 HydrophobicContact CG-CZ3 3.55Å; W49-R51 HydrophobicContact CD2-CG 4.1Å; W49-R51 HydrophobicContact CE3-CG 4.09Å; W49-R51 HydrophobicContact CH2-CG 4.41Å; W49-R51 HydrophobicContact CZ2-CG 4.46Å; W49-R51 HydrophobicContact CZ3-CG 4.24Å
50	P	95.8	Very high	91.9	Very high	2 Å²	2	70.3 Å²	70.3	1%	0.013	33%	0.333	C	S	.	.			trans	-54.4	139.6	164.4	23	-34.2	0	0	0	109.6	L7 L8 T12 E55 A56 F69	L7-P50 WeakPolarHBondContact O-CD 3.3Å; L8-P50 HydrophobicContact CD2-CG 4.09Å; T12-P50 HydrophobicContact CG2-CB 4.38Å; T12-P50 HydrophobicContact CG2-CG 4.23Å; T12-P50 WeakPolarHBondContact CG2-O 3.49Å; P50-E55 WeakPolarHBondContact CA-OE2 3.15Å; P50-E55 HydrophobicContact CB-CB 4.16Å; P50-E55 VanDerWaalsContact CB-CD 3.49Å; P50-E55 HydrophobicContact CB-CG 4.23Å; P50-E55 WeakPolarHBondContact CB-OE2 2.94Å; P50-A56 HydrophobicContact CB-CB 4.46Å; P50-A56 HydrophobicContact CG-CB 4Å; P50-F69 HydrophobicContact CB-CD1 4.08Å; P50-F69 HydrophobicContact CB-CE1 3.95Å; P50-F69 HydrophobicContact CG-CD1 4.02Å; P50-F69 HydrophobicContact CG-CE1 4.36Å
51	R	94.5	Very high	91.7	Very high	170 Å²	170	68.3 Å²	68.3	64%	0.642	33%	0.328	S	S	*	.			trans	-118.1	-15.2	-176.5	-69.4	-172.6	-179.9	-176.3	1.1	113.2	W49 E55	W49-R51 HydrophobicContact CD2-CG 4.1Å; W49-R51 HydrophobicContact CE3-CG 4.09Å; W49-R51 HydrophobicContact CH2-CG 4.41Å; W49-R51 HydrophobicContact CZ2-CG 4.46Å; W49-R51 HydrophobicContact CZ3-CG 4.24Å; R51-E55 PolarHBondContact N-OE2 2.75Å
52	Q	93.5	Very high	91.6	Very high	142 Å²	142	64.7 Å²	64.7	66%	0.664	31%	0.306	S	S	*	.	S	Bend	trans	-81	147.3	-180	-59.2	179	0.2	0	0	110.9	G54 E55	Q52-G54 PolarHBondContact O-N 3.36Å; Q52-E55 HydrophobicContact CB-CB 3.92Å; Q52-E55 HydrophobicContact CB-CG 4.12Å; Q52-E55 WeakPolarHBondContact CB-OE2 3.31Å; Q52-E55 PolarHBondContact N-OE2 3.31Å; Q52-E55 VanDerWaalsContact O-CB 3.26Å; Q52-E55 WeakPolarHBondContact O-CB 3.29Å; Q52-E55 PolarHBondContact O-N 3.1Å
53	R	93.2	Very high	91.6	Very high	44 Å²	44	63 Å²	63	17%	0.166	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	125.1	180	-166	-179.6	-175.9	-140.4	-14	110.1	W11 T16 I18 P19 D20 C23 E55	W11-R53 HydrophobicContact CD2-CB 4.29Å; W11-R53 HydrophobicContact CD2-CG 3.85Å; W11-R53 HydrophobicContact CE3-CG 4.08Å; W11-R53 HydrophobicContact CH2-CB 4.47Å; W11-R53 VanDerWaalsContact CH2-CD 3.45Å; W11-R53 HydrophobicContact CH2-CG 4.03Å; W11-R53 HydrophobicContact CZ2-CB 3.76Å; W11-R53 HydrophobicContact CZ2-CG 3.76Å; W11-R53 HydrophobicContact CZ3-CG 4.17Å; T16-R53 HydrophobicContact CG2-CB 4.23Å; T16-R53 HydrophobicContact CG2-CG 4.18Å; T16-R53 VanDerWaalsContact CG2-O 3.24Å; T16-R53 WeakPolarHBondContact CG2-O 3.31Å; I18-R53 PolarHBondContact O-NH1 2.91Å; I18-R53 PolarHBondContact O-NH2 3.43Å; P19-R53 PolarHBondContact O-NH2 3.31Å; P19-R53 VanDerWaalsContact O-NH2 3.14Å; D20-R53 VanDerWaalsContact CG-CZ 3.49Å; D20-R53 WeakPolarHBondContact OD1-CD 3.39Å; D20-R53 IonicContact OD1-CZ 3.64Å; D20-R53 IonicContact OD1-NE 2.84Å; D20-R53 PolarHBondContact OD1-NE 3.14Å; D20-R53 IonicContact OD1-NH1 2.71Å; D20-R53 PolarHBondContact OD1-NH1 3.14Å; D20-R53 IonicContact OD1-NH2 2.67Å; D20-R53 IonicContact OD2-CZ 3.64Å; D20-R53 IonicContact OD2-NH1 2.65Å; D20-R53 PolarHBondContact OD2-NH1 2.85Å; C23-R53 PolarHBondContact SG-NH2 2.94Å; R53-E55 PolarHBondContact O-N 2.93Å; R53-E55 VanDerWaalsContact O-N 3.15Å
54	G	93.3	Very high	91.6	Very high	2 Å²	2	62.2 Å²	62.2	2%	0.021	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	60.2	19.2	-177.5	0	0	0	0	0	115.8	W11 T12 L14 Q52 A56 F57 H59	W11-G54 PolarHBondContact O-N 2.89Å; T12-G54 CarbonylContact O-C 3.56Å; T12-G54 WeakPolarHBondContact O-CA 3.12Å; L14-G54 WeakPolarHBondContact O-CA 3.49Å; Q52-G54 PolarHBondContact O-N 3.36Å; G54-A56 VanDerWaalsContact C-N 3.31Å; G54-A56 PolarHBondContact O-N 3.27Å; G54-F57 WeakPolarHBondContact O-CB 3.36Å; G54-F57 PolarHBondContact O-N 3.29Å; G54-H59 PolarHBondContact O-NE2 3.11Å
55	E	93.8	Very high	91.6	Very high	65 Å²	65	56 Å²	56	30%	0.304	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-44.6	177.4	-163	-172.3	148.2	0	0	111.4	T12 P50 R51 Q52 R53 F69	T12-E55 PolarHBondContact O-N 3.43Å; P50-E55 WeakPolarHBondContact CA-OE2 3.15Å; P50-E55 HydrophobicContact CB-CB 4.16Å; P50-E55 VanDerWaalsContact CB-CD 3.49Å; P50-E55 HydrophobicContact CB-CG 4.23Å; P50-E55 WeakPolarHBondContact CB-OE2 2.94Å; R51-E55 PolarHBondContact N-OE2 2.75Å; Q52-E55 HydrophobicContact CB-CB 3.92Å; Q52-E55 HydrophobicContact CB-CG 4.12Å; Q52-E55 WeakPolarHBondContact CB-OE2 3.31Å; Q52-E55 PolarHBondContact N-OE2 3.31Å; Q52-E55 VanDerWaalsContact O-CB 3.26Å; Q52-E55 WeakPolarHBondContact O-CB 3.29Å; Q52-E55 PolarHBondContact O-N 3.1Å; R53-E55 PolarHBondContact O-N 2.93Å; R53-E55 VanDerWaalsContact O-N 3.15Å; E55-F69 HydrophobicContact CG-CE1 4.04Å; E55-F69 HydrophobicContact CG-CZ 4.12Å; E55-F69 WeakPolarHBondContact O-CZ 3.5Å
56	A	94.1	Very high	91.7	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.8	6.3	-179.4	0	0	0	0	0	113	L8 T12 L13 P50 G54 L58 F65 F69	L8-A56 HydrophobicContact CD2-CB 3.78Å; T12-A56 CarbonylContact O-C 3.54Å; T12-A56 WeakPolarHBondContact O-CA 3.35Å; T12-A56 PolarHBondContact O-N 2.66Å; L13-A56 HydrophobicContact CD2-CB 4.06Å; L13-A56 WeakPolarHBondContact CD2-O 3.49Å; P50-A56 HydrophobicContact CB-CB 4.46Å; P50-A56 HydrophobicContact CG-CB 4Å; G54-A56 VanDerWaalsContact C-N 3.31Å; G54-A56 PolarHBondContact O-N 3.27Å; A56-L58 PolarHBondContact O-N 3.42Å; A56-F65 HydrophobicContact CB-CE2 4.29Å; A56-F65 WeakPolarHBondContact O-CD2 3.29Å; A56-F65 WeakPolarHBondContact O-CE2 3.43Å; A56-F69 HydrophobicContact CB-CD1 4Å; A56-F69 HydrophobicContact CB-CD2 4.13Å; A56-F69 HydrophobicContact CB-CE1 4.09Å; A56-F69 HydrophobicContact CB-CE2 4.21Å; A56-F69 HydrophobicContact CB-CG 4.06Å; A56-F69 HydrophobicContact CB-CZ 4.21Å
57	F	92	Very high	91.8	Very high	21 Å²	21	57 Å²	57	9%	0.092	27%	0.274	C	S	.	.	S	Bend	trans	-58.3	142.8	171.6	175.5	-124.8	0	0	0	110.1	T12 L13 P15 G54 H59	T12-F57 PolarHBondContact O-N 2.89Å; T12-F57 VanDerWaalsContact O-N 3.16Å; L13-F57 WeakPolarHBondContact O-CB 3.29Å; L13-F57 WeakPolarHBondContact O-CD2 3.3Å; P15-F57 HydrophobicContact CB-CD1 3.84Å; P15-F57 HydrophobicContact CB-CE1 3.59Å; P15-F57 HydrophobicContact CB-CE2 4.26Å; P15-F57 HydrophobicContact CB-CG 4.28Å; P15-F57 HydrophobicContact CB-CZ 3.76Å; P15-F57 HydrophobicContact CG-CE1 4.24Å; P15-F57 HydrophobicContact CG-CE2 4.12Å; P15-F57 HydrophobicContact CG-CZ 3.88Å; G54-F57 WeakPolarHBondContact O-CB 3.36Å; G54-F57 PolarHBondContact O-N 3.29Å; F57-H59 HydrophobicContact CD1-CB 4.35Å; F57-H59 AromaticContact CD1-CD2 3.75Å; F57-H59 AromaticContact CD1-CE1 3.67Å; F57-H59 AromaticContact CD1-CG 3.64Å; F57-H59 AromaticContact CD1-ND1 3.6Å; F57-H59 AromaticContact CD1-NE2 3.75Å; F57-H59 PolarHBondContact O-CD2 2.99Å; F57-H59 VanDerWaalsContact O-CD2 3.23Å; F57-H59 PolarHBondContact O-N 3.49Å
58	L	88.8	Confident	91.8	Very high	8 Å²	8	64.9 Å²	64.9	4%	0.042	30%	0.302	C	S	.	.			trans	-73.2	52.6	-179.2	-76.8	164	0	0	0	111.8	A56 N60 F62 F65 R94 F95	A56-L58 PolarHBondContact O-N 3.42Å; L58-N60 PolarHBondContact O-N 2.8Å; L58-F62 HydrophobicContact CD2-CD1 3.84Å; L58-F62 HydrophobicContact CD2-CE1 4.19Å; L58-F65 HydrophobicContact CD2-CB 3.63Å; L58-F65 HydrophobicContact CD2-CD1 3.47Å; L58-F65 VanDerWaalsContact CD2-CD1 3.47Å; L58-F65 HydrophobicContact CD2-CD2 3.95Å; L58-F65 HydrophobicContact CD2-CE1 4Å; L58-F65 HydrophobicContact CD2-CE2 4.45Å; L58-F65 HydrophobicContact CD2-CG 3.42Å; L58-F65 VanDerWaalsContact CD2-CG 3.42Å; L58-F65 HydrophobicContact CD2-CZ 4.47Å; L58-F65 HydrophobicContact CG-CD1 4.44Å; L58-F65 HydrophobicContact CG-CD2 4.33Å; L58-F65 HydrophobicContact CG-CG 4.28Å; L58-R94 HydrophobicContact CB-CB 4.12Å; L58-R94 HydrophobicContact CD1-CB 3.63Å; L58-R94 PolarHBondContact O-NH1 3.19Å; L58-F95 HydrophobicContact CD1-CD2 3.6Å; L58-F95 HydrophobicContact CD1-CE2 3.63Å
59	H	77.1	Confident	91.7	Very high	92 Å²	92	62.7 Å²	62.7	43%	0.426	29%	0.292	S	S	.	.			trans	-47.4	-60.3	-166.6	-80.4	-87.8	0	0	0	113.2	G54 F57 R94	G54-H59 PolarHBondContact O-NE2 3.11Å; F57-H59 HydrophobicContact CD1-CB 4.35Å; F57-H59 AromaticContact CD1-CD2 3.75Å; F57-H59 AromaticContact CD1-CE1 3.67Å; F57-H59 AromaticContact CD1-CG 3.64Å; F57-H59 AromaticContact CD1-ND1 3.6Å; F57-H59 AromaticContact CD1-NE2 3.75Å; F57-H59 PolarHBondContact O-CD2 2.99Å; F57-H59 VanDerWaalsContact O-CD2 3.23Å; F57-H59 PolarHBondContact O-N 3.49Å; H59-R94 PolarHBondContact O-NH1 2.99Å
60	N	69.5	Low	91.7	Very high	166 Å²	166	61.3 Å²	61.3	89%	0.888	29%	0.287	S	S	*	.	S	Bend	trans	-141.9	-16.1	-176.7	-76.8	-51.9	0	0	0	116.2	L58	L58-N60 PolarHBondContact O-N 2.8Å
61	S	89.6	Confident	91.6	Very high	45 Å²	45	65 Å²	65	32%	0.315	31%	0.31	S	S	.	.			trans	-145	117.2	-169.2	171.6	0	0	0	0	112.7	N63 S64 F65	S61-N63 VanDerWaalsContact C-N 3.3Å; S61-N63 PolarHBondContact O-N 2.73Å; S61-S64 WeakPolarHBondContact CB-OG 3.26Å; S61-S64 PolarHBondContact O-N 3.05Å; S61-S64 PolarHBondContact OG-N 3.19Å; S61-S64 PolarHBondContact OG-OG 3.33Å; S61-F65 PolarHBondContact O-N 3.27Å; S61-F65 VanDerWaalsContact O-N 3.08Å
62	F	93.2	Very high	91.5	Very high	65 Å²	65	61.6 Å²	61.6	29%	0.285	30%	0.301	S	S	.	.	H	α-helix	trans	-62.2	-36.5	173.7	-62	-62.4	0	0	0	112.6	L58 E66 R94 V97 F98	L58-F62 HydrophobicContact CD2-CD1 3.84Å; L58-F62 HydrophobicContact CD2-CE1 4.19Å; F62-E66 WeakPolarHBondContact O-CB 3.34Å; F62-E66 PolarHBondContact O-N 2.79Å; F62-R94 WeakPolarHBondContact CE1-O 3.24Å; F62-V97 HydrophobicContact CD2-CG1 4.44Å; F62-V97 HydrophobicContact CE1-CB 4.34Å; F62-V97 HydrophobicContact CE1-CG1 4.39Å; F62-V97 HydrophobicContact CE2-CB 4.23Å; F62-V97 HydrophobicContact CE2-CG1 3.44Å; F62-V97 VanDerWaalsContact CE2-CG1 3.44Å; F62-V97 HydrophobicContact CZ-CB 3.67Å; F62-V97 HydrophobicContact CZ-CG1 3.42Å; F62-V97 VanDerWaalsContact CZ-CG1 3.42Å; F62-F98 HydrophobicContact CB-CD2 4.05Å; F62-F98 HydrophobicContact CD1-CB 3.72Å; F62-F98 AromaticContact CD1-CD2 3.8Å; F62-F98 HydrophobicContact CD1-CD2 3.8Å; F62-F98 HydrophobicContact CD1-CG 4.23Å; F62-F98 HydrophobicContact CE1-CB 3.92Å; F62-F98 HydrophobicContact CG-CD2 4.3Å
63	N	93.7	Very high	91.5	Very high	80 Å²	80	55.3 Å²	55.3	43%	0.428	27%	0.273	S	S	.	.	H	α-helix	trans	-65.5	-43.2	175	-72	-13.2	0	0	0	110.7	S61 F65 E66 E67 K102	S61-N63 VanDerWaalsContact C-N 3.3Å; S61-N63 PolarHBondContact O-N 2.73Å; N63-F65 VanDerWaalsContact C-N 3.35Å; N63-F65 PolarHBondContact O-N 2.82Å; N63-E66 PolarHBondContact O-N 2.86Å; N63-E67 VanDerWaalsContact O-CB 3.26Å; N63-E67 WeakPolarHBondContact O-CB 3.1Å; N63-E67 WeakPolarHBondContact O-CG 3.49Å; N63-E67 PolarHBondContact O-N 3.35Å; N63-K102 PolarHBondContact OD1-NZ 3.5Å
64	S	93	Very high	91.6	Very high	49 Å²	49	56.2 Å²	56.2	34%	0.343	28%	0.279	S	S	.	.	H	α-helix	trans	-72.3	-29.1	-177.2	-52	0	0	0	0	112.9	S61 R68	S61-S64 WeakPolarHBondContact CB-OG 3.26Å; S61-S64 PolarHBondContact O-N 3.05Å; S61-S64 PolarHBondContact OG-N 3.19Å; S61-S64 PolarHBondContact OG-OG 3.33Å; S64-R68 VanDerWaalsContact O-CB 3.28Å; S64-R68 WeakPolarHBondContact O-CB 3.35Å; S64-R68 VanDerWaalsContact O-CG 3.25Å; S64-R68 WeakPolarHBondContact O-CG 3.35Å; S64-R68 PolarHBondContact O-N 3.04Å; S64-R68 VanDerWaalsContact O-N 3.15Å
65	F	94.8	Very high	91.8	Very high	5 Å²	5	56.9 Å²	56.9	2%	0.022	28%	0.281	C	S	.	.	H	α-helix	trans	-66.4	-46.4	167.5	170.2	-104.6	0	0	0	111.4	L8 L13 A56 L58 S61 N63 F69 L70 F95 F98	L8-F65 HydrophobicContact CD1-CZ 4.2Å; L13-F65 HydrophobicContact CD2-CE2 4.04Å; L13-F65 HydrophobicContact CD2-CZ 4.44Å; A56-F65 HydrophobicContact CB-CE2 4.29Å; A56-F65 WeakPolarHBondContact O-CD2 3.29Å; A56-F65 WeakPolarHBondContact O-CE2 3.43Å; L58-F65 HydrophobicContact CD2-CB 3.63Å; L58-F65 HydrophobicContact CD2-CD1 3.47Å; L58-F65 VanDerWaalsContact CD2-CD1 3.47Å; L58-F65 HydrophobicContact CD2-CD2 3.95Å; L58-F65 HydrophobicContact CD2-CE1 4Å; L58-F65 HydrophobicContact CD2-CE2 4.45Å; L58-F65 HydrophobicContact CD2-CG 3.42Å; L58-F65 VanDerWaalsContact CD2-CG 3.42Å; L58-F65 HydrophobicContact CD2-CZ 4.47Å; L58-F65 HydrophobicContact CG-CD1 4.44Å; L58-F65 HydrophobicContact CG-CD2 4.33Å; L58-F65 HydrophobicContact CG-CG 4.28Å; S61-F65 PolarHBondContact O-N 3.27Å; S61-F65 VanDerWaalsContact O-N 3.08Å; N63-F65 VanDerWaalsContact C-N 3.35Å; N63-F65 PolarHBondContact O-N 2.82Å; F65-F69 AromaticContact CD2-CD2 3.78Å; F65-F69 HydrophobicContact CD2-CD2 3.78Å; F65-F69 HydrophobicContact CD2-CE2 4.48Å; F65-F69 HydrophobicContact CE2-CD2 4.4Å; F65-F69 HydrophobicContact CG-CD2 4.47Å; F65-F69 WeakPolarHBondContact O-CD2 3.46Å; F65-F69 PolarHBondContact O-N 3.34Å; F65-L70 HydrophobicContact CD1-CD1 3.96Å; F65-L70 HydrophobicContact CE1-CD1 3.44Å; F65-L70 VanDerWaalsContact CE1-CD1 3.44Å; F65-L70 HydrophobicContact CE1-CG 4.23Å; F65-L70 HydrophobicContact CZ-CD1 4.04Å; F65-L70 HydrophobicContact CZ-CG 4.49Å; F65-F95 HydrophobicContact CZ-CZ 4.42Å; F65-F98 HydrophobicContact CD1-CD2 4.26Å; F65-F98 HydrophobicContact CD1-CE1 4.47Å; F65-F98 AromaticContact CD1-CE2 3.88Å; F65-F98 HydrophobicContact CD1-CE2 3.88Å; F65-F98 AromaticContact CD1-CZ 4Å; F65-F98 HydrophobicContact CD1-CZ 4Å; F65-F98 HydrophobicContact CE1-CD1 4.32Å; F65-F98 AromaticContact CE1-CE1 3.96Å; F65-F98 HydrophobicContact CE1-CE1 3.96Å; F65-F98 HydrophobicContact CE1-CE2 4.2Å; F65-F98 AromaticContact CE1-CZ 3.9Å; F65-F98 HydrophobicContact CE1-CZ 3.9Å
66	E	95.7	Very high	91.9	Very high	30 Å²	30	53.8 Å²	53.8	14%	0.14	27%	0.267	C	S	.	.	I	π-helix	trans	-65	-45.4	177.5	-173.5	175.4	-158.6	0	0	112.5	F62 N63 L70 T71 F98 K102 W105	F62-E66 WeakPolarHBondContact O-CB 3.34Å; F62-E66 PolarHBondContact O-N 2.79Å; N63-E66 PolarHBondContact O-N 2.86Å; E66-L70 HydrophobicContact CG-CB 4.39Å; E66-L70 CarbonylContact O-C 3.56Å; E66-L70 PolarHBondContact O-N 3.49Å; E66-T71 VanDerWaalsContact C-OG1 3.28Å; E66-T71 VanDerWaalsContact O-CB 3.29Å; E66-T71 WeakPolarHBondContact O-CB 3.43Å; E66-T71 PolarHBondContact O-N 2.91Å; E66-T71 PolarHBondContact O-OG1 3.01Å; E66-F98 HydrophobicContact CB-CE2 4.38Å; E66-K102 WeakPolarHBondContact OE2-CD 3.36Å; E66-K102 IonicContact OE2-NZ 3.42Å; E66-K102 PolarHBondContact OE2-NZ 3.25Å; E66-W105 PolarHBondContact OE1-NE1 3.16Å
67	E	94.2	Very high	92.1	Very high	112 Å²	112	53.9 Å²	53.9	52%	0.523	27%	0.267	S	S	.	.	I	π-helix	trans	-62.7	-43.2	179.7	-74.8	159.7	-172.4	0	0	112.3	N63 T71	N63-E67 VanDerWaalsContact O-CB 3.26Å; N63-E67 WeakPolarHBondContact O-CB 3.1Å; N63-E67 WeakPolarHBondContact O-CG 3.49Å; N63-E67 PolarHBondContact O-N 3.35Å; E67-T71 WeakPolarHBondContact CA-OG1 3.35Å
68	R	94.3	Very high	92.4	Very high	178 Å²	178	53 Å²	53	67%	0.672	26%	0.263	S	S	*	.	I	π-helix	trans	-77	-53.3	-179.8	-71	178.8	176.7	-159.4	-2.4	112.5	S64	S64-R68 VanDerWaalsContact O-CB 3.28Å; S64-R68 WeakPolarHBondContact O-CB 3.35Å; S64-R68 VanDerWaalsContact O-CG 3.25Å; S64-R68 WeakPolarHBondContact O-CG 3.35Å; S64-R68 PolarHBondContact O-N 3.04Å; S64-R68 VanDerWaalsContact O-N 3.15Å
69	F	95.2	Very high	92.8	Very high	12 Å²	12	52.6 Å²	52.6	5%	0.053	26%	0.261	C	S	.	.	I	π-helix	trans	-101.5	-24.1	-164.7	-53.3	-76.8	0	0	0	114.2	T6 F48 P50 E55 A56 F65	T6-F69 WeakPolarHBondContact CB-O 3.41Å; T6-F69 VanDerWaalsContact CG2-O 3.29Å; T6-F69 WeakPolarHBondContact CG2-O 3.49Å; T6-F69 PolarHBondContact OG1-O 3.45Å; F48-F69 AromaticContact CE1-CD1 3.84Å; F48-F69 HydrophobicContact CE1-CD1 3.84Å; F48-F69 HydrophobicContact CZ-CD1 4.47Å; P50-F69 HydrophobicContact CB-CD1 4.08Å; P50-F69 HydrophobicContact CB-CE1 3.95Å; P50-F69 HydrophobicContact CG-CD1 4.02Å; P50-F69 HydrophobicContact CG-CE1 4.36Å; E55-F69 HydrophobicContact CG-CE1 4.04Å; E55-F69 HydrophobicContact CG-CZ 4.12Å; E55-F69 WeakPolarHBondContact O-CZ 3.5Å; A56-F69 HydrophobicContact CB-CD1 4Å; A56-F69 HydrophobicContact CB-CD2 4.13Å; A56-F69 HydrophobicContact CB-CE1 4.09Å; A56-F69 HydrophobicContact CB-CE2 4.21Å; A56-F69 HydrophobicContact CB-CG 4.06Å; A56-F69 HydrophobicContact CB-CZ 4.21Å; F65-F69 AromaticContact CD2-CD2 3.78Å; F65-F69 HydrophobicContact CD2-CD2 3.78Å; F65-F69 HydrophobicContact CD2-CE2 4.48Å; F65-F69 HydrophobicContact CE2-CD2 4.4Å; F65-F69 HydrophobicContact CG-CD2 4.47Å; F65-F69 WeakPolarHBondContact O-CD2 3.46Å; F65-F69 PolarHBondContact O-N 3.34Å
70	L	95.9	Very high	93.7	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	24%	0.241	C	C	.	.	I	π-helix	trans	-119.7	-26.9	-167.5	-58	-178	0	0	0	115.3	T6 L8 F65 E66 H72 S73 A76 F98 W105	T6-L70 HydrophobicContact CG2-CD2 4.49Å; L8-L70 HydrophobicContact CD1-CD2 4.42Å; F65-L70 HydrophobicContact CD1-CD1 3.96Å; F65-L70 HydrophobicContact CE1-CD1 3.44Å; F65-L70 VanDerWaalsContact CE1-CD1 3.44Å; F65-L70 HydrophobicContact CE1-CG 4.23Å; F65-L70 HydrophobicContact CZ-CD1 4.04Å; F65-L70 HydrophobicContact CZ-CG 4.49Å; E66-L70 HydrophobicContact CG-CB 4.39Å; E66-L70 CarbonylContact O-C 3.56Å; E66-L70 PolarHBondContact O-N 3.49Å; L70-H72 PolarHBondContact O-N 3.48Å; L70-H72 VanDerWaalsContact O-N 3.12Å; L70-S73 PolarHBondContact O-N 2.79Å; L70-A76 HydrophobicContact CD2-CB 3.7Å; L70-F98 HydrophobicContact CD1-CE1 4.01Å; L70-F98 HydrophobicContact CD1-CZ 3.64Å; L70-W105 HydrophobicContact CB-CH2 3.73Å; L70-W105 HydrophobicContact CB-CZ2 3.61Å; L70-W105 HydrophobicContact CB-CZ3 4.25Å; L70-W105 HydrophobicContact CD1-CD2 4.05Å; L70-W105 HydrophobicContact CD1-CE3 4.25Å; L70-W105 HydrophobicContact CD1-CZ2 4.5Å; L70-W105 WeakPolarHBondContact O-CH2 3.41Å
71	T	93.4	Very high	95	Very high	80 Å²	80	40.5 Å²	40.5	49%	0.491	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-23.1	-171.2	-73.1	0	0	0	0	113.3	E66 E67	E66-T71 VanDerWaalsContact C-OG1 3.28Å; E66-T71 VanDerWaalsContact O-CB 3.29Å; E66-T71 WeakPolarHBondContact O-CB 3.43Å; E66-T71 PolarHBondContact O-N 2.91Å; E66-T71 PolarHBondContact O-OG1 3.01Å; E67-T71 WeakPolarHBondContact CA-OG1 3.35Å
72	H	92.5	Very high	95.3	Very high	97 Å²	97	38.4 Å²	38.4	45%	0.449	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.2	0.9	179.2	-60.3	106	0	0	0	114.2	F3 L70	F3-H72 HydrophobicContact CD2-CB 3.87Å; F3-H72 HydrophobicContact CE2-CB 4.34Å; F3-H72 PolarHBondContact N-O 3.25Å; L70-H72 PolarHBondContact O-N 3.48Å; L70-H72 VanDerWaalsContact O-N 3.12Å
73	S	95.1	Very high	95.3	Very high	11 Å²	11	41 Å²	41	8%	0.077	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	145.9	-171.2	-58.7	0	0	0	0	112.9	F3 T6 L70 Y75	F3-S73 WeakPolarHBondContact O-CA 3.39Å; T6-S73 WeakPolarHBondContact OG1-CB 3.07Å; T6-S73 PolarHBondContact OG1-OG 2.98Å; L70-S73 PolarHBondContact O-N 2.79Å; S73-Y75 WeakPolarHBondContact CB-O 3.39Å
74	E	94.5	Very high	95.3	Very high	63 Å²	63	39 Å²	39	29%	0.294	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	-35.6	174	-71.7	-171.5	-174.4	0	0	112	K4 R108 Y161	K4-E74 HydrophobicContact CD-CB 4.49Å; K4-E74 IonicContact NZ-OE2 3.25Å; K4-E74 PolarHBondContact NZ-OE2 3.01Å; K4-E74 PolarHBondContact O-N 3.29Å; K4-E74 VanDerWaalsContact O-N 3.14Å; E74-R108 WeakPolarHBondContact O-CD 3.25Å; E74-Y161 PolarHBondContact OE2-N 3.06Å
75	Y	96.5	Very high	95.5	Very high	16 Å²	16	36.6 Å²	36.6	6%	0.063	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	165.4	-177.2	-67.3	-86.4	0	0	0	110.9	K4 F5 T6 S73 R108 L110 L156 Y161	K4-Y75 PolarHBondContact O-N 2.66Å; F5-Y75 WeakPolarHBondContact CA-O 3.17Å; F5-Y75 HydrophobicContact CD1-CG 4.49Å; F5-Y75 HydrophobicContact CE1-CD2 4.19Å; F5-Y75 HydrophobicContact CE1-CG 4.28Å; T6-Y75 PolarHBondContact N-O 2.98Å; S73-Y75 WeakPolarHBondContact CB-O 3.39Å; Y75-R108 WeakPolarHBondContact CA-O 3.36Å; Y75-R108 HydrophobicContact CD1-CB 4.44Å; Y75-L110 HydrophobicContact CD1-CD1 3.82Å; Y75-L110 HydrophobicContact CG-CD1 4.49Å; Y75-L156 HydrophobicContact CE1-CD2 4.32Å; Y75-Y161 HydrophobicContact CE1-CD2 4.23Å; Y75-Y161 AromaticContact CZ-CD2 3.98Å
76	A	97.1	Very high	95.4	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	142	165	0	0	0	0	0	111.2	T6 L8 L70 R108 I109 L110	T6-A76 CarbonylContact O-C 2.96Å; T6-A76 VanDerWaalsContact O-CA 3.24Å; T6-A76 WeakPolarHBondContact O-CA 3.31Å; L8-A76 HydrophobicContact CD1-CB 4.4Å; L70-A76 HydrophobicContact CD2-CB 3.7Å; A76-R108 PolarHBondContact N-O 2.66Å; A76-I109 HydrophobicContact CB-CG1 4.23Å; A76-I109 WeakPolarHBondContact O-CA 3.41Å; A76-L110 PolarHBondContact O-N 2.88Å
77	L	97.8	Very high	95.3	Very high	2 Å²	2	37.4 Å²	37.4	1%	0.01	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	112.4	-177.1	-56.8	179.1	0	0	0	108.4	F5 T6 L7 L8 L35 L110 I112	F5-L77 HydrophobicContact CB-CD1 4.26Å; F5-L77 HydrophobicContact CB-CG 4.39Å; F5-L77 HydrophobicContact CD1-CD1 3.73Å; F5-L77 HydrophobicContact CD1-CD2 4.12Å; F5-L77 HydrophobicContact CD1-CG 3.8Å; F5-L77 HydrophobicContact CE1-CD1 4.27Å; F5-L77 HydrophobicContact CE1-CD2 4.44Å; F5-L77 HydrophobicContact CG-CD1 3.95Å; F5-L77 HydrophobicContact CG-CG 4.3Å; T6-L77 PolarHBondContact O-N 3.17Å; L7-L77 HydrophobicContact CD2-CB 3.96Å; L7-L77 HydrophobicContact CD2-CD1 3.86Å; L7-L77 HydrophobicContact CD2-CG 4.31Å; L8-L77 PolarHBondContact N-O 3.22Å; L35-L77 HydrophobicContact CD2-CD1 3.89Å; L77-L110 HydrophobicContact CD2-CB 4.02Å; L77-L110 HydrophobicContact CD2-CD1 3.93Å; L77-I112 HydrophobicContact CB-CD1 4.21Å; L77-I112 HydrophobicContact CD1-CD1 4.25Å; L77-I112 HydrophobicContact CD2-CD1 4.5Å
78	L	97.6	Very high	95.3	Very high	2 Å²	2	32 Å²	32	1%	0.01	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	104.1	176.7	173.8	43.5	0	0	0	109	L8 L13 V80 L88 I91 F95 I109 L110 I111 I112	L8-L78 HydrophobicContact CB-CD1 4.5Å; L8-L78 CarbonylContact O-C 3.54Å; L8-L78 VanDerWaalsContact O-CA 3.32Å; L8-L78 WeakPolarHBondContact O-CA 3.23Å; L8-L78 WeakPolarHBondContact O-CD1 3.44Å; L13-L78 HydrophobicContact CD1-CD1 3.51Å; L13-L78 HydrophobicContact CD1-CD2 4.32Å; L78-V80 HydrophobicContact CD1-CG2 3.85Å; L78-V80 HydrophobicContact CG-CG2 4.28Å; L78-L88 HydrophobicContact CD1-CD2 4.35Å; L78-L88 HydrophobicContact CD2-CD2 3.71Å; L78-L88 HydrophobicContact CG-CD2 4.12Å; L78-I91 HydrophobicContact CD2-CD1 4.37Å; L78-F95 HydrophobicContact CD2-CE1 4.42Å; L78-I109 HydrophobicContact CB-CG2 4.49Å; L78-L110 WeakPolarHBondContact CB-O 3.26Å; L78-L110 PolarHBondContact N-O 3.4Å; L78-I111 HydrophobicContact CB-CG1 4.1Å; L78-I111 HydrophobicContact CD2-CG1 4.14Å; L78-I111 HydrophobicContact CG-CG1 4.17Å; L78-I111 CarbonylContact O-C 3.5Å; L78-I111 WeakPolarHBondContact O-CA 3.23Å; L78-I112 PolarHBondContact O-N 3.18Å
79	I	97.8	Very high	95.4	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	125.3	-175.3	-54.9	157.6	0	0	0	108.6	L7 L8 T9 A28 F31 A32 L35 I112 L114	L7-I79 HydrophobicContact CB-CD1 4.14Å; L7-I79 HydrophobicContact CD1-CD1 4.19Å; L7-I79 HydrophobicContact CD2-CD1 4.25Å; L7-I79 HydrophobicContact CG-CD1 4.41Å; L8-I79 PolarHBondContact O-N 2.93Å; T9-I79 WeakPolarHBondContact CA-O 3.35Å; T9-I79 HydrophobicContact CG2-CB 4.39Å; A28-I79 HydrophobicContact CB-CG2 3.84Å; F31-I79 HydrophobicContact CB-CG2 4.29Å; F31-I79 HydrophobicContact CD1-CD1 4.03Å; F31-I79 HydrophobicContact CD1-CG1 4.23Å; F31-I79 HydrophobicContact CD1-CG2 3.73Å; F31-I79 HydrophobicContact CE1-CD1 4.48Å; F31-I79 HydrophobicContact CG-CG2 4.34Å; A32-I79 HydrophobicContact CB-CD1 3.92Å; L35-I79 HydrophobicContact CD2-CD1 4.17Å; I79-I112 WeakPolarHBondContact CA-O 3.34Å; I79-I112 HydrophobicContact CG1-CB 4.34Å; I79-I112 HydrophobicContact CG1-CD1 4.29Å; I79-L114 HydrophobicContact CG2-CD1 4.17Å; I79-L114 HydrophobicContact CG2-CG 4.46Å
80	V	97	Very high	95.2	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	139.9	178.4	-167.4	0	0	0	0	109.1	L78 N84 C87 L88 I112 F113 L114	L78-V80 HydrophobicContact CD1-CG2 3.85Å; L78-V80 HydrophobicContact CG-CG2 4.28Å; V80-N84 HydrophobicContact CG1-CB 4.13Å; V80-N84 WeakPolarHBondContact CG1-O 3.37Å; V80-C87 VanDerWaalsContact CG1-SG 3.54Å; V80-L88 HydrophobicContact CG2-CD2 3.91Å; V80-L88 HydrophobicContact CG2-CG 4.31Å; V80-I112 PolarHBondContact N-O 3.39Å; V80-F113 WeakPolarHBondContact O-CA 3.4Å; V80-L114 PolarHBondContact O-N 3.24Å; V80-L114 VanDerWaalsContact O-N 3.15Å
81	S	96.4	Very high	95.1	Very high	4 Å²	4	31.8 Å²	31.8	3%	0.028	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	158	169.5	61.3	0	0	0	0	112.3	D25 E27 Q83 N84 A85 L114	D25-S81 WeakPolarHBondContact OD1-CB 3.37Å; D25-S81 PolarHBondContact OD1-N 3.17Å; D25-S81 PolarHBondContact OD1-OG 2.83Å; D25-S81 PolarHBondContact OD2-N 2.94Å; E27-S81 WeakPolarHBondContact OE2-CB 3.22Å; S81-Q83 PolarHBondContact O-N 3.22Å; S81-N84 CarbonylContact O-C 3.48Å; S81-N84 PolarHBondContact O-N 3.01Å; S81-N84 WeakPolarHBondContact OG-CB 3.34Å; S81-N84 PolarHBondContact OG-N 2.77Å; S81-A85 PolarHBondContact O-N 3.48Å; S81-L114 CarbonylContact C-O 3.55Å
82	G	95	Very high	95.2	Very high	1 Å²	1	30 Å²	30	1%	0.01	14%	0.142	C	C	.	.	S	Bend	trans	-66.2	-25.9	179	0	0	0	0	0	112.1	L114 Q116 T118	G82-L114 PolarHBondContact N-O 3.31Å; G82-Q116 WeakPolarHBondContact CA-O 3.33Å; G82-T118 WeakPolarHBondContact O-CB 3.24Å; G82-T118 PolarHBondContact O-N 3.07Å; G82-T118 PolarHBondContact O-OG1 2.9Å
83	Q	93.9	Very high	95.3	Very high	119 Å²	119	29.3 Å²	29.3	56%	0.556	15%	0.146	S	C	*	.	S	Bend	trans	-72.6	-45.6	172.7	-59.4	-171	16.8	0	0	110.5	S81 A85	S81-Q83 PolarHBondContact O-N 3.22Å; Q83-A85 VanDerWaalsContact C-N 3.28Å; Q83-A85 PolarHBondContact O-N 3.42Å
84	N	94.5	Very high	95.3	Very high	37 Å²	37	33.3 Å²	33.3	20%	0.198	16%	0.16	C	C	.	.	G	3₁₀ helix	trans	-86.9	8.8	-178.2	-65.1	8.1	0	0	0	113.5	E24 D25 V80 S81 S86 C87	E24-N84 PolarHBondContact O-ND2 2.63Å; D25-N84 WeakPolarHBondContact CA-ND2 3.37Å; D25-N84 VanDerWaalsContact CB-ND2 3.31Å; D25-N84 WeakPolarHBondContact CB-ND2 3.43Å; V80-N84 HydrophobicContact CG1-CB 4.13Å; V80-N84 WeakPolarHBondContact CG1-O 3.37Å; S81-N84 CarbonylContact O-C 3.48Å; S81-N84 PolarHBondContact O-N 3.01Å; S81-N84 WeakPolarHBondContact OG-CB 3.34Å; S81-N84 PolarHBondContact OG-N 2.77Å; N84-S86 PolarHBondContact O-N 2.85Å; N84-S86 VanDerWaalsContact O-N 3.09Å; N84-C87 WeakPolarHBondContact O-CB 3.25Å; N84-C87 PolarHBondContact O-N 3.31Å; N84-C87 PolarHBondContact O-SG 2.95Å
85	A	95.2	Very high	95.3	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	15%	0.146	C	C	.	.	G	3₁₀ helix	trans	-56.1	-28.6	179.6	0	0	0	0	0	113.2	S81 Q83 C87 L88 F113 P117 L120	S81-A85 PolarHBondContact O-N 3.48Å; Q83-A85 VanDerWaalsContact C-N 3.28Å; Q83-A85 PolarHBondContact O-N 3.42Å; A85-C87 PolarHBondContact O-N 3.25Å; A85-L88 VanDerWaalsContact O-CB 3.3Å; A85-L88 WeakPolarHBondContact O-CB 3.47Å; A85-L88 WeakPolarHBondContact O-CG 3.46Å; A85-L88 PolarHBondContact O-N 3.39Å; A85-L88 VanDerWaalsContact O-N 3.13Å; A85-F113 HydrophobicContact CB-CD1 4.29Å; A85-F113 HydrophobicContact CB-CE1 3.84Å; A85-P117 HydrophobicContact CB-CB 3.52Å; A85-L120 VanDerWaalsContact O-CD1 3.28Å; A85-L120 WeakPolarHBondContact O-CD1 3.25Å
86	S	93.9	Very high	95.2	Very high	46 Å²	46	33 Å²	33	32%	0.322	16%	0.161	S	C	.	.	G	3₁₀ helix	trans	-59.8	-20.9	171.7	62.7	0	0	0	0	114	N84 L88 D89	N84-S86 PolarHBondContact O-N 2.85Å; N84-S86 VanDerWaalsContact O-N 3.09Å; S86-L88 PolarHBondContact O-N 2.96Å; S86-D89 WeakPolarHBondContact O-CB 3.24Å; S86-D89 PolarHBondContact O-N 3.29Å; S86-D89 VanDerWaalsContact O-N 3.14Å
87	C	93.8	Very high	95.1	Very high	5 Å²	5	36.3 Å²	36.3	3%	0.034	18%	0.18	C	C	.	.	H	α-helix	trans	-60.6	-26.4	174.2	82.2	0	0	0	0	112.7	S10 L14 V80 N84 A85 D89 Y90	S10-C87 WeakPolarHBondContact CB-SG 3.3Å; L14-C87 HydrophobicContact CD1-CB 3.92Å; L14-C87 HydrophobicContact CD2-CB 4.17Å; L14-C87 HydrophobicContact CG-CB 4.45Å; V80-C87 VanDerWaalsContact CG1-SG 3.54Å; N84-C87 WeakPolarHBondContact O-CB 3.25Å; N84-C87 PolarHBondContact O-N 3.31Å; N84-C87 PolarHBondContact O-SG 2.95Å; A85-C87 PolarHBondContact O-N 3.25Å; C87-D89 VanDerWaalsContact C-N 3.27Å; C87-D89 PolarHBondContact O-N 2.95Å; C87-Y90 PolarHBondContact O-N 3.11Å
88	L	94.9	Very high	95.1	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-62	-35.7	177.7	-67	-178	0	0	0	111.5	L78 V80 A85 S86 Y90 I91 Y92 I111 F113 L120 F123	L78-L88 HydrophobicContact CD1-CD2 4.35Å; L78-L88 HydrophobicContact CD2-CD2 3.71Å; L78-L88 HydrophobicContact CG-CD2 4.12Å; V80-L88 HydrophobicContact CG2-CD2 3.91Å; V80-L88 HydrophobicContact CG2-CG 4.31Å; A85-L88 VanDerWaalsContact O-CB 3.3Å; A85-L88 WeakPolarHBondContact O-CB 3.47Å; A85-L88 WeakPolarHBondContact O-CG 3.46Å; A85-L88 PolarHBondContact O-N 3.39Å; A85-L88 VanDerWaalsContact O-N 3.13Å; S86-L88 PolarHBondContact O-N 2.96Å; L88-Y90 VanDerWaalsContact C-N 3.27Å; L88-Y90 PolarHBondContact O-N 3.5Å; L88-I91 HydrophobicContact CD2-CD1 3.96Å; L88-I91 VanDerWaalsContact O-CG1 3.25Å; L88-I91 WeakPolarHBondContact O-CG1 3.36Å; L88-I91 PolarHBondContact O-N 3.3Å; L88-Y92 WeakPolarHBondContact O-CB 3.09Å; L88-Y92 PolarHBondContact O-N 3.17Å; L88-I111 HydrophobicContact CD1-CD1 4.35Å; L88-F113 HydrophobicContact CD1-CE1 3.64Å; L88-F113 HydrophobicContact CD1-CZ 3.64Å; L88-L120 HydrophobicContact CB-CD1 3.9Å; L88-L120 HydrophobicContact CD1-CD1 3.9Å; L88-L120 HydrophobicContact CG-CD1 4.41Å; L88-F123 HydrophobicContact CB-CB 3.93Å; L88-F123 HydrophobicContact CB-CD2 3.67Å; L88-F123 HydrophobicContact CB-CE2 4.39Å; L88-F123 HydrophobicContact CB-CG 3.89Å; L88-F123 HydrophobicContact CD1-CG 4.48Å; L88-F123 WeakPolarHBondContact O-CD2 3.48Å
89	D	94.6	Very high	95	Very high	26 Å²	26	36.8 Å²	36.8	14%	0.139	18%	0.183	C	C	.	.	H	α-helix	trans	-63.4	-32.3	179.4	-72.8	1.7	0	0	0	112.3	S86 C87 L121 N122 F123	S86-D89 WeakPolarHBondContact O-CB 3.24Å; S86-D89 PolarHBondContact O-N 3.29Å; S86-D89 VanDerWaalsContact O-N 3.14Å; C87-D89 VanDerWaalsContact C-N 3.27Å; C87-D89 PolarHBondContact O-N 2.95Å; D89-L121 WeakPolarHBondContact OD2-CA 3.17Å; D89-L121 WeakPolarHBondContact OD2-CB 3.41Å; D89-L121 PolarHBondContact OD2-N 3.38Å; D89-L121 VanDerWaalsContact OD2-N 3.11Å; D89-N122 HydrophobicContact CB-CB 4.13Å; D89-N122 VanDerWaalsContact CG-N 3.28Å; D89-N122 PolarHBondContact OD1-N 2.76Å; D89-N122 PolarHBondContact OD2-N 2.98Å; D89-N122 PolarHBondContact OD2-ND2 2.91Å; D89-F123 PolarHBondContact OD1-N 3.42Å
90	Y	92.7	Very high	94.8	Very high	153 Å²	153	41.8 Å²	41.8	60%	0.6	21%	0.213	S	C	*	.	H	α-helix	trans	-70	-34.9	176.9	-67.8	-94.9	0	0	0	112.8	I18 C87 L88	I18-Y90 HydrophobicContact CD1-CD1 4.31Å; C87-Y90 PolarHBondContact O-N 3.11Å; L88-Y90 VanDerWaalsContact C-N 3.27Å; L88-Y90 PolarHBondContact O-N 3.5Å
91	I	93.3	Very high	94.7	Very high	5 Å²	5	44.6 Å²	44.6	3%	0.026	24%	0.236	C	C	.	.	H	α-helix	trans	-90.2	-18.6	178.8	63.1	172.8	0	0	0	112.9	L13 L14 L78 L88 R94 F95	L13-I91 HydrophobicContact CB-CD1 4.44Å; L13-I91 HydrophobicContact CD1-CD1 3.86Å; L14-I91 HydrophobicContact CD2-CG2 4.21Å; L78-I91 HydrophobicContact CD2-CD1 4.37Å; L88-I91 HydrophobicContact CD2-CD1 3.96Å; L88-I91 VanDerWaalsContact O-CG1 3.25Å; L88-I91 WeakPolarHBondContact O-CG1 3.36Å; L88-I91 PolarHBondContact O-N 3.3Å; I91-R94 PolarHBondContact O-N 3.4Å; I91-F95 HydrophobicContact CB-CD2 3.98Å; I91-F95 HydrophobicContact CB-CE2 4.18Å; I91-F95 HydrophobicContact CD1-CD2 4.07Å; I91-F95 HydrophobicContact CD1-CE2 3.78Å; I91-F95 HydrophobicContact CD1-CZ 4.25Å; I91-F95 HydrophobicContact CG1-CD2 4.15Å; I91-F95 HydrophobicContact CG1-CE2 4.31Å; I91-F95 PolarHBondContact O-N 3.17Å
92	Y	95	Very high	94.7	Very high	43 Å²	43	47 Å²	47	17%	0.169	25%	0.246	C	C	.	.	H	α-helix	trans	-48.1	-47.2	-176.4	-179.9	-117.9	0	0	0	114.2	L88 R94 F95 L96 N122 F123 D124 L127	L88-Y92 WeakPolarHBondContact O-CB 3.09Å; L88-Y92 PolarHBondContact O-N 3.17Å; Y92-R94 VanDerWaalsContact C-N 3.3Å; Y92-R94 PolarHBondContact O-N 2.72Å; Y92-F95 PolarHBondContact O-N 3.06Å; Y92-L96 HydrophobicContact CE1-CD1 4.37Å; Y92-L96 WeakPolarHBondContact O-CB 3.42Å; Y92-L96 PolarHBondContact O-N 3.19Å; Y92-N122 VanDerWaalsContact CE1-O 3.23Å; Y92-N122 WeakPolarHBondContact CE1-O 3.36Å; Y92-F123 HydrophobicContact CD2-CB 4.15Å; Y92-F123 AromaticContact CD2-CD2 3.55Å; Y92-F123 HydrophobicContact CD2-CD2 3.55Å; Y92-F123 HydrophobicContact CD2-CE2 4.04Å; Y92-F123 AromaticContact CD2-CG 3.83Å; Y92-F123 HydrophobicContact CD2-CG 3.83Å; Y92-F123 HydrophobicContact CE2-CG 4.5Å; Y92-F123 HydrophobicContact CG-CB 4.42Å; Y92-F123 HydrophobicContact CG-CD2 4.09Å; Y92-F123 HydrophobicContact CG-CG 4.47Å; Y92-D124 HydrophobicContact CE2-CB 4.06Å; Y92-D124 VanDerWaalsContact CE2-N 3.33Å; Y92-D124 VanDerWaalsContact OH-CB 3.3Å; Y92-D124 WeakPolarHBondContact OH-CB 3.17Å; Y92-L127 HydrophobicContact CE2-CD1 3.56Å
93	P	94.9	Very high	94.7	Very high	82 Å²	82	55 Å²	55	53%	0.532	28%	0.281	S	S	.	.	H	α-helix	trans	-63.6	-34.4	179.3	-21.6	34.4	0	0	0	113	V97	P93-V97 WeakPolarHBondContact O-CG2 3.33Å; P93-V97 PolarHBondContact O-N 3.04Å
94	R	94.2	Very high	94.7	Very high	96 Å²	96	51.6 Å²	51.6	36%	0.362	27%	0.27	S	S	.	.	H	α-helix	trans	-75	-38.7	177.3	-59.6	-167.2	-176.6	-132.7	-1.5	111.1	L58 H59 F62 I91 Y92 V97 F98	L58-R94 HydrophobicContact CB-CB 4.12Å; L58-R94 HydrophobicContact CD1-CB 3.63Å; L58-R94 PolarHBondContact O-NH1 3.19Å; H59-R94 PolarHBondContact O-NH1 2.99Å; F62-R94 WeakPolarHBondContact CE1-O 3.24Å; I91-R94 PolarHBondContact O-N 3.4Å; Y92-R94 VanDerWaalsContact C-N 3.3Å; Y92-R94 PolarHBondContact O-N 2.72Å; R94-V97 PolarHBondContact O-N 2.93Å; R94-F98 WeakPolarHBondContact O-CB 3.4Å; R94-F98 PolarHBondContact O-N 2.87Å
95	F	94.7	Very high	94.8	Very high	3 Å²	3	50 Å²	50	1%	0.013	26%	0.261	C	S	.	.	H	α-helix	trans	-66.6	-37.7	175.5	-90.4	-111.5	0	0	0	112.3	L13 L58 F65 L78 I91 Y92 V97 F98 F99 I109	L13-F95 HydrophobicContact CD1-CE2 4.26Å; L13-F95 HydrophobicContact CD1-CZ 3.86Å; L13-F95 HydrophobicContact CD2-CE2 4.38Å; L13-F95 HydrophobicContact CD2-CZ 4.22Å; L58-F95 HydrophobicContact CD1-CD2 3.6Å; L58-F95 HydrophobicContact CD1-CE2 3.63Å; F65-F95 HydrophobicContact CZ-CZ 4.42Å; L78-F95 HydrophobicContact CD2-CE1 4.42Å; I91-F95 HydrophobicContact CB-CD2 3.98Å; I91-F95 HydrophobicContact CB-CE2 4.18Å; I91-F95 HydrophobicContact CD1-CD2 4.07Å; I91-F95 HydrophobicContact CD1-CE2 3.78Å; I91-F95 HydrophobicContact CD1-CZ 4.25Å; I91-F95 HydrophobicContact CG1-CD2 4.15Å; I91-F95 HydrophobicContact CG1-CE2 4.31Å; I91-F95 PolarHBondContact O-N 3.17Å; Y92-F95 PolarHBondContact O-N 3.06Å; F95-V97 PolarHBondContact O-N 3.13Å; F95-F98 WeakPolarHBondContact O-CB 3.48Å; F95-F98 PolarHBondContact O-N 3Å; F95-F99 HydrophobicContact CB-CD2 4.42Å; F95-F99 HydrophobicContact CB-CE2 4.09Å; F95-F99 AromaticContact CD1-CE2 3.8Å; F95-F99 HydrophobicContact CD1-CE2 3.8Å; F95-F99 AromaticContact CD1-CZ 3.73Å; F95-F99 HydrophobicContact CD1-CZ 3.73Å; F95-F99 HydrophobicContact CE1-CZ 4.4Å; F95-F99 HydrophobicContact CG-CE2 4.46Å; F95-F99 WeakPolarHBondContact O-CD2 3.26Å; F95-F99 WeakPolarHBondContact O-CG 3.24Å; F95-F99 PolarHBondContact O-N 3.45Å; F95-I109 HydrophobicContact CE1-CD1 4.12Å
96	L	95.4	Very high	94.9	Very high	69 Å²	69	50.7 Å²	50.7	36%	0.361	27%	0.267	S	S	.	.	H	α-helix	trans	-62.9	-40.6	175	-171.8	151.6	0	0	0	112.1	Y92 T100 L127	Y92-L96 HydrophobicContact CE1-CD1 4.37Å; Y92-L96 WeakPolarHBondContact O-CB 3.42Å; Y92-L96 PolarHBondContact O-N 3.19Å; L96-T100 WeakPolarHBondContact O-CG2 3.41Å; L96-T100 PolarHBondContact O-N 3.31Å; L96-T100 PolarHBondContact O-OG1 3.37Å; L96-L127 HydrophobicContact CD1-CD1 4.3Å; L96-L127 HydrophobicContact CG-CD1 4.44Å
97	V	95.7	Very high	94.9	Very high	69 Å²	69	51.1 Å²	51.1	42%	0.418	26%	0.264	S	S	.	.	H	α-helix	trans	-70.5	-37	173.1	-176.4	0	0	0	0	111.5	F62 P93 R94 F95 T100 A101	F62-V97 HydrophobicContact CD2-CG1 4.44Å; F62-V97 HydrophobicContact CE1-CB 4.34Å; F62-V97 HydrophobicContact CE1-CG1 4.39Å; F62-V97 HydrophobicContact CE2-CB 4.23Å; F62-V97 HydrophobicContact CE2-CG1 3.44Å; F62-V97 VanDerWaalsContact CE2-CG1 3.44Å; F62-V97 HydrophobicContact CZ-CB 3.67Å; F62-V97 HydrophobicContact CZ-CG1 3.42Å; F62-V97 VanDerWaalsContact CZ-CG1 3.42Å; P93-V97 WeakPolarHBondContact O-CG2 3.33Å; P93-V97 PolarHBondContact O-N 3.04Å; R94-V97 PolarHBondContact O-N 2.93Å; F95-V97 PolarHBondContact O-N 3.13Å; V97-T100 WeakPolarHBondContact CA-OG1 3.33Å; V97-T100 PolarHBondContact O-N 3.29Å; V97-T100 PolarHBondContact O-OG1 3.03Å; V97-T100 VanDerWaalsContact O-OG1 3.07Å; V97-A101 WeakPolarHBondContact O-CB 3.37Å; V97-A101 PolarHBondContact O-N 2.98Å
98	F	96.1	Very high	95	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-61.3	-48.3	174	179.1	-114.7	0	0	0	112.3	F62 F65 E66 L70 R94 F95 A101 K102 W105 I109	F62-F98 HydrophobicContact CB-CD2 4.05Å; F62-F98 HydrophobicContact CD1-CB 3.72Å; F62-F98 AromaticContact CD1-CD2 3.8Å; F62-F98 HydrophobicContact CD1-CD2 3.8Å; F62-F98 HydrophobicContact CD1-CG 4.23Å; F62-F98 HydrophobicContact CE1-CB 3.92Å; F62-F98 HydrophobicContact CG-CD2 4.3Å; F65-F98 HydrophobicContact CD1-CD2 4.26Å; F65-F98 HydrophobicContact CD1-CE1 4.47Å; F65-F98 AromaticContact CD1-CE2 3.88Å; F65-F98 HydrophobicContact CD1-CE2 3.88Å; F65-F98 AromaticContact CD1-CZ 4Å; F65-F98 HydrophobicContact CD1-CZ 4Å; F65-F98 HydrophobicContact CE1-CD1 4.32Å; F65-F98 AromaticContact CE1-CE1 3.96Å; F65-F98 HydrophobicContact CE1-CE1 3.96Å; F65-F98 HydrophobicContact CE1-CE2 4.2Å; F65-F98 AromaticContact CE1-CZ 3.9Å; F65-F98 HydrophobicContact CE1-CZ 3.9Å; E66-F98 HydrophobicContact CB-CE2 4.38Å; L70-F98 HydrophobicContact CD1-CE1 4.01Å; L70-F98 HydrophobicContact CD1-CZ 3.64Å; R94-F98 WeakPolarHBondContact O-CB 3.4Å; R94-F98 PolarHBondContact O-N 2.87Å; F95-F98 WeakPolarHBondContact O-CB 3.48Å; F95-F98 PolarHBondContact O-N 3Å; F98-A101 PolarHBondContact O-N 3.32Å; F98-K102 HydrophobicContact CE2-CB 4.26Å; F98-K102 HydrophobicContact CE2-CG 4.2Å; F98-K102 HydrophobicContact CZ-CB 4.48Å; F98-K102 PolarHBondContact O-N 2.97Å; F98-W105 HydrophobicContact CE1-CB 3.63Å; F98-W105 AromaticContact CE1-CD1 3.9Å; F98-W105 AromaticContact CE1-CG 3.78Å; F98-W105 HydrophobicContact CE1-CG 3.78Å; F98-W105 HydrophobicContact CZ-CB 4.12Å; F98-W105 AromaticContact CZ-CD1 3.45Å; F98-W105 VanDerWaalsContact CZ-CD1 3.45Å; F98-W105 AromaticContact CZ-CG 3.76Å; F98-W105 HydrophobicContact CZ-CG 3.76Å; F98-I109 HydrophobicContact CE1-CD1 4.24Å
99	F	95.9	Very high	95.1	Very high	15 Å²	15	53.1 Å²	53.1	7%	0.066	27%	0.271	C	S	.	.	H	α-helix	trans	-69.9	-31.5	179.9	-66	-45	0	0	0	113.3	F95 K102 K103 W105 A106 I109 L128	F95-F99 HydrophobicContact CB-CD2 4.42Å; F95-F99 HydrophobicContact CB-CE2 4.09Å; F95-F99 AromaticContact CD1-CE2 3.8Å; F95-F99 HydrophobicContact CD1-CE2 3.8Å; F95-F99 AromaticContact CD1-CZ 3.73Å; F95-F99 HydrophobicContact CD1-CZ 3.73Å; F95-F99 HydrophobicContact CE1-CZ 4.4Å; F95-F99 HydrophobicContact CG-CE2 4.46Å; F95-F99 WeakPolarHBondContact O-CD2 3.26Å; F95-F99 WeakPolarHBondContact O-CG 3.24Å; F95-F99 PolarHBondContact O-N 3.45Å; F99-K102 CarbonylContact O-C 3.55Å; F99-K103 WeakPolarHBondContact O-CA 3.49Å; F99-K103 PolarHBondContact O-N 3.4Å; F99-K103 VanDerWaalsContact O-N 3.1Å; F99-W105 HydrophobicContact CD1-CB 4.12Å; F99-W105 HydrophobicContact CE1-CB 4.02Å; F99-A106 HydrophobicContact CD1-CB 4.1Å; F99-A106 HydrophobicContact CG-CB 4.35Å; F99-I109 HydrophobicContact CE1-CB 4.34Å; F99-I109 HydrophobicContact CE1-CD1 3.78Å; F99-I109 HydrophobicContact CE1-CG1 4.1Å; F99-I109 HydrophobicContact CZ-CB 4.27Å; F99-I109 HydrophobicContact CZ-CD1 3.97Å; F99-I109 HydrophobicContact CZ-CG1 4.39Å; F99-L128 HydrophobicContact CE1-CD2 4.2Å; F99-L128 HydrophobicContact CE2-CD2 3.8Å; F99-L128 HydrophobicContact CZ-CD2 3.5Å
100	T	94.6	Very high	95.2	Very high	104 Å²	104	52 Å²	52	64%	0.638	27%	0.265	S	S	*	.	H	α-helix	trans	-71.3	-33.5	171.9	47.6	0	0	0	0	112.2	L96 V97	L96-T100 WeakPolarHBondContact O-CG2 3.41Å; L96-T100 PolarHBondContact O-N 3.31Å; L96-T100 PolarHBondContact O-OG1 3.37Å; V97-T100 WeakPolarHBondContact CA-OG1 3.33Å; V97-T100 PolarHBondContact O-N 3.29Å; V97-T100 PolarHBondContact O-OG1 3.03Å; V97-T100 VanDerWaalsContact O-OG1 3.07Å
101	A	94.1	Very high	95.4	Very high	59 Å²	59	44.8 Å²	44.8	49%	0.488	24%	0.237	S	C	.	.	H	α-helix	trans	-75.4	-37	173.9	0	0	0	0	0	113.8	V97 F98	V97-A101 WeakPolarHBondContact O-CB 3.37Å; V97-A101 PolarHBondContact O-N 2.98Å; F98-A101 PolarHBondContact O-N 3.32Å
102	K	95.6	Very high	95.7	Very high	56 Å²	56	44.6 Å²	44.6	24%	0.243	24%	0.236	C	C	.	.			trans	-132.9	63	-173.9	-58.1	-65.2	173.6	84.4	0	111.4	N63 E66 F98 F99 S104 W105	N63-K102 PolarHBondContact OD1-NZ 3.5Å; E66-K102 WeakPolarHBondContact OE2-CD 3.36Å; E66-K102 IonicContact OE2-NZ 3.42Å; E66-K102 PolarHBondContact OE2-NZ 3.25Å; F98-K102 HydrophobicContact CE2-CB 4.26Å; F98-K102 HydrophobicContact CE2-CG 4.2Å; F98-K102 HydrophobicContact CZ-CB 4.48Å; F98-K102 PolarHBondContact O-N 2.97Å; F99-K102 CarbonylContact O-C 3.55Å; K102-S104 PolarHBondContact O-N 3.44Å; K102-W105 PolarHBondContact O-N 2.81Å
103	K	95	Very high	95.8	Very high	168 Å²	168	42.7 Å²	42.7	73%	0.73	23%	0.228	S	C	*	.	G	3₁₀ helix	trans	-49.9	-25.9	-174.5	-174.2	170.3	-179.5	174.3	0	115.7	F99 W105 A106	F99-K103 WeakPolarHBondContact O-CA 3.49Å; F99-K103 PolarHBondContact O-N 3.4Å; F99-K103 VanDerWaalsContact O-N 3.1Å; K103-W105 PolarHBondContact O-N 3.09Å; K103-A106 WeakPolarHBondContact O-CB 3.33Å; K103-A106 PolarHBondContact O-N 3.34Å
104	S	95.8	Very high	95.9	Very high	47 Å²	47	38.8 Å²	38.8	33%	0.329	20%	0.203	S	C	.	.	G	3₁₀ helix	trans	-59	-26.4	173.4	46.6	0	0	0	0	114.2	K102 E107 R108	K102-S104 PolarHBondContact O-N 3.44Å; S104-E107 PolarHBondContact O-N 3.04Å; S104-R108 WeakPolarHBondContact O-CG 3.34Å
105	W	96.1	Very high	95.9	Very high	3 Å²	3	36.2 Å²	36.2	1%	0.011	19%	0.194	C	C	.	.	G	3₁₀ helix	trans	-76.4	-23.5	178.4	-73.3	107.5	0	0	0	113.8	E66 L70 F98 F99 K102 K103 E107 R108 I109	E66-W105 PolarHBondContact OE1-NE1 3.16Å; L70-W105 HydrophobicContact CB-CH2 3.73Å; L70-W105 HydrophobicContact CB-CZ2 3.61Å; L70-W105 HydrophobicContact CB-CZ3 4.25Å; L70-W105 HydrophobicContact CD1-CD2 4.05Å; L70-W105 HydrophobicContact CD1-CE3 4.25Å; L70-W105 HydrophobicContact CD1-CZ2 4.5Å; L70-W105 WeakPolarHBondContact O-CH2 3.41Å; F98-W105 HydrophobicContact CE1-CB 3.63Å; F98-W105 AromaticContact CE1-CD1 3.9Å; F98-W105 AromaticContact CE1-CG 3.78Å; F98-W105 HydrophobicContact CE1-CG 3.78Å; F98-W105 HydrophobicContact CZ-CB 4.12Å; F98-W105 AromaticContact CZ-CD1 3.45Å; F98-W105 VanDerWaalsContact CZ-CD1 3.45Å; F98-W105 AromaticContact CZ-CG 3.76Å; F98-W105 HydrophobicContact CZ-CG 3.76Å; F99-W105 HydrophobicContact CD1-CB 4.12Å; F99-W105 HydrophobicContact CE1-CB 4.02Å; K102-W105 PolarHBondContact O-N 2.81Å; K103-W105 PolarHBondContact O-N 3.09Å; W105-E107 PolarHBondContact O-N 3.45Å; W105-E107 VanDerWaalsContact O-N 3.16Å; W105-R108 HydrophobicContact CD2-CB 4.47Å; W105-R108 HydrophobicContact CE3-CB 3.55Å; W105-R108 HydrophobicContact CE3-CG 4.37Å; W105-R108 HydrophobicContact CZ3-CB 3.75Å; W105-R108 HydrophobicContact CZ3-CG 4.43Å; W105-R108 PolarHBondContact O-N 3.37Å; W105-I109 HydrophobicContact CB-CD1 4.45Å; W105-I109 HydrophobicContact CB-CG1 4.28Å; W105-I109 HydrophobicContact CE3-CG1 4.11Å; W105-I109 WeakPolarHBondContact O-CG1 3.49Å; W105-I109 PolarHBondContact O-N 2.91Å
106	A	95.8	Very high	95.9	Very high	15 Å²	15	42.2 Å²	42.2	12%	0.124	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-64.1	-16.6	168.7	0	0	0	0	0	112.7	F99 K103 K129	F99-A106 HydrophobicContact CD1-CB 4.1Å; F99-A106 HydrophobicContact CG-CB 4.35Å; K103-A106 WeakPolarHBondContact O-CB 3.33Å; K103-A106 PolarHBondContact O-N 3.34Å; A106-K129 WeakPolarHBondContact O-CB 3.14Å; A106-K129 PolarHBondContact O-N 3.49Å
107	E	94.9	Very high	95.9	Very high	56 Å²	56	40.4 Å²	40.4	26%	0.262	22%	0.215	S	C	.	.	G	3₁₀ helix	trans	-98.3	5.3	172.1	-48.5	-157.9	123.1	0	0	114.2	S104 W105 K129	S104-E107 PolarHBondContact O-N 3.04Å; W105-E107 PolarHBondContact O-N 3.45Å; W105-E107 VanDerWaalsContact O-N 3.16Å; E107-K129 HydrophobicContact CB-CD 3.89Å; E107-K129 HydrophobicContact CG-CD 3.74Å; E107-K129 WeakPolarHBondContact OE1-CD 3.35Å; E107-K129 WeakPolarHBondContact OE1-CE 3.21Å; E107-K129 IonicContact OE1-NZ 3.48Å; E107-K129 PolarHBondContact OE1-NZ 3.46Å; E107-K129 IonicContact OE2-NZ 3.67Å
108	R	95.8	Very high	95.7	Very high	46 Å²	46	40.3 Å²	40.3	17%	0.174	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-138	-19.7	-172	-65.3	178.6	-163.5	179	5.1	115.2	E74 Y75 A76 S104 W105 Y161	E74-R108 WeakPolarHBondContact O-CD 3.25Å; Y75-R108 WeakPolarHBondContact CA-O 3.36Å; Y75-R108 HydrophobicContact CD1-CB 4.44Å; A76-R108 PolarHBondContact N-O 2.66Å; S104-R108 WeakPolarHBondContact O-CG 3.34Å; W105-R108 HydrophobicContact CD2-CB 4.47Å; W105-R108 HydrophobicContact CE3-CB 3.55Å; W105-R108 HydrophobicContact CE3-CG 4.37Å; W105-R108 HydrophobicContact CZ3-CB 3.75Å; W105-R108 HydrophobicContact CZ3-CG 4.43Å; W105-R108 PolarHBondContact O-N 3.37Å; R108-Y161 HydrophobicContact CG-CD2 4.14Å; R108-Y161 HydrophobicContact CG-CE2 3.69Å; R108-Y161 VanDerWaalsContact NE-CE1 3.32Å; R108-Y161 PolarHBondContact NE-OH 2.89Å; R108-Y161 VanDerWaalsContact NE-OH 3.17Å; R108-Y161 VanDerWaalsContact NH2-CE1 3.32Å; R108-Y161 PolarHBondContact NH2-OH 3.43Å
109	I	96.9	Very high	95.3	Very high	1 Å²	1	44.7 Å²	44.7	1%	0.005	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	132.1	170.1	-57.2	-160.7	0	0	0	108.3	A76 L78 F95 F98 F99 W105 L128	A76-I109 HydrophobicContact CB-CG1 4.23Å; A76-I109 WeakPolarHBondContact O-CA 3.41Å; L78-I109 HydrophobicContact CB-CG2 4.49Å; F95-I109 HydrophobicContact CE1-CD1 4.12Å; F98-I109 HydrophobicContact CE1-CD1 4.24Å; F99-I109 HydrophobicContact CE1-CB 4.34Å; F99-I109 HydrophobicContact CE1-CD1 3.78Å; F99-I109 HydrophobicContact CE1-CG1 4.1Å; F99-I109 HydrophobicContact CZ-CB 4.27Å; F99-I109 HydrophobicContact CZ-CD1 3.97Å; F99-I109 HydrophobicContact CZ-CG1 4.39Å; W105-I109 HydrophobicContact CB-CD1 4.45Å; W105-I109 HydrophobicContact CB-CG1 4.28Å; W105-I109 HydrophobicContact CE3-CG1 4.11Å; W105-I109 WeakPolarHBondContact O-CG1 3.49Å; W105-I109 PolarHBondContact O-N 2.91Å; I109-L128 HydrophobicContact CB-CD2 4.21Å; I109-L128 HydrophobicContact CG2-CD2 4.47Å
110	L	96.7	Very high	95	Very high	3 Å²	3	46.2 Å²	46.2	2%	0.016	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	155.3	170.5	-60	98.2	0	0	0	109.5	Y75 A76 L77 L78 H130 L156	Y75-L110 HydrophobicContact CD1-CD1 3.82Å; Y75-L110 HydrophobicContact CG-CD1 4.49Å; A76-L110 PolarHBondContact O-N 2.88Å; L77-L110 HydrophobicContact CD2-CB 4.02Å; L77-L110 HydrophobicContact CD2-CD1 3.93Å; L78-L110 WeakPolarHBondContact CB-O 3.26Å; L78-L110 PolarHBondContact N-O 3.4Å; L110-H130 HydrophobicContact CD2-CB 3.53Å; L110-H130 HydrophobicContact CG-CB 3.79Å; L110-L156 HydrophobicContact CD1-CD1 4.35Å; L110-L156 HydrophobicContact CD2-CD1 3.34Å; L110-L156 HydrophobicContact CD2-CD2 4.03Å; L110-L156 HydrophobicContact CD2-CG 4.33Å; L110-L156 HydrophobicContact CG-CD1 4.48Å
111	I	97.7	Very high	94.6	Very high	1 Å²	1	48.1 Å²	48.1	1%	0.005	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	138.5	173.4	-67.7	168.8	0	0	0	109.3	L78 L88 F113 F123 L125 L128 P132 I133	L78-I111 HydrophobicContact CB-CG1 4.1Å; L78-I111 HydrophobicContact CD2-CG1 4.14Å; L78-I111 HydrophobicContact CG-CG1 4.17Å; L78-I111 CarbonylContact O-C 3.5Å; L78-I111 WeakPolarHBondContact O-CA 3.23Å; L88-I111 HydrophobicContact CD1-CD1 4.35Å; I111-F113 HydrophobicContact CG2-CD1 4.24Å; I111-F113 HydrophobicContact CG2-CD2 3.95Å; I111-F113 HydrophobicContact CG2-CE1 3.98Å; I111-F113 HydrophobicContact CG2-CE2 3.67Å; I111-F113 HydrophobicContact CG2-CG 4.22Å; I111-F113 HydrophobicContact CG2-CZ 3.69Å; I111-F123 HydrophobicContact CD1-CD1 4.36Å; I111-F123 HydrophobicContact CD1-CE1 3.54Å; I111-F123 HydrophobicContact CD1-CZ 3.85Å; I111-L125 HydrophobicContact CD1-CD2 3.69Å; I111-L128 HydrophobicContact CD1-CD1 3.58Å; I111-L128 HydrophobicContact CG1-CD1 3.72Å; I111-P132 HydrophobicContact CB-CB 4.3Å; I111-P132 HydrophobicContact CG2-CB 4.32Å; I111-P132 WeakPolarHBondContact O-CA 3.02Å; I111-I133 PolarHBondContact O-N 2.97Å
112	I	98	Very high	94.4	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	118.1	170.5	-56.6	179	0	0	0	107.1	F31 L77 L78 I79 V80 L114 I133 F135 I153	F31-I112 HydrophobicContact CE1-CD1 4.1Å; F31-I112 HydrophobicContact CE1-CG2 3.99Å; F31-I112 HydrophobicContact CZ-CG2 4.21Å; L77-I112 HydrophobicContact CB-CD1 4.21Å; L77-I112 HydrophobicContact CD1-CD1 4.25Å; L77-I112 HydrophobicContact CD2-CD1 4.5Å; L78-I112 PolarHBondContact O-N 3.18Å; I79-I112 WeakPolarHBondContact CA-O 3.34Å; I79-I112 HydrophobicContact CG1-CB 4.34Å; I79-I112 HydrophobicContact CG1-CD1 4.29Å; V80-I112 PolarHBondContact N-O 3.39Å; I112-L114 HydrophobicContact CG2-CD2 4.16Å; I112-I133 CarbonylContact C-O 3.58Å; I112-I133 WeakPolarHBondContact CA-O 3.23Å; I112-I133 HydrophobicContact CG1-CB 4.39Å; I112-F135 HydrophobicContact CG2-CD2 3.65Å; I112-F135 HydrophobicContact CG2-CE2 3.75Å; I112-I153 HydrophobicContact CD1-CD1 3.93Å
113	F	97.6	Very high	94.3	Very high	4 Å²	4	47.4 Å²	47.4	2%	0.018	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	135.7	170.9	-69.9	-61.3	0	0	0	110.3	V80 A85 L88 I111 P117 L120 L125 P132 I133 L134 F135	V80-F113 WeakPolarHBondContact O-CA 3.4Å; A85-F113 HydrophobicContact CB-CD1 4.29Å; A85-F113 HydrophobicContact CB-CE1 3.84Å; L88-F113 HydrophobicContact CD1-CE1 3.64Å; L88-F113 HydrophobicContact CD1-CZ 3.64Å; I111-F113 HydrophobicContact CG2-CD1 4.24Å; I111-F113 HydrophobicContact CG2-CD2 3.95Å; I111-F113 HydrophobicContact CG2-CE1 3.98Å; I111-F113 HydrophobicContact CG2-CE2 3.67Å; I111-F113 HydrophobicContact CG2-CG 4.22Å; I111-F113 HydrophobicContact CG2-CZ 3.69Å; F113-P117 HydrophobicContact CD1-CB 4.04Å; F113-P117 HydrophobicContact CD1-CG 4.45Å; F113-P117 HydrophobicContact CD2-CB 4.36Å; F113-P117 HydrophobicContact CD2-CG 3.92Å; F113-P117 HydrophobicContact CE1-CB 3.92Å; F113-P117 HydrophobicContact CE1-CG 4.46Å; F113-P117 HydrophobicContact CE2-CB 4.26Å; F113-P117 HydrophobicContact CE2-CG 3.93Å; F113-P117 HydrophobicContact CG-CB 4.26Å; F113-P117 HydrophobicContact CG-CG 4.19Å; F113-P117 HydrophobicContact CZ-CB 4.03Å; F113-P117 HydrophobicContact CZ-CG 4.21Å; F113-L120 HydrophobicContact CZ-CD2 4.25Å; F113-L125 HydrophobicContact CE2-CD2 4.17Å; F113-L125 HydrophobicContact CZ-CD2 4.32Å; F113-P132 HydrophobicContact CD2-CB 3.79Å; F113-P132 HydrophobicContact CD2-CG 4.47Å; F113-P132 HydrophobicContact CE2-CB 3.86Å; F113-P132 HydrophobicContact CE2-CG 4.36Å; F113-I133 PolarHBondContact N-O 2.95Å; F113-L134 HydrophobicContact CB-CD1 4.07Å; F113-F135 PolarHBondContact O-N 3.47Å
114	L	97	Very high	94.2	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	110.1	172.3	-46.1	174	0	0	0	107.8	E27 A28 F31 I79 V80 S81 G82 I112 F135 W143	E27-L114 VanDerWaalsContact C-CD1 3.45Å; E27-L114 HydrophobicContact CB-CD1 4.09Å; E27-L114 VanDerWaalsContact O-CD1 3.26Å; E27-L114 WeakPolarHBondContact O-CD1 3.2Å; A28-L114 HydrophobicContact CB-CD1 4.46Å; F31-L114 HydrophobicContact CB-CD1 3.52Å; F31-L114 HydrophobicContact CB-CD2 4.15Å; F31-L114 HydrophobicContact CB-CG 4.47Å; F31-L114 HydrophobicContact CD1-CD2 4.12Å; F31-L114 HydrophobicContact CD2-CD1 4.4Å; F31-L114 HydrophobicContact CD2-CD2 3.49Å; F31-L114 VanDerWaalsContact CD2-CD2 3.49Å; F31-L114 HydrophobicContact CE1-CD2 4.44Å; F31-L114 HydrophobicContact CE2-CD2 3.87Å; F31-L114 HydrophobicContact CG-CD1 3.99Å; F31-L114 HydrophobicContact CG-CD2 3.64Å; F31-L114 HydrophobicContact CG-CG 4.45Å; F31-L114 HydrophobicContact CZ-CD2 4.34Å; I79-L114 HydrophobicContact CG2-CD1 4.17Å; I79-L114 HydrophobicContact CG2-CG 4.46Å; V80-L114 PolarHBondContact O-N 3.24Å; V80-L114 VanDerWaalsContact O-N 3.15Å; S81-L114 CarbonylContact C-O 3.55Å; G82-L114 PolarHBondContact N-O 3.31Å; I112-L114 HydrophobicContact CG2-CD2 4.16Å; L114-F135 HydrophobicContact CD2-CB 4.08Å; L114-F135 HydrophobicContact CD2-CD2 4.14Å; L114-F135 HydrophobicContact CD2-CG 4.32Å; L114-W143 HydrophobicContact CD1-CZ2 3.98Å
115	K	95.4	Very high	94.2	Very high	41 Å²	41	42.9 Å²	42.9	18%	0.178	23%	0.228	C	C	.	.	S	Bend	trans	66.3	162.6	-157	-51.9	156.2	172.5	166.7	0	113.2	E27 L134 F135 D138	E27-K115 IonicContact OE1-NZ 2.72Å; E27-K115 PolarHBondContact OE1-NZ 2.95Å; E27-K115 IonicContact OE2-NZ 3.23Å; K115-L134 VanDerWaalsContact C-CD1 3.42Å; K115-L134 VanDerWaalsContact O-CD1 3.26Å; K115-L134 WeakPolarHBondContact O-CD1 3.49Å; K115-F135 WeakPolarHBondContact CA-O 3.24Å; K115-F135 PolarHBondContact N-O 2.93Å; K115-D138 VanDerWaalsContact CE-CG 3.42Å; K115-D138 WeakPolarHBondContact CE-OD2 3.33Å; K115-D138 VanDerWaalsContact NZ-CB 3.32Å; K115-D138 IonicContact NZ-OD2 3.5Å; K115-D138 PolarHBondContact NZ-OD2 2.97Å
116	Q	94.8	Very high	94.1	Very high	129 Å²	129	47.1 Å²	47.1	60%	0.603	26%	0.259	S	S	*	.	S	Bend	trans	-58.6	130.2	177.5	-177	66.6	26.6	0	0	110.8	G82 T118	G82-Q116 WeakPolarHBondContact CA-O 3.33Å; Q116-T118 PolarHBondContact O-N 3.47Å
117	P	95.2	Very high	94	Very high	31 Å²	31	49.3 Å²	49.3	20%	0.201	27%	0.268	C	S	.	.	P	Polyproline II helix	trans	-61.3	126.2	177.7	23.7	-34.8	0	0	0	112.2	A85 F113	A85-P117 HydrophobicContact CB-CB 3.52Å; F113-P117 HydrophobicContact CD1-CB 4.04Å; F113-P117 HydrophobicContact CD1-CG 4.45Å; F113-P117 HydrophobicContact CD2-CB 4.36Å; F113-P117 HydrophobicContact CD2-CG 3.92Å; F113-P117 HydrophobicContact CE1-CB 3.92Å; F113-P117 HydrophobicContact CE1-CG 4.46Å; F113-P117 HydrophobicContact CE2-CB 4.26Å; F113-P117 HydrophobicContact CE2-CG 3.93Å; F113-P117 HydrophobicContact CG-CB 4.26Å; F113-P117 HydrophobicContact CG-CG 4.19Å; F113-P117 HydrophobicContact CZ-CB 4.03Å; F113-P117 HydrophobicContact CZ-CG 4.21Å
118	T	91.8	Very high	94	Very high	67 Å²	67	47.4 Å²	47.4	41%	0.411	26%	0.259	S	S	.	.	P	Polyproline II helix	trans	-98.9	146.4	172	69.6	0	0	0	0	109.3	G82 Q116 L120	G82-T118 WeakPolarHBondContact O-CB 3.24Å; G82-T118 PolarHBondContact O-N 3.07Å; G82-T118 PolarHBondContact O-OG1 2.9Å; Q116-T118 PolarHBondContact O-N 3.47Å; T118-L120 PolarHBondContact O-N 3.34Å
119	C	87.5	Confident	94	Very high	93 Å²	93	51.5 Å²	51.5	63%	0.628	28%	0.278	S	S	*	.	S	Bend	trans	53.9	26.2	172.3	-53.8	0	0	0	0	116.8	L121	C119-L121 PolarHBondContact O-N 3.3Å
120	L	88.1	Confident	93.8	Very high	46 Å²	46	53.8 Å²	53.8	24%	0.241	29%	0.289	C	S	.	.			trans	-74.5	102.1	169.8	-166.3	73.5	0	0	0	109.1	A85 L88 F113 T118 F123 L125	A85-L120 VanDerWaalsContact O-CD1 3.28Å; A85-L120 WeakPolarHBondContact O-CD1 3.25Å; L88-L120 HydrophobicContact CB-CD1 3.9Å; L88-L120 HydrophobicContact CD1-CD1 3.9Å; L88-L120 HydrophobicContact CG-CD1 4.41Å; F113-L120 HydrophobicContact CZ-CD2 4.25Å; T118-L120 PolarHBondContact O-N 3.34Å; L120-F123 HydrophobicContact CD1-CB 3.9Å; L120-F123 HydrophobicContact CG-CB 4.42Å; L120-L125 HydrophobicContact CD2-CD1 3.99Å; L120-L125 HydrophobicContact CD2-CD2 4.45Å; L120-L125 HydrophobicContact CD2-CG 4.18Å
121	L	86.2	Confident	93.8	Very high	145 Å²	145	58.5 Å²	58.5	76%	0.759	32%	0.32	S	S	*	.			trans	-106.6	-30.1	-170.4	-68.7	173	0	0	0	113.9	D89 C119	D89-L121 WeakPolarHBondContact OD2-CA 3.17Å; D89-L121 WeakPolarHBondContact OD2-CB 3.41Å; D89-L121 PolarHBondContact OD2-N 3.38Å; D89-L121 VanDerWaalsContact OD2-N 3.11Å; C119-L121 PolarHBondContact O-N 3.3Å
122	N	90.1	Very high	93.7	Very high	89 Å²	89	61 Å²	61	48%	0.476	34%	0.336	S	S	.	.	S	Bend	trans	-125.1	-27.2	-169.2	-58.7	-93.4	0	0	0	114.3	D89 Y92 D124	D89-N122 HydrophobicContact CB-CB 4.13Å; D89-N122 VanDerWaalsContact CG-N 3.28Å; D89-N122 PolarHBondContact OD1-N 2.76Å; D89-N122 PolarHBondContact OD2-N 2.98Å; D89-N122 PolarHBondContact OD2-ND2 2.91Å; Y92-N122 VanDerWaalsContact CE1-O 3.23Å; Y92-N122 WeakPolarHBondContact CE1-O 3.36Å; N122-D124 PolarHBondContact O-N 2.82Å; N122-D124 VanDerWaalsContact O-N 3.12Å
123	F	93.5	Very high	93.7	Very high	10 Å²	10	61.2 Å²	61.2	4%	0.044	34%	0.337	C	S	.	.			trans	-71	106	-178	-167.4	-75.5	0	0	0	111.7	L88 D89 Y92 I111 L120 L125	L88-F123 HydrophobicContact CB-CB 3.93Å; L88-F123 HydrophobicContact CB-CD2 3.67Å; L88-F123 HydrophobicContact CB-CE2 4.39Å; L88-F123 HydrophobicContact CB-CG 3.89Å; L88-F123 HydrophobicContact CD1-CG 4.48Å; L88-F123 WeakPolarHBondContact O-CD2 3.48Å; D89-F123 PolarHBondContact OD1-N 3.42Å; Y92-F123 HydrophobicContact CD2-CB 4.15Å; Y92-F123 AromaticContact CD2-CD2 3.55Å; Y92-F123 HydrophobicContact CD2-CD2 3.55Å; Y92-F123 HydrophobicContact CD2-CE2 4.04Å; Y92-F123 AromaticContact CD2-CG 3.83Å; Y92-F123 HydrophobicContact CD2-CG 3.83Å; Y92-F123 HydrophobicContact CE2-CG 4.5Å; Y92-F123 HydrophobicContact CG-CB 4.42Å; Y92-F123 HydrophobicContact CG-CD2 4.09Å; Y92-F123 HydrophobicContact CG-CG 4.47Å; I111-F123 HydrophobicContact CD1-CD1 4.36Å; I111-F123 HydrophobicContact CD1-CE1 3.54Å; I111-F123 HydrophobicContact CD1-CZ 3.85Å; L120-F123 HydrophobicContact CD1-CB 3.9Å; L120-F123 HydrophobicContact CG-CB 4.42Å; F123-L125 HydrophobicContact CD1-CD2 3.99Å; F123-L125 HydrophobicContact CD1-CG 4.42Å; F123-L125 HydrophobicContact CE1-CD2 4.11Å; F123-L125 PolarHBondContact O-N 3.12Å; F123-L125 VanDerWaalsContact O-N 3.15Å
124	D	94.3	Very high	93.7	Very high	66 Å²	66	63.2 Å²	63.2	35%	0.353	35%	0.348	S	S	.	.			trans	-74.2	102.6	174.8	-177.1	3.4	0	0	0	111.3	Y92 N122 S126 L127	Y92-D124 HydrophobicContact CE2-CB 4.06Å; Y92-D124 VanDerWaalsContact CE2-N 3.33Å; Y92-D124 VanDerWaalsContact OH-CB 3.3Å; Y92-D124 WeakPolarHBondContact OH-CB 3.17Å; N122-D124 PolarHBondContact O-N 2.82Å; N122-D124 VanDerWaalsContact O-N 3.12Å; D124-S126 PolarHBondContact O-N 3.35Å; D124-S126 WeakPolarHBondContact OD1-CA 3.28Å; D124-S126 WeakPolarHBondContact OD1-CB 3.4Å; D124-S126 PolarHBondContact OD1-N 3.3Å; D124-S126 PolarHBondContact OD1-OG 2.91Å; D124-S126 PolarHBondContact OD2-OG 2.96Å; D124-S126 VanDerWaalsContact OD2-OG 3.06Å; D124-L127 HydrophobicContact CB-CG 4.21Å; D124-L127 WeakPolarHBondContact O-CG 3.29Å; D124-L127 PolarHBondContact O-N 3.49Å
125	L	94.1	Very high	93.7	Very high	54 Å²	54	63.2 Å²	63.2	28%	0.283	35%	0.348	S	S	.	.	G	3₁₀ helix	trans	-60.9	-21.6	175.5	-65.7	168.9	0	0	0	113	I111 F113 L120 F123 L127 L128 P132	I111-L125 HydrophobicContact CD1-CD2 3.69Å; F113-L125 HydrophobicContact CE2-CD2 4.17Å; F113-L125 HydrophobicContact CZ-CD2 4.32Å; L120-L125 HydrophobicContact CD2-CD1 3.99Å; L120-L125 HydrophobicContact CD2-CD2 4.45Å; L120-L125 HydrophobicContact CD2-CG 4.18Å; F123-L125 HydrophobicContact CD1-CD2 3.99Å; F123-L125 HydrophobicContact CD1-CG 4.42Å; F123-L125 HydrophobicContact CE1-CD2 4.11Å; F123-L125 PolarHBondContact O-N 3.12Å; F123-L125 VanDerWaalsContact O-N 3.15Å; L125-L127 PolarHBondContact O-N 2.96Å; L125-L128 PolarHBondContact O-N 3.28Å; L125-P132 HydrophobicContact CD1-CG 4.3Å
126	S	94.8	Very high	93.6	Very high	93 Å²	93	66.3 Å²	66.3	65%	0.65	37%	0.366	S	S	*	.	G	3₁₀ helix	trans	-74.1	-9.1	179.5	81.1	0	0	0	0	114.1	D124 L128	D124-S126 PolarHBondContact O-N 3.35Å; D124-S126 WeakPolarHBondContact OD1-CA 3.28Å; D124-S126 WeakPolarHBondContact OD1-CB 3.4Å; D124-S126 PolarHBondContact OD1-N 3.3Å; D124-S126 PolarHBondContact OD1-OG 2.91Å; D124-S126 PolarHBondContact OD2-OG 2.96Å; D124-S126 VanDerWaalsContact OD2-OG 3.06Å; S126-L128 PolarHBondContact O-N 3.4Å
127	L	93.6	Very high	93.4	Very high	61 Å²	61	62.9 Å²	62.9	32%	0.319	35%	0.352	S	S	.	.	G	3₁₀ helix	trans	-65.8	-21.6	168.1	-63.8	-171.9	0	0	0	112.9	Y92 L96 D124 L125	Y92-L127 HydrophobicContact CE2-CD1 3.56Å; L96-L127 HydrophobicContact CD1-CD1 4.3Å; L96-L127 HydrophobicContact CG-CD1 4.44Å; D124-L127 HydrophobicContact CB-CG 4.21Å; D124-L127 WeakPolarHBondContact O-CG 3.29Å; D124-L127 PolarHBondContact O-N 3.49Å; L125-L127 PolarHBondContact O-N 2.96Å
128	L	95.3	Very high	92.7	Very high	16 Å²	16	64.8 Å²	64.8	8%	0.084	36%	0.36	C	S	.	.	S	Bend	trans	-96.1	140.2	177.7	-61.3	-176.8	0	0	0	111.3	F99 I109 I111 L125 S126 H130	F99-L128 HydrophobicContact CE1-CD2 4.2Å; F99-L128 HydrophobicContact CE2-CD2 3.8Å; F99-L128 HydrophobicContact CZ-CD2 3.5Å; I109-L128 HydrophobicContact CB-CD2 4.21Å; I109-L128 HydrophobicContact CG2-CD2 4.47Å; I111-L128 HydrophobicContact CD1-CD1 3.58Å; I111-L128 HydrophobicContact CG1-CD1 3.72Å; L125-L128 PolarHBondContact O-N 3.28Å; S126-L128 PolarHBondContact O-N 3.4Å; L128-H130 VanDerWaalsContact C-N 3.28Å; L128-H130 PolarHBondContact O-N 2.9Å
129	K	94.5	Very high	92.4	Very high	132 Å²	132	63.3 Å²	63.3	57%	0.574	35%	0.353	S	S	*	.	S	Bend	trans	-72.3	-22.4	177.8	-172.5	174.2	179.7	179.8	0	113.5	A106 E107	A106-K129 WeakPolarHBondContact O-CB 3.14Å; A106-K129 PolarHBondContact O-N 3.49Å; E107-K129 HydrophobicContact CB-CD 3.89Å; E107-K129 HydrophobicContact CG-CD 3.74Å; E107-K129 WeakPolarHBondContact OE1-CD 3.35Å; E107-K129 WeakPolarHBondContact OE1-CE 3.21Å; E107-K129 IonicContact OE1-NZ 3.48Å; E107-K129 PolarHBondContact OE1-NZ 3.46Å; E107-K129 IonicContact OE2-NZ 3.67Å
130	H	94.1	Very high	92.2	Very high	49 Å²	49	61.5 Å²	61.5	23%	0.227	34%	0.339	C	S	.	.	S	Bend	trans	-105	133.4	178.7	-66.7	-86.9	0	0	0	109.7	L110 L128	L110-H130 HydrophobicContact CD2-CB 3.53Å; L110-H130 HydrophobicContact CG-CB 3.79Å; L128-H130 VanDerWaalsContact C-N 3.28Å; L128-H130 PolarHBondContact O-N 2.9Å
131	P	95.5	Very high	92.1	Very high	102 Å²	102	65 Å²	65	66%	0.662	36%	0.358	S	S	*	.	P	Polyproline II helix	trans	-64.4	154.9	171.6	30.2	-35.2	0	0	0	110.2
132	P	97	Very high	92.2	Very high	52 Å²	52	61.3 Å²	61.3	34%	0.338	34%	0.337	S	S	.	.	P	Polyproline II helix	trans	-62.6	143.7	174.4	28.4	-35.7	0	0	0	111	I111 F113 L125	I111-P132 HydrophobicContact CB-CB 4.3Å; I111-P132 HydrophobicContact CG2-CB 4.32Å; I111-P132 WeakPolarHBondContact O-CA 3.02Å; F113-P132 HydrophobicContact CD2-CB 3.79Å; F113-P132 HydrophobicContact CD2-CG 4.47Å; F113-P132 HydrophobicContact CE2-CB 3.86Å; F113-P132 HydrophobicContact CE2-CG 4.36Å; L125-P132 HydrophobicContact CD1-CG 4.3Å
133	I	97.7	Very high	92.4	Very high	6 Å²	6	57.2 Å²	57.2	3%	0.031	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	134.5	168.6	-57.2	176.9	0	0	0	107.1	I111 I112 F113 F135 K152 I153 L156	I111-I133 PolarHBondContact O-N 2.97Å; I112-I133 CarbonylContact C-O 3.58Å; I112-I133 WeakPolarHBondContact CA-O 3.23Å; I112-I133 HydrophobicContact CG1-CB 4.39Å; F113-I133 PolarHBondContact N-O 2.95Å; I133-F135 HydrophobicContact CG2-CD2 4.42Å; I133-F135 HydrophobicContact CG2-CE2 4Å; I133-K152 HydrophobicContact CD1-CB 3.87Å; I133-K152 HydrophobicContact CG1-CB 4.26Å; I133-K152 HydrophobicContact CG1-CD 4.43Å; I133-K152 HydrophobicContact CG2-CD 4.39Å; I133-I153 HydrophobicContact CD1-CG1 3.76Å; I133-L156 HydrophobicContact CD1-CD1 4.25Å
134	L	97.2	Very high	92.4	Very high	45 Å²	45	60.7 Å²	60.7	24%	0.236	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	109.2	-175.2	173.4	65.9	0	0	0	109.2	F113 K115 S149	F113-L134 HydrophobicContact CB-CD1 4.07Å; K115-L134 VanDerWaalsContact C-CD1 3.42Å; K115-L134 VanDerWaalsContact O-CD1 3.26Å; K115-L134 WeakPolarHBondContact O-CD1 3.49Å; L134-S149 PolarHBondContact O-OG 2.75Å
135	F	97.5	Very high	92.4	Very high	1 Å²	1	63.3 Å²	63.3	0%	0.004	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	132.7	163.4	-71.6	-94.8	0	0	0	108.2	F31 I112 F113 L114 K115 I133 W143 D146 S149 W150 I153	F31-F135 HydrophobicContact CE1-CE2 4.39Å; F31-F135 HydrophobicContact CE2-CD1 4.17Å; F31-F135 AromaticContact CE2-CD2 3.93Å; F31-F135 HydrophobicContact CE2-CD2 3.93Å; F31-F135 HydrophobicContact CE2-CE1 4.05Å; F31-F135 AromaticContact CE2-CE2 3.8Å; F31-F135 HydrophobicContact CE2-CE2 3.8Å; F31-F135 HydrophobicContact CE2-CG 4.12Å; F31-F135 AromaticContact CE2-CZ 3.85Å; F31-F135 HydrophobicContact CE2-CZ 3.85Å; F31-F135 AromaticContact CZ-CD2 3.88Å; F31-F135 HydrophobicContact CZ-CD2 3.88Å; F31-F135 HydrophobicContact CZ-CE1 4.28Å; F31-F135 AromaticContact CZ-CE2 3.39Å; F31-F135 HydrophobicContact CZ-CE2 3.39Å; F31-F135 AromaticContact CZ-CZ 3.62Å; F31-F135 HydrophobicContact CZ-CZ 3.62Å; I112-F135 HydrophobicContact CG2-CD2 3.65Å; I112-F135 HydrophobicContact CG2-CE2 3.75Å; F113-F135 PolarHBondContact O-N 3.47Å; L114-F135 HydrophobicContact CD2-CB 4.08Å; L114-F135 HydrophobicContact CD2-CD2 4.14Å; L114-F135 HydrophobicContact CD2-CG 4.32Å; K115-F135 WeakPolarHBondContact CA-O 3.24Å; K115-F135 PolarHBondContact N-O 2.93Å; I133-F135 HydrophobicContact CG2-CD2 4.42Å; I133-F135 HydrophobicContact CG2-CE2 4Å; F135-W143 HydrophobicContact CD1-CB 4.38Å; F135-D146 WeakPolarHBondContact CA-OD2 3.43Å; F135-D146 HydrophobicContact CD1-CB 3.8Å; F135-D146 HydrophobicContact CE1-CB 4.11Å; F135-S149 VanDerWaalsContact CZ-CB 3.43Å; F135-W150 HydrophobicContact CE1-CD2 4.36Å; F135-W150 AromaticContact CE1-CE2 3.8Å; F135-W150 HydrophobicContact CE1-CG 4.47Å; F135-W150 HydrophobicContact CE1-CZ2 4.12Å; F135-W150 AromaticContact CE1-NE1 3.67Å; F135-W150 HydrophobicContact CZ-CD2 4.31Å; F135-W150 HydrophobicContact CZ-CZ2 4.14Å; F135-I153 HydrophobicContact CE2-CD1 3.92Å; F135-I153 HydrophobicContact CZ-CD1 3.83Å
136	N	93.2	Very high	92.4	Very high	105 Å²	105	61.7 Å²	61.7	56%	0.561	34%	0.338	S	S	*	.			trans	-82.3	-18.8	-170.9	-67.1	-74.5	0	0	0	114.3
137	D	89.1	Confident	92.4	Very high	57 Å²	57	63.9 Å²	63.9	31%	0.305	34%	0.339	S	S	.	.			trans	-118.3	169.8	-168.6	-58.8	-83.2	0	0	0	113.3	Q142 W143	D137-Q142 HydrophobicContact CB-CB 3.32Å; D137-Q142 HydrophobicContact CB-CG 4.01Å; D137-Q142 PolarHBondContact OD1-NE2 3.46Å; D137-W143 PolarHBondContact O-NE1 2.86Å
138	D	81.5	Confident	92.5	Very high	71 Å²	71	67 Å²	67	38%	0.38	35%	0.351	S	S	.	.	S	Bend	trans	-95.9	-36	175.4	25	36.2	0	0	0	115.5	K115 W143	K115-D138 VanDerWaalsContact CE-CG 3.42Å; K115-D138 WeakPolarHBondContact CE-OD2 3.33Å; K115-D138 VanDerWaalsContact NZ-CB 3.32Å; K115-D138 IonicContact NZ-OD2 3.5Å; K115-D138 PolarHBondContact NZ-OD2 2.97Å; D138-W143 WeakPolarHBondContact O-CZ2 3.44Å
139	S	86.6	Confident	92.5	Very high	37 Å²	37	66.3 Å²	66.3	26%	0.259	35%	0.348	S	S	.	.	S	Bend	trans	-83.2	146	-170.9	84.1	0	0	0	0	113.1	N141 Q142 W143	S139-N141 PolarHBondContact O-N 3.28Å; S139-Q142 VanDerWaalsContact CB-OE1 3.28Å; S139-Q142 WeakPolarHBondContact O-CA 3.43Å; S139-Q142 PolarHBondContact O-N 3.06Å; S139-Q142 PolarHBondContact OG-N 3.06Å; S139-Q142 PolarHBondContact OG-OE1 3.22Å; S139-W143 PolarHBondContact O-N 2.65Å
140	T	82.7	Confident	92.6	Very high	55 Å²	55	60.7 Å²	60.7	34%	0.337	32%	0.323	S	S	.	.	H	α-helix	trans	-49.1	-40.3	170.2	47.9	0	0	0	0	112.6	Q142 W143 I144	T140-Q142 VanDerWaalsContact C-N 3.31Å; T140-Q142 PolarHBondContact O-N 3.25Å; T140-W143 HydrophobicContact CG2-CE3 3.87Å; T140-W143 HydrophobicContact CG2-CH2 4.48Å; T140-W143 HydrophobicContact CG2-CZ3 3.6Å; T140-W143 PolarHBondContact O-N 3.44Å; T140-I144 WeakPolarHBondContact O-CD1 3.48Å; T140-I144 WeakPolarHBondContact O-CG1 3.45Å; T140-I144 PolarHBondContact O-N 2.54Å
141	N	86.2	Confident	92.7	Very high	119 Å²	119	62.9 Å²	62.9	64%	0.636	34%	0.336	S	S	*	.	H	α-helix	trans	-65.3	-30.5	177.3	-67.8	-30.5	0	0	0	113.3	S139 N145	S139-N141 PolarHBondContact O-N 3.28Å; N141-N145 PolarHBondContact O-ND2 3.46Å
142	Q	87.9	Confident	92.6	Very high	67 Å²	67	61.7 Å²	61.7	31%	0.313	32%	0.32	S	S	.	.	H	α-helix	trans	-85.4	-38.8	176.5	-76	154.1	-80	0	0	112.1	D137 S139 T140 I144 N145	D137-Q142 HydrophobicContact CB-CB 3.32Å; D137-Q142 HydrophobicContact CB-CG 4.01Å; D137-Q142 PolarHBondContact OD1-NE2 3.46Å; S139-Q142 VanDerWaalsContact CB-OE1 3.28Å; S139-Q142 WeakPolarHBondContact O-CA 3.43Å; S139-Q142 PolarHBondContact O-N 3.06Å; S139-Q142 PolarHBondContact OG-N 3.06Å; S139-Q142 PolarHBondContact OG-OE1 3.22Å; T140-Q142 VanDerWaalsContact C-N 3.31Å; T140-Q142 PolarHBondContact O-N 3.25Å; Q142-I144 PolarHBondContact O-N 2.88Å; Q142-N145 WeakPolarHBondContact O-CA 3.42Å; Q142-N145 WeakPolarHBondContact O-CB 3.46Å; Q142-N145 PolarHBondContact O-N 3.45Å
143	W	94.5	Very high	92.5	Very high	3 Å²	3	59.3 Å²	59.3	1%	0.011	31%	0.305	C	S	.	.	H	α-helix	trans	-54	-38.5	175.9	-61.7	-25.3	0	0	0	112.3	E27 L30 F31 L114 F135 D137 D138 S139 T140 N145 D146 W150	E27-W143 WeakPolarHBondContact O-CH2 3.38Å; L30-W143 HydrophobicContact CB-CH2 4.11Å; L30-W143 HydrophobicContact CB-CZ3 4.34Å; F31-W143 VanDerWaalsContact CA-CZ3 3.46Å; F31-W143 HydrophobicContact CB-CE3 4.28Å; F31-W143 HydrophobicContact CB-CH2 3.67Å; F31-W143 HydrophobicContact CB-CZ2 4.13Å; F31-W143 HydrophobicContact CB-CZ3 3.74Å; F31-W143 AromaticContact CD2-CD2 3.61Å; F31-W143 HydrophobicContact CD2-CD2 3.61Å; F31-W143 AromaticContact CD2-CE2 3.95Å; F31-W143 AromaticContact CD2-CE3 3.59Å; F31-W143 HydrophobicContact CD2-CE3 3.59Å; F31-W143 HydrophobicContact CD2-CG 4.1Å; F31-W143 HydrophobicContact CD2-CH2 4.29Å; F31-W143 HydrophobicContact CD2-CZ2 4.27Å; F31-W143 AromaticContact CD2-CZ3 3.96Å; F31-W143 HydrophobicContact CD2-CZ3 3.96Å; F31-W143 HydrophobicContact CE2-CD2 4.28Å; F31-W143 HydrophobicContact CE2-CE3 4.45Å; F31-W143 HydrophobicContact CE2-CG 4.3Å; F31-W143 HydrophobicContact CG-CE3 4.4Å; F31-W143 HydrophobicContact CG-CZ3 4.34Å; L114-W143 HydrophobicContact CD1-CZ2 3.98Å; F135-W143 HydrophobicContact CD1-CB 4.38Å; D137-W143 PolarHBondContact O-NE1 2.86Å; D138-W143 WeakPolarHBondContact O-CZ2 3.44Å; S139-W143 PolarHBondContact O-N 2.65Å; T140-W143 HydrophobicContact CG2-CE3 3.87Å; T140-W143 HydrophobicContact CG2-CH2 4.48Å; T140-W143 HydrophobicContact CG2-CZ3 3.6Å; T140-W143 PolarHBondContact O-N 3.44Å; W143-N145 PolarHBondContact O-N 3.46Å; W143-D146 PolarHBondContact O-N 3.42Å; W143-W150 VanDerWaalsContact O-CD1 3.3Å; W143-W150 PolarHBondContact O-NE1 3.02Å
144	I	93	Very high	92.3	Very high	84 Å²	84	59.2 Å²	59.2	43%	0.431	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.1	-35.2	173.4	-73.2	163.5	0	0	0	112.8	Y34 T140 Q142	Y34-I144 HydrophobicContact CE2-CD1 4.35Å; Y34-I144 HydrophobicContact CE2-CG1 4.24Å; Y34-I144 VanDerWaalsContact OH-CG1 3.26Å; Y34-I144 WeakPolarHBondContact OH-CG1 3.5Å; T140-I144 WeakPolarHBondContact O-CD1 3.48Å; T140-I144 WeakPolarHBondContact O-CG1 3.45Å; T140-I144 PolarHBondContact O-N 2.54Å; Q142-I144 PolarHBondContact O-N 2.88Å
145	N	93.8	Very high	92.1	Very high	121 Å²	121	62.7 Å²	62.7	65%	0.647	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.8	-13.1	-173.5	-56.8	-47	0	0	0	113.7	N141 Q142 W143 Q147	N141-N145 PolarHBondContact O-ND2 3.46Å; Q142-N145 WeakPolarHBondContact O-CA 3.42Å; Q142-N145 WeakPolarHBondContact O-CB 3.46Å; Q142-N145 PolarHBondContact O-N 3.45Å; W143-N145 PolarHBondContact O-N 3.46Å; N145-Q147 PolarHBondContact O-N 3.33Å
146	D	95.4	Very high	91.7	Very high	19 Å²	19	63.5 Å²	63.5	10%	0.102	33%	0.325	C	S	.	.			trans	-76.1	74.7	173.1	-170.7	-12.8	0	0	0	110.8	F135 W143 E148 S149 W150	F135-D146 WeakPolarHBondContact CA-OD2 3.43Å; F135-D146 HydrophobicContact CD1-CB 3.8Å; F135-D146 HydrophobicContact CE1-CB 4.11Å; W143-D146 PolarHBondContact O-N 3.42Å; D146-E148 PolarHBondContact O-N 3.42Å; D146-E148 PolarHBondContact OD1-N 3.42Å; D146-S149 VanDerWaalsContact CG-OG 3.27Å; D146-S149 PolarHBondContact O-N 2.94Å; D146-S149 WeakPolarHBondContact OD1-CB 3.48Å; D146-S149 PolarHBondContact OD1-N 3.36Å; D146-S149 PolarHBondContact OD1-OG 3.47Å; D146-S149 VanDerWaalsContact OD2-CB 3.24Å; D146-S149 WeakPolarHBondContact OD2-CB 3.35Å; D146-S149 PolarHBondContact OD2-OG 3.28Å; D146-W150 PolarHBondContact O-N 2.97Å
147	Q	94.5	Very high	91.4	Very high	140 Å²	140	59 Å²	59	65%	0.654	30%	0.301	S	S	*	.	H	α-helix	trans	-61.8	-28.1	179.7	-172.1	176.6	-2.2	0	0	112.2	N145 L151	N145-Q147 PolarHBondContact O-N 3.33Å; Q147-L151 HydrophobicContact CG-CD1 4.12Å; Q147-L151 HydrophobicContact CG-CG 4.39Å; Q147-L151 VanDerWaalsContact O-CB 3.29Å; Q147-L151 WeakPolarHBondContact O-CB 3.36Å; Q147-L151 WeakPolarHBondContact O-CD1 3.37Å; Q147-L151 WeakPolarHBondContact O-CG 3.42Å; Q147-L151 PolarHBondContact O-N 2.97Å
148	E	95.4	Very high	91.4	Very high	125 Å²	125	63.9 Å²	63.9	58%	0.584	32%	0.319	S	S	*	.	H	α-helix	trans	-72.8	-44.2	179.9	-159.2	-167.6	123.7	0	0	111.2	D146 L151 K152	D146-E148 PolarHBondContact O-N 3.42Å; D146-E148 PolarHBondContact OD1-N 3.42Å; E148-L151 PolarHBondContact O-N 3.32Å; E148-K152 WeakPolarHBondContact O-CG 3.49Å; E148-K152 PolarHBondContact O-N 2.9Å; E148-K152 WeakPolarHBondContact OE1-CE 3.38Å; E148-K152 IonicContact OE1-NZ 3.4Å; E148-K152 PolarHBondContact OE1-NZ 3.15Å
149	S	96.4	Very high	91.5	Very high	2 Å²	2	66.1 Å²	66.1	1%	0.014	33%	0.327	C	S	.	.	H	α-helix	trans	-67.2	-38.7	174.8	-64.4	0	0	0	0	112	L134 F135 D146 L151 K152 I153	L134-S149 PolarHBondContact O-OG 2.75Å; F135-S149 VanDerWaalsContact CZ-CB 3.43Å; D146-S149 VanDerWaalsContact CG-OG 3.27Å; D146-S149 PolarHBondContact O-N 2.94Å; D146-S149 WeakPolarHBondContact OD1-CB 3.48Å; D146-S149 PolarHBondContact OD1-N 3.36Å; D146-S149 PolarHBondContact OD1-OG 3.47Å; D146-S149 VanDerWaalsContact OD2-CB 3.24Å; D146-S149 WeakPolarHBondContact OD2-CB 3.35Å; D146-S149 PolarHBondContact OD2-OG 3.28Å; S149-L151 VanDerWaalsContact C-N 3.35Å; S149-L151 PolarHBondContact O-N 3.05Å; S149-K152 PolarHBondContact O-N 3.48Å; S149-I153 WeakPolarHBondContact O-CG1 3.37Å; S149-I153 PolarHBondContact O-N 3.15Å
150	W	96.1	Very high	91	Very high	14 Å²	14	74.2 Å²	74.2	5%	0.053	35%	0.352	C	S	.	.	H	α-helix	trans	-66.2	-31.2	171	-76.4	116.9	0	0	0	114.1	F31 Y34 L35 Y38 F135 W143 D146 I153 G154	F31-W150 HydrophobicContact CE2-CH2 4.48Å; F31-W150 HydrophobicContact CE2-CZ2 4.18Å; F31-W150 HydrophobicContact CZ-CH2 4.16Å; F31-W150 HydrophobicContact CZ-CZ2 4.26Å; Y34-W150 HydrophobicContact CD1-CH2 4.18Å; Y34-W150 AromaticContact CD1-CZ2 3.93Å; Y34-W150 HydrophobicContact CD1-CZ2 3.93Å; Y34-W150 AromaticContact CE1-CH2 3.98Å; Y34-W150 HydrophobicContact CE1-CH2 3.98Å; Y34-W150 AromaticContact CE1-CZ2 3.53Å; Y34-W150 HydrophobicContact CE1-CZ2 3.53Å; L35-W150 HydrophobicContact CD1-CH2 3.71Å; L35-W150 HydrophobicContact CD1-CZ3 3.55Å; Y38-W150 AromaticContact CD1-CE3 3.92Å; Y38-W150 HydrophobicContact CD1-CE3 3.92Å; Y38-W150 HydrophobicContact CD1-CH2 4.16Å; Y38-W150 AromaticContact CD1-CZ3 3.56Å; Y38-W150 HydrophobicContact CD1-CZ3 3.56Å; Y38-W150 HydrophobicContact CE1-CD2 4.08Å; Y38-W150 AromaticContact CE1-CE3 3.38Å; Y38-W150 HydrophobicContact CE1-CE3 3.38Å; Y38-W150 HydrophobicContact CE1-CH2 4.4Å; Y38-W150 AromaticContact CE1-CZ3 3.56Å; Y38-W150 HydrophobicContact CE1-CZ3 3.56Å; Y38-W150 HydrophobicContact CE2-CD2 4.35Å; Y38-W150 HydrophobicContact CE2-CE3 4.4Å; Y38-W150 HydrophobicContact CG-CH2 4.24Å; Y38-W150 HydrophobicContact CG-CZ3 4.11Å; Y38-W150 AromaticContact CZ-CD2 3.81Å; Y38-W150 AromaticContact CZ-CE3 3.63Å; F135-W150 HydrophobicContact CE1-CD2 4.36Å; F135-W150 AromaticContact CE1-CE2 3.8Å; F135-W150 HydrophobicContact CE1-CG 4.47Å; F135-W150 HydrophobicContact CE1-CZ2 4.12Å; F135-W150 AromaticContact CE1-NE1 3.67Å; F135-W150 HydrophobicContact CZ-CD2 4.31Å; F135-W150 HydrophobicContact CZ-CZ2 4.14Å; W143-W150 VanDerWaalsContact O-CD1 3.3Å; W143-W150 PolarHBondContact O-NE1 3.02Å; D146-W150 PolarHBondContact O-N 2.97Å; W150-I153 HydrophobicContact CE3-CB 4.39Å; W150-I153 HydrophobicContact CE3-CD1 4.2Å; W150-I153 HydrophobicContact CE3-CG2 4.44Å; W150-I153 HydrophobicContact CZ3-CD1 4.02Å; W150-I153 HydrophobicContact CZ3-CG2 4.34Å; W150-G154 WeakPolarHBondContact O-CA 3.04Å; W150-G154 PolarHBondContact O-N 3.22Å
151	L	94.8	Very high	90.3	Very high	96 Å²	96	73.3 Å²	73.3	50%	0.503	34%	0.343	S	S	.	.	H	α-helix	trans	-67.1	-44.4	172.7	-80.4	166.8	0	0	0	111.1	Q147 E148 S149 I153 G154 E155	Q147-L151 HydrophobicContact CG-CD1 4.12Å; Q147-L151 HydrophobicContact CG-CG 4.39Å; Q147-L151 VanDerWaalsContact O-CB 3.29Å; Q147-L151 WeakPolarHBondContact O-CB 3.36Å; Q147-L151 WeakPolarHBondContact O-CD1 3.37Å; Q147-L151 WeakPolarHBondContact O-CG 3.42Å; Q147-L151 PolarHBondContact O-N 2.97Å; E148-L151 PolarHBondContact O-N 3.32Å; S149-L151 VanDerWaalsContact C-N 3.35Å; S149-L151 PolarHBondContact O-N 3.05Å; L151-I153 PolarHBondContact O-N 2.94Å; L151-G154 CarbonylContact O-C 3.6Å; L151-G154 WeakPolarHBondContact O-CA 3.19Å; L151-G154 PolarHBondContact O-N 2.92Å; L151-G154 VanDerWaalsContact O-N 3.11Å; L151-E155 WeakPolarHBondContact O-CG 3.32Å; L151-E155 PolarHBondContact O-N 2.9Å
152	K	95.3	Very high	89.4	Confident	76 Å²	76	74 Å²	74	33%	0.33	35%	0.345	S	S	.	.	H	α-helix	trans	-58.7	-45.8	175.8	-67.3	162.2	-168.9	158.7	0	111.8	I133 E148 S149 E155 L156	I133-K152 HydrophobicContact CD1-CB 3.87Å; I133-K152 HydrophobicContact CG1-CB 4.26Å; I133-K152 HydrophobicContact CG1-CD 4.43Å; I133-K152 HydrophobicContact CG2-CD 4.39Å; E148-K152 WeakPolarHBondContact O-CG 3.49Å; E148-K152 PolarHBondContact O-N 2.9Å; E148-K152 WeakPolarHBondContact OE1-CE 3.38Å; E148-K152 IonicContact OE1-NZ 3.4Å; E148-K152 PolarHBondContact OE1-NZ 3.15Å; S149-K152 PolarHBondContact O-N 3.48Å; K152-E155 PolarHBondContact O-N 3.34Å; K152-L156 WeakPolarHBondContact O-CD1 3.4Å; K152-L156 WeakPolarHBondContact O-CG 3.15Å; K152-L156 PolarHBondContact O-N 2.92Å
153	I	94.8	Very high	88	Confident	2 Å²	2	74.2 Å²	74.2	1%	0.01	35%	0.352	C	S	.	.	H	α-helix	trans	-63.8	-43.8	173.2	-64.5	178	0	0	0	110.7	L35 I112 I133 F135 S149 W150 L151 E155 L156 I157	L35-I153 HydrophobicContact CD1-CG2 4.4Å; I112-I153 HydrophobicContact CD1-CD1 3.93Å; I133-I153 HydrophobicContact CD1-CG1 3.76Å; F135-I153 HydrophobicContact CE2-CD1 3.92Å; F135-I153 HydrophobicContact CZ-CD1 3.83Å; S149-I153 WeakPolarHBondContact O-CG1 3.37Å; S149-I153 PolarHBondContact O-N 3.15Å; W150-I153 HydrophobicContact CE3-CB 4.39Å; W150-I153 HydrophobicContact CE3-CD1 4.2Å; W150-I153 HydrophobicContact CE3-CG2 4.44Å; W150-I153 HydrophobicContact CZ3-CD1 4.02Å; W150-I153 HydrophobicContact CZ3-CG2 4.34Å; L151-I153 PolarHBondContact O-N 2.94Å; I153-E155 VanDerWaalsContact C-N 3.32Å; I153-E155 PolarHBondContact O-N 3.02Å; I153-L156 PolarHBondContact O-N 2.95Å; I153-L156 VanDerWaalsContact O-N 3.15Å; I153-I157 HydrophobicContact CG2-CD1 3.83Å; I153-I157 HydrophobicContact CG2-CG1 4.34Å; I153-I157 WeakPolarHBondContact O-CG1 3.45Å; I153-I157 PolarHBondContact O-N 3.1Å
154	G	93.5	Very high	86	Confident	4 Å²	4	77.8 Å²	77.8	4%	0.041	38%	0.378	C	S	.	.	H	α-helix	trans	-61.7	-31.9	179	0	0	0	0	0	114.7	W150 L151 K158	W150-G154 WeakPolarHBondContact O-CA 3.04Å; W150-G154 PolarHBondContact O-N 3.22Å; L151-G154 CarbonylContact O-C 3.6Å; L151-G154 WeakPolarHBondContact O-CA 3.19Å; L151-G154 PolarHBondContact O-N 2.92Å; L151-G154 VanDerWaalsContact O-N 3.11Å; G154-K158 WeakPolarHBondContact O-CD 3.37Å; G154-K158 VanDerWaalsContact O-CG 3.22Å; G154-K158 WeakPolarHBondContact O-CG 3.49Å; G154-K158 PolarHBondContact O-N 3Å; G154-K158 VanDerWaalsContact O-N 3.15Å
155	E	92.4	Very high	84.1	Confident	118 Å²	118	77.9 Å²	77.9	55%	0.551	38%	0.378	S	S	*	.	H	α-helix	trans	-68.5	-44.4	171.9	-73.9	-174.3	160.3	0	0	111.4	L151 K152 I153 I157 K158 H159	L151-E155 WeakPolarHBondContact O-CG 3.32Å; L151-E155 PolarHBondContact O-N 2.9Å; K152-E155 PolarHBondContact O-N 3.34Å; I153-E155 VanDerWaalsContact C-N 3.32Å; I153-E155 PolarHBondContact O-N 3.02Å; E155-I157 VanDerWaalsContact C-N 3.31Å; E155-I157 PolarHBondContact O-N 2.94Å; E155-K158 PolarHBondContact O-N 3.18Å; E155-H159 WeakPolarHBondContact O-CB 3.35Å; E155-H159 PolarHBondContact O-CD2 2.92Å; E155-H159 PolarHBondContact O-N 3.04Å
156	L	88.5	Confident	82	Confident	18 Å²	18	80 Å²	80	9%	0.094	39%	0.389	C	S	.	.	H	α-helix	trans	-65.7	-33.8	177	-63.2	159.4	0	0	0	112.5	K4 F5 Y75 L110 I133 K152 I153	K4-L156 VanDerWaalsContact CE-O 3.29Å; K4-L156 WeakPolarHBondContact CE-O 3.47Å; K4-L156 PolarHBondContact NZ-O 3.29Å; F5-L156 HydrophobicContact CE1-CB 4.49Å; Y75-L156 HydrophobicContact CE1-CD2 4.32Å; L110-L156 HydrophobicContact CD1-CD1 4.35Å; L110-L156 HydrophobicContact CD2-CD1 3.34Å; L110-L156 HydrophobicContact CD2-CD2 4.03Å; L110-L156 HydrophobicContact CD2-CG 4.33Å; L110-L156 HydrophobicContact CG-CD1 4.48Å; I133-L156 HydrophobicContact CD1-CD1 4.25Å; K152-L156 WeakPolarHBondContact O-CD1 3.4Å; K152-L156 WeakPolarHBondContact O-CG 3.15Å; K152-L156 PolarHBondContact O-N 2.92Å; I153-L156 PolarHBondContact O-N 2.95Å; I153-L156 VanDerWaalsContact O-N 3.15Å
157	I	88	Confident	79.8	Confident	12 Å²	12	82.1 Å²	82.1	6%	0.062	42%	0.416	C	S	.	.	H	α-helix	trans	-59.3	-54.2	170	-73	169	0	0	0	110.2	K4 F5 T39 Y43 L45 I153 E155	K4-I157 WeakPolarHBondContact CE-O 3.16Å; K4-I157 PolarHBondContact NZ-O 2.59Å; F5-I157 HydrophobicContact CE2-CG1 3.61Å; F5-I157 HydrophobicContact CZ-CB 4.45Å; F5-I157 HydrophobicContact CZ-CG1 3.62Å; T39-I157 HydrophobicContact CG2-CD1 4.07Å; Y43-I157 HydrophobicContact CD1-CG2 3.62Å; Y43-I157 HydrophobicContact CD2-CD1 3.82Å; Y43-I157 HydrophobicContact CD2-CG2 4.23Å; Y43-I157 HydrophobicContact CE1-CG2 3.84Å; Y43-I157 HydrophobicContact CE2-CD1 3.52Å; Y43-I157 HydrophobicContact CE2-CG2 4.44Å; Y43-I157 HydrophobicContact CG-CD1 4.49Å; Y43-I157 HydrophobicContact CG-CG2 3.82Å; L45-I157 HydrophobicContact CD1-CG2 3.67Å; I153-I157 HydrophobicContact CG2-CD1 3.83Å; I153-I157 HydrophobicContact CG2-CG1 4.34Å; I153-I157 WeakPolarHBondContact O-CG1 3.45Å; I153-I157 PolarHBondContact O-N 3.1Å; E155-I157 VanDerWaalsContact C-N 3.31Å; E155-I157 PolarHBondContact O-N 2.94Å
158	K	88.7	Confident	77.7	Confident	158 Å²	158	78.8 Å²	78.8	69%	0.687	40%	0.402	S	S	*	.	H	α-helix	trans	-67.7	-36.2	-177	-71	167.7	-176.3	176.3	0	113	G154 E155 R160	G154-K158 WeakPolarHBondContact O-CD 3.37Å; G154-K158 VanDerWaalsContact O-CG 3.22Å; G154-K158 WeakPolarHBondContact O-CG 3.49Å; G154-K158 PolarHBondContact O-N 3Å; G154-K158 VanDerWaalsContact O-N 3.15Å; E155-K158 PolarHBondContact O-N 3.18Å; K158-R160 PolarHBondContact O-N 2.9Å; K158-R160 VanDerWaalsContact O-N 3.16Å
159	H	83.8	Confident	75.4	Confident	119 Å²	119	75.4 Å²	75.4	55%	0.551	39%	0.388	S	S	*	.	S	Bend	trans	-72.4	105.3	175.5	-77.3	-58.2	0	0	0	110.6	K4 E155 Y161	K4-H159 PolarHBondContact NZ-O 3.02Å; E155-H159 WeakPolarHBondContact O-CB 3.35Å; E155-H159 PolarHBondContact O-CD2 2.92Å; E155-H159 PolarHBondContact O-N 3.04Å; H159-Y161 PolarHBondContact O-N 3.45Å
160	R	76	Confident	72.8	Confident	206 Å²	206	80.8 Å²	80.8	78%	0.777	43%	0.425	S	S	*	.			trans	-58.3	126.8	160.2	-71.6	-176	177.2	175.3	-0	108.6	K158 I162	K158-R160 PolarHBondContact O-N 2.9Å; K158-R160 VanDerWaalsContact O-N 3.16Å; R160-I162 PolarHBondContact O-N 3.19Å
161	Y	67.6	Low	70.4	Confident	36 Å²	36	87.5 Å²	87.5	14%	0.141	45%	0.451	C	S	.	.			trans	-66.1	106.7	173.2	178.9	-93.5	0	0	0	109	E74 Y75 R108 H159 P163	E74-Y161 PolarHBondContact OE2-N 3.06Å; Y75-Y161 HydrophobicContact CE1-CD2 4.23Å; Y75-Y161 AromaticContact CZ-CD2 3.98Å; R108-Y161 HydrophobicContact CG-CD2 4.14Å; R108-Y161 HydrophobicContact CG-CE2 3.69Å; R108-Y161 VanDerWaalsContact NE-CE1 3.32Å; R108-Y161 PolarHBondContact NE-OH 2.89Å; R108-Y161 VanDerWaalsContact NE-OH 3.17Å; R108-Y161 VanDerWaalsContact NH2-CE1 3.32Å; R108-Y161 PolarHBondContact NH2-OH 3.43Å; H159-Y161 PolarHBondContact O-N 3.45Å; Y161-P163 HydrophobicContact CD1-CG 4.05Å; Y161-P163 VanDerWaalsContact CE1-CA 3.47Å; Y161-P163 HydrophobicContact CE1-CB 3.86Å; Y161-P163 HydrophobicContact CE1-CG 3.78Å; Y161-P163 WeakPolarHBondContact O-CD 3.09Å
162	I	67.8	Low	68.2	Low	135 Å²	135	89.2 Å²	89.2	69%	0.692	46%	0.456	S	S	*	.			trans	-88.4	111.5	168.7	-58.5	177.2	0	0	0	106.4	R160 S164	R160-I162 PolarHBondContact O-N 3.19Å; I162-S164 PolarHBondContact O-N 2.75Å
163	P	58.4	Low	65.8	Low	70 Å²	70	91.2 Å²	91.2	46%	0.455	47%	0.47	S	S	.	.			trans	-56.3	140.1	175.3	-19.3	30.4	0	0	0	109.8	Y161 I165	Y161-P163 HydrophobicContact CD1-CG 4.05Å; Y161-P163 VanDerWaalsContact CE1-CA 3.47Å; Y161-P163 HydrophobicContact CE1-CB 3.86Å; Y161-P163 HydrophobicContact CE1-CG 3.78Å; Y161-P163 WeakPolarHBondContact O-CD 3.09Å; P163-I165 VanDerWaalsContact C-N 3.31Å; P163-I165 WeakPolarHBondContact O-CG1 3.29Å; P163-I165 PolarHBondContact O-N 2.74Å
164	S	52.6	Low	63	Low	79 Å²	79	94 Å²	94	55%	0.552	48%	0.484	S	S	*	.			trans	-69.1	86.8	-176.1	52.5	0	0	0	0	111.5	I162 N166 G167	I162-S164 PolarHBondContact O-N 2.75Å; S164-N166 PolarHBondContact O-N 3.32Å; S164-G167 PolarHBondContact O-N 2.84Å; S164-G167 VanDerWaalsContact O-N 3.15Å
165	I	52	Low	60.4	Low	86 Å²	86	96.8 Å²	96.8	44%	0.441	50%	0.501	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.7	-28.1	-174.3	-64.7	-165.6	0	0	0	112.7	P163 G167 L169	P163-I165 VanDerWaalsContact C-N 3.31Å; P163-I165 WeakPolarHBondContact O-CG1 3.29Å; P163-I165 PolarHBondContact O-N 2.74Å; I165-G167 PolarHBondContact O-N 3.35Å; I165-G167 VanDerWaalsContact O-N 3.15Å; I165-L169 HydrophobicContact CB-CD2 4.17Å; I165-L169 HydrophobicContact CD1-CD2 4.28Å; I165-L169 HydrophobicContact CG1-CD2 3.96Å; I165-L169 HydrophobicContact CG2-CB 4.08Å; I165-L169 HydrophobicContact CG2-CD2 3.77Å; I165-L169 WeakPolarHBondContact O-CB 3.39Å
166	N	51.3	Low	57.8	Low	165 Å²	165	93.6 Å²	93.6	88%	0.882	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.6	-5.2	-175.6	-59.5	-21.3	0	0	0	114.9	S164	S164-N166 PolarHBondContact O-N 3.32Å
167	G	49.1	Very low	55.6	Low	63 Å²	63	95.1 Å²	95.1	65%	0.649	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.9	-60.9	-178.1	0	0	0	0	0	114.9	S164 I165	S164-G167 PolarHBondContact O-N 2.84Å; S164-G167 VanDerWaalsContact O-N 3.15Å; I165-G167 PolarHBondContact O-N 3.35Å; I165-G167 VanDerWaalsContact O-N 3.15Å
168	D	48.7	Very low	53.5	Low	71 Å²	71	99.4 Å²	99.4	38%	0.38	52%	0.52	S	S	.	.	T	Hydrogen-bonded Turn	trans	-153.7	17.4	-175.7	-130.8	-22.6	0	0	0	113.8	S170 R171	D168-S170 PolarHBondContact O-N 3.23Å; D168-R171 PolarHBondContact O-N 3.41Å; D168-R171 IonicContact OD1-CZ 2.89Å; D168-R171 IonicContact OD1-NE 3.31Å; D168-R171 PolarHBondContact OD1-NE 2.81Å; D168-R171 IonicContact OD1-NH2 2.71Å; D168-R171 PolarHBondContact OD1-NH2 3.02Å; D168-R171 IonicContact OD2-CZ 3.86Å; D168-R171 IonicContact OD2-NE 3.8Å; D168-R171 PolarHBondContact OD2-NE 2.57Å; D168-R171 IonicContact OD2-NH2 3.9Å; D168-R171 PolarHBondContact OD2-NH2 3.47Å
169	L	47.9	Very low	51.3	Low	53 Å²	53	98.9 Å²	98.9	28%	0.277	52%	0.515	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-8.2	-175.5	-109.6	69.1	0	0	0	114.4	I165 R171 H172 L173	I165-L169 HydrophobicContact CB-CD2 4.17Å; I165-L169 HydrophobicContact CD1-CD2 4.28Å; I165-L169 HydrophobicContact CG1-CD2 3.96Å; I165-L169 HydrophobicContact CG2-CB 4.08Å; I165-L169 HydrophobicContact CG2-CD2 3.77Å; I165-L169 WeakPolarHBondContact O-CB 3.39Å; L169-R171 PolarHBondContact O-N 2.85Å; L169-H172 HydrophobicContact CD1-CB 4.38Å; L169-H172 HydrophobicContact CG-CB 4.26Å; L169-H172 PolarHBondContact O-N 3.46Å; L169-H172 VanDerWaalsContact O-N 3.09Å; L169-L173 HydrophobicContact CB-CD1 3.94Å; L169-L173 HydrophobicContact CB-CG 3.91Å; L169-L173 HydrophobicContact CD2-CD1 4.15Å; L169-L173 HydrophobicContact CD2-CD2 3.92Å; L169-L173 HydrophobicContact CD2-CG 3.81Å; L169-L173 HydrophobicContact CG-CD1 4.42Å; L169-L173 HydrophobicContact CG-CG 3.96Å; L169-L173 VanDerWaalsContact O-CB 3.29Å; L169-L173 WeakPolarHBondContact O-CB 3.43Å; L169-L173 WeakPolarHBondContact O-CG 3.14Å; L169-L173 PolarHBondContact O-N 2.75Å
170	S	41	Very low	49.3	Very low	115 Å²	115	99.4 Å²	99.4	80%	0.804	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-14.7	164	47.8	0	0	0	0	113.7	D168	D168-S170 PolarHBondContact O-N 3.23Å
171	R	46.4	Very low	47.8	Very low	155 Å²	155	94.5 Å²	94.5	59%	0.585	50%	0.501	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.1	-17.6	170.3	-51	-170.5	-153.3	-150.2	9.9	114.4	D168 L169 Y179	D168-R171 PolarHBondContact O-N 3.41Å; D168-R171 IonicContact OD1-CZ 2.89Å; D168-R171 IonicContact OD1-NE 3.31Å; D168-R171 PolarHBondContact OD1-NE 2.81Å; D168-R171 IonicContact OD1-NH2 2.71Å; D168-R171 PolarHBondContact OD1-NH2 3.02Å; D168-R171 IonicContact OD2-CZ 3.86Å; D168-R171 IonicContact OD2-NE 3.8Å; D168-R171 PolarHBondContact OD2-NE 2.57Å; D168-R171 IonicContact OD2-NH2 3.9Å; D168-R171 PolarHBondContact OD2-NH2 3.47Å; L169-R171 PolarHBondContact O-N 2.85Å; R171-Y179 PolarHBondContact O-OH 3.06Å
172	H	49	Very low	46.7	Very low	132 Å²	132	95.5 Å²	95.5	61%	0.611	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.9	-6.7	-169	-63.4	-72.2	0	0	0	115	L169	L169-H172 HydrophobicContact CD1-CB 4.38Å; L169-H172 HydrophobicContact CG-CB 4.26Å; L169-H172 PolarHBondContact O-N 3.46Å; L169-H172 VanDerWaalsContact O-N 3.09Å
173	L	43.8	Very low	46	Very low	118 Å²	118	96.7 Å²	96.7	62%	0.618	51%	0.509	S	S	*	.			trans	-87.9	2.4	171.9	-77.2	172.8	0	0	0	114.2	L169 T175	L169-L173 HydrophobicContact CB-CD1 3.94Å; L169-L173 HydrophobicContact CB-CG 3.91Å; L169-L173 HydrophobicContact CD2-CD1 4.15Å; L169-L173 HydrophobicContact CD2-CD2 3.92Å; L169-L173 HydrophobicContact CD2-CG 3.81Å; L169-L173 HydrophobicContact CG-CD1 4.42Å; L169-L173 HydrophobicContact CG-CG 3.96Å; L169-L173 VanDerWaalsContact O-CB 3.29Å; L169-L173 WeakPolarHBondContact O-CB 3.43Å; L169-L173 WeakPolarHBondContact O-CG 3.14Å; L169-L173 PolarHBondContact O-N 2.75Å; L173-T175 PolarHBondContact O-N 2.86Å; L173-T175 VanDerWaalsContact O-N 3.17Å
174	L	37.4	Very low	46.9	Very low	61 Å²	61	101.5 Å²	101.5	32%	0.319	52%	0.518	S	S	.	.	S	Bend	trans	-63.3	116.6	160	-74.6	171.5	0	0	0	107.1	E178 Y179	L174-E178 HydrophobicContact CD2-CB 4.29Å; L174-Y179 HydrophobicContact CB-CD2 3.82Å; L174-Y179 HydrophobicContact CB-CE2 3.87Å; L174-Y179 HydrophobicContact CD1-CD2 4.24Å; L174-Y179 HydrophobicContact CD1-CE2 3.89Å
175	T	39	Very low	47.8	Very low	62 Å²	62	102.4 Å²	102.4	38%	0.38	52%	0.515	S	S	.	.			trans	-54.5	143.5	175.7	61.2	0	0	0	0	109.2	L173 T177 E178	L173-T175 PolarHBondContact O-N 2.86Å; L173-T175 VanDerWaalsContact O-N 3.17Å; T175-T177 WeakPolarHBondContact CB-OG1 3.21Å; T175-T177 PolarHBondContact O-N 3.42Å; T175-T177 PolarHBondContact OG1-OG1 2.8Å; T175-E178 PolarHBondContact O-N 3.35Å
176	P	37.8	Very low	48.8	Very low	52 Å²	52	102.6 Å²	102.6	34%	0.338	52%	0.524	S	S	.	.	T	Hydrogen-bonded Turn	trans	-47.6	-29.4	175.7	-31.6	30.2	0	0	0	115.3	E178 P1661 I1663	P176-E178 PolarHBondContact O-N 2.91Å; P176-P1661 HydrophobicContact CB-CB 4.46Å; P176-P1661 HydrophobicContact CB-CG 4.37Å; P176-P1661 WeakPolarHBondContact CB-O 3.4Å; P176-I1663 HydrophobicContact CB-CD1 3.94Å; P176-I1663 VanDerWaalsContact CD-CD1 3.47Å; P176-I1663 HydrophobicContact CG-CD1 3.77Å
177	T	41.8	Very low	49.9	Very low	49 Å²	49	97.5 Å²	97.5	30%	0.301	50%	0.498	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.8	-38.6	167.9	9.3	0	0	0	0	115.4	T175 T1662 I1663	T175-T177 WeakPolarHBondContact CB-OG1 3.21Å; T175-T177 PolarHBondContact O-N 3.42Å; T175-T177 PolarHBondContact OG1-OG1 2.8Å; T177-T1662 HydrophobicContact CG2-CG2 3.77Å; T177-I1663 HydrophobicContact CG2-CB 4.03Å; T177-I1663 HydrophobicContact CG2-CG2 3.71Å; T177-I1663 VanDerWaalsContact OG1-CG2 3.31Å; T177-I1663 WeakPolarHBondContact OG1-CG2 3.49Å
178	E	44.5	Very low	51.2	Low	103 Å²	103	98.7 Å²	98.7	48%	0.481	49%	0.494	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.8	-14.2	-172.6	-69.1	-173.2	133.1	0	0	113.8	L174 T175 P176 Y180	L174-E178 HydrophobicContact CD2-CB 4.29Å; T175-E178 PolarHBondContact O-N 3.35Å; P176-E178 PolarHBondContact O-N 2.91Å; E178-Y180 PolarHBondContact O-N 3.1Å
179	Y	41.6	Very low	52.8	Low	146 Å²	146	97.1 Å²	97.1	57%	0.573	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.2	-13.9	174.4	-110.6	-82.6	0	0	0	113.3	R171 L174 I181	R171-Y179 PolarHBondContact O-OH 3.06Å; L174-Y179 HydrophobicContact CB-CD2 3.82Å; L174-Y179 HydrophobicContact CB-CE2 3.87Å; L174-Y179 HydrophobicContact CD1-CD2 4.24Å; L174-Y179 HydrophobicContact CD1-CE2 3.89Å; Y179-I181 VanDerWaalsContact C-N 3.26Å; Y179-I181 PolarHBondContact O-N 3.45Å
180	Y	41.3	Very low	53.5	Low	130 Å²	130	103.1 Å²	103.1	51%	0.51	52%	0.517	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-0.6	177.4	-86.3	-79.9	0	0	0	115.3	E178 S182 N1660	E178-Y180 PolarHBondContact O-N 3.1Å; Y180-S182 PolarHBondContact O-N 2.92Å; Y180-S182 VanDerWaalsContact O-N 3.14Å; Y180-N1660 VanDerWaalsContact OH-CG 3.31Å; Y180-N1660 PolarHBondContact OH-ND2 2.79Å; Y180-N1660 PolarHBondContact OH-OD1 3.06Å
181	I	44.9	Very low	54.9	Low	103 Å²	103	106.9 Å²	106.9	53%	0.528	51%	0.513	S	S	.	.	S	Bend	trans	-67.9	113.9	171.4	-59.4	174.9	0	0	0	108.9	Y179 R183	Y179-I181 VanDerWaalsContact C-N 3.26Å; Y179-I181 PolarHBondContact O-N 3.45Å; I181-R183 HydrophobicContact CB-CG 4.48Å; I181-R183 HydrophobicContact CG2-CG 3.96Å; I181-R183 PolarHBondContact O-N 2.95Å
182	S	44.3	Very low	56	Low	57 Å²	57	102 Å²	102	40%	0.399	51%	0.511	S	S	.	.			trans	-60.3	78.7	171.5	-78.7	0	0	0	0	111.9	Y180 R198	Y180-S182 PolarHBondContact O-N 2.92Å; Y180-S182 VanDerWaalsContact O-N 3.14Å; S182-R198 PolarHBondContact OG-NH2 3.26Å
183	R	52.7	Low	57.1	Low	161 Å²	161	101.3 Å²	101.3	61%	0.608	51%	0.508	S	S	*	.			trans	-78.1	123.7	177.9	-71.6	-173.5	177.5	179.5	1.8	110.3	I181	I181-R183 HydrophobicContact CB-CG 4.48Å; I181-R183 HydrophobicContact CG2-CG 3.96Å; I181-R183 PolarHBondContact O-N 2.95Å
184	W	78.8	Confident	58.4	Low	171 Å²	171	100.1 Å²	100.1	65%	0.648	51%	0.507	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.2	124	160.5	-65.3	91.3	0	0	0	108.5	A196 R198	W184-A196 HydrophobicContact CE3-CB 3.66Å; W184-A196 HydrophobicContact CZ3-CB 4.16Å; W184-A196 VanDerWaalsContact CZ3-O 3.31Å; W184-A196 WeakPolarHBondContact CZ3-O 3.48Å; W184-R198 HydrophobicContact CD2-CB 4.05Å; W184-R198 HydrophobicContact CE3-CB 3.75Å; W184-R198 HydrophobicContact CH2-CB 4.23Å; W184-R198 HydrophobicContact CZ2-CB 4.47Å; W184-R198 HydrophobicContact CZ3-CB 3.86Å
185	M	70.1	Confident	60.4	Low	97 Å²	97	101.5 Å²	101.5	48%	0.478	51%	0.514	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	126.5	172.6	-174.5	165.5	76.1	0	0	108.9	V187 V197 I199	M185-V187 HydrophobicContact CE-CG2 3.6Å; M185-V187 HydrophobicContact CG-CG2 4.09Å; M185-V187 PolarHBondContact O-N 3.21Å; M185-V197 PolarHBondContact N-O 3.02Å; M185-V197 PolarHBondContact O-N 2.76Å; M185-I199 HydrophobicContact CE-CD1 3.97Å; M185-I199 HydrophobicContact SD-CD1 4.32Å
186	S	73.1	Confident	62.4	Low	90 Å²	90	101.6 Å²	101.6	63%	0.629	52%	0.522	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.9	116	170.7	-178.6	0	0	0	0	109.2	P194 L195	S186-P194 WeakPolarHBondContact OG-CB 3.4Å; S186-L195 WeakPolarHBondContact CA-O 3.44Å
187	V	74.9	Confident	64.2	Low	58 Å²	58	102 Å²	102	35%	0.352	52%	0.523	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	116.2	175.8	-175.6	0	0	0	0	107.6	M185 L195 V197	M185-V187 HydrophobicContact CE-CG2 3.6Å; M185-V187 HydrophobicContact CG-CG2 4.09Å; M185-V187 PolarHBondContact O-N 3.21Å; V187-L195 PolarHBondContact N-O 2.89Å; V187-L195 PolarHBondContact O-N 3.3Å; V187-V197 HydrophobicContact CB-CG2 3.95Å; V187-V197 HydrophobicContact CG2-CB 4.13Å; V187-V197 HydrophobicContact CG2-CG2 3.83Å
188	T	76.5	Confident	65.7	Low	89 Å²	89	105.8 Å²	105.8	55%	0.546	53%	0.532	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	130.6	170.8	42.6	0	0	0	0	110.4	Q193 P194	T188-Q193 CarbonylContact C-O 3.6Å; T188-Q193 VanDerWaalsContact CA-O 3.3Å; T188-Q193 WeakPolarHBondContact CA-O 3.37Å; T188-P194 HydrophobicContact CG2-CB 4.39Å
189	D	82.4	Confident	66.6	Low	37 Å²	37	105.9 Å²	105.9	20%	0.198	54%	0.535	C	S	.	.			trans	-73.1	-179.6	170.9	74.9	-4.4	0	0	0	112.7	R191 G192 Q193 L195	D189-R191 PolarHBondContact O-N 3.48Å; D189-R191 VanDerWaalsContact OD1-CA 3.3Å; D189-R191 WeakPolarHBondContact OD1-CA 3.41Å; D189-R191 WeakPolarHBondContact OD1-CB 3.46Å; D189-R191 PolarHBondContact OD1-N 3.5Å; D189-R191 IonicContact OD2-CZ 3.15Å; D189-R191 IonicContact OD2-NE 2.77Å; D189-R191 PolarHBondContact OD2-NE 2.85Å; D189-R191 IonicContact OD2-NH2 2.69Å; D189-R191 PolarHBondContact OD2-NH2 2.73Å; D189-G192 PolarHBondContact O-N 3.33Å; D189-G192 PolarHBondContact OD1-N 3.45Å; D189-G192 VanDerWaalsContact OD1-N 3.13Å; D189-Q193 PolarHBondContact N-O 2.91Å; D189-Q193 PolarHBondContact OD1-N 2.93Å; D189-L195 HydrophobicContact CB-CD1 3.71Å
190	L	62.7	Low	67.5	Low	180 Å²	180	102.8 Å²	102.8	94%	0.942	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-2.6	176.7	-59.6	177.2	0	0	0	114.2
191	R	69.3	Low	67.7	Low	194 Å²	194	102.1 Å²	102.1	73%	0.732	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.6	4.1	174	-58.4	169.5	-70.2	-150.2	-1.8	111.9	D189 Q193	D189-R191 PolarHBondContact O-N 3.48Å; D189-R191 VanDerWaalsContact OD1-CA 3.3Å; D189-R191 WeakPolarHBondContact OD1-CA 3.41Å; D189-R191 WeakPolarHBondContact OD1-CB 3.46Å; D189-R191 PolarHBondContact OD1-N 3.5Å; D189-R191 IonicContact OD2-CZ 3.15Å; D189-R191 IonicContact OD2-NE 2.77Å; D189-R191 PolarHBondContact OD2-NE 2.85Å; D189-R191 IonicContact OD2-NH2 2.69Å; D189-R191 PolarHBondContact OD2-NH2 2.73Å; R191-Q193 VanDerWaalsContact C-N 3.31Å; R191-Q193 HydrophobicContact CB-CG 4.45Å
192	G	69.4	Low	67.7	Low	52 Å²	52	103 Å²	103	54%	0.536	56%	0.556	S	S	.	*	S	Bend	trans	77.1	9.2	-176.8	0	0	0	0	0	114.6	D189	D189-G192 PolarHBondContact O-N 3.33Å; D189-G192 PolarHBondContact OD1-N 3.45Å; D189-G192 VanDerWaalsContact OD1-N 3.13Å
193	Q	72.3	Confident	67.4	Low	118 Å²	118	103.2 Å²	103.2	55%	0.551	57%	0.567	S	S	*	*			trans	-85.9	125.3	-179.2	-63.3	-170.1	-13.9	0	0	110.7	T188 D189 R191 L195	T188-Q193 CarbonylContact C-O 3.6Å; T188-Q193 VanDerWaalsContact CA-O 3.3Å; T188-Q193 WeakPolarHBondContact CA-O 3.37Å; D189-Q193 PolarHBondContact N-O 2.91Å; D189-Q193 PolarHBondContact OD1-N 2.93Å; R191-Q193 VanDerWaalsContact C-N 3.31Å; R191-Q193 HydrophobicContact CB-CG 4.45Å; Q193-L195 PolarHBondContact O-N 2.79Å
194	P	72.6	Confident	66.7	Low	93 Å²	93	101.1 Å²	101.1	60%	0.604	56%	0.564	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-73	106.9	179.4	28.8	-33.6	0	0	0	111.3	S186 T188	S186-P194 WeakPolarHBondContact OG-CB 3.4Å; T188-P194 HydrophobicContact CG2-CB 4.39Å
195	L	78.9	Confident	64.9	Low	90 Å²	90	96.8 Å²	96.8	47%	0.471	56%	0.559	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-83.7	130.2	164.1	-76.5	93.4	0	0	0	109.9	S186 V187 D189 Q193 V197	S186-L195 WeakPolarHBondContact CA-O 3.44Å; V187-L195 PolarHBondContact N-O 2.89Å; V187-L195 PolarHBondContact O-N 3.3Å; D189-L195 HydrophobicContact CB-CD1 3.71Å; Q193-L195 PolarHBondContact O-N 2.79Å; L195-V197 HydrophobicContact CB-CG2 4.29Å; L195-V197 PolarHBondContact O-N 2.86Å; L195-V197 VanDerWaalsContact O-N 3.14Å
196	A	81	Confident	63.3	Low	64 Å²	64	95.3 Å²	95.3	53%	0.529	55%	0.553	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-76.2	96.4	165.1	0	0	0	0	0	109	W184	W184-A196 HydrophobicContact CE3-CB 3.66Å; W184-A196 HydrophobicContact CZ3-CB 4.16Å; W184-A196 VanDerWaalsContact CZ3-O 3.31Å; W184-A196 WeakPolarHBondContact CZ3-O 3.48Å
197	V	75.3	Confident	61.7	Low	61 Å²	61	94.3 Å²	94.3	37%	0.37	55%	0.546	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	114.2	175.4	-178.7	0	0	0	0	108.7	M185 V187 L195 I199	M185-V197 PolarHBondContact N-O 3.02Å; M185-V197 PolarHBondContact O-N 2.76Å; V187-V197 HydrophobicContact CB-CG2 3.95Å; V187-V197 HydrophobicContact CG2-CB 4.13Å; V187-V197 HydrophobicContact CG2-CG2 3.83Å; L195-V197 HydrophobicContact CB-CG2 4.29Å; L195-V197 PolarHBondContact O-N 2.86Å; L195-V197 VanDerWaalsContact O-N 3.14Å; V197-I199 PolarHBondContact O-N 2.83Å
198	R	74.2	Confident	59.8	Low	127 Å²	127	95.4 Å²	95.4	48%	0.479	56%	0.562	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-81.4	111	168.7	-173.7	-177.7	178.4	177.3	0.9	108.6	S182 W184 T200	S182-R198 PolarHBondContact OG-NH2 3.26Å; W184-R198 HydrophobicContact CD2-CB 4.05Å; W184-R198 HydrophobicContact CE3-CB 3.75Å; W184-R198 HydrophobicContact CH2-CB 4.23Å; W184-R198 HydrophobicContact CZ2-CB 4.47Å; W184-R198 HydrophobicContact CZ3-CB 3.86Å; R198-T200 HydrophobicContact CG-CG2 4.05Å; R198-T200 PolarHBondContact O-N 3.3Å
199	I	62.4	Low	57.7	Low	106 Å²	106	97 Å²	97	54%	0.544	57%	0.574	S	S	.	*			trans	-74.6	118.6	173	-56.1	176.6	0	0	0	107.9	M185 V197	M185-I199 HydrophobicContact CE-CD1 3.97Å; M185-I199 HydrophobicContact SD-CD1 4.32Å; V197-I199 PolarHBondContact O-N 2.83Å
200	T	59.6	Low	55.4	Low	81 Å²	81	98.9 Å²	98.9	50%	0.497	59%	0.594	S	S	.	*			trans	-121	120.6	174.9	52.7	0	0	0	0	109.7	R198	R198-T200 HydrophobicContact CG-CG2 4.05Å; R198-T200 PolarHBondContact O-N 3.3Å
201	S	45.4	Very low	54	Low	116 Å²	116	95.1 Å²	95.1	81%	0.811	58%	0.583	S	S	*	*			trans	-71.4	131.8	167.4	-174.2	0	0	0	0	109.6
202	T	44.9	Very low	52.3	Low	122 Å²	122	97.2 Å²	97.2	75%	0.748	59%	0.591	S	S	*	*			trans	-140.9	93	179.4	55.6	0	0	0	0	111.4
203	G	38.9	Very low	50.7	Low	61 Å²	61	99.4 Å²	99.4	63%	0.629	60%	0.596	S	S	*	*	S	Bend	trans	173.9	115.5	172.6	0	0	0	0	0	110.1	F277	G203-F277 VanDerWaalsContact N-CZ 3.28Å
204	Q	39	Very low	49	Very low	116 Å²	116	99.8 Å²	99.8	54%	0.542	60%	0.601	S	S	.	*	S	Bend	cis	-86.4	109.9	-8.7	-126.6	-161.9	87.7	0	0	125.2	D206 F277	Q204-D206 PolarHBondContact O-N 2.88Å; Q204-F277 VanDerWaalsContact C-CB 3.41Å; Q204-F277 HydrophobicContact CB-CB 3.58Å; Q204-F277 HydrophobicContact CB-CD1 2.75Å; Q204-F277 HydrophobicContact CB-CD2 3.22Å; Q204-F277 HydrophobicContact CB-CE1 3.43Å; Q204-F277 VanDerWaalsContact CB-CE1 3.43Å; Q204-F277 HydrophobicContact CB-CE2 3.81Å; Q204-F277 HydrophobicContact CB-CG 2.66Å; Q204-F277 HydrophobicContact CB-CZ 3.92Å; Q204-F277 HydrophobicContact CG-CB 3.58Å; Q204-F277 HydrophobicContact CG-CD1 3.88Å; Q204-F277 HydrophobicContact CG-CD2 3.39Å; Q204-F277 HydrophobicContact CG-CE2 4.38Å; Q204-F277 HydrophobicContact CG-CG 3.1Å; Q204-F277 VanDerWaalsContact N-CD1 3.27Å; Q204-F277 WeakPolarHBondContact O-CD1 3.15Å; Q204-F277 WeakPolarHBondContact O-CD2 3.39Å; Q204-F277 WeakPolarHBondContact O-CE1 3.35Å; Q204-F277 WeakPolarHBondContact O-CG 3.42Å; Q204-F277 WeakPolarHBondContact O-CZ 3.35Å; Q204-F277 VanDerWaalsContact OE1-CA 3.24Å
205	S	39.9	Very low	47	Very low	80 Å²	80	104.2 Å²	104.2	56%	0.559	62%	0.619	S	S	*	*			trans	-71.2	121.8	163.6	54.8	0	0	0	0	108.2	C276 F277	S205-C276 VanDerWaalsContact O-CB 3.27Å; S205-C276 WeakPolarHBondContact O-CB 3.35Å; S205-C276 PolarHBondContact O-SG 2.74Å; S205-F277 PolarHBondContact O-N 3.05Å
206	D	37.4	Very low	44.8	Very low	66 Å²	66	104.5 Å²	104.5	35%	0.353	63%	0.629	S	S	.	*			trans	-129.7	130.6	157.4	-166.9	22.5	0	0	0	111	Q204 F277 T278	Q204-D206 PolarHBondContact O-N 2.88Å; D206-F277 HydrophobicContact CB-CB 4.31Å; D206-F277 WeakPolarHBondContact CB-O 3.29Å; D206-T278 HydrophobicContact CB-CG2 3.51Å; D206-T278 VanDerWaalsContact OD2-CG2 3.3Å; D206-T278 WeakPolarHBondContact OD2-CG2 3.3Å; D206-T278 PolarHBondContact OD2-OG1 3.4Å
207	S	37.8	Very low	42.5	Very low	69 Å²	69	105 Å²	105	48%	0.483	64%	0.641	S	S	.	*	S	Bend	trans	55.1	149.7	-164	75.9	0	0	0	0	116.2	N1652	S207-N1652 PolarHBondContact OG-ND2 3.36Å
208	A	36.9	Very low	40.7	Very low	81 Å²	81	109.8 Å²	109.8	67%	0.669	66%	0.662	S	S	*	*			trans	-112.5	174.3	-178.9	0	0	0	0	0	111.3	A210	A208-A210 HydrophobicContact CB-CB 4.43Å
209	P	30.5	Very low	38.8	Very low	124 Å²	124	111.1 Å²	111.1	81%	0.805	67%	0.674	S	S	*	*				-123	133.8	94.5	34.8	-31.4	0	0	0	111.7
210	A	34.1	Very low	37.5	Very low	75 Å²	75	111.4 Å²	111.4	62%	0.62	68%	0.682	S	S	*	*			cis	77.1	94	46.8	0	0	0	0	0	113.1	A208	A208-A210 HydrophobicContact CB-CB 4.43Å
211	S	33.5	Very low	36.5	Very low	101 Å²	101	113.4 Å²	113.4	71%	0.706	69%	0.689	S	S	*	*			trans	64.7	153.3	174.6	68	0	0	0	0	114.9
212	W	33.9	Very low	36.1	Very low	239 Å²	239	115.4 Å²	115.4	91%	0.905	69%	0.69	S	S	*	*			cis	-121.8	166.1	22.7	-92.9	61	0	0	0	114.7
213	P	37.1	Very low	35.7	Very low	98 Å²	98	113.4 Å²	113.4	64%	0.636	69%	0.694	S	S	*	*			trans	-125.8	175.7	-142.6	44.2	-32.1	0	0	0	116.4
214	D	35.3	Very low	35.4	Very low	125 Å²	125	117.7 Å²	117.7	67%	0.668	70%	0.7	S	S	*	*			trans	41	98.7	140.6	-153.1	-22	0	0	0	119.1	S216	D214-S216 VanDerWaalsContact C-N 3.31Å; D214-S216 PolarHBondContact O-N 2.95Å; D214-S216 WeakPolarHBondContact OD1-CB 3.39Å; D214-S216 PolarHBondContact OD1-N 3.08Å; D214-S216 VanDerWaalsContact OD1-N 3.17Å; D214-S216 PolarHBondContact OD1-OG 3.15Å
215	L	31.4	Very low	35.4	Very low	186 Å²	186	121.9 Å²	121.9	97%	0.974	72%	0.716	S	S	*	*	S	Bend	trans	-86.8	58.2	169.5	-75.9	169.2	0	0	0	112
216	S	31.5	Very low	35.2	Very low	96 Å²	96	125.2 Å²	125.2	67%	0.671	72%	0.723	S	S	*	*			trans	-143.5	44.7	175	71.3	0	0	0	0	115.8	D214	D214-S216 VanDerWaalsContact C-N 3.31Å; D214-S216 PolarHBondContact O-N 2.95Å; D214-S216 WeakPolarHBondContact OD1-CB 3.39Å; D214-S216 PolarHBondContact OD1-N 3.08Å; D214-S216 VanDerWaalsContact OD1-N 3.17Å; D214-S216 PolarHBondContact OD1-OG 3.15Å
217	G	33.7	Very low	35.3	Very low	76 Å²	76	128.2 Å²	128.2	78%	0.784	74%	0.743	S	S	*	*			trans	-134.3	106.6	174.2	0	0	0	0	0	113.9
218	I	36.8	Very low	35.4	Very low	160 Å²	160	132 Å²	132	82%	0.821	76%	0.757	S	S	*	*			trans	-100.4	114.1	-179.9	-64.1	175.8	0	0	0	110.5
219	E	33.9	Very low	35.5	Very low	156 Å²	156	134.1 Å²	134.1	73%	0.729	76%	0.757	S	S	*	*			trans	61.9	172.5	161.9	-69.4	-162.9	130.5	0	0	117.2
220	P	36.8	Very low	36	Very low	111 Å²	111	132.9 Å²	132.9	72%	0.721	75%	0.749	S	S	*	*			cis	-128.3	141.5	-1.3	21.6	2.5	0	0	0	117.5
221	I	37.3	Very low	36.1	Very low	124 Å²	124	136.1 Å²	136.1	64%	0.636	75%	0.754	S	S	*	*				51.8	133.7	121.7	-57.9	169	0	0	0	121.7
222	N	37	Very low	36.2	Very low	157 Å²	157	141.3 Å²	141.3	84%	0.84	76%	0.76	S	S	*	*			trans	88.8	127.7	155.8	-80.4	-25.3	0	0	0	122.3
223	G	36.6	Very low	36.5	Very low	80 Å²	80	134.8 Å²	134.8	83%	0.825	75%	0.749	S	S	*	*			trans	167.9	92.2	165.8	0	0	0	0	0	114
224	M	33.3	Very low	36.5	Very low	151 Å²	151	137.9 Å²	137.9	74%	0.744	76%	0.758	S	S	*	*			trans	-88	146.6	-170.7	-70.6	176.7	165.6	0	0	116.5
225	K	38.1	Very low	36.5	Very low	204 Å²	204	135 Å²	135	89%	0.887	76%	0.757	S	S	*	*			trans	178.4	101	130.2	-97.9	161.4	-177.7	178.5	0	109.8
226	H	36.9	Very low	36.8	Very low	151 Å²	151	134 Å²	134	70%	0.699	75%	0.748	S	S	*	*				81.1	153.1	66.1	-93.8	-70.8	0	0	0	117.2
227	V	39.6	Very low	37	Very low	128 Å²	128	138.8 Å²	138.8	78%	0.776	75%	0.751	S	S	*	*			trans	83.4	112.5	-176.3	-178.4	0	0	0	0	112.3
228	L	40	Very low	37.2	Very low	148 Å²	148	142.2 Å²	142.2	78%	0.775	75%	0.751	S	S	*	*			cis	-163.5	165.7	-2.6	-93.8	172.7	0	0	0	105.2
229	D	37.2	Very low	37.2	Very low	126 Å²	126	138.5 Å²	138.5	67%	0.674	74%	0.739	S	S	*	*			cis	-177.5	-159.4	-25.3	-135.2	59.4	0	0	0	104.7
230	P	40.9	Very low	37.2	Very low	99 Å²	99	140.1 Å²	140.1	64%	0.643	75%	0.747	S	S	*	*			cis	-131.8	-179.2	-16	32.7	-10.2	0	0	0	116.2
231	I	37.4	Very low	37.1	Very low	142 Å²	142	140.1 Å²	140.1	73%	0.728	75%	0.75	S	S	*	*			trans	80.5	87.4	159.8	-38.6	-171.6	0	0	0	119.6
232	Y	34.4	Very low	37.1	Very low	210 Å²	210	138.7 Å²	138.7	82%	0.824	76%	0.756	S	S	*	*				43.1	155.2	114.2	-83	-99.9	0	0	0	122.5
233	P	42.1	Very low	37.1	Very low	103 Å²	103	137 Å²	137	67%	0.669	76%	0.757	S	S	*	*			cis	-142.1	160	17.1	36.4	-15	0	0	0	120.3
234	I	36.3	Very low	37	Very low	162 Å²	162	138.7 Å²	138.7	83%	0.831	75%	0.75	S	S	*	*			trans	59.7	131.2	145.1	-62.5	162	0	0	0	119.6
235	G	36.1	Very low	37	Very low	64 Å²	64	139.8 Å²	139.8	66%	0.66	75%	0.751	S	S	*	*			cis	159	163.5	-9	0	0	0	0	0	115
236	Q	37.4	Very low	36.8	Very low	165 Å²	165	136.1 Å²	136.1	77%	0.771	74%	0.738	S	S	*	*			trans	73	148.3	170.3	-57.2	-166.2	30.1	0	0	117.6
237	R	35.2	Very low	36.8	Very low	197 Å²	197	136.7 Å²	136.7	74%	0.743	74%	0.74	S	S	*	*			cis	-167.5	141.1	-5.1	-115.2	177.2	174.4	-174.4	-1.8	111.7
238	L	36.9	Very low	36.2	Very low	149 Å²	149	135.9 Å²	135.9	78%	0.78	74%	0.74	S	S	*	*			trans	60.4	157.7	142.8	-60.9	169.5	0	0	0	120.7
239	S	37.1	Very low	36.4	Very low	82 Å²	82	133.9 Å²	133.9	57%	0.573	74%	0.736	S	S	*	*			cis	-178.2	140.1	-21.7	53.6	0	0	0	0	113.7
240	Q	35.2	Very low	36.3	Very low	190 Å²	190	133.7 Å²	133.7	89%	0.888	74%	0.74	S	S	*	*			trans	56.9	161.7	148	-64.8	169.2	-10.7	0	0	118.5
241	S	35.1	Very low	36	Very low	111 Å²	111	137.2 Å²	137.2	78%	0.776	75%	0.747	S	S	*	*			cis	-161	145.1	6.5	34.2	0	0	0	0	107.3
242	A	36.3	Very low	35.7	Very low	93 Å²	93	135.3 Å²	135.3	77%	0.769	75%	0.747	S	S	*	*				86.3	113.5	51.4	0	0	0	0	0	116.2
243	S	37.2	Very low	35.7	Very low	123 Å²	123	135.3 Å²	135.3	86%	0.86	75%	0.746	S	S	*	*			trans	164.3	178.3	142.7	48.6	0	0	0	0	114.4
244	V	35.2	Very low	35.2	Very low	114 Å²	114	136.4 Å²	136.4	69%	0.691	75%	0.746	S	S	*	*				-143.5	173.1	-88.8	-177.5	0	0	0	0	108.6
245	F	32.2	Very low	35.3	Very low	174 Å²	174	134.7 Å²	134.7	76%	0.763	75%	0.748	S	S	*	*			trans	86.4	150.2	163.5	-63.6	-89.5	0	0	0	119
246	E	33.3	Very low	35.1	Very low	128 Å²	128	138 Å²	138	60%	0.598	76%	0.756	S	S	*	*			cis	-168.2	162.3	-48.1	-125.9	179.1	162.6	0	0	112.1
247	H	37	Very low	35.3	Very low	163 Å²	163	135.5 Å²	135.5	76%	0.755	75%	0.754	S	S	*	*			trans	66.7	156.6	158.2	-60.5	-26.7	0	0	0	121.4
248	S	28.5	Very low	35.2	Very low	111 Å²	111	132.8 Å²	132.8	78%	0.776	75%	0.754	S	S	*	*			trans	-147.3	-152.1	-175.5	53.2	0	0	0	0	108.1
249	P	42.8	Very low	35.1	Very low	105 Å²	105	134 Å²	134	68%	0.682	76%	0.76	S	S	*	*				-107.7	-175.6	-80.3	38.4	-25	0	0	0	112.2
250	T	36.1	Very low	34.8	Very low	123 Å²	123	138 Å²	138	76%	0.755	77%	0.769	S	S	*	*				177.6	138.1	129.5	25.6	0	0	0	0	116.2
251	Q	34.4	Very low	34.7	Very low	172 Å²	172	137.3 Å²	137.3	80%	0.804	77%	0.771	S	S	*	*			trans	52.1	109.6	135.7	-68.3	179.8	-0.6	0	0	124.2
252	S	31.2	Very low	34.5	Very low	103 Å²	103	137.5 Å²	137.5	72%	0.72	76%	0.76	S	S	*	*				107.4	154	102.3	76.1	0	0	0	0	122.9
253	R	35.3	Very low	34.3	Very low	210 Å²	210	138.5 Å²	138.5	79%	0.792	76%	0.756	S	S	*	*			trans	86.8	109.6	154.4	-67.6	-156.4	131.8	124.1	1.9	122.8
254	D	31.5	Very low	34	Very low	125 Å²	125	138.5 Å²	138.5	67%	0.668	75%	0.746	S	S	*	*				54.5	106.4	113.4	-42.4	-17.7	0	0	0	120.1
255	S	37.6	Very low	33.9	Very low	127 Å²	127	137.4 Å²	137.4	89%	0.888	74%	0.736	S	S	*	*				-173.6	132.2	122.5	26.7	0	0	0	0	113.3
256	T	31.7	Very low	33.8	Very low	133 Å²	133	135.6 Å²	135.6	82%	0.816	73%	0.728	S	S	*	*			trans	-101	159.7	166.2	43.8	0	0	0	0	109.5
257	P	41.3	Very low	33.9	Very low	112 Å²	112	134.8 Å²	134.8	73%	0.727	73%	0.728	S	S	*	*				-150.7	152.7	92.7	38.6	-20.8	0	0	0	117.1
258	N	34.1	Very low	33.6	Very low	140 Å²	140	136.3 Å²	136.3	75%	0.749	73%	0.727	S	S	*	*			trans	35.4	117.2	137.5	-51	-13.2	0	0	0	120.9
259	L	33.7	Very low	33.8	Very low	175 Å²	175	136.4 Å²	136.4	92%	0.916	72%	0.718	S	S	*	*				-145.1	144.4	104.2	-144.4	75.2	0	0	0	111.1
260	H	32.2	Very low	33.4	Very low	165 Å²	165	141.7 Å²	141.7	76%	0.764	72%	0.724	S	S	*	*			trans	-92.1	134.5	-178	-101.5	-90.7	0	0	0	111.9
261	L	31.3	Very low	33.1	Very low	177 Å²	177	140.2 Å²	140.2	93%	0.927	72%	0.719	S	S	*	*			trans	-152	125.7	133.1	-108.9	165.2	0	0	0	107.8
262	H	31.8	Very low	32.8	Very low	115 Å²	115	141.9 Å²	141.9	53%	0.532	72%	0.724	S	S	.	*			trans	-160.3	170.7	-167.8	-172.9	-89.6	0	0	0	108.1	N265	H262-N265 PolarHBondContact NE2-ND2 3.25Å
263	V	31.8	Very low	32.7	Very low	113 Å²	113	141.6 Å²	141.6	69%	0.685	72%	0.722	S	S	*	*			trans	75	118.2	-176.7	-170.6	0	0	0	0	110.9
264	N	32	Very low	32.3	Very low	123 Å²	123	135.9 Å²	135.9	66%	0.658	72%	0.715	S	S	*	*			cis	-141.1	142.4	-1.3	-113.5	0.3	0	0	0	109.2
265	N	32.5	Very low	32.2	Very low	91 Å²	91	141.1 Å²	141.1	49%	0.487	73%	0.725	S	S	.	*			cis	68.1	142.1	13.2	-151.5	-1.1	0	0	0	115.5	H262	H262-N265 PolarHBondContact NE2-ND2 3.25Å
266	F	30.3	Very low	31.8	Very low	136 Å²	136	138.6 Å²	138.6	60%	0.596	71%	0.706	S	S	*	*			trans	59	139.3	179.5	-57.2	-65.6	0	0	0	117.1
267	N	34.7	Very low	31.8	Very low	111 Å²	111	134.7 Å²	134.7	59%	0.594	68%	0.678	S	S	*	*			cis	-132.5	134.8	-3	-103.2	-52.3	0	0	0	107.9
268	R	30.6	Very low	31.2	Very low	195 Å²	195	132.6 Å²	132.6	74%	0.736	66%	0.663	S	S	*	*				60.7	116	82.8	-155.5	-157.2	-110.4	168.7	-5.8	109.2
269	I	33.5	Very low	30.9	Very low	114 Å²	114	130.3 Å²	130.3	59%	0.585	64%	0.644	S	S	*	*				-162.7	135.2	80	-89.1	170.4	0	0	0	111.2
270	R	33.1	Very low	30.6	Very low	215 Å²	215	128.1 Å²	128.1	81%	0.811	63%	0.627	S	S	*	*			trans	28.7	144	137.3	-56.8	178.5	179.5	158.1	-2.1	119.9
271	S	30	Very low	30.4	Very low	93 Å²	93	125.3 Å²	125.3	65%	0.65	61%	0.614	S	S	*	*			cis	-179	153.6	2.9	41.3	0	0	0	0	113.4
272	F	28	Very low	30.5	Very low	206 Å²	206	125 Å²	125	90%	0.904	61%	0.608	S	S	*	*			trans	46.3	133.7	139.4	-80.1	-98	0	0	0	122.9
273	S	29	Very low	30.2	Very low	97 Å²	97	129.2 Å²	129.2	68%	0.678	62%	0.621	S	S	*	*			trans	101.6	95.5	134.4	-164	0	0	0	0	120.5
274	S	28	Very low	30.1	Very low	91 Å²	91	133.7 Å²	133.7	64%	0.636	63%	0.627	S	S	*	*				15.5	142.9	116.6	48.7	0	0	0	0	122.6
275	R	28.9	Very low	30.2	Very low	234 Å²	234	133 Å²	133	88%	0.883	62%	0.623	S	S	*	*			trans	75	130.3	155.7	-68.5	172.2	-167.6	-169.3	5	115.8
276	C	29	Very low	30	Very low	74 Å²	74	135.3 Å²	135.3	50%	0.5	64%	0.641	S	S	.	*			cis	-165.2	-171.2	32.9	-109	0	0	0	0	111.5	S205	S205-C276 VanDerWaalsContact O-CB 3.27Å; S205-C276 WeakPolarHBondContact O-CB 3.35Å; S205-C276 PolarHBondContact O-SG 2.74Å
277	F	31.6	Very low	30	Very low	51 Å²	51	133.4 Å²	133.4	22%	0.224	64%	0.64	C	S	.	*			trans	-63.1	156	168.9	-70	-162.2	0	0	0	110.7	G203 Q204 S205 D206	G203-F277 VanDerWaalsContact N-CZ 3.28Å; Q204-F277 VanDerWaalsContact C-CB 3.41Å; Q204-F277 HydrophobicContact CB-CB 3.58Å; Q204-F277 HydrophobicContact CB-CD1 2.75Å; Q204-F277 HydrophobicContact CB-CD2 3.22Å; Q204-F277 HydrophobicContact CB-CE1 3.43Å; Q204-F277 VanDerWaalsContact CB-CE1 3.43Å; Q204-F277 HydrophobicContact CB-CE2 3.81Å; Q204-F277 HydrophobicContact CB-CG 2.66Å; Q204-F277 HydrophobicContact CB-CZ 3.92Å; Q204-F277 HydrophobicContact CG-CB 3.58Å; Q204-F277 HydrophobicContact CG-CD1 3.88Å; Q204-F277 HydrophobicContact CG-CD2 3.39Å; Q204-F277 HydrophobicContact CG-CE2 4.38Å; Q204-F277 HydrophobicContact CG-CG 3.1Å; Q204-F277 VanDerWaalsContact N-CD1 3.27Å; Q204-F277 WeakPolarHBondContact O-CD1 3.15Å; Q204-F277 WeakPolarHBondContact O-CD2 3.39Å; Q204-F277 WeakPolarHBondContact O-CE1 3.35Å; Q204-F277 WeakPolarHBondContact O-CG 3.42Å; Q204-F277 WeakPolarHBondContact O-CZ 3.35Å; Q204-F277 VanDerWaalsContact OE1-CA 3.24Å; S205-F277 PolarHBondContact O-N 3.05Å; D206-F277 HydrophobicContact CB-CB 4.31Å; D206-F277 WeakPolarHBondContact CB-O 3.29Å
278	T	28.3	Very low	29.9	Very low	68 Å²	68	136.5 Å²	136.5	42%	0.417	65%	0.649	S	S	.	*				-179.8	117.1	111	27.8	0	0	0	0	115.6	D206 S1654	D206-T278 HydrophobicContact CB-CG2 3.51Å; D206-T278 VanDerWaalsContact OD2-CG2 3.3Å; D206-T278 WeakPolarHBondContact OD2-CG2 3.3Å; D206-T278 PolarHBondContact OD2-OG1 3.4Å; T278-S1654 WeakPolarHBondContact CG2-OG 3.33Å
279	R	28	Very low	29.8	Very low	92 Å²	92	131.4 Å²	131.4	35%	0.347	66%	0.657	S	S	.	*				37.3	94.8	112.3	-66.3	-169.8	54.6	152	159.4	118.3	S1654 L1655 E1656	R279-S1654 VanDerWaalsContact NE-C 3.25Å; R279-S1654 PolarHBondContact NH1-O 3.32Å; R279-L1655 CarbonylContact C-O 3.53Å; R279-L1655 WeakPolarHBondContact CA-O 3.47Å; R279-L1655 VanDerWaalsContact CB-C 3.43Å; R279-L1655 VanDerWaalsContact CB-O 3.3Å; R279-L1655 WeakPolarHBondContact CB-O 3.33Å; R279-L1655 VanDerWaalsContact NE-N 3.2Å; R279-L1655 PolarHBondContact O-N 3.12Å; R279-L1655 VanDerWaalsContact O-N 3.07Å; R279-E1656 VanDerWaalsContact CD-OE1 3.3Å; R279-E1656 WeakPolarHBondContact CD-OE1 3.28Å; R279-E1656 WeakPolarHBondContact CD-OE2 3.43Å; R279-E1656 HydrophobicContact CG-CB 3.94Å; R279-E1656 VanDerWaalsContact CG-CD 3.46Å; R279-E1656 HydrophobicContact CG-CG 3.62Å; R279-E1656 VanDerWaalsContact CG-OE1 3.31Å; R279-E1656 WeakPolarHBondContact CG-OE1 3.5Å; R279-E1656 IonicContact CZ-OE2 3.78Å; R279-E1656 VanDerWaalsContact CZ-OE2 3.31Å; R279-E1656 IonicContact NE-OE2 3.05Å; R279-E1656 PolarHBondContact NE-OE2 2.94Å; R279-E1656 IonicContact NH2-OE2 2.98Å; R279-E1656 PolarHBondContact NH2-OE2 3.45Å
280	K	28	Very low	29.7	Very low	129 Å²	129	132.5 Å²	132.5	56%	0.561	66%	0.663	S	S	*	*			trans	-164.5	159.9	135	-81.5	-116.2	178.4	-163.2	0	113.4	N1653 L1655	K280-N1653 WeakPolarHBondContact CE-O 3.46Å; K280-N1653 PolarHBondContact NZ-O 3.49Å; K280-L1655 WeakPolarHBondContact CA-O 3.45Å; K280-L1655 HydrophobicContact CB-CB 4.49Å; K280-L1655 HydrophobicContact CD-CB 3.63Å; K280-L1655 HydrophobicContact CD-CD1 4.4Å; K280-L1655 HydrophobicContact CG-CB 3.76Å; K280-L1655 PolarHBondContact N-O 2.86Å
281	H	27.3	Very low	29.7	Very low	106 Å²	106	129.4 Å²	129.4	49%	0.491	66%	0.663	S	S	.	*			trans	-66	142.4	-179.6	-64.1	-64.5	0	0	0	114.9	L1655	H281-L1655 VanDerWaalsContact CD2-CD1 3.49Å; H281-L1655 WeakPolarHBondContact CD2-CD1 3.47Å; H281-L1655 WeakPolarHBondContact NE2-CD2 3.41Å
282	Q	33.1	Very low	29.8	Very low	171 Å²	171	130.7 Å²	130.7	80%	0.799	67%	0.669	S	S	*	*			trans	-176.2	124.6	133.3	-97.3	151.2	0.9	0	0	105.3
283	Y	26.6	Very low	29.8	Very low	204 Å²	204	125.5 Å²	125.5	80%	0.8	66%	0.658	S	S	*	*			cis	54.4	90.9	39.6	-94.1	-78.4	0	0	0	113
284	Y	30.5	Very low	29.7	Very low	206 Å²	206	131.5 Å²	131.5	81%	0.808	67%	0.666	S	S	*	*				-169.3	142.3	126	-97.4	-62.6	0	0	0	111.5
285	N	33.1	Very low	30	Very low	109 Å²	109	133 Å²	133	58%	0.583	67%	0.673	S	S	*	*			trans	31.1	142.6	153.3	-53.9	-5.7	0	0	0	121.3	V287	N285-V287 HydrophobicContact CB-CB 3.99Å; N285-V287 VanDerWaalsContact OD1-CB 3.23Å; N285-V287 WeakPolarHBondContact OD1-CB 3.48Å; N285-V287 WeakPolarHBondContact OD1-CG1 3.33Å; N285-V287 VanDerWaalsContact OD1-CG2 3.24Å; N285-V287 WeakPolarHBondContact OD1-CG2 3.42Å
286	T	27.8	Very low	30.1	Very low	140 Å²	140	126.8 Å²	126.8	86%	0.859	66%	0.662	S	S	*	*			cis	-89	139	9.8	49.5	0	0	0	0	113.9
287	V	31.3	Very low	30.2	Very low	96 Å²	96	131.8 Å²	131.8	58%	0.582	68%	0.682	S	S	*	*	S	Bend	cis	62	130.8	-4.2	-176.7	0	0	0	0	117.9	N285	N285-V287 HydrophobicContact CB-CB 3.99Å; N285-V287 VanDerWaalsContact OD1-CB 3.23Å; N285-V287 WeakPolarHBondContact OD1-CB 3.48Å; N285-V287 WeakPolarHBondContact OD1-CG1 3.33Å; N285-V287 VanDerWaalsContact OD1-CG2 3.24Å; N285-V287 WeakPolarHBondContact OD1-CG2 3.42Å
288	F	32.7	Very low	30	Very low	175 Å²	175	133.1 Å²	133.1	77%	0.768	70%	0.698	S	S	*	*			trans	-49.6	145.2	170.9	-77.2	-115.9	0	0	0	113.4	L290	F288-L290 HydrophobicContact CB-CB 4.45Å; F288-L290 PolarHBondContact O-N 3.47Å
289	G	27.6	Very low	30	Very low	88 Å²	88	133 Å²	133	91%	0.907	71%	0.711	S	S	*	*	S	Bend	trans	-73.5	41.8	161.9	0	0	0	0	0	114.1	D291	G289-D291 PolarHBondContact O-N 3.04Å
290	L	32.5	Very low	29.9	Very low	137 Å²	137	135 Å²	135	72%	0.717	73%	0.729	S	S	*	*			trans	-90.1	90.1	161.9	-85.9	174.8	0	0	0	107.2	F288 P292	F288-L290 HydrophobicContact CB-CB 4.45Å; F288-L290 PolarHBondContact O-N 3.47Å; L290-P292 WeakPolarHBondContact O-CD 3.26Å
291	D	33.2	Very low	29.8	Very low	151 Å²	151	136.2 Å²	136.2	81%	0.807	74%	0.736	S	S	*	*			trans	-64.4	108.4	-173.1	-154.2	-6.2	0	0	0	111	G289 S293	G289-D291 PolarHBondContact O-N 3.04Å; D291-S293 PolarHBondContact O-N 2.94Å
292	P	30.9	Very low	29.7	Very low	120 Å²	120	137.2 Å²	137.2	78%	0.779	75%	0.745	S	S	*	*			trans	-104.9	75.4	-162.6	37.6	-28.6	0	0	0	111.8	L290	L290-P292 WeakPolarHBondContact O-CD 3.26Å
293	S	28.2	Very low	29.5	Very low	96 Å²	96	135.1 Å²	135.1	67%	0.671	74%	0.739	S	S	*	*			trans	-124.6	109.4	171	65.8	0	0	0	0	111.9	D291 P295	D291-S293 PolarHBondContact O-N 2.94Å; S293-P295 WeakPolarHBondContact O-CD 3.45Å
294	W	27.5	Very low	29.7	Very low	223 Å²	223	129.8 Å²	129.8	85%	0.845	73%	0.727	S	S	*	*			trans	-62.8	128.7	170.1	-64.6	-4.1	0	0	0	110.7	T296	W294-T296 PolarHBondContact O-N 3.04Å
295	P	34.6	Very low	29.7	Very low	122 Å²	122	127 Å²	127	79%	0.792	73%	0.725	S	S	*	*			trans	-67.3	106.6	140.8	30.1	-28.1	0	0	0	106.4	S293 L297	S293-P295 WeakPolarHBondContact O-CD 3.45Å; P295-L297 PolarHBondContact O-N 3.05Å; P295-L297 VanDerWaalsContact O-N 3.09Å
296	T	30.8	Very low	29.6	Very low	104 Å²	104	126.8 Å²	126.8	64%	0.638	72%	0.724	S	S	*	*			trans	-33.4	108.4	-177.9	35.4	0	0	0	0	115	W294 S298	W294-T296 PolarHBondContact O-N 3.04Å; T296-S298 WeakPolarHBondContact CB-OG 3.46Å; T296-S298 PolarHBondContact O-N 2.91Å
297	L	30.2	Very low	29.9	Very low	179 Å²	179	126.6 Å²	126.6	94%	0.937	72%	0.718	S	S	*	*			trans	-71.4	65.3	152.2	-99.8	168.6	0	0	0	108.9	P295	P295-L297 PolarHBondContact O-N 3.05Å; P295-L297 VanDerWaalsContact O-N 3.09Å
298	S	28.9	Very low	29.9	Very low	79 Å²	79	131.7 Å²	131.7	55%	0.552	73%	0.728	S	S	*	*			trans	-128.3	116.3	175.6	70.4	0	0	0	0	110.3	T296	T296-S298 WeakPolarHBondContact CB-OG 3.46Å; T296-S298 PolarHBondContact O-N 2.91Å
299	G	27.2	Very low	29.8	Very low	67 Å²	67	128.8 Å²	128.8	69%	0.691	73%	0.729	S	S	*	*			trans	20.5	105.4	162.2	0	0	0	0	0	118.1
300	N	25.9	Very low	29.9	Very low	134 Å²	134	127.9 Å²	127.9	72%	0.717	72%	0.719	S	S	*	*				-158.4	126.7	100.9	-92.9	-18.9	0	0	0	109.2
301	Q	25.7	Very low	29.7	Very low	153 Å²	153	127.6 Å²	127.6	72%	0.715	72%	0.723	S	S	*	*				68.1	132.3	95.4	-72	-173.5	53.8	0	0	112.5
302	L	26.7	Very low	29.6	Very low	128 Å²	128	129.8 Å²	129.8	67%	0.67	73%	0.726	S	S	*	*			cis	-142.6	134.8	5.2	-93.9	137.4	0	0	0	106.5
303	N	27.5	Very low	29.5	Very low	126 Å²	126	130.1 Å²	130.1	67%	0.674	73%	0.729	S	S	*	*				78.9	157.5	72.2	-169.8	27.5	0	0	0	113
304	V	30.5	Very low	29.7	Very low	92 Å²	92	133.8 Å²	133.8	56%	0.558	74%	0.736	S	S	*	*			trans	59.9	149.6	178.8	-99.2	0	0	0	0	114.4	N306	V304-N306 WeakPolarHBondContact CG1-OD1 3.01Å
305	I	32.1	Very low	29.8	Very low	149 Å²	149	130.7 Å²	130.7	76%	0.764	73%	0.734	S	S	*	*			cis	-136.8	148.8	12.3	-59.8	-78.7	0	0	0	107
306	N	30.9	Very low	29.6	Very low	103 Å²	103	131 Å²	131	55%	0.551	73%	0.729	S	S	*	*			cis	-176	172.1	-31.4	-95.4	-13.4	0	0	0	108.1	V304	V304-N306 WeakPolarHBondContact CG1-OD1 3.01Å
307	N	34.1	Very low	29.6	Very low	137 Å²	137	133.6 Å²	133.6	73%	0.733	73%	0.734	S	S	*	*			trans	76.7	148.5	154.7	-63.8	-12.4	0	0	0	120.1
308	Y	30.4	Very low	29.8	Very low	203 Å²	203	130.8 Å²	130.8	80%	0.796	73%	0.725	S	S	*	*			cis	-179	142.9	-31.1	-134.9	-91.2	0	0	0	107.5
309	S	30.1	Very low	29.8	Very low	114 Å²	114	131.1 Å²	131.1	80%	0.797	73%	0.727	S	S	*	*			trans	54.9	134.6	162.5	58.3	0	0	0	0	119.8
310	G	30.3	Very low	30	Very low	68 Å²	68	135.5 Å²	135.5	70%	0.701	73%	0.729	S	S	*	*			cis	136.4	176.6	2.4	0	0	0	0	0	112.1
311	V	27.1	Very low	30.2	Very low	132 Å²	132	138.1 Å²	138.1	80%	0.8	73%	0.73	S	S	*	*			trans	70	113.6	164.9	-171.3	0	0	0	0	114.4
312	K	32.8	Very low	30.5	Very low	197 Å²	197	138.7 Å²	138.7	86%	0.857	73%	0.733	S	S	*	*				-175.5	156.9	58.7	-141.1	162	-162.4	175	0	112.3
313	C	28.3	Very low	30.7	Very low	127 Å²	127	138.4 Å²	138.4	86%	0.858	73%	0.732	S	S	*	*			trans	-99.9	157.5	168.5	-45.1	0	0	0	0	112.2
314	Q	32.6	Very low	30.9	Very low	172 Å²	172	139.3 Å²	139.3	80%	0.804	74%	0.736	S	S	*	*			trans	-153	147.9	151.9	-171	163.1	-11.1	0	0	111	D316	Q314-D316 PolarHBondContact NE2-OD2 3.2Å
315	I	29.8	Very low	30.9	Very low	158 Å²	158	141.7 Å²	141.7	81%	0.81	75%	0.745	S	S	*	*			trans	-125	145.2	172.4	-64	169.4	0	0	0	106.6
316	D	30.1	Very low	30.8	Very low	128 Å²	128	140.5 Å²	140.5	68%	0.684	74%	0.736	S	S	*	*			trans	-179.5	158.7	157.7	-81.8	-38.7	0	0	0	107.7	Q314	Q314-D316 PolarHBondContact NE2-OD2 3.2Å
317	E	30.8	Very low	30.9	Very low	159 Å²	159	142 Å²	142	74%	0.743	74%	0.737	S	S	*	*			cis	-170.1	167	-40.9	-153.2	-172.7	-137.4	0	0	107.7
318	T	33.4	Very low	30.8	Very low	121 Å²	121	145.3 Å²	145.3	74%	0.742	74%	0.74	S	S	*	*			trans	71.3	162.7	165.1	76.5	0	0	0	0	120.2
319	S	30.4	Very low	30.8	Very low	85 Å²	85	139.5 Å²	139.5	59%	0.594	73%	0.729	S	S	*	*			cis	-179.1	169.7	-45.8	63	0	0	0	0	111.9
320	H	31.6	Very low	30.8	Very low	160 Å²	160	142 Å²	142	74%	0.741	73%	0.725	S	S	*	*			trans	74.6	150.2	158.5	-73.2	-55.6	0	0	0	120.6
321	Y	29.5	Very low	30.8	Very low	189 Å²	189	145.2 Å²	145.2	74%	0.741	72%	0.722	S	S	*	*			cis	-174.3	171.2	-27.7	-140.3	-124.6	0	0	0	110.6
322	E	32.5	Very low	31	Very low	164 Å²	164	145.4 Å²	145.4	77%	0.766	72%	0.719	S	S	*	*			trans	68.6	160.9	163.7	-60.5	-146.3	142.8	0	0	121.1
323	N	30.1	Very low	30.8	Very low	123 Å²	123	141.5 Å²	141.5	66%	0.658	71%	0.711	S	S	*	*			cis	-173.2	179.8	-47.3	-137	-41.3	0	0	0	109.8
324	L	31.7	Very low	30.8	Very low	144 Å²	144	144.8 Å²	144.8	75%	0.754	71%	0.714	S	S	*	*			trans	87.1	113.7	176	-58.9	134.9	0	0	0	114.9
325	L	30	Very low	30.6	Very low	143 Å²	143	142.9 Å²	142.9	75%	0.749	71%	0.708	S	S	*	*				64.4	126.7	67.4	-62.7	160.3	0	0	0	111.1
326	E	30.6	Very low	30.4	Very low	124 Å²	124	143 Å²	143	58%	0.579	71%	0.71	S	S	*	*			cis	-158.4	176.7	16.7	-119.4	-176.8	128.5	0	0	106.6
327	K	33.4	Very low	30.5	Very low	133 Å²	133	141.8 Å²	141.8	58%	0.578	71%	0.709	S	S	*	*			cis	-170.5	136.7	27.2	-136.6	150	-176	132.2	0	109.1
328	R	30.7	Very low	30.4	Very low	207 Å²	207	142.1 Å²	142.1	78%	0.781	71%	0.714	S	S	*	*			trans	51.5	145.5	138.3	-64.9	-180	-165.9	176.8	1.5	121.9
329	S	30.5	Very low	30.1	Very low	82 Å²	82	146.5 Å²	146.5	57%	0.573	72%	0.719	S	S	*	*			cis	176.5	166.3	-12.2	60.8	0	0	0	0	111.2
330	K	31.2	Very low	30	Very low	165 Å²	165	151.7 Å²	151.7	72%	0.717	73%	0.731	S	S	*	*			trans	71.9	152.6	154.4	-66.3	174.5	171.1	-129.8	0	115.8
331	H	30.4	Very low	29.8	Very low	136 Å²	136	148.2 Å²	148.2	63%	0.63	73%	0.73	S	S	*	*			cis	-158.2	158.1	-12.9	-95.8	-46.1	0	0	0	104.1
332	N	30.9	Very low	29.6	Very low	137 Å²	137	145.2 Å²	145.2	73%	0.733	74%	0.736	S	S	*	*			cis	-152.2	161.1	0.1	-126	-0	0	0	0	109.8
333	V	27.5	Very low	29.4	Very low	115 Å²	115	146.2 Å²	146.2	70%	0.697	74%	0.741	S	S	*	*			trans	-83.1	139.4	167.5	176.2	0	0	0	0	109.3	I335	V333-I335 HydrophobicContact CG1-CD1 4.24Å; V333-I335 HydrophobicContact CG1-CG1 4.18Å
334	E	29.1	Very low	29.1	Very low	195 Å²	195	149 Å²	149	91%	0.911	75%	0.752	S	S	*	*			trans	-149.4	126.3	142.9	-149.2	150.9	-139.5	0	0	109.3
335	I	27.8	Very low	29	Very low	133 Å²	133	148 Å²	148	68%	0.682	76%	0.756	S	S	*	*			trans	-122.5	134.8	179.6	-65	166.2	0	0	0	105.6	V333	V333-I335 HydrophobicContact CG1-CD1 4.24Å; V333-I335 HydrophobicContact CG1-CG1 4.18Å
336	D	26.8	Very low	28.9	Very low	159 Å²	159	147.8 Å²	147.8	85%	0.85	75%	0.754	S	S	*	*			trans	-167.4	155.2	137.9	-104.8	-12.6	0	0	0	113.1
337	P	31.6	Very low	29	Very low	103 Å²	103	147.7 Å²	147.7	67%	0.669	76%	0.764	S	S	*	*			trans	-123.4	138.2	-159.9	38.2	-23	0	0	0	115.2
338	I	27.8	Very low	28.8	Very low	167 Å²	167	145.6 Å²	145.6	86%	0.856	76%	0.757	S	S	*	*			trans	-135.7	104.9	170.5	-56	-177.2	0	0	0	112.8
339	Y	27.1	Very low	28.9	Very low	213 Å²	213	143.2 Å²	143.2	84%	0.835	75%	0.752	S	S	*	*			trans	14.8	114	138.6	-80.3	-93.3	0	0	0	119.3
340	K	28.8	Very low	29	Very low	194 Å²	194	142.8 Å²	142.8	84%	0.843	74%	0.741	S	S	*	*				171.7	159.3	103.7	-101.9	160.5	-177.1	169	0	116.1
341	A	28.4	Very low	28.9	Very low	87 Å²	87	139.4 Å²	139.4	72%	0.719	74%	0.738	S	S	*	*			trans	63.2	100	149.5	0	0	0	0	0	118.5	Q343	A341-Q343 PolarHBondContact O-N 3.07Å
342	S	24.4	Very low	28.9	Very low	126 Å²	126	141.9 Å²	141.9	88%	0.881	75%	0.747	S	S	*	*			trans	-57.1	126.6	156.9	35.9	0	0	0	0	112
343	Q	28.3	Very low	28.9	Very low	184 Å²	184	142.4 Å²	142.4	86%	0.86	75%	0.748	S	S	*	*			trans	-136.1	137.5	163.5	-88.2	-171	4.9	0	0	111.6	A341	A341-Q343 PolarHBondContact O-N 3.07Å
344	M	25.2	Very low	29	Very low	182 Å²	182	146.5 Å²	146.5	90%	0.897	76%	0.756	S	S	*	*			trans	-97.9	113	-172.9	176.6	-175.4	176.3	0	0	109.4
345	C	28.4	Very low	29	Very low	122 Å²	122	142.2 Å²	142.2	82%	0.824	75%	0.748	S	S	*	*			trans	-88.5	145.5	-175.6	-74.6	0	0	0	0	113.2
346	I	27.7	Very low	28.9	Very low	139 Å²	139	141.1 Å²	141.1	71%	0.713	75%	0.751	S	S	*	*			trans	-117.2	125.7	-173.9	-60.3	167	0	0	0	109.4
347	P	32.5	Very low	29	Very low	123 Å²	123	142.8 Å²	142.8	80%	0.799	75%	0.754	S	S	*	*			trans	-83	143.2	166.5	33.2	-31.7	0	0	0	111.4
348	Q	29.3	Very low	28.7	Very low	89 Å²	89	146.6 Å²	146.6	42%	0.416	76%	0.76	S	S	.	*			trans	-127.4	140.5	175	-65.9	173.2	-9.3	0	0	110.4	C419	Q348-C419 PolarHBondContact NE2-O 3.33Å; Q348-C419 PolarHBondContact OE1-O 2.91Å
349	K	33.1	Very low	28.9	Very low	157 Å²	157	146.4 Å²	146.4	68%	0.683	76%	0.76	S	S	*	*			trans	-136.7	146	151.3	-78.2	-170.3	172.8	-178.3	0	108.1	H416	K349-H416 VanDerWaalsContact CE-CE1 3.5Å; K349-H416 WeakPolarHBondContact CE-CE1 3.34Å; K349-H416 VanDerWaalsContact CE-NE2 3.28Å; K349-H416 WeakPolarHBondContact CE-NE2 3.41Å; K349-H416 PolarHBondContact NZ-CE1 3Å; K349-H416 PolarHBondContact NZ-NE2 3.5Å; K349-H416 VanDerWaalsContact NZ-NE2 3.18Å
350	Q	33.1	Very low	29	Very low	72 Å²	72	142.2 Å²	142.2	34%	0.336	75%	0.752	S	S	.	*	P	Polyproline II helix	trans	-102.5	166.2	-171.6	-64.5	165.5	1.1	0	0	112.3	H417 I418 C419	Q350-H417 HydrophobicContact CB-CB 4.01Å; Q350-H417 HydrophobicContact CG-CB 3.74Å; Q350-H417 PolarHBondContact OE1-ND1 3.17Å; Q350-I418 PolarHBondContact NE2-O 3.26Å; Q350-C419 PolarHBondContact NE2-SG 2.84Å
351	S	28.8	Very low	29	Very low	95 Å²	95	142.2 Å²	142.2	66%	0.664	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-71.5	136.3	172.6	51.5	0	0	0	0	113.3
352	K	30.8	Very low	28.9	Very low	188 Å²	188	142.5 Å²	142.5	82%	0.817	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-83.6	121.5	147.9	-94.7	178.7	177.1	167.8	0	108.3
353	I	30	Very low	29.1	Very low	148 Å²	148	144 Å²	144	76%	0.759	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-81.5	121	171.7	-62.5	168.7	0	0	0	107.7
354	K	30.1	Very low	29.2	Very low	200 Å²	200	143.5 Å²	143.5	87%	0.87	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-94	138.7	145.2	-90	-168.6	171.2	-173.3	0	107.2
355	S	28.7	Very low	29.3	Very low	106 Å²	106	143.3 Å²	143.3	74%	0.741	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-66.2	131.9	-173.1	39.6	0	0	0	0	111.9
356	C	26.4	Very low	29.2	Very low	109 Å²	109	142 Å²	142	74%	0.736	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-79.9	130	155.4	-59.5	0	0	0	0	107.7	F358	C356-F358 HydrophobicContact CB-CD2 4.28Å
357	E	28.2	Very low	29.2	Very low	195 Å²	195	143.7 Å²	143.7	91%	0.911	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-88.9	128.3	153.4	-69.4	-171.7	149.6	0	0	107.9
358	F	25.7	Very low	28.9	Very low	183 Å²	183	144.4 Å²	144.4	80%	0.803	74%	0.735	S	S	*	*			trans	-133.6	169	177.5	-117.1	-84.3	0	0	0	106.4	C356	C356-F358 HydrophobicContact CB-CD2 4.28Å
359	L	31.2	Very low	28.9	Very low	162 Å²	162	145.2 Å²	145.2	85%	0.848	75%	0.75	S	S	*	*			trans	85.8	104.3	-165.6	-51.6	166.8	0	0	0	110.1
360	N	29.2	Very low	28.7	Very low	125 Å²	125	144 Å²	144	67%	0.668	75%	0.751	S	S	*	*			cis	59.5	87.6	23.5	-177.5	43.6	0	0	0	114.6
361	E	29.1	Very low	28.5	Very low	194 Å²	194	150.1 Å²	150.1	91%	0.907	77%	0.771	S	S	*	*			trans	-123	128.2	139.2	-74.9	-156.6	145.7	0	0	109.8
362	S	26.9	Very low	28.6	Very low	94 Å²	94	151.3 Å²	151.3	66%	0.657	77%	0.769	S	S	*	*			trans	-123.2	152.5	165.3	-69	0	0	0	0	108.2
363	I	29.2	Very low	28.5	Very low	158 Å²	158	149 Å²	149	81%	0.81	77%	0.766	S	S	*	*			trans	75.1	105.1	171.1	-47.7	157.4	0	0	0	115.4
364	L	30.1	Very low	28.5	Very low	172 Å²	172	151.1 Å²	151.1	90%	0.901	77%	0.769	S	S	*	*				-156.1	129.4	118.4	-120.1	152.3	0	0	0	112.9
365	F	27	Very low	28.5	Very low	178 Å²	178	146.8 Å²	146.8	78%	0.781	76%	0.764	S	S	*	*			trans	-116.9	118.8	-174.5	-140.6	-82	0	0	0	108.8
366	C	25.9	Very low	28.8	Very low	95 Å²	95	148.7 Å²	148.7	64%	0.642	77%	0.771	S	S	*	*			trans	171	122.6	131.4	-93.2	0	0	0	0	115.3
367	K	27.8	Very low	29	Very low	175 Å²	175	146.8 Å²	146.8	76%	0.761	77%	0.77	S	S	*	*			trans	13.2	125.3	131	-59.5	170.6	-179.4	172.4	0	117.6
368	L	26.9	Very low	29.2	Very low	138 Å²	138	144.8 Å²	144.8	72%	0.723	76%	0.764	S	S	*	*				-148	127.1	103.4	-141.5	76.5	0	0	0	111.9
369	S	28.5	Very low	29.5	Very low	106 Å²	106	143.6 Å²	143.6	74%	0.741	77%	0.765	S	S	*	*			trans	-105.7	133.7	172	176.3	0	0	0	0	110.1
370	N	29	Very low	29.6	Very low	131 Å²	131	141.8 Å²	141.8	70%	0.701	76%	0.756	S	S	*	*			trans	-154.9	144	156.2	-87.6	-53	0	0	0	107.2
371	R	29.2	Very low	29.8	Very low	200 Å²	200	143 Å²	143	76%	0.755	76%	0.762	S	S	*	*			cis	164.8	149	-19.9	-123.2	-176.2	170.7	-161.7	-1.6	103.9
372	I	29.8	Very low	30.1	Very low	121 Å²	121	136.8 Å²	136.8	62%	0.621	75%	0.751	S	S	*	*			trans	80.9	87.7	151.8	-63	164.1	0	0	0	117.5
373	N	29.4	Very low	30.3	Very low	139 Å²	139	137.3 Å²	137.3	74%	0.743	75%	0.754	S	S	*	*				72.9	157.7	116.9	-55.7	-3.4	0	0	0	122.4
374	K	30.5	Very low	30.5	Very low	192 Å²	192	137.1 Å²	137.1	84%	0.835	75%	0.75	S	S	*	*			trans	83.2	93.3	165.7	-57.3	-172.7	-179.6	-176.9	0	114.7
375	S	29.5	Very low	30.8	Very low	109 Å²	109	138.3 Å²	138.3	76%	0.762	74%	0.744	S	S	*	*				85.8	109	64.6	70.3	0	0	0	0	113.2
376	T	34.8	Very low	31.1	Very low	146 Å²	146	133.7 Å²	133.7	90%	0.896	73%	0.733	S	S	*	*			trans	-130.6	110.1	171.3	36.5	0	0	0	0	108.7
377	G	31.4	Very low	31.5	Very low	69 Å²	69	136 Å²	136	71%	0.711	74%	0.739	S	S	*	*			trans	-86.6	140.9	171.6	0	0	0	0	0	111.4
378	I	31.5	Very low	31.8	Very low	154 Å²	154	133.4 Å²	133.4	79%	0.79	74%	0.738	S	S	*	*			trans	21.2	121.3	133.2	-31.5	176.2	0	0	0	116.4
379	I	33.4	Very low	32.2	Very low	158 Å²	158	133.6 Å²	133.6	81%	0.81	74%	0.738	S	S	*	*				-174.9	146.9	117.6	-93.4	156.5	0	0	0	111.1
380	N	32	Very low	32.5	Very low	124 Å²	124	134.2 Å²	134.2	66%	0.663	74%	0.738	S	S	*	*			trans	-54.6	168.5	177	-40.5	-22.6	0	0	0	112.3
381	D	33.6	Very low	33.1	Very low	150 Å²	150	132.6 Å²	132.6	80%	0.802	74%	0.735	S	S	*	*				-179	168.2	62.1	-110.9	-42	0	0	0	111.7
382	G	35.1	Very low	33.1	Very low	64 Å²	64	129.5 Å²	129.5	66%	0.66	73%	0.733	S	S	*	*			trans	75.7	125.5	158.1	0	0	0	0	0	117
383	S	32.4	Very low	33.3	Very low	104 Å²	104	131.6 Å²	131.6	73%	0.727	74%	0.74	S	S	*	*			cis	127.6	128.4	9.2	58.3	0	0	0	0	109.6
384	E	33.2	Very low	33.4	Very low	154 Å²	154	130.6 Å²	130.6	72%	0.72	74%	0.739	S	S	*	*			trans	84.8	142	139.8	-76.7	-178.7	174.7	0	0	124
385	Y	35.2	Very low	33.4	Very low	197 Å²	197	128.4 Å²	128.4	77%	0.773	73%	0.733	S	S	*	*			trans	56.5	146.4	163.3	-59.2	-67.5	0	0	0	121.7
386	S	33.5	Very low	33.5	Very low	81 Å²	81	130.6 Å²	130.6	57%	0.566	73%	0.729	S	S	*	*			cis	-173.9	163.1	-40	54.4	0	0	0	0	111.2
387	N	34.1	Very low	33.4	Very low	144 Å²	144	133.4 Å²	133.4	77%	0.77	73%	0.725	S	S	*	*			trans	69.8	127.8	142.8	-74.7	-27.3	0	0	0	121.6
388	V	34.3	Very low	33.3	Very low	121 Å²	121	134.7 Å²	134.7	73%	0.733	72%	0.722	S	S	*	*				132.2	120.3	106.6	129.6	0	0	0	0	118.9
389	I	35.1	Very low	33.4	Very low	141 Å²	141	135.4 Å²	135.4	72%	0.723	72%	0.722	S	S	*	*			trans	75	99.1	147.6	-64.7	169.5	0	0	0	122.2
390	T	35.2	Very low	33.3	Very low	120 Å²	120	139.2 Å²	139.2	74%	0.736	73%	0.726	S	S	*	*				0.2	175.3	120.1	41.6	0	0	0	0	122.2
391	P	41	Very low	33.2	Very low	97 Å²	97	142.8 Å²	142.8	63%	0.63	74%	0.736	S	S	*	*			cis	-142.4	-170.9	-36	40.1	-21.5	0	0	0	115.4
392	N	30.2	Very low	33.1	Very low	135 Å²	135	144.1 Å²	144.1	72%	0.722	74%	0.741	S	S	*	*			trans	82.3	155.1	143.7	-75.9	-7.2	0	0	0	124.4
393	H	33.9	Very low	32.9	Very low	164 Å²	164	149.9 Å²	149.9	76%	0.759	75%	0.748	S	S	*	*			trans	96.2	82.5	154.8	-73.9	-55.3	0	0	0	123.6
394	T	31.3	Very low	32.7	Very low	119 Å²	119	152.9 Å²	152.9	73%	0.73	76%	0.755	S	S	*	*				29.2	134	120.9	-5.7	0	0	0	0	122.7
395	M	31	Very low	32.6	Very low	146 Å²	146	150.5 Å²	150.5	72%	0.719	76%	0.755	S	S	*	*				132.5	142.6	110.8	-129.7	-168	-173.1	0	0	118.6
396	K	30.9	Very low	32.7	Very low	154 Å²	154	146.1 Å²	146.1	67%	0.67	75%	0.751	S	S	*	*			trans	85	100.3	141.7	-94.3	170.1	-178.4	162.7	0	123.6
397	Y	33	Very low	32.4	Very low	206 Å²	206	149.6 Å²	149.6	81%	0.808	76%	0.763	S	S	*	*				112.9	150.8	97.3	-115.3	-129.3	0	0	0	122.8
398	C	30.3	Very low	32.2	Very low	96 Å²	96	152.5 Å²	152.5	65%	0.649	77%	0.769	S	S	*	*			trans	57.6	121.7	170.5	-71.9	0	0	0	0	118.8
399	Q	32.1	Very low	31.9	Very low	169 Å²	169	154.8 Å²	154.8	79%	0.79	77%	0.771	S	S	*	*				67.8	128.7	53.3	-63.2	-167.4	3.1	0	0	113.7
400	R	31.4	Very low	31.6	Very low	238 Å²	238	157.5 Å²	157.5	90%	0.898	78%	0.778	S	S	*	*				-150	170.2	57.5	-81.1	179.3	171.1	171.1	-2.9	114.6
401	K	30.8	Very low	31.2	Very low	199 Å²	199	158.5 Å²	158.5	87%	0.865	78%	0.777	S	S	*	*			trans	-93.2	154.7	175.3	-58.2	173.7	178.8	175.2	0	111.9
402	I	31.5	Very low	30.6	Very low	177 Å²	177	163.4 Å²	163.4	91%	0.908	79%	0.789	S	S	*	*			trans	-129.8	151.2	138.8	-62.7	-175.3	0	0	0	107.3
403	K	29.9	Very low	30.5	Very low	186 Å²	186	166.3 Å²	166.3	81%	0.809	80%	0.795	S	S	*	*			trans	-141.8	-177.1	-178.8	-154.5	-171.6	-178.4	-168.7	0	107.7
404	L	29.6	Very low	30.4	Very low	167 Å²	167	166 Å²	166	87%	0.874	79%	0.794	S	S	*	*			trans	92.9	145.1	-178.1	-58.8	166.6	0	0	0	113.5
405	S	29.7	Very low	30.5	Very low	103 Å²	103	165.3 Å²	165.3	72%	0.72	79%	0.792	S	S	*	*			cis	-162.2	153.1	-20.1	-152.5	0	0	0	0	109.1
406	P	37	Very low	30.4	Very low	105 Å²	105	163.2 Å²	163.2	68%	0.682	78%	0.78	S	S	*	*			trans	-89.4	157.2	179.3	35.9	-35.4	0	0	0	113.7
407	N	28.2	Very low	30.2	Very low	155 Å²	155	159.7 Å²	159.7	83%	0.829	77%	0.766	S	S	*	*			trans	167.9	126	130.5	-90.7	-9.5	0	0	0	113
408	K	30.6	Very low	30	Very low	204 Å²	204	156.5 Å²	156.5	89%	0.887	76%	0.761	S	S	*	*			trans	-178.8	125.5	136.9	-104.4	169	-177.3	-178.2	0	110.9
409	H	27.1	Very low	30	Very low	170 Å²	170	155.3 Å²	155.3	79%	0.787	75%	0.753	S	S	*	*			trans	-75.1	149.9	168.8	-70.9	-76.6	0	0	0	111.1
410	F	29.1	Very low	29.9	Very low	198 Å²	198	155.2 Å²	155.2	87%	0.868	76%	0.757	S	S	*	*			trans	-145.9	138.6	141.7	-93	-73.2	0	0	0	109.3
411	I	26.4	Very low	29.9	Very low	140 Å²	140	148.4 Å²	148.4	72%	0.718	75%	0.745	S	S	*	*			trans	-117.4	133	178	-60.8	168.9	0	0	0	107
412	F	29.2	Very low	29.7	Very low	200 Å²	200	144.5 Å²	144.5	88%	0.877	74%	0.743	S	S	*	*			trans	-145.5	155.1	162.5	-102.9	-77.3	0	0	0	111.9
413	K	27.4	Very low	29.7	Very low	196 Å²	196	145.3 Å²	145.3	85%	0.852	74%	0.74	S	S	*	*			trans	-95	171.1	-167	-62.3	-177.3	177.3	-176.3	0	113.1
414	E	31.7	Very low	29.8	Very low	158 Å²	158	146 Å²	146	74%	0.738	74%	0.743	S	S	*	*			trans	-37.7	160.2	159	-72.3	-161.4	150.9	0	0	114.3
415	P	34.5	Very low	29.8	Very low	104 Å²	104	146 Å²	146	68%	0.675	74%	0.743	S	S	*	*				-161.6	-177.2	51	46.1	-23.1	0	0	0	121.4
416	H	28.4	Very low	29.9	Very low	103 Å²	103	149.1 Å²	149.1	48%	0.477	75%	0.75	S	S	.	*			trans	44.5	92.5	145.1	-58	-9.1	0	0	0	121.9	K349	K349-H416 VanDerWaalsContact CE-CE1 3.5Å; K349-H416 WeakPolarHBondContact CE-CE1 3.34Å; K349-H416 VanDerWaalsContact CE-NE2 3.28Å; K349-H416 WeakPolarHBondContact CE-NE2 3.41Å; K349-H416 PolarHBondContact NZ-CE1 3Å; K349-H416 PolarHBondContact NZ-NE2 3.5Å; K349-H416 VanDerWaalsContact NZ-NE2 3.18Å
417	H	26.6	Very low	29.5	Very low	79 Å²	79	153.5 Å²	153.5	37%	0.366	76%	0.758	S	S	.	*				35.4	106.1	106.2	-59.4	-40.1	0	0	0	120.3	Q350	Q350-H417 HydrophobicContact CB-CB 4.01Å; Q350-H417 HydrophobicContact CG-CB 3.74Å; Q350-H417 PolarHBondContact OE1-ND1 3.17Å
418	I	29	Very low	29.5	Very low	139 Å²	139	154 Å²	154	71%	0.713	76%	0.76	S	S	*	*			trans	-132.5	140.4	159.2	-61.6	177.8	0	0	0	110.7	Q350	Q350-I418 PolarHBondContact NE2-O 3.26Å
419	C	29.1	Very low	29.6	Very low	72 Å²	72	154.4 Å²	154.4	49%	0.486	76%	0.762	S	S	.	*			trans	-121.1	152.7	177.1	-95.4	0	0	0	0	111.4	Q348 Q350	Q348-C419 PolarHBondContact NE2-O 3.33Å; Q348-C419 PolarHBondContact OE1-O 2.91Å; Q350-C419 PolarHBondContact NE2-SG 2.84Å
420	I	30.8	Very low	29.8	Very low	167 Å²	167	156 Å²	156	86%	0.856	77%	0.767	S	S	*	*			trans	-128.9	144.4	-174.1	-61.6	179.8	0	0	0	111.5
421	S	31.1	Very low	29.9	Very low	95 Å²	95	156.3 Å²	156.3	66%	0.664	77%	0.768	S	S	*	*			trans	-74.2	144.9	-171.5	-175.4	0	0	0	0	115.1	K423	S421-K423 VanDerWaalsContact C-N 3.29Å; S421-K423 PolarHBondContact O-N 3.47Å; S421-K423 VanDerWaalsContact O-N 3.13Å
422	S	27.5	Very low	30.1	Very low	117 Å²	117	159.2 Å²	159.2	82%	0.818	78%	0.775	S	S	*	*	S	Bend	trans	-75.1	8.9	-171	52	0	0	0	0	117	K424	S422-K424 PolarHBondContact O-N 3.36Å
423	K	30.8	Very low	30.3	Very low	193 Å²	193	161.6 Å²	161.6	84%	0.839	78%	0.779	S	S	*	*	S	Bend	trans	-81.9	10.1	-173.3	-79.3	-171.4	173.6	178.7	0	116.8	S421	S421-K423 VanDerWaalsContact C-N 3.29Å; S421-K423 PolarHBondContact O-N 3.47Å; S421-K423 VanDerWaalsContact O-N 3.13Å
424	K	31.7	Very low	30.6	Very low	200 Å²	200	161.7 Å²	161.7	87%	0.87	78%	0.779	S	S	*	*			trans	-143.8	73.8	178.9	-72.4	-175.3	178.9	172.7	0	114.3	S422	S422-K424 PolarHBondContact O-N 3.36Å
425	L	30.8	Very low	30.6	Very low	167 Å²	167	162.5 Å²	162.5	87%	0.874	78%	0.78	S	S	*	*			trans	-144.6	26.4	170.5	-122.8	167.6	0	0	0	116.4
426	I	31.4	Very low	30.6	Very low	169 Å²	169	165.1 Å²	165.1	87%	0.867	79%	0.788	S	S	*	*			trans	-112.6	83.6	168.5	-54	179.6	0	0	0	110
427	K	29	Very low	30.7	Very low	198 Å²	198	165.7 Å²	165.7	86%	0.861	80%	0.799	S	S	*	*			trans	168.3	101.8	159.5	-98.3	159.8	-177	173.8	0	109.4
428	L	27.6	Very low	31	Very low	165 Å²	165	171.3 Å²	171.3	86%	0.864	83%	0.825	S	S	*	*			trans	173.2	55.4	142.5	-97.6	164.1	0	0	0	114.9
429	F	32.8	Very low	31.1	Very low	213 Å²	213	169.6 Å²	169.6	93%	0.934	83%	0.826	S	S	*	*			trans	-139.1	93.2	152.4	-85.4	-67.7	0	0	0	110.8
430	K	31.6	Very low	31.2	Very low	204 Å²	204	172.6 Å²	172.6	89%	0.887	84%	0.842	S	S	*	*			trans	-107.4	117.7	163.1	-91.5	-174	174.1	179.7	0	107.8
431	F	31.3	Very low	31.2	Very low	204 Å²	204	170 Å²	170	90%	0.895	84%	0.837	S	S	*	*			trans	-127.7	136.5	159	-109.7	-88.8	0	0	0	111
432	K	30.6	Very low	31.3	Very low	200 Å²	200	172.6 Å²	172.6	87%	0.87	84%	0.839	S	S	*	*	P	Polyproline II helix	trans	-77.5	133.3	-178	-63.3	173.1	179.3	174.2	0	109.4
433	R	32.3	Very low	31.6	Very low	251 Å²	251	175.1 Å²	175.1	95%	0.947	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-95.7	129.4	148.4	-75.3	-173.1	174.6	175.2	-0.5	108.4
434	K	33.5	Very low	31.7	Very low	197 Å²	197	175.1 Å²	175.1	86%	0.857	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-75.1	151	167.2	-96.7	-170.8	171.2	-169.6	0	108.9
435	K	31.8	Very low	31.8	Very low	176 Å²	176	168.9 Å²	168.9	77%	0.765	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-67.2	152.9	153.5	-70.6	-176.2	172.1	-174	0	108.6
436	D	34.3	Very low	31.7	Very low	158 Å²	158	167.7 Å²	167.7	85%	0.845	83%	0.827	S	S	*	*				-158.5	161.4	105.1	-81.6	-32	0	0	0	109.1
437	T	30.5	Very low	31.7	Very low	115 Å²	115	168 Å²	168	71%	0.706	83%	0.825	S	S	*	*			trans	-125.8	143.9	-164.9	47.8	0	0	0	0	111.3
438	H	33.9	Very low	31.9	Very low	197 Å²	197	163.4 Å²	163.4	91%	0.912	82%	0.818	S	S	*	*			trans	-160.9	166	141.8	-102.2	-68	0	0	0	110.7
439	S	30.6	Very low	32.1	Very low	103 Å²	103	164.8 Å²	164.8	72%	0.72	82%	0.82	S	S	*	*			trans	-133	-163.6	-161.1	57.2	0	0	0	0	112.7
440	V	32.3	Very low	32.1	Very low	136 Å²	136	162.2 Å²	162.2	82%	0.824	82%	0.815	S	S	*	*			trans	101.1	145.8	179.9	179.8	0	0	0	0	114.4
441	C	30	Very low	32.3	Very low	111 Å²	111	158.4 Å²	158.4	75%	0.75	80%	0.8	S	S	*	*				176.8	160	-59.9	-93.7	0	0	0	0	110.1
442	E	32.4	Very low	32.3	Very low	151 Å²	151	156.1 Å²	156.1	71%	0.706	80%	0.797	S	S	*	*			trans	72.8	124.1	151	-143.6	-173	-104.7	0	0	121.8
443	K	35.4	Very low	32.7	Very low	169 Å²	169	150.8 Å²	150.8	74%	0.735	79%	0.79	S	S	*	*				162.9	131	111	-84.4	-171.8	179.4	179.8	0	114.8
444	F	31.8	Very low	33.1	Very low	193 Å²	193	146.3 Å²	146.3	85%	0.846	78%	0.777	S	S	*	*			trans	13.7	156.4	152.4	-61	-86.7	0	0	0	123.1
445	G	33	Very low	33.1	Very low	69 Å²	69	139.6 Å²	139.6	71%	0.711	76%	0.759	S	S	*	*			cis	-179.4	-173.6	3.9	0	0	0	0	0	113.5
446	T	29.3	Very low	33.4	Very low	142 Å²	142	137.8 Å²	137.8	87%	0.871	76%	0.762	S	S	*	*			trans	-110.6	150.2	-174.8	44.5	0	0	0	0	113.4
447	Q	32.7	Very low	33.5	Very low	177 Å²	177	138.5 Å²	138.5	83%	0.827	76%	0.758	S	S	*	*			trans	-141.6	135.5	173.2	-167	74.3	8.4	0	0	111.3
448	S	32.7	Very low	33.9	Very low	101 Å²	101	137.9 Å²	137.9	71%	0.706	75%	0.754	S	S	*	*			trans	49	96.9	162.1	57.3	0	0	0	0	119.6
449	Q	32.2	Very low	33.9	Very low	193 Å²	193	136.6 Å²	136.6	90%	0.902	75%	0.753	S	S	*	*				-59	172.6	124.9	-65	174.2	-14.5	0	0	109.8
450	L	32.8	Very low	34.4	Very low	159 Å²	159	136.6 Å²	136.6	83%	0.832	75%	0.753	S	S	*	*			trans	84.2	70.6	175.8	-162.4	79.7	0	0	0	116.7
451	E	34.2	Very low	34.5	Very low	124 Å²	124	136.1 Å²	136.1	58%	0.579	75%	0.746	S	S	*	*	S	Bend	trans	-149.4	-50.5	150.2	-110.1	-55.7	102	0	0	112.7	A453 K454	E451-A453 PolarHBondContact O-N 3.06Å; E451-K454 PolarHBondContact O-N 2.82Å; E451-K454 IonicContact OE1-NZ 2.66Å; E451-K454 PolarHBondContact OE1-NZ 3.25Å
452	L	33.2	Very low	34.9	Very low	156 Å²	156	137.1 Å²	137.1	82%	0.817	75%	0.748	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.9	19.9	-172.4	-149.4	70.7	0	0	0	115.7	K454 A455	L452-K454 VanDerWaalsContact C-N 3.25Å; L452-A455 HydrophobicContact CD1-CB 4.06Å; L452-A455 HydrophobicContact CG-CB 4.38Å
453	A	39	Very low	35.2	Very low	89 Å²	89	132.4 Å²	132.4	74%	0.736	74%	0.74	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.9	-1.8	163.5	0	0	0	0	0	112.8	E451	E451-A453 PolarHBondContact O-N 3.06Å
454	K	38.8	Very low	35.5	Very low	156 Å²	156	133.6 Å²	133.6	68%	0.678	75%	0.749	S	S	*	*	S	Bend	trans	-101.4	-7.8	-177.3	-66.1	172.4	-175.5	161.7	0	115.3	E451 L452 V456	E451-K454 PolarHBondContact O-N 2.82Å; E451-K454 IonicContact OE1-NZ 2.66Å; E451-K454 PolarHBondContact OE1-NZ 3.25Å; L452-K454 VanDerWaalsContact C-N 3.25Å; K454-V456 PolarHBondContact O-N 3.16Å
455	A	34	Very low	35.7	Very low	57 Å²	57	129.4 Å²	129.4	47%	0.471	74%	0.743	S	S	.	*			trans	-80.3	-11.7	-175	0	0	0	0	0	114.6	L452 K457	L452-A455 HydrophobicContact CD1-CB 4.06Å; L452-A455 HydrophobicContact CG-CB 4.38Å; A455-K457 PolarHBondContact O-N 3.22Å
456	V	39	Very low	35.7	Very low	137 Å²	137	134.5 Å²	134.5	83%	0.83	75%	0.753	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83	51.6	-174.1	-165.2	0	0	0	0	111.7	K454	K454-V456 PolarHBondContact O-N 3.16Å
457	K	37	Very low	36.1	Very low	173 Å²	173	134.3 Å²	134.3	75%	0.752	75%	0.745	S	S	*	*	T	Hydrogen-bonded Turn	trans	-155.5	10.7	176.3	-142.4	176	177.1	176	0	117.7	A455	A455-K457 PolarHBondContact O-N 3.22Å
458	T	37.5	Very low	36	Very low	102 Å²	102	134.2 Å²	134.2	63%	0.626	75%	0.745	S	S	*	*	S	Bend	trans	-134.8	6	-173.1	41.3	0	0	0	0	116.3
459	L	35.3	Very low	36.2	Very low	171 Å²	171	138.4 Å²	138.4	90%	0.895	75%	0.753	S	S	*	*	S	Bend	trans	-108.9	5.4	166.6	-100.8	82.5	0	0	0	114
460	S	39.6	Very low	36.4	Very low	103 Å²	103	135 Å²	135	72%	0.72	75%	0.75	S	S	*	*	S	Bend	trans	-86.3	-21.6	173.9	-164.7	0	0	0	0	113.3
461	D	35.9	Very low	36.4	Very low	125 Å²	125	130.4 Å²	130.4	67%	0.668	74%	0.742	S	S	*	*	S	Bend	trans	-119	18.7	-166.2	-58.8	-57.9	0	0	0	113.3
462	V	38.2	Very low	36.5	Very low	133 Å²	133	132.4 Å²	132.4	81%	0.806	76%	0.756	S	S	*	*	S	Bend	trans	-130.2	93.2	175.5	-174.4	0	0	0	0	110.1
463	G	37.6	Very low	36.5	Very low	52 Å²	52	129.5 Å²	129.5	54%	0.536	75%	0.749	S	S	.	*			cis	-168.6	132.5	-6.7	0	0	0	0	0	112.9	S465	G463-S465 PolarHBondContact O-N 3.24Å
464	Q	42.3	Very low	36.3	Very low	194 Å²	194	131.4 Å²	131.4	91%	0.907	75%	0.751	S	S	*	*	S	Bend	trans	-76.4	52.3	166.5	-68.5	167.8	-44.6	0	0	109.8
465	S	36.3	Very low	36	Very low	105 Å²	105	128.3 Å²	128.3	73%	0.734	75%	0.749	S	S	*	*			trans	-123.5	27.9	-164.7	-174.6	0	0	0	0	112.5	G463	G463-S465 PolarHBondContact O-N 3.24Å
466	L	33.6	Very low	35.9	Very low	176 Å²	176	132.4 Å²	132.4	92%	0.921	76%	0.763	S	S	*	*			trans	-143.7	38.8	168.2	-108.8	156.4	0	0	0	110.5
467	I	36.1	Very low	35.6	Very low	137 Å²	137	132.5 Å²	132.5	70%	0.703	76%	0.759	S	S	*	*			trans	-85.1	160.5	149.1	-56.6	175.8	0	0	0	105.9
468	E	31.7	Very low	35.4	Very low	176 Å²	176	130.9 Å²	130.9	82%	0.822	76%	0.758	S	S	*	*			trans	72	84.6	-179.7	-50.8	-169.9	175.7	0	0	115.9
469	H	36.5	Very low	35.1	Very low	189 Å²	189	133.5 Å²	133.5	88%	0.875	77%	0.765	S	S	*	*				-162.5	120.5	129.7	-102.3	-63.5	0	0	0	110.7
470	S	35.8	Very low	35	Very low	120 Å²	120	131.7 Å²	131.7	84%	0.839	76%	0.755	S	S	*	*			trans	38.1	122.5	162.7	56.3	0	0	0	0	119.3
471	G	34.1	Very low	34.5	Very low	64 Å²	64	134 Å²	134	66%	0.66	76%	0.755	S	S	*	*			cis	126.2	138.1	9.3	0	0	0	0	0	110.7
472	D	34.7	Very low	34.3	Very low	165 Å²	165	134.2 Å²	134.2	88%	0.882	76%	0.755	S	S	*	*			trans	63.7	145.5	172.2	-56.3	-28.9	0	0	0	117.3
473	S	34.5	Very low	34	Very low	95 Å²	95	135 Å²	135	66%	0.664	75%	0.75	S	S	*	*			cis	-163.5	134.5	-18.3	55.4	0	0	0	0	112.2
474	V	34.4	Very low	33.7	Very low	129 Å²	129	138.9 Å²	138.9	78%	0.782	75%	0.754	S	S	*	*				58.5	117.7	127.5	-177.1	0	0	0	0	120.9
475	S	32.2	Very low	33.2	Very low	92 Å²	92	137.1 Å²	137.1	64%	0.643	75%	0.746	S	S	*	*			trans	84.7	136.6	141.2	77.2	0	0	0	0	123.2
476	N	32.5	Very low	33.1	Very low	143 Å²	143	141.4 Å²	141.4	77%	0.765	75%	0.754	S	S	*	*			trans	60.6	127	137.7	-60.2	-10.4	0	0	0	121.3
477	L	31.5	Very low	33	Very low	139 Å²	139	141.5 Å²	141.5	73%	0.728	75%	0.75	S	S	*	*				86.5	129.8	62	-127	168.3	0	0	0	112.6
478	N	33.4	Very low	33.2	Very low	139 Å²	139	140.8 Å²	140.8	74%	0.743	75%	0.754	S	S	*	*			trans	70.8	112.2	-174.3	-57.1	-30.4	0	0	0	114
479	M	30.5	Very low	33.2	Very low	157 Å²	157	136.6 Å²	136.6	77%	0.773	74%	0.744	S	S	*	*				82.8	128.6	65.6	-170.4	-165.6	75.2	0	0	113
480	L	32.8	Very low	33	Very low	132 Å²	132	133.3 Å²	133.3	69%	0.691	74%	0.741	S	S	*	*			trans	93.5	138.4	160.2	-126	76.4	0	0	0	119.9
481	E	31	Very low	32.9	Very low	151 Å²	151	131.8 Å²	131.8	71%	0.706	73%	0.731	S	S	*	*			trans	68.7	100.6	148.5	-86.4	-178	144.9	0	0	123.8
482	I	31.7	Very low	32.9	Very low	130 Å²	130	139.4 Å²	139.4	67%	0.667	74%	0.741	S	S	*	*				78.8	123.3	108.2	-81.8	-175	0	0	0	121
483	Q	30.4	Very low	32.9	Very low	150 Å²	150	135.8 Å²	135.8	70%	0.701	73%	0.729	S	S	*	*			trans	87.6	132.1	144.8	-85.4	173.3	36.7	0	0	124.8
484	Q	31.9	Very low	32.8	Very low	133 Å²	133	137 Å²	137	62%	0.621	73%	0.732	S	S	*	*			trans	85.8	113.6	133.6	-74.1	-178.5	37.6	0	0	123.1
485	Q	32.3	Very low	32.8	Very low	158 Å²	158	136.5 Å²	136.5	74%	0.738	73%	0.73	S	S	*	*				60.6	129.2	124.4	-62.7	177.8	8.4	0	0	121.3
486	Q	34.6	Very low	32.9	Very low	194 Å²	194	137.4 Å²	137.4	91%	0.907	73%	0.727	S	S	*	*				-158.4	158.5	105.2	-104	157.9	53.1	0	0	112.4
487	Q	31.4	Very low	32.9	Very low	179 Å²	179	137.4 Å²	137.4	84%	0.836	72%	0.72	S	S	*	*			trans	-95.7	173.1	177.7	-55.1	-177	-39.2	0	0	110.9
488	P	38.8	Very low	32.7	Very low	122 Å²	122	139.3 Å²	139.3	79%	0.792	72%	0.723	S	S	*	*				-141.9	177.4	81.8	20.7	3	0	0	0	113.7
489	S	32.4	Very low	32.6	Very low	88 Å²	88	139.2 Å²	139.2	62%	0.615	72%	0.722	S	S	*	*			cis	-174.9	163.5	-32.9	58.3	0	0	0	0	109.8
490	C	32.8	Very low	32.5	Very low	119 Å²	119	138.9 Å²	138.9	80%	0.804	72%	0.723	S	S	*	*			trans	79	145	167.2	-55.9	0	0	0	0	118.8
491	S	33	Very low	32.2	Very low	89 Å²	89	137.8 Å²	137.8	62%	0.622	73%	0.726	S	S	*	*			cis	-174.3	140	-21.1	53.5	0	0	0	0	113.2
492	Y	34.7	Very low	32.2	Very low	224 Å²	224	135.8 Å²	135.8	88%	0.878	73%	0.728	S	S	*	*			trans	64.8	146.8	158	-64.3	-57.2	0	0	0	119.3
493	S	34	Very low	32.2	Very low	89 Å²	89	137 Å²	137	62%	0.622	74%	0.735	S	S	*	*			cis	-168.3	146.1	-7.3	47.2	0	0	0	0	112.7
494	T	33.4	Very low	32.2	Very low	120 Å²	120	133.8 Å²	133.8	74%	0.736	73%	0.729	S	S	*	*			trans	48.1	140.6	142.3	58.7	0	0	0	0	120.6
495	T	34.1	Very low	32.3	Very low	119 Å²	119	133.8 Å²	133.8	73%	0.73	73%	0.733	S	S	*	*			cis	-176.8	-170.9	6.5	22.8	0	0	0	0	106
496	D	33.1	Very low	32.4	Very low	110 Å²	110	134 Å²	134	59%	0.588	73%	0.734	S	S	*	*			cis	-170.1	171.1	-0.3	-117.8	21.6	0	0	0	106.5
497	K	32.8	Very low	32.4	Very low	144 Å²	144	128.6 Å²	128.6	63%	0.626	72%	0.722	S	S	*	*			cis	-172	139.7	-23.8	-119	-170.1	-159.6	75	0	108.8
498	F	27.7	Very low	32.5	Very low	179 Å²	179	126.6 Å²	126.6	79%	0.785	72%	0.717	S	S	*	*			trans	63.9	168.8	161.7	-72.8	-119.6	0	0	0	115.7
499	N	31.1	Very low	32.4	Very low	136 Å²	136	124.3 Å²	124.3	73%	0.727	71%	0.709	S	S	*	*			cis	-149.6	178.7	6.3	-147.2	-10.2	0	0	0	113.9
500	L	27.8	Very low	32.6	Very low	151 Å²	151	128.6 Å²	128.6	79%	0.791	72%	0.716	S	S	*	*			trans	-92.8	169.9	178	-91	72.7	0	0	0	115.5
501	S	26.8	Very low	32.7	Very low	108 Å²	108	128.7 Å²	128.7	76%	0.755	71%	0.705	S	S	*	*			trans	93.1	124.5	138.8	72	0	0	0	0	122.6
502	C	31.6	Very low	32.7	Very low	110 Å²	110	132 Å²	132	74%	0.743	71%	0.711	S	S	*	*				178.5	130.1	125.2	-91	0	0	0	0	108
503	L	30.5	Very low	32.5	Very low	154 Å²	154	132.7 Å²	132.7	81%	0.806	71%	0.712	S	S	*	*				68.7	132.9	63	-69	161.8	0	0	0	112.7
504	S	30.6	Very low	32.6	Very low	83 Å²	83	134.6 Å²	134.6	58%	0.58	72%	0.719	S	S	*	*			cis	-171.5	175.8	-1.2	-179.6	0	0	0	0	111.5
505	N	34.3	Very low	32.6	Very low	133 Å²	133	136.9 Å²	136.9	71%	0.711	72%	0.719	S	S	*	*			trans	107.1	108	157.6	-51.9	-18.2	0	0	0	115.8
506	H	34.3	Very low	32.6	Very low	163 Å²	163	138.5 Å²	138.5	76%	0.755	72%	0.718	S	S	*	*				75.4	137.9	81.9	-80.2	-70.7	0	0	0	113.8	D508	H506-D508 IonicContact ND1-OD2 3.43Å; H506-D508 PolarHBondContact ND1-OD2 2.92Å
507	A	34.7	Very low	32.6	Very low	80 Å²	80	138.5 Å²	138.5	66%	0.661	72%	0.722	S	S	*	*			cis	-146.7	150.8	15.1	0	0	0	0	0	110.9
508	D	34.6	Very low	32.6	Very low	137 Å²	137	137.4 Å²	137.4	73%	0.733	72%	0.723	S	S	*	*				63.4	136.6	90.3	-65	-65.6	0	0	0	115.6	H506	H506-D508 IonicContact ND1-OD2 3.43Å; H506-D508 PolarHBondContact ND1-OD2 2.92Å
509	A	37	Very low	32.8	Very low	74 Å²	74	135.2 Å²	135.2	61%	0.612	72%	0.72	S	S	*	*			cis	-171.1	166.3	1.2	0	0	0	0	0	114.7
510	K	35.6	Very low	33	Very low	178 Å²	178	135.4 Å²	135.4	77%	0.774	72%	0.721	S	S	*	*			trans	69	156.3	144.6	-79.2	169.3	173.3	-73.5	0	121.2
511	E	34.3	Very low	33.1	Very low	122 Å²	122	134.8 Å²	134.8	57%	0.57	72%	0.718	S	S	*	*			cis	-171.6	159.7	-27.9	-137.6	-174.3	111.9	0	0	111
512	Q	33.9	Very low	33.4	Very low	159 Å²	159	134.4 Å²	134.4	74%	0.743	71%	0.711	S	S	*	*			trans	62.9	134.5	162.1	-59.8	171.4	24	0	0	118.2
513	R	30.8	Very low	33.5	Very low	237 Å²	237	133.7 Å²	133.7	89%	0.894	70%	0.7	S	S	*	*			cis	82.3	120.9	9.7	-153.8	-171	-156.3	-164.9	8.8	117.1
514	V	35.6	Very low	33.6	Very low	130 Å²	130	131 Å²	131	79%	0.788	68%	0.683	S	S	*	*			trans	136.7	142.1	167.1	155.9	0	0	0	0	109.3
515	K	34.4	Very low	33.7	Very low	167 Å²	167	131 Å²	131	73%	0.726	67%	0.674	S	S	*	*			cis	-164.8	165.5	-18.1	-102.7	178.9	173.8	-177.1	0	108.5
516	H	33.5	Very low	33.5	Very low	154 Å²	154	127.4 Å²	127.4	71%	0.713	66%	0.659	S	S	*	*			trans	9.3	160.7	146.5	-49.9	-68.4	0	0	0	121.4
517	T	33.4	Very low	33.3	Very low	110 Å²	110	125.2 Å²	125.2	68%	0.675	65%	0.647	S	S	*	*			cis	-170.6	159.6	36.7	-18.6	0	0	0	0	111.4
518	N	32.6	Very low	33.2	Very low	120 Å²	120	126.8 Å²	126.8	64%	0.642	65%	0.652	S	S	*	*			trans	50	117.5	144.5	-73.6	26.3	0	0	0	119.8
519	N	31.4	Very low	32.9	Very low	133 Å²	133	124.8 Å²	124.8	71%	0.711	65%	0.649	S	S	*	*				88.5	167.5	68.4	-74.4	17.6	0	0	0	112
520	D	34.5	Very low	32.5	Very low	140 Å²	140	129.8 Å²	129.8	75%	0.749	66%	0.659	S	S	*	*			trans	81.8	126.6	165.6	-50.1	-5.9	0	0	0	115.5
521	D	31.3	Very low	32.2	Very low	139 Å²	139	128.6 Å²	128.6	74%	0.743	66%	0.66	S	S	*	*			cis	-166.2	-176.7	-25.3	-145	-19.1	0	0	0	109.6
522	V	33.1	Very low	31.9	Very low	99 Å²	99	129.5 Å²	129.5	60%	0.6	67%	0.674	S	S	*	*			trans	59.4	97.4	140.7	164.3	0	0	0	0	116.2
523	N	33.6	Very low	31.8	Very low	95 Å²	95	126.5 Å²	126.5	51%	0.508	67%	0.668	S	S	.	*				90.6	156.4	91.8	-76	-5	0	0	0	113.6
524	H	32.9	Very low	31.6	Very low	97 Å²	97	122.3 Å²	122.3	45%	0.449	66%	0.662	S	S	.	*			cis	-168.3	169.7	1.7	-115.7	-19.5	0	0	0	110.3	D1589	H524-D1589 IonicContact CE1-OD2 3.34Å; H524-D1589 PolarHBondContact CE1-OD2 3.12Å; H524-D1589 IonicContact CG-OD2 3.88Å; H524-D1589 IonicContact ND1-OD2 2.57Å; H524-D1589 PolarHBondContact ND1-OD2 3Å
525	Q	31.7	Very low	31.3	Very low	85 Å²	85	124.7 Å²	124.7	40%	0.397	67%	0.665	S	S	.	*			trans	63.8	116.1	137.3	-66.7	156.7	-4.8	0	0	120	D1588 D1589	Q525-D1588 HydrophobicContact CG-CB 4.09Å; Q525-D1588 WeakPolarHBondContact CG-OD1 3.47Å; Q525-D1588 PolarHBondContact NE2-OD1 2.75Å; Q525-D1588 PolarHBondContact NE2-OD2 3.23Å; Q525-D1588 VanDerWaalsContact NE2-OD2 3.1Å; Q525-D1589 WeakPolarHBondContact CA-OD1 3.28Å; Q525-D1589 HydrophobicContact CG-CB 3.41Å; Q525-D1589 VanDerWaalsContact CG-CB 3.41Å; Q525-D1589 WeakPolarHBondContact CG-OD2 3.42Å; Q525-D1589 VanDerWaalsContact N-CG 3.34Å; Q525-D1589 PolarHBondContact N-OD1 3.33Å; Q525-D1589 PolarHBondContact N-OD2 3.29Å
526	S	30.5	Very low	31.1	Very low	56 Å²	56	122 Å²	122	39%	0.392	67%	0.667	S	S	.	*			cis	104.6	124.9	7.9	95.2	0	0	0	0	119.7	D1589	S526-D1589 WeakPolarHBondContact CB-OD1 3.3Å; S526-D1589 PolarHBondContact OG-OD1 2.84Å
527	K	31	Very low	31.2	Very low	118 Å²	118	120.5 Å²	120.5	51%	0.513	67%	0.668	S	S	.	*			trans	175.6	135.7	145.3	-107	172.3	159.6	175.5	0	109.4	P1586 N1587	K527-P1586 HydrophobicContact CD-CB 3.77Å; K527-N1587 WeakPolarHBondContact CE-O 3.49Å; K527-N1587 PolarHBondContact NZ-O 3.4Å
528	C	31.1	Very low	31.1	Very low	112 Å²	112	121.3 Å²	121.3	76%	0.757	67%	0.669	S	S	*	*			cis	85.2	105	20.7	-166.8	0	0	0	0	116.3
529	S	29.4	Very low	31.2	Very low	96 Å²	96	124.5 Å²	124.5	67%	0.671	68%	0.677	S	S	*	*				163.4	149.3	128.6	-75.1	0	0	0	0	115.4
530	Q	28.7	Very low	31.3	Very low	178 Å²	178	122.7 Å²	122.7	83%	0.832	68%	0.675	S	S	*	*			trans	62.4	110.1	157.2	-68.3	164.7	-16.5	0	0	118.2
531	I	29.4	Very low	31.2	Very low	154 Å²	154	122.9 Å²	122.9	79%	0.79	68%	0.676	S	S	*	*			cis	69.3	111.4	45.8	-51	174.1	0	0	0	114.9
532	T	27.5	Very low	31.2	Very low	140 Å²	140	121.7 Å²	121.7	86%	0.859	68%	0.678	S	S	*	*			trans	-152.9	133.9	142.9	-52.7	0	0	0	0	109.2
533	P	31.3	Very low	31.2	Very low	97 Å²	97	120.7 Å²	120.7	63%	0.63	69%	0.688	S	S	*	*			trans	-114.5	-168.4	-176.2	41.1	-32.6	0	0	0	115.2
534	I	27.6	Very low	31.1	Very low	148 Å²	148	124 Å²	124	76%	0.759	71%	0.705	S	S	*	*			trans	84.4	138.6	174.1	-55.5	158.5	0	0	0	112.4
535	Q	29.3	Very low	31.2	Very low	181 Å²	181	131 Å²	131	85%	0.846	73%	0.727	S	S	*	*			cis	-145.9	171.7	21.2	-148.3	144.5	36.8	0	0	114.2
536	S	29.6	Very low	31	Very low	109 Å²	109	132 Å²	132	76%	0.762	75%	0.745	S	S	*	*			trans	-147.1	151.9	173	57.2	0	0	0	0	112.3
537	V	35.3	Very low	31	Very low	124 Å²	124	135 Å²	135	75%	0.752	75%	0.754	S	S	*	*			trans	-149.6	114.2	178.1	176.5	0	0	0	0	105.9
538	D	31.9	Very low	30.9	Very low	127 Å²	127	133.9 Å²	133.9	68%	0.679	76%	0.761	S	S	*	*				57.2	140.4	86.4	-62.7	-45.2	0	0	0	113.1
539	F	34.6	Very low	30.9	Very low	186 Å²	186	136.1 Å²	136.1	82%	0.816	76%	0.76	S	S	*	*			cis	-148.5	177.6	4.7	-108.2	-38.6	0	0	0	107.4
540	S	32.2	Very low	30.8	Very low	95 Å²	95	139.7 Å²	139.7	66%	0.664	77%	0.768	S	S	*	*			cis	-135.5	-159.7	11.9	-49.2	0	0	0	0	109.5
541	D	33.6	Very low	31	Very low	144 Å²	144	134.8 Å²	134.8	77%	0.77	76%	0.758	S	S	*	*			cis	-155.9	170.5	-1.7	-142.1	-63.5	0	0	0	111
542	S	30.5	Very low	31.1	Very low	114 Å²	114	134.6 Å²	134.6	80%	0.797	76%	0.764	S	S	*	*			trans	164.2	141.1	156.6	45.1	0	0	0	0	109.4
543	G	32.5	Very low	31.4	Very low	79 Å²	79	130.8 Å²	130.8	81%	0.814	75%	0.753	S	S	*	*			trans	-130.1	93.9	-170.1	0	0	0	0	0	114.9
544	L	33.3	Very low	31.3	Very low	163 Å²	163	133.5 Å²	133.5	85%	0.853	76%	0.762	S	S	*	*			trans	-117.9	120.1	174.4	-102	172	0	0	0	110.7
545	W	33.5	Very low	31.5	Very low	244 Å²	244	131.4 Å²	131.4	92%	0.924	76%	0.76	S	S	*	*			trans	-143.3	140.8	168.1	-80.3	93.8	0	0	0	113.6
546	S	28.4	Very low	31.5	Very low	108 Å²	108	128.6 Å²	128.6	76%	0.755	76%	0.755	S	S	*	*			trans	-160.1	162.9	168.6	-83.2	0	0	0	0	109.6
547	M	29.8	Very low	31.7	Very low	118 Å²	118	129.5 Å²	129.5	58%	0.581	75%	0.751	S	S	*	*			trans	63.2	74.6	168.9	-78.9	165.9	44.3	0	0	118.7	E1826	M547-E1826 VanDerWaalsContact CE-OE1 3.24Å; M547-E1826 WeakPolarHBondContact CE-OE1 3.43Å
548	S	28.9	Very low	31.4	Very low	95 Å²	95	128.4 Å²	128.4	66%	0.664	75%	0.749	S	S	*	*				60.9	142.4	103.5	75	0	0	0	0	123.5
549	Q	30.7	Very low	31.4	Very low	158 Å²	158	130 Å²	130	74%	0.738	76%	0.757	S	S	*	*			trans	91.9	117.6	153.6	-62.6	-169.1	36.4	0	0	119.8
550	M	29	Very low	31.1	Very low	171 Å²	171	128 Å²	128	84%	0.842	75%	0.75	S	S	*	*				60.3	137.7	129.3	-63.2	-169.2	-173.2	0	0	120.3
551	A	31.9	Very low	31	Very low	75 Å²	75	132.4 Å²	132.4	62%	0.62	75%	0.752	S	S	*	*			cis	-166	-179.4	-8.4	0	0	0	0	0	110
552	T	32.7	Very low	30.8	Very low	150 Å²	150	132.5 Å²	132.5	92%	0.92	75%	0.748	S	S	*	*			trans	68.8	144.9	169.7	66.2	0	0	0	0	116.3
553	G	32.6	Very low	30.9	Very low	61 Å²	61	132.4 Å²	132.4	63%	0.629	73%	0.734	S	S	*	*			cis	-173.6	-174.7	-1.2	0	0	0	0	0	113.3
554	D	30.5	Very low	30.8	Very low	153 Å²	153	132.1 Å²	132.1	82%	0.818	72%	0.717	S	S	*	*			trans	52.2	81.5	163	-57.9	-15.4	0	0	0	116.2
555	C	30.6	Very low	30.6	Very low	105 Å²	105	127.1 Å²	127.1	71%	0.709	70%	0.696	S	S	*	*				69.1	162.3	54.3	-48.1	0	0	0	0	114.9
556	T	30.4	Very low	30.3	Very low	121 Å²	121	121.1 Å²	121.1	74%	0.742	69%	0.689	S	S	*	*			trans	78.9	136.8	169.4	75.5	0	0	0	0	116.9
557	N	33.4	Very low	30.1	Very low	129 Å²	129	120.7 Å²	120.7	69%	0.69	69%	0.686	S	S	*	*			cis	-147	152.5	-11.9	-117.2	-23.4	0	0	0	114.3
558	S	27.6	Very low	30	Very low	100 Å²	100	121.3 Å²	121.3	70%	0.699	69%	0.688	S	S	*	*			trans	-82.1	136.9	175.3	49.9	0	0	0	0	111.8
559	L	32.3	Very low	29.8	Very low	161 Å²	161	119.7 Å²	119.7	84%	0.843	68%	0.676	S	S	*	*			trans	-149.7	98.5	153.7	-134.8	72.2	0	0	0	105.6
560	Q	28.9	Very low	29.7	Very low	143 Å²	143	117.3 Å²	117.3	67%	0.668	68%	0.677	S	S	*	*				68.9	122.2	61.1	-152.4	-157.7	29.2	0	0	112.9
561	R	29.9	Very low	29.7	Very low	189 Å²	189	114.5 Å²	114.5	71%	0.713	67%	0.67	S	S	*	*			trans	95.8	116	163.9	-58.6	-169.7	173.3	173.4	-3.7	118.5
562	H	30	Very low	29.5	Very low	146 Å²	146	120 Å²	120	68%	0.676	68%	0.68	S	S	*	*			trans	41.5	121.4	135.5	-43.6	-59.1	0	0	0	119
563	H	31.8	Very low	29.4	Very low	112 Å²	112	115.9 Å²	115.9	52%	0.519	67%	0.667	S	S	.	*				-166.9	178.9	80.6	-88.4	-66.4	0	0	0	109.9	T1642	H563-T1642 CarbonylContact C-O 3.51Å; H563-T1642 WeakPolarHBondContact CA-O 3.45Å; H563-T1642 WeakPolarHBondContact CB-O 3.47Å; H563-T1642 VanDerWaalsContact CG-O 3.32Å; H563-T1642 VanDerWaalsContact ND1-C 3.26Å; H563-T1642 PolarHBondContact ND1-O 3.22Å
564	T	30.5	Very low	29.1	Very low	73 Å²	73	121.7 Å²	121.7	45%	0.448	67%	0.671	S	S	.	*			trans	-108.7	-170.7	-155.9	58.8	0	0	0	0	116	S1640 N1641 T1642	T564-S1640 CarbonylContact O-C 3.45Å; T564-N1641 CarbonylContact C-O 3.21Å; T564-N1641 WeakPolarHBondContact CA-O 3.47Å; T564-N1641 PolarHBondContact N-O 2.82Å; T564-N1641 PolarHBondContact OG1-O 3.45Å; T564-T1642 PolarHBondContact N-O 2.94Å; T564-T1642 PolarHBondContact OG1-O 3.27Å; T564-T1642 PolarHBondContact OG1-OG1 3.16Å
565	S	28.2	Very low	29	Very low	58 Å²	58	122.8 Å²	122.8	41%	0.406	67%	0.669	S	S	.	*			trans	43.3	114.8	137.5	62.8	0	0	0	0	123.6	N1641 T1642	S565-N1641 PolarHBondContact OG-O 2.97Å; S565-N1641 VanDerWaalsContact OG-O 3.11Å; S565-T1642 PolarHBondContact OG-OG1 2.93Å
566	C	27.3	Very low	29	Very low	117 Å²	117	122.8 Å²	122.8	79%	0.791	67%	0.666	S	S	*	*				90.6	129.8	119.8	-65.1	0	0	0	0	122.6
567	S	26	Very low	29	Very low	100 Å²	100	123.3 Å²	123.3	70%	0.699	66%	0.664	S	S	*	*			trans	73.9	113.8	136	57.3	0	0	0	0	122.2
568	E	26.3	Very low	28.7	Very low	131 Å²	131	126.8 Å²	126.8	61%	0.612	67%	0.667	S	S	*	*				68.1	93.7	125.6	-59	-171.9	141.9	0	0	121.3
569	S	26	Very low	29	Very low	60 Å²	60	127.7 Å²	127.7	42%	0.42	66%	0.664	S	S	.	*				31	119.3	118.8	152.8	0	0	0	0	119.3	K791	S569-K791 VanDerWaalsContact CB-CD 3.43Å; S569-K791 VanDerWaalsContact OG-CD 3.24Å; S569-K791 WeakPolarHBondContact OG-CD 3.21Å; S569-K791 PolarHBondContact OG-NZ 3.31Å
570	S	28.7	Very low	29	Very low	109 Å²	109	126.3 Å²	126.3	76%	0.762	66%	0.658	S	S	*	*				-159.4	136.1	117.8	47.4	0	0	0	0	115.3
571	V	27.1	Very low	29.3	Very low	112 Å²	112	125.2 Å²	125.2	68%	0.679	66%	0.657	S	S	*	*			trans	31.3	145.7	130.1	-158	0	0	0	0	120.8
572	F	28.6	Very low	29.5	Very low	191 Å²	191	122.3 Å²	122.3	84%	0.838	66%	0.655	S	S	*	*			trans	92.7	118.8	165.2	-69.2	-77.9	0	0	0	118.3
573	G	30.3	Very low	29.6	Very low	62 Å²	62	119.8 Å²	119.8	64%	0.639	65%	0.653	S	S	*	*				141.8	80.9	95.4	0	0	0	0	0	120.4
574	Y	27.7	Very low	29.7	Very low	183 Å²	183	121 Å²	121	72%	0.718	66%	0.663	S	S	*	*			trans	74.8	135.9	134.8	-80.9	-76	0	0	0	123.9
575	F	28.2	Very low	29.9	Very low	176 Å²	176	123.8 Å²	123.8	77%	0.772	68%	0.675	S	S	*	*			trans	72	140.8	153.6	-61.9	-50	0	0	0	118.6
576	T	28.9	Very low	30.1	Very low	105 Å²	105	124.4 Å²	124.4	64%	0.644	68%	0.68	S	S	*	*			cis	-154.7	152.4	8.2	-11.7	0	0	0	0	113.2
577	N	30.6	Very low	30.3	Very low	132 Å²	132	125.3 Å²	125.3	71%	0.706	68%	0.677	S	S	*	*			trans	65.6	150.8	150.2	-77.6	-33.3	0	0	0	119.3
578	R	28.2	Very low	30.5	Very low	203 Å²	203	127.3 Å²	127.3	77%	0.766	68%	0.675	S	S	*	*			cis	-169.2	161.9	-25.8	-139.2	-173.4	169.8	150	-1.5	109.8
579	N	33.3	Very low	30.7	Very low	119 Å²	119	126.3 Å²	126.3	64%	0.636	68%	0.678	S	S	*	*			trans	72	106.3	153.9	-68.5	3.2	0	0	0	120.7
580	N	31.9	Very low	30.8	Very low	132 Å²	132	129 Å²	129	71%	0.706	69%	0.688	S	S	*	*				80.4	126.4	114.3	-75.8	43.4	0	0	0	123.2
581	N	36.7	Very low	30.8	Very low	120 Å²	120	131 Å²	131	64%	0.642	69%	0.685	S	S	*	*			trans	70.5	143.4	146.2	-61.4	50.3	0	0	0	117.3
582	D	34.2	Very low	31	Very low	127 Å²	127	129.4 Å²	129.4	68%	0.679	67%	0.672	S	S	*	*			cis	-161.2	162.1	-11.9	-111.6	-20.8	0	0	0	111.6
583	C	31.4	Very low	30.9	Very low	94 Å²	94	127.4 Å²	127.4	64%	0.635	66%	0.659	S	S	*	*			trans	55.7	121.6	148.2	-77.6	0	0	0	0	122.2
584	N	33.6	Very low	30.8	Very low	137 Å²	137	129.6 Å²	129.6	73%	0.733	66%	0.655	S	S	*	*				82	137	129.4	-59.3	6	0	0	0	117.8
585	N	34.3	Very low	30.8	Very low	131 Å²	131	128.3 Å²	128.3	70%	0.701	66%	0.656	S	S	*	*			cis	-156.2	162.2	-3.3	-135.8	18.9	0	0	0	113.7
586	S	33	Very low	30.6	Very low	72 Å²	72	128.4 Å²	128.4	50%	0.503	66%	0.659	S	S	.	*			trans	45.5	107.8	146.7	63.3	0	0	0	0	118.1
587	D	31.2	Very low	30.6	Very low	135 Å²	135	128.6 Å²	128.6	72%	0.722	66%	0.662	S	S	*	*				110.5	149.5	70	-80	-31.8	0	0	0	107.2
588	Q	31.1	Very low	30.3	Very low	142 Å²	142	129 Å²	129	66%	0.664	66%	0.663	S	S	*	*			cis	-162.3	150.5	-7.9	-116.3	163.4	39.8	0	0	107.5
589	T	29.3	Very low	30.2	Very low	110 Å²	110	124.4 Å²	124.4	68%	0.675	66%	0.657	S	S	*	*			trans	55.1	147.9	144	63.4	0	0	0	0	120.8
590	N	29.3	Very low	30	Very low	117 Å²	117	124.8 Å²	124.8	63%	0.626	66%	0.664	S	S	*	*			cis	-167	176.4	-8	-111.7	11.8	0	0	0	108.8
591	E	28.5	Very low	30	Very low	150 Å²	150	123.5 Å²	123.5	70%	0.701	66%	0.663	S	S	*	*				25.2	153.5	128.7	-50.8	177.2	124.9	0	0	119.5
592	I	30.3	Very low	29.5	Very low	80 Å²	80	124.4 Å²	124.4	41%	0.41	67%	0.666	S	S	.	*			cis	171.3	141.8	11.9	-111.1	172.2	0	0	0	106.8
593	R	28	Very low	29.4	Very low	149 Å²	149	125.3 Å²	125.3	56%	0.562	67%	0.671	S	S	*	*			trans	46	179.7	152.3	-60.5	-176.4	-155.9	100.3	-1.2	122.3	A1282 S1283	R593-A1282 PolarHBondContact NH1-O 2.76Å; R593-A1282 PolarHBondContact NH2-O 3.47Å; R593-S1283 PolarHBondContact NH1-O 2.6Å
594	L	27.3	Very low	29.2	Very low	108 Å²	108	125.4 Å²	125.4	57%	0.565	68%	0.678	S	S	*	*			trans	72.9	111.3	152.1	-70.8	162.2	0	0	0	114.6	T1284	L594-T1284 WeakPolarHBondContact CD1-O 3.44Å
595	Q	27.5	Very low	29	Very low	156 Å²	156	123.3 Å²	123.3	73%	0.729	67%	0.674	S	S	*	*				97.3	110.8	69.5	-107.9	-170.7	2.6	0	0	111.9
596	Q	25	Very low	28.7	Very low	177 Å²	177	127.2 Å²	127.2	83%	0.827	68%	0.679	S	S	*	*			trans	62.2	175.7	132.7	-94.4	-167.9	-19.3	0	0	118.2
597	P	28.2	Very low	28.7	Very low	109 Å²	109	132.7 Å²	132.7	71%	0.708	69%	0.694	S	S	*	*			trans	-113.6	-134.5	-145.8	40.1	-25.7	0	0	0	111.8
598	I	24.4	Very low	28.7	Very low	141 Å²	141	130.2 Å²	130.2	72%	0.723	69%	0.693	S	S	*	*			trans	91	86.4	169.3	-59.9	179.2	0	0	0	115.4
599	T	25.8	Very low	28.6	Very low	107 Å²	107	130 Å²	130	66%	0.656	69%	0.692	S	S	*	*			trans	68.6	114.3	130.6	65.5	0	0	0	0	122.4
600	T	28.2	Very low	28.5	Very low	127 Å²	127	132.5 Å²	132.5	78%	0.779	70%	0.699	S	S	*	*				57.4	-176.2	121.9	78.4	0	0	0	0	117.9
601	P	32.2	Very low	28.5	Very low	104 Å²	104	135.6 Å²	135.6	68%	0.675	70%	0.702	S	S	*	*			cis	-122.3	179.5	-18.5	23.9	-1.2	0	0	0	113.3
602	I	27.6	Very low	28.5	Very low	139 Å²	139	136.5 Å²	136.5	71%	0.713	71%	0.711	S	S	*	*				153.4	124	121.1	-79.5	167.4	0	0	0	110
603	N	30.6	Very low	28.4	Very low	147 Å²	147	137.4 Å²	137.4	79%	0.786	72%	0.724	S	S	*	*			trans	52.1	115.7	165.7	-57.3	-13.1	0	0	0	117.7
604	A	28.6	Very low	28.7	Very low	95 Å²	95	135.9 Å²	135.9	79%	0.785	73%	0.734	S	S	*	*				69.7	141.7	57.8	0	0	0	0	0	113
605	S	28.1	Very low	28.9	Very low	93 Å²	93	138.6 Å²	138.6	65%	0.65	74%	0.737	S	S	*	*			cis	-159	142	23.2	61.4	0	0	0	0	116.1
606	R	29.4	Very low	28.9	Very low	214 Å²	214	134 Å²	134	81%	0.808	72%	0.721	S	S	*	*			trans	64.9	155.8	150.4	-60.8	165	179.4	170.9	-1.4	116.6
607	F	32.3	Very low	29	Very low	186 Å²	186	127.9 Å²	127.9	82%	0.816	70%	0.699	S	S	*	*			cis	-122.9	136.8	3.6	-69.1	-106.5	0	0	0	108.5
608	A	31.5	Very low	29	Very low	83 Å²	83	131.1 Å²	131.1	69%	0.686	71%	0.709	S	S	*	*				61.2	82.4	60.2	0	0	0	0	0	111.4
609	E	28.5	Very low	29.2	Very low	139 Å²	139	131.6 Å²	131.6	65%	0.65	71%	0.706	S	S	*	*				65.8	112.5	61	-163.1	179.9	-138.4	0	0	113.5	R611	E609-R611 HydrophobicContact CG-CG 4.13Å; E609-R611 IonicContact OE1-CZ 2.67Å; E609-R611 VanDerWaalsContact OE1-CZ 3.23Å; E609-R611 IonicContact OE1-NE 3.43Å; E609-R611 PolarHBondContact OE1-NE 3.15Å; E609-R611 IonicContact OE1-NH2 3.37Å; E609-R611 PolarHBondContact OE1-NH2 3.1Å; E609-R611 IonicContact OE2-NE 4Å
610	I	28.1	Very low	29.6	Very low	161 Å²	161	134.7 Å²	134.7	83%	0.826	72%	0.716	S	S	*	*			trans	-120.5	102.5	159.1	-60.9	179.9	0	0	0	107.4
611	R	28.1	Very low	29.5	Very low	183 Å²	183	138 Å²	138	69%	0.691	72%	0.72	S	S	*	*			trans	-91.5	143.3	156.1	-58.5	-177.1	-164.9	-169.6	4.5	108.1	E609	E609-R611 HydrophobicContact CG-CG 4.13Å; E609-R611 IonicContact OE1-CZ 2.67Å; E609-R611 VanDerWaalsContact OE1-CZ 3.23Å; E609-R611 IonicContact OE1-NE 3.43Å; E609-R611 PolarHBondContact OE1-NE 3.15Å; E609-R611 IonicContact OE1-NH2 3.37Å; E609-R611 PolarHBondContact OE1-NH2 3.1Å; E609-R611 IonicContact OE2-NE 4Å
612	L	29.3	Very low	29.5	Very low	168 Å²	168	141 Å²	141	88%	0.88	73%	0.73	S	S	*	*			trans	-134.4	99.7	153.8	-77.9	179.4	0	0	0	109.9
613	S	27.3	Very low	29.5	Very low	100 Å²	100	137.2 Å²	137.2	70%	0.699	73%	0.726	S	S	*	*			trans	-72.8	159.1	157.7	-53.4	0	0	0	0	109.3
614	P	35.5	Very low	29.6	Very low	117 Å²	117	139.3 Å²	139.3	76%	0.76	73%	0.731	S	S	*	*			trans	-81.1	154.5	-168.4	32.9	-36.7	0	0	0	113.4
615	W	30.2	Very low	29.6	Very low	165 Å²	165	144 Å²	144	63%	0.625	74%	0.737	S	S	*	*			trans	177.1	138	142.5	-100.1	21.9	0	0	0	114.1	S752 N753	W615-S752 WeakPolarHBondContact CZ3-OG 3.24Å; W615-N753 WeakPolarHBondContact CH2-ND2 3.39Å; W615-N753 WeakPolarHBondContact CH2-OD1 3.12Å; W615-N753 WeakPolarHBondContact CZ3-ND2 3.26Å
616	S	28.4	Very low	29.8	Very low	58 Å²	58	144.9 Å²	144.9	41%	0.406	74%	0.743	S	S	.	*			trans	62.5	156.3	144.6	64.4	0	0	0	0	122.6	S751	S616-S751 WeakPolarHBondContact CB-OG 3.42Å
617	S	27.1	Very low	29.7	Very low	50 Å²	50	140.6 Å²	140.6	35%	0.35	74%	0.74	S	S	.	*			trans	-112.3	150	-172.5	-4.4	0	0	0	0	113.4	P749 F750	S617-P749 WeakPolarHBondContact OG-CB 3.47Å; S617-F750 VanDerWaalsContact OG-CD2 3.25Å; S617-F750 WeakPolarHBondContact OG-CD2 3.41Å
618	L	28.7	Very low	29.4	Very low	176 Å²	176	139 Å²	139	92%	0.921	74%	0.736	S	S	*	*			trans	-137.8	144.9	165.7	-159.2	70.4	0	0	0	111.2
619	K	27.9	Very low	29.3	Very low	151 Å²	151	144 Å²	144	66%	0.657	74%	0.742	S	S	*	*			trans	-98.3	130.5	-173.1	-68.5	168.8	-179.4	168.3	0	110.8	E748	K619-E748 PolarHBondContact NZ-O 3.46Å
620	I	33.2	Very low	29.2	Very low	172 Å²	172	146.5 Å²	146.5	88%	0.882	75%	0.751	S	S	*	*			trans	-86.4	133.1	167.9	-61.9	176.1	0	0	0	108.6
621	K	27.4	Very low	29.2	Very low	197 Å²	197	146.8 Å²	146.8	86%	0.857	75%	0.753	S	S	*	*			trans	-153.4	85	-178.3	-154.1	-174.7	-172.3	-172	0	113.3
622	D	31.3	Very low	29.2	Very low	166 Å²	166	144.3 Å²	144.3	89%	0.888	75%	0.749	S	S	*	*			trans	-145.9	149.7	167.3	-80.9	-57.7	0	0	0	107.8
623	G	28	Very low	29	Very low	61 Å²	61	144 Å²	144	63%	0.629	74%	0.741	S	S	*	*			cis	179.4	166.9	-4.5	0	0	0	0	0	110.1
624	Q	32.2	Very low	29	Very low	190 Å²	190	143.9 Å²	143.9	89%	0.888	74%	0.74	S	S	*	*			trans	65.7	116.8	179	-54.6	177.7	-15.7	0	0	115
625	Q	28.4	Very low	28.7	Very low	195 Å²	195	145 Å²	145	91%	0.911	74%	0.739	S	S	*	*			cis	75.5	104.5	47.4	-65.6	-167.4	-6.5	0	0	116.5
626	S	32.3	Very low	28.7	Very low	111 Å²	111	145.2 Å²	145.2	78%	0.776	75%	0.748	S	S	*	*				-167.2	121.2	117.5	63.2	0	0	0	0	113.2
627	T	28.6	Very low	28.7	Very low	123 Å²	123	147.8 Å²	147.8	76%	0.755	76%	0.761	S	S	*	*			trans	-8.6	124.4	147.9	44.7	0	0	0	0	117.1
628	E	25.3	Very low	28.8	Very low	154 Å²	154	150.6 Å²	150.6	72%	0.72	78%	0.776	S	S	*	*				87.5	118.2	78.1	-171.4	-172.5	-152.6	0	0	113.3
629	F	28.7	Very low	28.8	Very low	188 Å²	188	149.3 Å²	149.3	83%	0.825	77%	0.77	S	S	*	*				178	151.6	122.9	-113.9	-91.9	0	0	0	111.8
630	K	27.8	Very low	28.9	Very low	190 Å²	190	146.1 Å²	146.1	83%	0.826	77%	0.772	S	S	*	*			trans	-93.3	144.3	169	-70	175.6	176.9	173.7	0	110.3
631	L	28.1	Very low	28.7	Very low	167 Å²	167	143.9 Å²	143.9	87%	0.874	77%	0.766	S	S	*	*				-153.9	155.8	129.1	-136.6	72.8	0	0	0	113.8
632	E	26.3	Very low	28.8	Very low	131 Å²	131	140.5 Å²	140.5	61%	0.612	76%	0.763	S	S	*	*			trans	-63.8	168.9	-167.3	-52.6	-171	114.4	0	0	118.5
633	K	26.6	Very low	28.7	Very low	163 Å²	163	138.4 Å²	138.4	71%	0.709	76%	0.756	S	S	*	*			trans	48.9	128	134.8	-70.2	164.9	-160.3	157.2	0	117.2
634	S	27.4	Very low	29.1	Very low	96 Å²	96	143 Å²	143	67%	0.671	76%	0.764	S	S	*	*			cis	176.2	175.8	40.8	41.2	0	0	0	0	110.6
635	N	28.7	Very low	29.2	Very low	140 Å²	140	140 Å²	140	75%	0.749	76%	0.755	S	S	*	*			trans	17.3	142	137.4	-46.1	-6.3	0	0	0	118.4
636	Q	30.1	Very low	29.7	Very low	171 Å²	171	136.7 Å²	136.7	80%	0.799	74%	0.743	S	S	*	*			cis	-162.2	160.7	31.8	-153.9	155.2	-11.5	0	0	113.8
637	T	29.1	Very low	30	Very low	112 Å²	112	137.6 Å²	137.6	69%	0.687	74%	0.739	S	S	*	*			trans	-49.3	164.5	152.7	36.3	0	0	0	0	112.6
638	T	29.1	Very low	30.3	Very low	108 Å²	108	138.1 Å²	138.1	66%	0.663	74%	0.737	S	S	*	*			cis	-159.7	173.3	29.9	-18.4	0	0	0	0	111.2
639	D	27.7	Very low	30.7	Very low	149 Å²	149	136.6 Å²	136.6	80%	0.797	73%	0.734	S	S	*	*			trans	-6.7	153.4	144	-39.7	-26.7	0	0	0	117.5
640	A	29.9	Very low	31.1	Very low	84 Å²	84	133.5 Å²	133.5	69%	0.694	73%	0.726	S	S	*	*			cis	-163.6	177.6	34.7	0	0	0	0	0	114.3
641	T	28.5	Very low	31.4	Very low	125 Å²	125	130.8 Å²	130.8	77%	0.767	72%	0.721	S	S	*	*			trans	-3.2	140.1	148.1	62.6	0	0	0	0	117.6
642	T	30.8	Very low	31.6	Very low	127 Å²	127	129.1 Å²	129.1	78%	0.779	71%	0.713	S	S	*	*				-156.1	164.6	56	33.4	0	0	0	0	115.7
643	T	28.8	Very low	31.9	Very low	122 Å²	122	128.8 Å²	128.8	75%	0.748	72%	0.715	S	S	*	*			trans	-33.5	144.2	160.8	48	0	0	0	0	117.5
644	I	36.3	Very low	32.1	Very low	156 Å²	156	127.7 Å²	127.7	80%	0.8	72%	0.717	S	S	*	*			trans	-151.9	113.1	140.3	-105.6	154.4	0	0	0	111.1
645	D	35.4	Very low	32.4	Very low	129 Å²	129	129 Å²	129	69%	0.69	72%	0.722	S	S	*	*			trans	63.7	135.4	134.3	-53.9	-6.6	0	0	0	126.9
646	N	38.1	Very low	32.4	Very low	125 Å²	125	127 Å²	127	67%	0.668	72%	0.718	S	S	*	*			trans	98.9	100.8	132.3	-74.4	-27.1	0	0	0	123.6
647	N	37.9	Very low	32.5	Very low	129 Å²	129	124.3 Å²	124.3	69%	0.69	71%	0.714	S	S	*	*				84.4	87.9	119.6	-64	-25.6	0	0	0	123.1
648	N	34.9	Very low	32.5	Very low	134 Å²	134	124.5 Å²	124.5	72%	0.717	72%	0.715	S	S	*	*				40.8	129.2	102.5	-83.6	-6.3	0	0	0	122.5
649	N	35	Very low	32.6	Very low	122 Å²	122	124.3 Å²	124.3	65%	0.652	71%	0.714	S	S	*	*				100.5	128.1	122	-76.7	-4.9	0	0	0	123.4
650	N	35.8	Very low	32.8	Very low	124 Å²	124	123.5 Å²	123.5	66%	0.663	71%	0.709	S	S	*	*			trans	82.2	104.3	133	-70.5	-9.6	0	0	0	122.1
651	N	34	Very low	33	Very low	132 Å²	132	125.7 Å²	125.7	71%	0.706	71%	0.708	S	S	*	*				64.2	147	110.5	-68.4	-1.4	0	0	0	122.9
652	N	33.3	Very low	33.1	Very low	132 Å²	132	124.2 Å²	124.2	71%	0.706	70%	0.703	S	S	*	*			trans	94.7	120.6	146.3	-70.1	-10	0	0	0	120.8
653	N	32.2	Very low	33.1	Very low	125 Å²	125	124.3 Å²	124.3	67%	0.668	70%	0.699	S	S	*	*			trans	78.8	130.6	136.5	-60.7	-10.7	0	0	0	120.8
654	N	31.3	Very low	33.2	Very low	139 Å²	139	125.1 Å²	125.1	74%	0.743	69%	0.694	S	S	*	*			trans	39.5	125.5	131.6	-44.7	-16.3	0	0	0	117.3
655	T	33.4	Very low	33.1	Very low	125 Å²	125	125.8 Å²	125.8	77%	0.767	69%	0.693	S	S	*	*				-167.9	166.6	64.6	35.4	0	0	0	0	113.1
656	S	28.4	Very low	32.8	Very low	97 Å²	97	122.6 Å²	122.6	68%	0.678	69%	0.691	S	S	*	*			trans	19.6	153.1	133.8	-36.4	0	0	0	0	120.5
657	T	31.8	Very low	32.4	Very low	114 Å²	114	124.5 Å²	124.5	70%	0.699	70%	0.7	S	S	*	*			cis	-170.4	140.5	41.7	-20.5	0	0	0	0	111
658	T	29.9	Very low	32	Very low	116 Å²	116	123.6 Å²	123.6	71%	0.712	70%	0.699	S	S	*	*			trans	39.7	146.9	135.3	58.6	0	0	0	0	121.7
659	T	30.4	Very low	31.7	Very low	105 Å²	105	122.5 Å²	122.5	64%	0.644	70%	0.701	S	S	*	*			cis	-173.2	171	25.8	-4.4	0	0	0	0	112.1
660	N	32.8	Very low	31.3	Very low	132 Å²	132	122.6 Å²	122.6	71%	0.706	71%	0.706	S	S	*	*			trans	75.8	146.6	144.6	-72.3	-5.7	0	0	0	119.5
661	I	33.2	Very low	31	Very low	129 Å²	129	122.6 Å²	122.6	66%	0.662	71%	0.706	S	S	*	*			cis	-163.6	143.3	-15.5	-122.3	167.7	0	0	0	110.2
662	S	30.6	Very low	30.7	Very low	95 Å²	95	121.4 Å²	121.4	66%	0.664	70%	0.7	S	S	*	*			trans	61.8	160.5	155.6	75.3	0	0	0	0	120.7
663	N	31.3	Very low	30.5	Very low	128 Å²	128	121.9 Å²	121.9	68%	0.684	70%	0.701	S	S	*	*			cis	-164.3	168.3	-21.1	-109.1	16.6	0	0	0	110.8
664	E	32	Very low	30.4	Very low	140 Å²	140	121.3 Å²	121.3	65%	0.654	70%	0.704	S	S	*	*			trans	73.6	133.4	141.6	-81.4	154.6	-132.7	0	0	123.2
665	H	33.4	Very low	30.3	Very low	170 Å²	170	122.1 Å²	122.1	79%	0.787	71%	0.707	S	S	*	*			trans	58	127	158.1	-51.8	-51.1	0	0	0	119.5
666	G	28.9	Very low	30	Very low	61 Å²	61	122.9 Å²	122.9	63%	0.629	71%	0.707	S	S	*	*			cis	104	141.1	-1.6	0	0	0	0	0	114.4
667	L	30.8	Very low	30.1	Very low	166 Å²	166	123.1 Å²	123.1	87%	0.869	70%	0.697	S	S	*	*			trans	76.6	144.6	-170.8	-47.6	170.7	0	0	0	114.2
668	T	29.5	Very low	29.9	Very low	109 Å²	109	123.3 Å²	123.3	67%	0.669	69%	0.688	S	S	*	*			cis	-163.8	138.3	-23.6	19.6	0	0	0	0	109.5
669	C	26.8	Very low	30	Very low	111 Å²	111	122.1 Å²	122.1	75%	0.75	69%	0.69	S	S	*	*			trans	49.2	164.8	139.8	-57	0	0	0	0	123.7
670	T	27.3	Very low	30	Very low	125 Å²	125	120.7 Å²	120.7	77%	0.767	70%	0.696	S	S	*	*			trans	81.2	136.8	154.3	27.2	0	0	0	0	120.6
671	D	29	Very low	29.8	Very low	123 Å²	123	123 Å²	123	66%	0.658	71%	0.705	S	S	*	*			trans	82.3	72.3	151.3	-55	-11.7	0	0	0	121.8
672	N	28.7	Very low	29.6	Very low	108 Å²	108	124.8 Å²	124.8	58%	0.578	71%	0.71	S	S	*	*				59.2	130.6	108.3	-80.5	-27.8	0	0	0	122.9
673	I	28.6	Very low	29.4	Very low	141 Å²	141	127.9 Å²	127.9	72%	0.723	72%	0.72	S	S	*	*			trans	85	141.5	137.7	-72.5	168.9	0	0	0	116.7	L1013	I673-L1013 HydrophobicContact CD1-CD2 4.29Å
674	P	30.5	Very low	29.1	Very low	114 Å²	114	128.3 Å²	128.3	74%	0.74	72%	0.722	S	S	*	*			trans	-114.6	171.5	-140.9	41.8	-33.2	0	0	0	114.9
675	L	28.2	Very low	28.8	Very low	155 Å²	155	126.7 Å²	126.7	81%	0.812	72%	0.722	S	S	*	*			trans	-146.8	144.8	158.9	-109.9	161.5	0	0	0	109.7
676	N	27.8	Very low	28.3	Very low	141 Å²	141	127 Å²	127	75%	0.754	72%	0.721	S	S	*	*			trans	-133.4	107.8	-170.3	-174.7	17.6	0	0	0	110.2
677	Q	30	Very low	28.1	Very low	102 Å²	102	130.7 Å²	130.7	48%	0.477	73%	0.726	S	S	.	*			trans	165.9	152.3	164	-96.2	155.8	92.4	0	0	109.6	D1603 K1604	Q677-D1603 PolarHBondContact NE2-O 2.87Å; Q677-K1604 VanDerWaalsContact CD-O 3.25Å; Q677-K1604 PolarHBondContact NE2-O 2.85Å; Q677-K1604 PolarHBondContact OE1-O 2.98Å
678	K	29.4	Very low	27.8	Very low	119 Å²	119	128.9 Å²	128.9	52%	0.517	72%	0.716	S	S	.	*			cis	-146.1	174	35.9	-134.8	-166	-169.3	-179.9	0	116.7	T1605 N1606	K678-T1605 WeakPolarHBondContact CB-O 3.36Å; K678-T1605 WeakPolarHBondContact CD-O 3.47Å; K678-T1605 WeakPolarHBondContact CG-O 3.48Å; K678-N1606 WeakPolarHBondContact CD-O 3.25Å
679	A	30.5	Very low	27.5	Very low	91 Å²	91	130.6 Å²	130.6	75%	0.752	72%	0.721	S	S	*	*			trans	-28.6	151.5	160.9	0	0	0	0	0	119.6
680	G	30.1	Very low	27.3	Very low	75 Å²	75	131.2 Å²	131.2	77%	0.773	72%	0.716	S	S	*	*			trans	-137.5	142.4	148.4	0	0	0	0	0	109.2
681	M	29.8	Very low	27.3	Very low	179 Å²	179	130.1 Å²	130.1	88%	0.882	71%	0.713	S	S	*	*			trans	-64.7	138.3	176	-75.4	159	-179.6	0	0	110
682	E	27.8	Very low	27.1	Very low	167 Å²	167	131.6 Å²	131.6	78%	0.78	72%	0.721	S	S	*	*				65.5	109.1	63.3	-165	177	-111.5	0	0	112.2
683	N	27.3	Very low	27.1	Very low	160 Å²	160	130.8 Å²	130.8	86%	0.856	72%	0.724	S	S	*	*			trans	-164.5	145.6	142.7	-109.1	-73.4	0	0	0	110.1
684	D	24.9	Very low	27	Very low	137 Å²	137	132.8 Å²	132.8	73%	0.733	73%	0.73	S	S	*	*			trans	-63.8	165.9	176.1	-66.8	-72.8	0	0	0	111.4
685	T	25.5	Very low	26.8	Very low	107 Å²	107	134.9 Å²	134.9	66%	0.656	73%	0.73	S	S	*	*				-173.7	170.1	55.7	-29.9	0	0	0	0	111.8
686	F	23.7	Very low	26.7	Very low	176 Å²	176	137.1 Å²	137.1	77%	0.772	73%	0.733	S	S	*	*			trans	83.7	118.1	146.5	-82.6	-52.2	0	0	0	121.4
687	L	24.6	Very low	26.6	Very low	138 Å²	138	135.4 Å²	135.4	72%	0.723	73%	0.728	S	S	*	*			trans	95.8	123.5	135.6	-64.8	166.8	0	0	0	121.5
688	L	23.8	Very low	26.5	Very low	129 Å²	129	139 Å²	139	68%	0.675	74%	0.742	S	S	*	*			trans	63.9	110.9	132.7	-64.6	169.6	0	0	0	121.1
689	L	22.6	Very low	26.5	Very low	145 Å²	145	139 Å²	139	76%	0.759	75%	0.748	S	S	*	*			trans	69.2	176.5	130.7	-69.3	172.8	0	0	0	119.2
690	N	24.1	Very low	26.4	Very low	123 Å²	123	141.7 Å²	141.7	66%	0.658	74%	0.744	S	S	*	*			trans	78.1	105.1	156.2	-68	-27.8	0	0	0	119.7
691	C	25.8	Very low	26.2	Very low	103 Å²	103	145.3 Å²	145.3	70%	0.696	75%	0.745	S	S	*	*				39.7	108.4	98.2	-54.4	0	0	0	0	117.9
692	N	24.9	Very low	26.1	Very low	153 Å²	153	141.7 Å²	141.7	82%	0.818	74%	0.738	S	S	*	*			trans	-132.5	127.6	141.5	-73.1	-54.5	0	0	0	106.1
693	S	29.4	Very low	26.1	Very low	92 Å²	92	141 Å²	141	64%	0.643	74%	0.739	S	S	*	*			cis	79	62.4	8.9	94.1	0	0	0	0	118.2
694	E	25.5	Very low	26.4	Very low	182 Å²	182	139.1 Å²	139.1	85%	0.85	74%	0.736	S	S	*	*			trans	-129.8	142.6	153.8	-66.2	-177.9	152.5	0	0	108.1
695	Q	27.7	Very low	26.4	Very low	159 Å²	159	137.5 Å²	137.5	74%	0.743	74%	0.735	S	S	*	*			cis	153	120.6	-17.4	-106.4	-170.4	17	0	0	104.3
696	F	26.4	Very low	26.6	Very low	201 Å²	201	139.5 Å²	139.5	88%	0.882	75%	0.747	S	S	*	*			trans	-161.2	72.8	150.5	-121.9	-74.6	0	0	0	113.5
697	V	25.6	Very low	26.7	Very low	106 Å²	106	135.9 Å²	135.9	64%	0.642	74%	0.743	S	S	*	*				56.5	132.1	127.3	172.1	0	0	0	0	120.5
698	K	26.7	Very low	26.7	Very low	178 Å²	178	133.3 Å²	133.3	77%	0.774	73%	0.731	S	S	*	*			trans	84.6	136.8	176.6	-66.8	172.8	-178.8	178.4	0	115.9
699	D	30.2	Very low	26.8	Very low	119 Å²	119	129.9 Å²	129.9	64%	0.636	72%	0.715	S	S	*	*			cis	-159	156.4	-5.9	-96.6	-37.9	0	0	0	106.7
700	Q	27.1	Very low	26.9	Very low	146 Å²	146	129.1 Å²	129.1	68%	0.682	71%	0.712	S	S	*	*			cis	-171.8	146.4	-28.4	-132.1	-168.4	101.4	0	0	107.3
701	L	27.6	Very low	27	Very low	151 Å²	151	130.2 Å²	130.2	79%	0.791	71%	0.71	S	S	*	*			trans	64.5	148.3	161.7	-55.7	166.1	0	0	0	119
702	S	26.6	Very low	27	Very low	103 Å²	103	134 Å²	134	72%	0.72	72%	0.716	S	S	*	*			cis	-170.6	155.9	-24.9	51.7	0	0	0	0	111.8
703	N	28.2	Very low	27.2	Very low	152 Å²	152	129.1 Å²	129.1	81%	0.813	70%	0.701	S	S	*	*			trans	-42.2	165.5	161.7	-68.6	-12.1	0	0	0	114.6
704	P	33.9	Very low	27.1	Very low	121 Å²	121	128.8 Å²	128.8	79%	0.786	70%	0.695	S	S	*	*			cis	-128.4	-151.6	22	45.1	-27	0	0	0	112.5
705	S	24.8	Very low	27.2	Very low	103 Å²	103	125.9 Å²	125.9	72%	0.72	69%	0.686	S	S	*	*			cis	-158.6	165.6	7.9	39.3	0	0	0	0	112.3
706	V	29.8	Very low	27.2	Very low	150 Å²	150	122.3 Å²	122.3	91%	0.909	67%	0.669	S	S	*	*			trans	-84.5	123.5	167.3	173.8	0	0	0	0	110.9
707	S	25	Very low	27.2	Very low	99 Å²	99	117.5 Å²	117.5	69%	0.692	67%	0.667	S	S	*	*			trans	-166.2	125.8	154.6	58.4	0	0	0	0	113.4
708	N	24.8	Very low	27.3	Very low	85 Å²	85	115.9 Å²	115.9	46%	0.455	65%	0.654	S	S	.	*			trans	4.3	151.8	141.6	-81	-37.6	0	0	0	121.5	L1184 T1185	N708-L1184 VanDerWaalsContact ND2-C 3.26Å; N708-L1184 WeakPolarHBondContact ND2-CA 3.4Å; N708-L1184 PolarHBondContact ND2-N 3.44Å; N708-T1185 PolarHBondContact OD1-OG1 3.5Å
709	V	26	Very low	27.3	Very low	56 Å²	56	113.8 Å²	113.8	34%	0.339	65%	0.645	S	S	.	*			trans	79.8	117.2	145	169.7	0	0	0	0	118.5	T1185 K1186	V709-T1185 HydrophobicContact CG2-CG2 4.22Å; V709-T1185 WeakPolarHBondContact CG2-OG1 3.11Å; V709-K1186 VanDerWaalsContact CG2-N 3.26Å
710	N	25.2	Very low	27.1	Very low	130 Å²	130	113.7 Å²	113.7	70%	0.695	64%	0.643	S	S	*	*			trans	31.1	145	130.6	-45.2	-34.7	0	0	0	119.7
711	K	26.8	Very low	27.2	Very low	145 Å²	145	114.7 Å²	114.7	63%	0.63	65%	0.646	S	S	*	*			cis	-169	137.3	22.9	-147.6	167.5	178.8	-176.3	0	112.3
712	F	25.6	Very low	27.4	Very low	184 Å²	184	114 Å²	114	81%	0.807	64%	0.643	S	S	*	*			trans	62.4	163.7	154.7	-75.1	-150.9	0	0	0	114.3
713	G	28.5	Very low	27.7	Very low	50 Å²	50	113.8 Å²	113.8	52%	0.515	63%	0.634	S	S	.	*			cis	92.6	144.5	33.4	0	0	0	0	0	108.9
714	T	27.6	Very low	28	Very low	84 Å²	84	112.3 Å²	112.3	52%	0.515	63%	0.626	S	S	.	*			cis	-165.5	167.9	12.4	50.8	0	0	0	0	109
715	N	26.9	Very low	28	Very low	122 Å²	122	112.7 Å²	112.7	65%	0.652	62%	0.621	S	S	*	*			trans	-145.7	77.6	145.7	-109.8	-36	0	0	0	115.6
716	E	27.2	Very low	28.4	Very low	83 Å²	83	113.1 Å²	113.1	39%	0.388	62%	0.616	S	S	.	*				43.3	115.2	129.3	-57.3	-162.7	126.8	0	0	122.7	K1194	E716-K1194 IonicContact OE1-NZ 2.61Å; E716-K1194 PolarHBondContact OE1-NZ 2.84Å; E716-K1194 WeakPolarHBondContact OE2-CE 3.38Å; E716-K1194 WeakPolarHBondContact OE2-CG 3.49Å; E716-K1194 IonicContact OE2-NZ 2.65Å; E716-K1194 PolarHBondContact OE2-NZ 2.67Å
717	A	27.7	Very low	28.6	Very low	101 Å²	101	111.7 Å²	111.7	84%	0.835	60%	0.603	S	S	*	*				-147.1	134.9	125.5	0	0	0	0	0	111.6
718	L	27.4	Very low	28.9	Very low	71 Å²	71	113.1 Å²	113.1	37%	0.372	60%	0.603	S	S	.	*			cis	-163.5	129.2	-30.2	-121.1	163	0	0	0	110.2	T1197	L718-T1197 HydrophobicContact CD1-CG2 4Å
719	K	27.1	Very low	29.1	Very low	135 Å²	135	114.6 Å²	114.6	59%	0.587	62%	0.615	S	S	*	*			trans	32.8	134.9	145.8	-86.2	-174.5	160.5	-170	0	123.8
720	L	26.2	Very low	29.1	Very low	116 Å²	116	116.5 Å²	116.5	61%	0.607	63%	0.627	S	S	*	*			trans	73.6	149	137.8	-62.8	168	0	0	0	118.2
721	F	29.3	Very low	29.3	Very low	167 Å²	167	117.8 Å²	117.8	73%	0.732	63%	0.628	S	S	*	*			cis	-122.3	-158.5	4	-59.4	-103.2	0	0	0	109.2
722	N	31.5	Very low	29.3	Very low	136 Å²	136	116.6 Å²	116.6	73%	0.727	63%	0.628	S	S	*	*			cis	-164.8	144.6	2.1	-145.9	77.9	0	0	0	106
723	N	32.9	Very low	29.3	Very low	99 Å²	99	114 Å²	114	53%	0.529	62%	0.623	S	S	.	*			cis	-168.3	169.2	-17.4	-116.9	40.5	0	0	0	109.4
724	D	33.3	Very low	29.2	Very low	121 Å²	121	119.4 Å²	119.4	65%	0.647	64%	0.639	S	S	*	*			trans	57.8	108.1	142.9	-50.6	-12.7	0	0	0	123.3
725	D	34.4	Very low	29.2	Very low	130 Å²	130	118.9 Å²	118.9	70%	0.695	65%	0.651	S	S	*	*				115.4	107.4	105.2	-85.8	16.5	0	0	0	123.6
726	N	34.3	Very low	29.5	Very low	112 Å²	112	119 Å²	119	60%	0.599	66%	0.659	S	S	*	*				83.8	103	121.4	-77.8	-40.1	0	0	0	122.5
727	N	33.2	Very low	29.4	Very low	120 Å²	120	122.5 Å²	122.5	64%	0.642	68%	0.677	S	S	*	*				97.4	112.6	118.4	-70.4	-28.5	0	0	0	121.6
728	N	30.7	Very low	29.3	Very low	129 Å²	129	125.6 Å²	125.6	69%	0.69	67%	0.671	S	S	*	*				97.3	113.8	119.8	-80.8	-9.3	0	0	0	121.6
729	V	29	Very low	29.3	Very low	116 Å²	116	129.3 Å²	129.3	70%	0.703	69%	0.691	S	S	*	*				63.9	127.1	113.8	168.5	0	0	0	0	117.3
730	T	26.9	Very low	29.2	Very low	96 Å²	96	131 Å²	131	59%	0.589	70%	0.701	S	S	*	*			cis	-175.7	170.6	-1.6	30.1	0	0	0	0	108.1
731	H	28	Very low	29.2	Very low	156 Å²	156	134.9 Å²	134.9	72%	0.722	72%	0.719	S	S	*	*			trans	70	152.8	155	-64.2	-57.1	0	0	0	116.5
732	D	26.9	Very low	28.9	Very low	120 Å²	120	131 Å²	131	64%	0.642	71%	0.713	S	S	*	*			cis	-158.6	160.6	-16.5	-113.7	-0.5	0	0	0	111.5
733	L	26.2	Very low	28.7	Very low	131 Å²	131	130.9 Å²	130.9	69%	0.686	72%	0.721	S	S	*	*			trans	33.4	114.1	143.9	-58.3	166.5	0	0	0	120.4
734	N	26.9	Very low	28.2	Very low	162 Å²	162	131.3 Å²	131.3	87%	0.866	73%	0.727	S	S	*	*				153.9	152.9	109.1	-81.4	-57.9	0	0	0	114.1
735	G	27.6	Very low	27.9	Very low	74 Å²	74	135.7 Å²	135.7	76%	0.763	74%	0.741	S	S	*	*			trans	121	117.1	159.7	0	0	0	0	0	115.9
736	P	33.4	Very low	27.3	Very low	125 Å²	125	135.6 Å²	135.6	81%	0.812	74%	0.741	S	S	*	*			trans	-118.3	157	-175.6	40	-30.8	0	0	0	115.1
737	M	25	Very low	26.9	Very low	155 Å²	155	136.9 Å²	136.9	76%	0.764	75%	0.746	S	S	*	*			trans	-165	145.6	134.7	-104.2	-155	-171.2	0	0	112.5
738	K	24.8	Very low	26.8	Very low	167 Å²	167	137 Å²	137	73%	0.726	74%	0.743	S	S	*	*			trans	40	120.9	144	-61.5	174.3	-175.5	169.2	0	117.7
739	N	27.3	Very low	26.6	Very low	148 Å²	148	133.9 Å²	133.9	79%	0.791	73%	0.73	S	S	*	*			cis	-146.9	168.4	48.8	-103.4	-20.1	0	0	0	114.5
740	Q	25.8	Very low	26.3	Very low	170 Å²	170	133.7 Å²	133.7	79%	0.794	72%	0.72	S	S	*	*			trans	-74.5	137.6	179.7	-64.5	150.2	-69.7	0	0	111.6
741	M	26.1	Very low	26.2	Very low	198 Å²	198	132.7 Å²	132.7	98%	0.975	72%	0.717	S	S	*	*			trans	-122.8	91.4	160.6	-159.9	172.7	-162.4	0	0	107.5
742	S	23.6	Very low	26	Very low	86 Å²	86	128.4 Å²	128.4	60%	0.601	70%	0.704	S	S	*	*			trans	-145.2	122.7	-175.2	54.6	0	0	0	0	109.8
743	C	26	Very low	25.8	Very low	133 Å²	133	128.3 Å²	128.3	90%	0.899	70%	0.704	S	S	*	*			trans	-67.9	134.8	-173.8	-52.4	0	0	0	0	112.1
744	T	22.7	Very low	25.7	Very low	109 Å²	109	127.3 Å²	127.3	67%	0.669	71%	0.708	S	S	*	*			trans	-150.7	88.3	154.9	-38.2	0	0	0	0	111.2	N746	T744-N746 HydrophobicContact CG2-CB 4Å; T744-N746 VanDerWaalsContact CG2-ND2 3.28Å; T744-N746 WeakPolarHBondContact CG2-ND2 3.34Å
745	F	26.7	Very low	25.7	Very low	213 Å²	213	126.4 Å²	126.4	93%	0.934	71%	0.709	S	S	*	*			trans	-63.4	126.3	147.6	-99.7	-110.2	0	0	0	107
746	N	22.8	Very low	25.6	Very low	128 Å²	128	127.2 Å²	127.2	68%	0.684	70%	0.702	S	S	*	*			trans	-158.6	88.8	167.8	-102.5	-31.1	0	0	0	112.7	T744	T744-N746 HydrophobicContact CG2-CB 4Å; T744-N746 VanDerWaalsContact CG2-ND2 3.28Å; T744-N746 WeakPolarHBondContact CG2-ND2 3.34Å
747	L	24.8	Very low	25.2	Very low	138 Å²	138	129.3 Å²	129.3	72%	0.723	70%	0.699	S	S	*	*				29.5	109.9	126.3	-66	159	0	0	0	118.5
748	E	30.5	Very low	25.2	Very low	122 Å²	122	127.2 Å²	127.2	57%	0.57	69%	0.688	S	S	*	*				65.3	155.6	127.4	-82.7	-167	177.9	0	0	121.1	K619 F750	K619-E748 PolarHBondContact NZ-O 3.46Å; E748-F750 WeakPolarHBondContact OE2-CE2 3.42Å
749	P	27	Very low	25.3	Very low	65 Å²	65	125.8 Å²	125.8	42%	0.422	68%	0.683	S	S	.	*			cis	-141.7	167.3	30.4	41.9	-22.1	0	0	0	119.9	S617	S617-P749 WeakPolarHBondContact OG-CB 3.47Å
750	F	23.9	Very low	25.2	Very low	111 Å²	111	122.1 Å²	122.1	49%	0.487	67%	0.669	S	S	.	*			trans	10.6	145.8	139.7	-69.1	-100.8	0	0	0	121.8	S617 E748	S617-F750 VanDerWaalsContact OG-CD2 3.25Å; S617-F750 WeakPolarHBondContact OG-CD2 3.41Å; E748-F750 WeakPolarHBondContact OE2-CE2 3.42Å
751	S	23.2	Very low	25.3	Very low	75 Å²	75	122.5 Å²	122.5	52%	0.524	67%	0.669	S	S	.	*			trans	69.8	154.3	132.6	69.9	0	0	0	0	120	S616	S616-S751 WeakPolarHBondContact CB-OG 3.42Å
752	S	23.9	Very low	25.4	Very low	66 Å²	66	119.3 Å²	119.3	46%	0.462	66%	0.655	S	S	.	*			cis	-177.5	161	-17.7	51.3	0	0	0	0	110.6	W615	W615-S752 WeakPolarHBondContact CZ3-OG 3.24Å
753	N	23.3	Very low	25.6	Very low	118 Å²	118	121.2 Å²	121.2	63%	0.631	66%	0.659	S	S	*	*			trans	65.5	149.9	156.1	-71.8	-5.4	0	0	0	119.6	W615	W615-N753 WeakPolarHBondContact CH2-ND2 3.39Å; W615-N753 WeakPolarHBondContact CH2-OD1 3.12Å; W615-N753 WeakPolarHBondContact CZ3-ND2 3.26Å
754	S	24.1	Very low	25.7	Very low	111 Å²	111	121.2 Å²	121.2	78%	0.776	65%	0.65	S	S	*	*			trans	58.7	129.1	169.9	42	0	0	0	0	115.6
755	T	27.2	Very low	26	Very low	143 Å²	143	123.4 Å²	123.4	88%	0.877	65%	0.653	S	S	*	*			cis	-114.3	126.8	47.1	40.2	0	0	0	0	116
756	S	24.5	Very low	26.2	Very low	90 Å²	90	118.3 Å²	118.3	63%	0.629	64%	0.643	S	S	*	*			trans	-92.9	166.4	147.1	57	0	0	0	0	109.1
757	F	25.1	Very low	26.4	Very low	169 Å²	169	118.9 Å²	118.9	74%	0.741	65%	0.645	S	S	*	*			trans	68.5	148.5	179	-69.8	-139	0	0	0	112.2
758	E	25.8	Very low	26.6	Very low	112 Å²	112	119.8 Å²	119.8	52%	0.523	65%	0.646	S	S	.	*			cis	-158.9	169.4	-10.3	-110.2	171.5	166.9	0	0	104.8
759	E	26.5	Very low	26.5	Very low	136 Å²	136	117.4 Å²	117.4	64%	0.636	64%	0.643	S	S	*	*			cis	-157.9	173.3	13.3	-141.8	-177.3	153.9	0	0	109.3
760	S	25.3	Very low	26.6	Very low	71 Å²	71	121.8 Å²	121.8	50%	0.497	66%	0.657	S	S	.	*			trans	-9.2	135.1	163.4	72	0	0	0	0	118.9
761	K	27.9	Very low	26.8	Very low	179 Å²	179	123 Å²	123	78%	0.778	67%	0.667	S	S	*	*				-164.2	150.7	68.2	-83.6	150.6	-170.7	152.3	0	110.4
762	N	27.8	Very low	27.1	Very low	130 Å²	130	122.9 Å²	122.9	70%	0.695	67%	0.667	S	S	*	*				58.4	121.9	62.1	-76.7	81.4	0	0	0	109.9
763	D	28.5	Very low	27.4	Very low	127 Å²	127	128.3 Å²	128.3	68%	0.679	68%	0.682	S	S	*	*			cis	-152.9	178.1	14	-56.4	-66.2	0	0	0	107.1
764	D	28.4	Very low	27.7	Very low	133 Å²	133	128.5 Å²	128.5	71%	0.711	68%	0.682	S	S	*	*			cis	-159.9	178.2	-6.9	-134.4	-27.6	0	0	0	112.2
765	E	28.2	Very low	28.1	Very low	155 Å²	155	131.1 Å²	131.1	72%	0.724	68%	0.679	S	S	*	*			trans	39.7	110	148.8	-66.3	-167.5	142.5	0	0	121.2
766	S	31.1	Very low	28.3	Very low	106 Å²	106	131.3 Å²	131.3	74%	0.741	67%	0.67	S	S	*	*			trans	-27.7	150.8	137.7	58.5	0	0	0	0	116.8
767	L	27.9	Very low	28.7	Very low	139 Å²	139	134.2 Å²	134.2	73%	0.728	68%	0.679	S	S	*	*			trans	-172.6	152.1	136.5	-87.5	141	0	0	0	106.6
768	H	29	Very low	29	Very low	157 Å²	157	135.3 Å²	135.3	73%	0.727	68%	0.68	S	S	*	*			cis	-143.3	156.6	5.3	-141.2	-44.2	0	0	0	110.4
769	S	27.6	Very low	29.4	Very low	72 Å²	72	136.1 Å²	136.1	50%	0.503	69%	0.694	S	S	.	*			trans	-39.5	153.1	162.4	59.9	0	0	0	0	116
770	H	29.7	Very low	29.5	Very low	157 Å²	157	135.4 Å²	135.4	73%	0.727	69%	0.691	S	S	*	*				-162.6	128.6	117.1	-95.8	-7.8	0	0	0	111.2
771	I	28.8	Very low	29.7	Very low	137 Å²	137	141.1 Å²	141.1	70%	0.703	71%	0.71	S	S	*	*				65.7	121.2	87.3	-78.1	-175.3	0	0	0	110.7
772	S	29.2	Very low	29.7	Very low	73 Å²	73	138.2 Å²	138.2	51%	0.51	70%	0.703	S	S	.	*			cis	-177.9	164.8	13.7	-123.1	0	0	0	0	113.7
773	K	30.5	Very low	29.6	Very low	180 Å²	180	136.8 Å²	136.8	78%	0.783	70%	0.703	S	S	*	*			trans	70.1	157.8	142.2	-68.1	165.7	-168.4	174.7	0	116.7
774	L	28.4	Very low	29.5	Very low	121 Å²	121	137.4 Å²	137.4	63%	0.634	71%	0.705	S	S	*	*			cis	-157.2	168.2	-4.8	-123.1	164.7	0	0	0	111.4
775	K	32.8	Very low	29.3	Very low	166 Å²	166	135.9 Å²	135.9	72%	0.722	71%	0.705	S	S	*	*			trans	79.8	109.1	163.4	-69.8	161.8	-177.4	-178.5	0	115.6
776	Q	30.6	Very low	29.2	Very low	147 Å²	147	133.2 Å²	133.2	69%	0.687	70%	0.703	S	S	*	*				71.4	122.2	64.3	-66.9	169.7	-32.4	0	0	110.8
777	N	34.3	Very low	29	Very low	152 Å²	152	132.8 Å²	132.8	81%	0.813	70%	0.696	S	S	*	*			cis	-140.7	143	35.8	-71.2	-67.6	0	0	0	115.4
778	Y	29.8	Very low	29	Very low	192 Å²	192	134 Å²	134	75%	0.753	69%	0.692	S	S	*	*			trans	-72	160.3	151.6	-89.9	-82.3	0	0	0	109.7	Q780	Y778-Q780 HydrophobicContact CD1-CB 3.85Å; Y778-Q780 HydrophobicContact CG-CB 4.26Å
779	P	35.1	Very low	29	Very low	128 Å²	128	133.1 Å²	133.1	83%	0.831	69%	0.692	S	S	*	*				-110.6	153	66.1	-6.3	27.4	0	0	0	113.5
780	Q	28.3	Very low	29	Very low	122 Å²	122	132.7 Å²	132.7	57%	0.57	69%	0.689	S	S	*	*			cis	81.1	64.9	15.1	-156.3	-176.6	8.4	0	0	116.6	Y778 N782	Y778-Q780 HydrophobicContact CD1-CB 3.85Å; Y778-Q780 HydrophobicContact CG-CB 4.26Å; Q780-N782 HydrophobicContact CG-CB 3.58Å; Q780-N782 PolarHBondContact NE2-ND2 3.33Å
781	E	30.4	Very low	28.9	Very low	190 Å²	190	131.8 Å²	131.8	89%	0.888	68%	0.683	S	S	*	*			trans	-127.9	108.3	139.6	-67.7	-175.7	175.7	0	0	105.8
782	N	27	Very low	29	Very low	118 Å²	118	130.1 Å²	130.1	63%	0.631	68%	0.679	S	S	*	*			cis	72.5	49.2	9.5	-136.8	53.8	0	0	0	115.2	Q780	Q780-N782 HydrophobicContact CG-CB 3.58Å; Q780-N782 PolarHBondContact NE2-ND2 3.33Å
783	S	27.1	Very low	29	Very low	100 Å²	100	134.3 Å²	134.3	70%	0.699	69%	0.69	S	S	*	*			trans	-127.3	121.3	147.5	-70.9	0	0	0	0	107
784	I	25.4	Very low	28.9	Very low	141 Å²	141	131.1 Å²	131.1	72%	0.723	68%	0.682	S	S	*	*				60.7	92.6	70.4	-60.1	171.3	0	0	0	107.4
785	S	24.2	Very low	29	Very low	101 Å²	101	131.1 Å²	131.1	71%	0.706	68%	0.683	S	S	*	*				73.6	146.1	74.6	179.3	0	0	0	0	111.8
786	S	26	Very low	28.9	Very low	99 Å²	99	129.5 Å²	129.5	69%	0.692	68%	0.682	S	S	*	*			trans	64.7	167.3	175.9	72	0	0	0	0	113.7
787	T	26.3	Very low	28.6	Very low	96 Å²	96	126.9 Å²	126.9	59%	0.589	68%	0.676	S	S	*	*			cis	-149.1	173.7	11.1	-28.9	0	0	0	0	111.1
788	Y	28.9	Very low	28.4	Very low	165 Å²	165	125.4 Å²	125.4	65%	0.647	67%	0.668	S	S	*	*			trans	61.9	101.4	169.6	-63.4	-78.2	0	0	0	115.5
789	L	28.4	Very low	28.4	Very low	139 Å²	139	120.7 Å²	120.7	73%	0.728	66%	0.663	S	S	*	*				89.1	149.5	61.4	-85.4	155.5	0	0	0	113.9
790	S	26.9	Very low	27.9	Very low	63 Å²	63	120 Å²	120	44%	0.441	65%	0.653	S	S	.	*			trans	-40.6	148.2	158.9	55.7	0	0	0	0	112
791	K	28.3	Very low	27.8	Very low	138 Å²	138	120.5 Å²	120.5	60%	0.6	66%	0.659	S	S	*	*				-140.4	140.2	50.8	-79.6	155.6	-179.2	166.8	0	112	S569	S569-K791 VanDerWaalsContact CB-CD 3.43Å; S569-K791 VanDerWaalsContact OG-CD 3.24Å; S569-K791 WeakPolarHBondContact OG-CD 3.21Å; S569-K791 PolarHBondContact OG-NZ 3.31Å
792	V	30.7	Very low	27.7	Very low	102 Å²	102	115.7 Å²	115.7	62%	0.618	65%	0.652	S	S	*	*				62.7	74.9	54.5	-175.3	0	0	0	0	110.9
793	H	28.7	Very low	27.7	Very low	160 Å²	160	115.9 Å²	115.9	74%	0.741	66%	0.662	S	S	*	*				179.1	147.7	119.2	-83.9	-60.7	0	0	0	106.9
794	N	29.5	Very low	27.7	Very low	114 Å²	114	114.1 Å²	114.1	61%	0.61	65%	0.654	S	S	*	*			cis	-142.9	168.9	5.9	-135.5	0.4	0	0	0	112.7
795	N	30	Very low	27.7	Very low	121 Å²	121	114 Å²	114	65%	0.647	66%	0.66	S	S	*	*			trans	-5	133.6	143.9	-48.7	-9.3	0	0	0	114.7
796	N	30.2	Very low	27.8	Very low	132 Å²	132	115.5 Å²	115.5	71%	0.706	66%	0.659	S	S	*	*			cis	-148.3	144.2	13	-111.5	-8.6	0	0	0	109.7
797	T	25.6	Very low	27.8	Very low	91 Å²	91	113.3 Å²	113.3	56%	0.558	65%	0.651	S	S	*	*				37.8	65	50.2	42.1	0	0	0	0	112.9
798	N	28.8	Very low	27.8	Very low	121 Å²	121	117.4 Å²	117.4	65%	0.647	66%	0.661	S	S	*	*				-166.6	131.4	91.7	-81.1	-18.9	0	0	0	109.8
799	S	30.2	Very low	27.5	Very low	93 Å²	93	112.9 Å²	112.9	65%	0.65	65%	0.648	S	S	*	*			cis	45.7	72.8	20.9	82	0	0	0	0	113
800	N	25.6	Very low	27.4	Very low	115 Å²	115	113.2 Å²	113.2	62%	0.615	64%	0.644	S	S	*	*			trans	-151.9	133.7	138.3	-99.7	-29.3	0	0	0	110.8
801	N	25.4	Very low	27.3	Very low	131 Å²	131	115.5 Å²	115.5	70%	0.701	66%	0.656	S	S	*	*			trans	58.2	99	136.7	-52.8	-13.8	0	0	0	114.9
802	A	28	Very low	27.1	Very low	90 Å²	90	116.8 Å²	116.8	74%	0.744	66%	0.664	S	S	*	*			cis	51.8	143	37.1	0	0	0	0	0	112.9
803	S	28.4	Very low	26.8	Very low	121 Å²	121	119.2 Å²	119.2	85%	0.846	67%	0.672	S	S	*	*			trans	70.8	161.4	-164.8	-159.5	0	0	0	0	115.1
804	A	27.1	Very low	26.6	Very low	63 Å²	63	116.1 Å²	116.1	52%	0.521	67%	0.668	S	S	.	*			trans	54.1	81.2	159.8	0	0	0	0	0	118.9	I806	A804-I806 HydrophobicContact CB-CD1 3.81Å; A804-I806 HydrophobicContact CB-CG1 4.46Å
805	T	23.7	Very low	26.4	Very low	140 Å²	140	116.4 Å²	116.4	86%	0.859	68%	0.675	S	S	*	*				-148.3	120.4	97.3	6.6	0	0	0	0	107.5
806	I	27.5	Very low	26.1	Very low	132 Å²	132	119.5 Å²	119.5	68%	0.677	68%	0.683	S	S	*	*			cis	66	120.9	33.9	-51.8	175.2	0	0	0	112.1	A804	A804-I806 HydrophobicContact CB-CD1 3.81Å; A804-I806 HydrophobicContact CB-CG1 4.46Å
807	G	25.9	Very low	26	Very low	52 Å²	52	118.9 Å²	118.9	54%	0.536	68%	0.675	S	S	.	*			trans	77.7	155.3	-177.3	0	0	0	0	0	113.2
808	K	26.7	Very low	26.1	Very low	182 Å²	182	119.2 Å²	119.2	79%	0.791	67%	0.671	S	S	*	*			cis	-134.5	143.2	1.4	-68.8	-175.7	-177.4	177.9	0	108.8
809	D	22.7	Very low	26.1	Very low	71 Å²	71	117.2 Å²	117.2	38%	0.38	66%	0.66	S	S	.	*				62.8	144.7	52.5	-48.8	-56.2	0	0	0	112.7	F1621	D809-F1621 HydrophobicContact CB-CE2 4.48Å; D809-F1621 WeakPolarHBondContact OD1-CE2 3.49Å; D809-F1621 WeakPolarHBondContact OD1-CZ 3.13Å; D809-F1621 WeakPolarHBondContact OD2-CE1 3.48Å; D809-F1621 WeakPolarHBondContact OD2-CZ 3.38Å
810	F	25.5	Very low	25.8	Very low	146 Å²	146	117.4 Å²	117.4	64%	0.64	66%	0.661	S	S	*	*			trans	68.7	102.2	-175.8	-63.5	-88.1	0	0	0	112.9
811	T	24.5	Very low	25.9	Very low	111 Å²	111	119.3 Å²	119.3	68%	0.681	67%	0.671	S	S	*	*			cis	62.6	134.8	36.8	-31.5	0	0	0	0	112.3
812	Q	25.5	Very low	26.1	Very low	165 Å²	165	120 Å²	120	77%	0.771	67%	0.673	S	S	*	*			trans	78.8	123	-178.3	-52	-173.2	3.5	0	0	113.6
813	L	23.5	Very low	26	Very low	153 Å²	153	119.8 Å²	119.8	80%	0.801	67%	0.666	S	S	*	*			cis	91.7	101.9	40.3	-168.9	92.5	0	0	0	112.6
814	S	24.1	Very low	26.1	Very low	94 Å²	94	119.3 Å²	119.3	66%	0.657	66%	0.66	S	S	*	*			trans	75.3	167.1	150.5	78.5	0	0	0	0	121.3
815	T	25.3	Very low	26	Very low	121 Å²	121	122.5 Å²	122.5	74%	0.742	67%	0.667	S	S	*	*			trans	78.7	95.2	161.6	55.2	0	0	0	0	121.4
816	F	24.8	Very low	26.4	Very low	186 Å²	186	121.2 Å²	121.2	82%	0.816	66%	0.659	S	S	*	*				73.9	136.6	112.1	-107.1	-136.5	0	0	0	122.4
817	Q	27.4	Very low	26.3	Very low	118 Å²	118	122.7 Å²	122.7	55%	0.551	66%	0.663	S	S	*	*			trans	91.3	90.7	149.2	-64.7	-170.6	-8	0	0	122.9	T1581	Q817-T1581 PolarHBondContact OE1-OG1 3.16Å
818	Q	27.4	Very low	26.5	Very low	99 Å²	99	126.6 Å²	126.6	46%	0.463	67%	0.671	S	S	.	*				92.6	150.3	108.4	-78.1	157.9	-10.2	0	0	122.4	T1581	Q818-T1581 VanDerWaalsContact OE1-CG2 3.32Å; Q818-T1581 PolarHBondContact OE1-OG1 2.74Å
819	N	28.5	Very low	26.5	Very low	78 Å²	78	123.9 Å²	123.9	42%	0.417	67%	0.666	S	S	.	*			trans	80.7	83.1	161.1	-65.6	3.9	0	0	0	119.5	N1580 T1581 P1582	N819-N1580 PolarHBondContact ND2-O 3.41Å; N819-T1581 VanDerWaalsContact ND2-C 3.31Å; N819-T1581 PolarHBondContact ND2-N 2.96Å; N819-P1582 WeakPolarHBondContact OD1-CA 3.41Å
820	S	24.9	Very low	26.7	Very low	97 Å²	97	124.9 Å²	124.9	68%	0.678	68%	0.678	S	S	*	*				47.9	126.4	118.1	-50.5	0	0	0	0	121
821	L	28.2	Very low	26.8	Very low	156 Å²	156	126.4 Å²	126.4	82%	0.817	69%	0.685	S	S	*	*				-174.9	143.3	101.6	-95.4	163.3	0	0	0	113.9
822	I	29.8	Very low	27.1	Very low	144 Å²	144	127.7 Å²	127.7	74%	0.738	69%	0.686	S	S	*	*			trans	61.1	96.5	155.9	-57	164.2	0	0	0	117.5
823	S	24.1	Very low	27.1	Very low	86 Å²	86	125.5 Å²	125.5	60%	0.601	68%	0.684	S	S	*	*			trans	-83	162.2	142.1	-177	0	0	0	0	109.4	I825	S823-I825 PolarHBondContact OG-N 3.31Å
824	P	31.2	Very low	27.2	Very low	111 Å²	111	125 Å²	125	72%	0.721	68%	0.678	S	S	*	*				-131.1	91.8	126.3	36	-28.1	0	0	0	113.4	V826	P824-V826 PolarHBondContact O-N 3.3Å
825	I	25.2	Very low	27.4	Very low	131 Å²	131	129.7 Å²	129.7	67%	0.672	68%	0.683	S	S	*	*			trans	-58.5	116.4	142.6	-64.3	165.5	0	0	0	106.9	S823 Q827	S823-I825 PolarHBondContact OG-N 3.31Å; I825-Q827 HydrophobicContact CG2-CG 4.15Å
826	V	31.7	Very low	27.4	Very low	113 Å²	113	128.8 Å²	128.8	69%	0.685	68%	0.681	S	S	*	*			trans	-130.6	85.5	155.4	-175.6	0	0	0	0	108	P824 N828	P824-V826 PolarHBondContact O-N 3.3Å; V826-N828 PolarHBondContact O-N 2.9Å
827	Q	26.7	Very low	27.3	Very low	163 Å²	163	126.6 Å²	126.6	76%	0.762	68%	0.678	S	S	*	*			trans	-58.3	130.8	155.8	-63.1	159.8	-61	0	0	108	I825	I825-Q827 HydrophobicContact CG2-CG 4.15Å
828	N	28.1	Very low	27.3	Very low	133 Å²	133	126.7 Å²	126.7	71%	0.711	69%	0.688	S	S	*	*			trans	-168	139.9	155	-95.2	-43.8	0	0	0	109.8	V826	V826-N828 PolarHBondContact O-N 2.9Å
829	N	26.9	Very low	27.1	Very low	126 Å²	126	126.6 Å²	126.6	67%	0.674	70%	0.697	S	S	*	*			cis	-169.6	153.8	-30.2	-140	-45.2	0	0	0	107.7
830	S	27.4	Very low	27	Very low	92 Å²	92	133.6 Å²	133.6	64%	0.643	72%	0.718	S	S	*	*			trans	62.8	173.1	165.2	81.9	0	0	0	0	114.9
831	K	28.5	Very low	27	Very low	178 Å²	178	135.7 Å²	135.7	77%	0.774	72%	0.72	S	S	*	*			cis	-158.9	176.6	10.5	-142.5	158.1	-166.9	166.7	0	110
832	L	30.7	Very low	26.8	Very low	137 Å²	137	133.3 Å²	133.3	72%	0.717	72%	0.716	S	S	*	*			trans	66.2	86.5	156.9	-70.8	159.4	0	0	0	116.8
833	T	24.4	Very low	26.6	Very low	119 Å²	119	131.2 Å²	131.2	73%	0.73	71%	0.711	S	S	*	*				-22.3	165	120	50.2	0	0	0	0	117.1
834	E	26	Very low	26.8	Very low	142 Å²	142	133.8 Å²	133.8	66%	0.664	72%	0.723	S	S	*	*			trans	96.5	154.4	168.1	-53.4	-166.7	124.3	0	0	116.8
835	Y	27.6	Very low	26.5	Very low	193 Å²	193	133.4 Å²	133.4	76%	0.757	72%	0.722	S	S	*	*			trans	63.1	85.1	175.3	-53.4	-71.7	0	0	0	116.4
836	S	25.6	Very low	26.7	Very low	103 Å²	103	134.7 Å²	134.7	72%	0.72	73%	0.73	S	S	*	*				95.5	144.6	65.8	65.2	0	0	0	0	113.9
837	L	23.9	Very low	26.5	Very low	140 Å²	140	134.8 Å²	134.8	73%	0.733	73%	0.731	S	S	*	*			trans	-38.6	146.3	169.1	-107.2	69.9	0	0	0	113.6	C839	L837-C839 HydrophobicContact CD2-CB 3.84Å; L837-C839 HydrophobicContact CG-CB 4.33Å
838	P	26.7	Very low	26.8	Very low	119 Å²	119	135.3 Å²	135.3	77%	0.773	74%	0.738	S	S	*	*				-129	99	101.8	35.8	-30.2	0	0	0	114.4	R840	P838-R840 VanDerWaalsContact C-N 3.34Å; P838-R840 PolarHBondContact O-N 3.19Å; P838-R840 VanDerWaalsContact O-N 3.09Å
839	C	23.3	Very low	26.7	Very low	97 Å²	97	136.6 Å²	136.6	66%	0.655	74%	0.739	S	S	*	*			trans	-70.3	95.6	145.7	-77.9	0	0	0	0	108.9	L837	L837-C839 HydrophobicContact CD2-CB 3.84Å; L837-C839 HydrophobicContact CG-CB 4.33Å
840	R	25.8	Very low	26.9	Very low	226 Å²	226	138.5 Å²	138.5	85%	0.853	75%	0.748	S	S	*	*			trans	-135	117.2	155	-78.4	-172.7	174.3	178.6	-2	106	P838	P838-R840 VanDerWaalsContact C-N 3.34Å; P838-R840 PolarHBondContact O-N 3.19Å; P838-R840 VanDerWaalsContact O-N 3.09Å
841	I	24.5	Very low	26.8	Very low	141 Å²	141	141.8 Å²	141.8	72%	0.723	75%	0.752	S	S	*	*			cis	52.6	84	36.5	-41.6	178.4	0	0	0	111.5	T843	I841-T843 HydrophobicContact CG2-CG2 4.4Å
842	S	25.2	Very low	26.9	Very low	105 Å²	105	138.8 Å²	138.8	73%	0.734	75%	0.751	S	S	*	*			trans	-172.9	95.3	142.3	-172.8	0	0	0	0	107.6
843	T	25.5	Very low	26.8	Very low	101 Å²	101	137.3 Å²	137.3	62%	0.62	75%	0.748	S	S	*	*				64.5	85	67.9	73	0	0	0	0	115.3	I841	I841-T843 HydrophobicContact CG2-CG2 4.4Å
844	T	27	Very low	26.9	Very low	139 Å²	139	138.4 Å²	138.4	85%	0.853	75%	0.748	S	S	*	*			trans	-143.7	114.1	135.1	39.2	0	0	0	0	104.9
845	C	25.6	Very low	27.1	Very low	104 Å²	104	140 Å²	140	70%	0.703	75%	0.753	S	S	*	*			cis	64.1	79.6	46.2	-55.9	0	0	0	0	113.4
846	D	30	Very low	27.1	Very low	157 Å²	157	137.6 Å²	137.6	84%	0.84	75%	0.751	S	S	*	*			trans	-151.4	107.1	136.6	-88.2	-39.3	0	0	0	105.7
847	V	27	Very low	27.4	Very low	116 Å²	116	142.7 Å²	142.7	70%	0.703	76%	0.756	S	S	*	*				61	87.6	77	-175.2	0	0	0	0	111.9
848	L	32.4	Very low	27.6	Very low	174 Å²	174	142.3 Å²	142.3	91%	0.911	76%	0.755	S	S	*	*			trans	-131.7	102.6	154.1	-108.8	172.7	0	0	0	109.2
849	Q	26.8	Very low	28	Very low	159 Å²	159	143.6 Å²	143.6	74%	0.743	76%	0.755	S	S	*	*			trans	-77.6	137.8	176.9	-54.2	165.7	-66.8	0	0	110.3
850	I	31.5	Very low	28.5	Very low	167 Å²	167	144.8 Å²	144.8	86%	0.856	75%	0.754	S	S	*	*			trans	-137.7	97.5	141.3	-56.3	-175.9	0	0	0	108.9
851	H	25.1	Very low	28.8	Very low	160 Å²	160	140.6 Å²	140.6	74%	0.741	75%	0.749	S	S	*	*			trans	-73.9	146.3	157.3	-100.5	-58.8	0	0	0	108.7
852	P	29.6	Very low	29.2	Very low	115 Å²	115	141.7 Å²	141.7	75%	0.747	75%	0.749	S	S	*	*				-148.7	171.8	77.5	35.7	-16.5	0	0	0	115
853	T	29.3	Very low	29.5	Very low	106 Å²	106	142.6 Å²	142.6	65%	0.65	75%	0.752	S	S	*	*			cis	-163.5	130.3	-25.4	-86	0	0	0	0	106.3
854	I	26.9	Very low	30	Very low	143 Å²	143	144.8 Å²	144.8	73%	0.733	76%	0.755	S	S	*	*			trans	-78.6	140.1	172	-67.3	173.7	0	0	0	109.6	I856	I854-I856 HydrophobicContact CG2-CD1 4.09Å; I854-I856 HydrophobicContact CG2-CG1 3.84Å
855	K	29	Very low	30.3	Very low	176 Å²	176	144.5 Å²	144.5	77%	0.765	75%	0.748	S	S	*	*			trans	-124.2	97.3	158.2	-81.4	-163.5	173.9	-169.1	0	109.9
856	I	28.8	Very low	30.7	Very low	141 Å²	141	145.3 Å²	145.3	72%	0.723	75%	0.746	S	S	*	*			trans	-86.3	138.3	156.5	-67.9	164	0	0	0	106.5	I854	I854-I856 HydrophobicContact CG2-CD1 4.09Å; I854-I856 HydrophobicContact CG2-CG1 3.84Å
857	Y	31.5	Very low	30.6	Very low	210 Å²	210	145.1 Å²	145.1	82%	0.824	74%	0.744	S	S	*	*			trans	-106.4	122.7	158.4	-99.4	-81.2	0	0	0	107.8
858	D	29	Very low	30.6	Very low	133 Å²	133	144.2 Å²	144.2	71%	0.711	74%	0.743	S	S	*	*			trans	-102.6	142.2	174.2	173.5	21.8	0	0	0	108.4
859	L	33.4	Very low	30.5	Very low	145 Å²	145	142 Å²	142	76%	0.759	74%	0.737	S	S	*	*			trans	-163.7	84.6	171.7	-109.7	177.5	0	0	0	113.3
860	N	33.6	Very low	30.5	Very low	122 Å²	122	140.2 Å²	140.2	65%	0.652	74%	0.737	S	S	*	*			trans	68.3	123.5	151.8	-60.8	-33.9	0	0	0	119.6
861	N	32.6	Very low	30.4	Very low	138 Å²	138	141.9 Å²	141.9	74%	0.738	74%	0.737	S	S	*	*				76.5	89.8	54.5	-69.8	-49.1	0	0	0	116
862	K	32.8	Very low	30.6	Very low	165 Å²	165	140.3 Å²	140.3	72%	0.717	74%	0.739	S	S	*	*				164.4	135.1	118.1	-97.9	-164.8	164.4	-142.9	0	114	E864	K862-E864 IonicContact NZ-OE1 2.72Å; K862-E864 PolarHBondContact NZ-OE1 3.09Å; K862-E864 IonicContact NZ-OE2 3.51Å
863	P	32	Very low	30.6	Very low	124 Å²	124	140.3 Å²	140.3	81%	0.805	74%	0.737	S	S	*	*			trans	-115.7	124.9	161	35.5	-23.8	0	0	0	113.2
864	E	35.7	Very low	30.4	Very low	147 Å²	147	141.8 Å²	141.8	69%	0.687	74%	0.741	S	S	*	*			trans	-160.5	152.1	174	-91.1	160.9	-135	0	0	106.4	K862	K862-E864 IonicContact NZ-OE1 2.72Å; K862-E864 PolarHBondContact NZ-OE1 3.09Å; K862-E864 IonicContact NZ-OE2 3.51Å
865	N	34.2	Very low	30.4	Very low	132 Å²	132	138.6 Å²	138.6	71%	0.706	73%	0.731	S	S	*	*			cis	-161.6	171.4	-32.5	-133.6	39.9	0	0	0	107.5
866	D	32.9	Very low	30.4	Very low	122 Å²	122	137.7 Å²	137.7	65%	0.652	73%	0.727	S	S	*	*			trans	53.1	114.8	149.4	-65.9	-42.4	0	0	0	124.2
867	L	28.4	Very low	30.3	Very low	152 Å²	152	141.4 Å²	141.4	80%	0.796	73%	0.731	S	S	*	*				58.9	124	119.6	-108.5	71.8	0	0	0	123.4
868	S	27.4	Very low	30.2	Very low	97 Å²	97	135.2 Å²	135.2	68%	0.678	72%	0.719	S	S	*	*				100.9	150.6	118.9	79.4	0	0	0	0	122.6
869	T	29.9	Very low	30.3	Very low	128 Å²	128	136.3 Å²	136.3	79%	0.785	72%	0.723	S	S	*	*			trans	59.3	89.2	160.3	38.6	0	0	0	0	120.4
870	V	26.9	Very low	30.1	Very low	122 Å²	122	132.1 Å²	132.1	74%	0.739	72%	0.715	S	S	*	*				-7.7	128.6	128.9	178.9	0	0	0	0	115.3
871	K	29.9	Very low	29.8	Very low	201 Å²	201	131.8 Å²	131.8	87%	0.874	72%	0.717	S	S	*	*			trans	-147.2	114.1	143.2	-124.7	170	-172.3	172.8	0	112.4
872	V	29.3	Very low	29.7	Very low	128 Å²	128	132.3 Å²	132.3	78%	0.776	72%	0.715	S	S	*	*			trans	-67	132.6	166.1	172.2	0	0	0	0	109
873	T	28.7	Very low	29.5	Very low	115 Å²	115	130.8 Å²	130.8	71%	0.706	71%	0.714	S	S	*	*			trans	-161.6	132.4	141.2	10.3	0	0	0	0	110.2
874	D	26.6	Very low	29.2	Very low	137 Å²	137	130 Å²	130	73%	0.733	71%	0.707	S	S	*	*				34	138.1	122.9	-80.2	-51.4	0	0	0	119.8
875	C	26.4	Very low	28.9	Very low	76 Å²	76	129.1 Å²	129.1	51%	0.514	71%	0.707	S	S	.	*			cis	-173.2	170.4	30.7	-139.8	0	0	0	0	114.6
876	K	28	Very low	28.5	Very low	157 Å²	157	129 Å²	129	68%	0.683	71%	0.706	S	S	*	*			trans	65.3	108.5	142.7	-79	151.1	-167	134.6	0	119.6
877	R	27.9	Very low	28.2	Very low	219 Å²	219	129.9 Å²	129.9	83%	0.826	71%	0.711	S	S	*	*				89.4	146	112	-80.2	-179.3	170	174.8	-5.6	118.2
878	S	29	Very low	28.2	Very low	79 Å²	79	128.8 Å²	128.8	55%	0.552	71%	0.706	S	S	*	*			cis	173.1	174.3	-20	48.7	0	0	0	0	107.8
879	I	30.1	Very low	28	Very low	156 Å²	156	127.8 Å²	127.8	80%	0.8	70%	0.699	S	S	*	*			trans	70.8	94.7	167.1	-49.6	148.6	0	0	0	111.5
880	G	29.6	Very low	27.8	Very low	57 Å²	57	127.8 Å²	127.8	59%	0.588	69%	0.693	S	S	*	*			cis	89.9	167.2	5	0	0	0	0	0	114.1
881	T	28.4	Very low	27.7	Very low	116 Å²	116	129.7 Å²	129.7	71%	0.712	69%	0.692	S	S	*	*			trans	68.3	157.8	-171.2	82.1	0	0	0	0	113.8
882	H	30.1	Very low	27.6	Very low	149 Å²	149	127.4 Å²	127.4	69%	0.69	69%	0.687	S	S	*	*			cis	-116.2	134.9	-7.4	-100	-86.5	0	0	0	107.7
883	L	27.2	Very low	27.4	Very low	133 Å²	133	125 Å²	125	70%	0.696	69%	0.689	S	S	*	*				57.2	144	89.4	-90	83.4	0	0	0	113.7
884	V	27.2	Very low	27.5	Very low	108 Å²	108	124.4 Å²	124.4	66%	0.655	69%	0.687	S	S	*	*			cis	159.8	170.7	-8.8	122.3	0	0	0	0	104.4
885	N	27.9	Very low	27.5	Very low	127 Å²	127	124.6 Å²	124.6	68%	0.679	69%	0.687	S	S	*	*			trans	73.7	119.5	175	-72	-15.5	0	0	0	113.2
886	N	26.5	Very low	27.5	Very low	131 Å²	131	128.3 Å²	128.3	70%	0.701	70%	0.697	S	S	*	*				75.1	139	61.1	-64.7	4.1	0	0	0	111
887	N	26.4	Very low	27.4	Very low	140 Å²	140	127.1 Å²	127.1	75%	0.749	70%	0.697	S	S	*	*			trans	70.3	144.2	168.6	-58.2	15.3	0	0	0	114.5
888	D	27.8	Very low	27.2	Very low	128 Å²	128	121.5 Å²	121.5	68%	0.684	68%	0.684	S	S	*	*			cis	-136.3	159.2	-5.7	-132.1	-50.5	0	0	0	113.6
889	S	24.8	Very low	27.1	Very low	77 Å²	77	124.7 Å²	124.7	54%	0.538	69%	0.69	S	S	.	*			trans	-56.5	-173.7	159.7	64.2	0	0	0	0	112.6
890	L	25.3	Very low	26.9	Very low	127 Å²	127	123.4 Å²	123.4	67%	0.665	69%	0.685	S	S	*	*			trans	72	105.4	154.2	-96.7	60.7	0	0	0	117.8
891	K	24.2	Very low	26.8	Very low	163 Å²	163	128.3 Å²	128.3	71%	0.709	69%	0.69	S	S	*	*				93.7	156.5	109.9	-93.7	176.1	-165	163.4	0	120.2
892	I	28.2	Very low	26.7	Very low	152 Å²	152	131.7 Å²	131.7	78%	0.779	70%	0.695	S	S	*	*			trans	60.4	98.4	155.3	-59.9	150.4	0	0	0	114.2
893	G	26.2	Very low	26.6	Very low	79 Å²	79	127.9 Å²	127.9	81%	0.814	70%	0.696	S	S	*	*			cis	141.1	-112.8	-6.4	0	0	0	0	0	113.4
894	P	30.3	Very low	26.4	Very low	102 Å²	102	127.6 Å²	127.6	66%	0.662	69%	0.694	S	S	*	*			trans	-106.4	-172.7	-133.9	40	-34.5	0	0	0	114
895	L	26.2	Very low	26.4	Very low	140 Å²	140	130.4 Å²	130.4	73%	0.733	70%	0.702	S	S	*	*			trans	77.2	144.1	175.8	-49.7	152.4	0	0	0	111.9
896	Q	26.2	Very low	26.2	Very low	154 Å²	154	129.8 Å²	129.8	72%	0.72	70%	0.703	S	S	*	*			cis	-142.9	136.3	2.5	-128.3	151	14.6	0	0	105.9
897	L	26	Very low	26.3	Very low	132 Å²	132	128.9 Å²	128.9	69%	0.691	70%	0.698	S	S	*	*				54.4	130.5	55.7	-130.4	179.7	0	0	0	111.2
898	N	24.4	Very low	26.6	Very low	102 Å²	102	128 Å²	128	55%	0.545	70%	0.7	S	S	.	*			trans	73.4	115.6	178.9	-63.5	-22.2	0	0	0	114.4
899	Q	26.5	Very low	26.4	Very low	145 Å²	145	126.6 Å²	126.6	68%	0.678	70%	0.696	S	S	*	*				83.4	134.2	96.3	-69.7	156.7	1.2	0	0	110.5
900	D	26	Very low	26.5	Very low	129 Å²	129	129.2 Å²	129.2	69%	0.69	70%	0.704	S	S	*	*			cis	-143.8	153.9	48.2	-132.5	-23.1	0	0	0	117.7
901	F	27.8	Very low	26.6	Very low	160 Å²	160	130.8 Å²	130.8	70%	0.702	71%	0.707	S	S	*	*			trans	-50.3	141.5	161	-68.4	-108.1	0	0	0	112.8
902	K	26.2	Very low	26.6	Very low	187 Å²	187	130.6 Å²	130.6	81%	0.813	71%	0.709	S	S	*	*				169.7	169.5	119.3	-92.6	152.8	-172	155.7	0	113.1	I904	K902-I904 HydrophobicContact CG-CD1 4.26Å
903	G	26.6	Very low	26.6	Very low	69 Å²	69	132.1 Å²	132.1	71%	0.711	71%	0.713	S	S	*	*			trans	92.4	51.5	170.3	0	0	0	0	0	113.7
904	I	24.6	Very low	26.7	Very low	128 Å²	128	134.8 Å²	134.8	66%	0.656	71%	0.708	S	S	*	*				62	92.9	69.9	-63.1	171	0	0	0	112.5	K902	K902-I904 HydrophobicContact CG-CD1 4.26Å
905	M	25.8	Very low	26.8	Very low	166 Å²	166	134.8 Å²	134.8	82%	0.818	71%	0.709	S	S	*	*				62.3	177.1	129.9	-55.1	175.5	90.7	0	0	120.7
906	T	24.9	Very low	26.9	Very low	114 Å²	114	137.2 Å²	137.2	70%	0.699	71%	0.709	S	S	*	*			trans	69.7	100.1	159.9	46.7	0	0	0	0	117.9
907	D	28.6	Very low	27	Very low	113 Å²	113	134.8 Å²	134.8	60%	0.604	71%	0.709	S	S	*	*				60.8	141.3	110.2	-84.5	-79.7	0	0	0	119.7	T909	D907-T909 WeakPolarHBondContact OD1-CB 3.4Å; D907-T909 WeakPolarHBondContact OD1-CG2 3.22Å; D907-T909 PolarHBondContact OD1-N 3.42Å; D907-T909 PolarHBondContact OD1-OG1 3.17Å
908	P	31.6	Very low	27	Very low	122 Å²	122	133 Å²	133	79%	0.792	71%	0.708	S	S	*	*			cis	-125.3	131.5	48.4	40.2	-28.1	0	0	0	117.4
909	T	25.1	Very low	27.3	Very low	97 Å²	97	137 Å²	137	60%	0.595	72%	0.723	S	S	*	*				-28.9	174.1	128.9	35	0	0	0	0	117	D907	D907-T909 WeakPolarHBondContact OD1-CB 3.4Å; D907-T909 WeakPolarHBondContact OD1-CG2 3.22Å; D907-T909 PolarHBondContact OD1-N 3.42Å; D907-T909 PolarHBondContact OD1-OG1 3.17Å
910	L	26.2	Very low	27.6	Very low	133 Å²	133	135.5 Å²	135.5	70%	0.696	73%	0.729	S	S	*	*			trans	77.6	140.1	174.4	-57.2	135.7	0	0	0	114.1
911	E	26.9	Very low	28	Very low	160 Å²	160	134.7 Å²	134.7	75%	0.748	73%	0.729	S	S	*	*			cis	-127.5	132.7	0.5	-109.5	142.8	-146.9	0	0	109.2
912	Q	25	Very low	28.2	Very low	159 Å²	159	132.8 Å²	132.8	74%	0.743	73%	0.732	S	S	*	*				41.4	103.3	98.5	-57.6	-173.2	10	0	0	114.9
913	Q	27.9	Very low	28.2	Very low	184 Å²	184	129.8 Å²	129.8	86%	0.86	73%	0.725	S	S	*	*				-167.8	117.4	109.5	-105.1	167.5	44	0	0	113.6
914	N	28.7	Very low	28.4	Very low	134 Å²	134	132.8 Å²	132.8	72%	0.717	72%	0.724	S	S	*	*			trans	-48.8	149	134.7	-88.2	-31	0	0	0	108.6
915	P	32.5	Very low	28.6	Very low	103 Å²	103	131.5 Å²	131.5	67%	0.669	72%	0.722	S	S	*	*				-153.8	152.8	52.6	45.6	-26.5	0	0	0	118.8
916	Y	27.7	Very low	28.7	Very low	190 Å²	190	129.9 Å²	129.9	75%	0.745	72%	0.717	S	S	*	*				55.5	135	125.4	-78.2	-122.9	0	0	0	121.9
917	S	27.2	Very low	28.9	Very low	103 Å²	103	132.8 Å²	132.8	72%	0.72	72%	0.723	S	S	*	*				73.2	154.1	125.4	76.5	0	0	0	0	119.5
918	S	27.8	Very low	28.8	Very low	95 Å²	95	132.2 Å²	132.2	66%	0.664	72%	0.724	S	S	*	*			cis	-167.9	-155.4	-22	50.8	0	0	0	0	107.2
919	E	29.2	Very low	28.6	Very low	186 Å²	186	133.7 Å²	133.7	87%	0.869	72%	0.722	S	S	*	*			trans	74.1	130.2	173.2	-46.6	-172.7	156.9	0	0	112.9
920	S	33.3	Very low	28.8	Very low	113 Å²	113	136.8 Å²	136.8	79%	0.79	73%	0.727	S	S	*	*			cis	-140.3	116.8	14.3	57.4	0	0	0	0	113.9
921	T	33.4	Very low	28.9	Very low	113 Å²	113	136.3 Å²	136.3	69%	0.693	72%	0.724	S	S	*	*			trans	-56	158	136.5	24.3	0	0	0	0	109.8	L923	T921-L923 HydrophobicContact CG2-CB 4.18Å; T921-L923 HydrophobicContact CG2-CD1 4.37Å
922	P	32.7	Very low	28.9	Very low	119 Å²	119	135.6 Å²	135.6	77%	0.773	73%	0.725	S	S	*	*			cis	-121.7	156.6	35.3	17.4	6.9	0	0	0	114.7
923	L	27	Very low	29	Very low	125 Å²	125	132.6 Å²	132.6	65%	0.654	72%	0.722	S	S	*	*			cis	84.9	127.9	31.8	-169	139.8	0	0	0	114.2	T921	T921-L923 HydrophobicContact CG2-CB 4.18Å; T921-L923 HydrophobicContact CG2-CD1 4.37Å
924	N	29.3	Very low	29	Very low	131 Å²	131	131.7 Å²	131.7	70%	0.701	72%	0.718	S	S	*	*			trans	68.9	153.1	172.4	-83	-14.1	0	0	0	118.1
925	T	29.3	Very low	28.9	Very low	101 Å²	101	131.4 Å²	131.4	62%	0.62	72%	0.715	S	S	*	*			cis	-148.1	151.7	4.3	-4.9	0	0	0	0	111.2
926	N	28.4	Very low	28.6	Very low	133 Å²	133	132.2 Å²	132.2	71%	0.711	71%	0.713	S	S	*	*			trans	35.2	130.8	142.3	-53.1	-12.1	0	0	0	119.8
927	Q	28.8	Very low	28.6	Very low	175 Å²	175	129.9 Å²	129.9	82%	0.818	71%	0.712	S	S	*	*				-168.2	117.6	81.5	-93.1	-163.8	15.4	0	0	114.7
928	T	27.1	Very low	28.5	Very low	101 Å²	101	131.9 Å²	131.9	62%	0.62	72%	0.715	S	S	*	*				74.9	116.1	115.9	-51.2	0	0	0	0	120.9
929	M	27.9	Very low	28.4	Very low	153 Å²	153	132.2 Å²	132.2	75%	0.754	71%	0.713	S	S	*	*			trans	81.3	98.1	148.2	-72.5	-178.7	-167.2	0	0	121.5
930	K	27.7	Very low	28.3	Very low	161 Å²	161	131 Å²	131	70%	0.7	71%	0.712	S	S	*	*				108.4	111.9	98.3	-88.9	-176.6	169.1	-169.4	0	119.6
931	I	28.3	Very low	28	Very low	123 Å²	123	130.5 Å²	130.5	63%	0.631	71%	0.708	S	S	*	*				84.8	129.3	119.5	-75	176.1	0	0	0	118.3
932	D	27.9	Very low	27.7	Very low	145 Å²	145	130 Å²	130	78%	0.775	71%	0.709	S	S	*	*			trans	54.1	127.3	159.2	-56.7	-7.2	0	0	0	118.9
933	S	27.7	Very low	27.5	Very low	97 Å²	97	134 Å²	134	68%	0.678	72%	0.717	S	S	*	*			cis	-176.5	139.2	4.2	40.1	0	0	0	0	110.1
934	Q	26.7	Very low	27.4	Very low	165 Å²	165	134.7 Å²	134.7	77%	0.771	72%	0.722	S	S	*	*			trans	63.6	101.2	138	-70.2	-163.4	-73.2	0	0	121.6
935	I	27.4	Very low	27.4	Very low	128 Å²	128	132.4 Å²	132.4	66%	0.656	72%	0.716	S	S	*	*				85.6	116.1	101.2	-88.1	171.9	0	0	0	118.6
936	D	26.9	Very low	27.2	Very low	119 Å²	119	134.8 Å²	134.8	64%	0.636	72%	0.724	S	S	*	*			trans	70	112.2	142	-54.4	-3.9	0	0	0	118.8
937	I	27.2	Very low	27.1	Very low	141 Å²	141	134.8 Å²	134.8	72%	0.723	72%	0.723	S	S	*	*				59.4	100.5	56.5	-50.6	163.3	0	0	0	109.7
938	N	25.5	Very low	26.9	Very low	146 Å²	146	133.1 Å²	133.1	78%	0.781	72%	0.718	S	S	*	*				-143.1	132.1	97.7	-141.9	1.7	0	0	0	114.2
939	V	25.6	Very low	26.7	Very low	102 Å²	102	133.2 Å²	133.2	62%	0.618	72%	0.723	S	S	*	*			trans	-89.7	140.4	160.6	171.5	0	0	0	0	106
940	N	26.4	Very low	26.5	Very low	159 Å²	159	131.7 Å²	131.7	85%	0.85	72%	0.722	S	S	*	*			trans	-141.7	99.9	148.1	-119.5	-6	0	0	0	108.3
941	C	26.5	Very low	26.2	Very low	103 Å²	103	132.1 Å²	132.1	70%	0.696	73%	0.727	S	S	*	*			trans	-75.7	162.5	168.6	-69.4	0	0	0	0	109.5
942	S	27.5	Very low	26	Very low	102 Å²	102	131.4 Å²	131.4	71%	0.713	73%	0.731	S	S	*	*			trans	-50.5	154.8	161.2	54.6	0	0	0	0	112.5
943	E	27.8	Very low	25.8	Very low	203 Å²	203	132 Å²	132	95%	0.949	73%	0.729	S	S	*	*				-138.3	162.5	111.6	-128.3	173	-144.4	0	0	110.1
944	D	26.6	Very low	25.7	Very low	141 Å²	141	132.9 Å²	132.9	75%	0.754	73%	0.727	S	S	*	*			trans	-128.5	160.8	-150.9	-169	11	0	0	0	112.2
945	S	28.3	Very low	25.7	Very low	82 Å²	82	132.3 Å²	132.3	57%	0.573	73%	0.729	S	S	*	*			trans	76.8	157.7	152	81.6	0	0	0	0	120.6
946	L	25.8	Very low	25.7	Very low	152 Å²	152	130.7 Å²	130.7	80%	0.796	73%	0.729	S	S	*	*			trans	74.5	148.1	163.6	-59.7	166.3	0	0	0	115.4
947	L	25.2	Very low	25.8	Very low	132 Å²	132	130.5 Å²	130.5	69%	0.691	73%	0.732	S	S	*	*			cis	-156.9	168.2	19.1	-132.7	149.7	0	0	0	110.2
948	I	25.1	Very low	25.8	Very low	140 Å²	140	130.6 Å²	130.6	72%	0.718	73%	0.728	S	S	*	*			trans	75.5	121	165.6	-55.9	151	0	0	0	113.9
949	S	21.9	Very low	26	Very low	104 Å²	104	128.5 Å²	128.5	73%	0.727	72%	0.716	S	S	*	*			cis	90.7	155.6	26.5	-52.3	0	0	0	0	116.1
950	V	24.7	Very low	26.3	Very low	120 Å²	120	127.9 Å²	127.9	73%	0.727	72%	0.717	S	S	*	*			trans	86	96.2	166.2	-166.8	0	0	0	0	117.6
951	E	21.9	Very low	26.5	Very low	170 Å²	170	125.9 Å²	125.9	79%	0.794	71%	0.706	S	S	*	*				38.1	135.9	120.6	-63.3	173.7	146.1	0	0	122.9
952	C	23.5	Very low	26.7	Very low	108 Å²	108	127.6 Å²	127.6	73%	0.73	71%	0.707	S	S	*	*			trans	82.7	117.8	138	-70.3	0	0	0	0	122.7
953	E	24	Very low	26.9	Very low	157 Å²	157	129.6 Å²	129.6	73%	0.734	70%	0.703	S	S	*	*				73.4	116.1	125.4	-66.9	-153.1	119.5	0	0	122.9
954	N	26	Very low	27	Very low	117 Å²	117	127.4 Å²	127.4	63%	0.626	69%	0.692	S	S	*	*				70.2	130.1	126.4	-59	-27.1	0	0	0	121.4
955	N	27	Very low	27.2	Very low	152 Å²	152	126.4 Å²	126.4	81%	0.813	69%	0.687	S	S	*	*			trans	70.7	142.6	152.5	-59.6	-29.2	0	0	0	118.3
956	S	27.3	Very low	27.1	Very low	95 Å²	95	129.5 Å²	129.5	66%	0.664	69%	0.694	S	S	*	*			cis	-167.2	144.6	-16.2	50	0	0	0	0	110.8
957	T	27.3	Very low	27.1	Very low	114 Å²	114	128.9 Å²	128.9	70%	0.699	69%	0.692	S	S	*	*			trans	11.6	137.7	147.7	54.8	0	0	0	0	121
958	F	27	Very low	27.2	Very low	143 Å²	143	128 Å²	128	63%	0.627	70%	0.697	S	S	*	*				-174.9	132.2	103.9	-108.9	-111.8	0	0	0	108
959	N	31.1	Very low	27.2	Very low	102 Å²	102	126.9 Å²	126.9	55%	0.545	70%	0.7	S	S	.	*				67.3	149.4	71.3	-93.7	-5	0	0	0	114.3
960	S	31.8	Very low	27.5	Very low	89 Å²	89	127.9 Å²	127.9	62%	0.622	70%	0.702	S	S	*	*			cis	-149.2	-151.2	-13.4	46	0	0	0	0	108
961	D	29.6	Very low	27.5	Very low	117 Å²	117	130.1 Å²	130.1	63%	0.626	71%	0.706	S	S	*	*			cis	-169.7	-169	16.1	-150.7	-84.2	0	0	0	110.5
962	I	31.7	Very low	27.9	Very low	140 Å²	140	128.3 Å²	128.3	72%	0.718	71%	0.707	S	S	*	*			trans	72.3	125.1	156.7	-66.6	168.1	0	0	0	118.7
963	K	30.6	Very low	28.2	Very low	144 Å²	144	130 Å²	130	63%	0.626	71%	0.709	S	S	*	*			cis	-175.9	145.4	-21	-118.5	169.5	-162.6	164.5	0	110.6
964	Q	30.2	Very low	28.5	Very low	156 Å²	156	130.6 Å²	130.6	73%	0.729	71%	0.709	S	S	*	*			trans	66.6	155.3	146.6	-68.7	167	-15	0	0	118.3
965	N	30.7	Very low	28.7	Very low	120 Å²	120	131.3 Å²	131.3	64%	0.642	71%	0.708	S	S	*	*			cis	-155.1	135.9	-1	-128.3	4.2	0	0	0	114.5
966	M	26.2	Very low	28.8	Very low	148 Å²	148	129.6 Å²	129.6	73%	0.729	70%	0.704	S	S	*	*			trans	50.6	125.3	136.4	-72.2	-175.3	-179.1	0	0	125.6
967	N	26.7	Very low	29	Very low	139 Å²	139	132.6 Å²	132.6	74%	0.743	71%	0.711	S	S	*	*				85.5	98.6	127.8	-61.5	-5.7	0	0	0	124
968	S	26.3	Very low	29	Very low	114 Å²	114	132.4 Å²	132.4	80%	0.797	71%	0.71	S	S	*	*				40.8	127.9	113.7	-166.9	0	0	0	0	122.2
969	C	25.4	Very low	29.3	Very low	115 Å²	115	132.4 Å²	132.4	78%	0.777	72%	0.717	S	S	*	*				165.6	175.2	98.8	-161.5	0	0	0	0	114
970	V	27.8	Very low	29.2	Very low	126 Å²	126	131.8 Å²	131.8	76%	0.764	72%	0.72	S	S	*	*			trans	89.5	91.1	158.5	-164.3	0	0	0	0	121.2
971	M	26.1	Very low	29.1	Very low	167 Å²	167	134.2 Å²	134.2	82%	0.823	73%	0.725	S	S	*	*				14.4	129.7	127.1	-75.2	-85.7	-152.7	0	0	122
972	T	29.7	Very low	29.1	Very low	131 Å²	131	134.8 Å²	134.8	80%	0.804	73%	0.726	S	S	*	*				174.6	127.1	110.2	27.9	0	0	0	0	109.8
973	N	29.8	Very low	29	Very low	145 Å²	145	135.4 Å²	135.4	78%	0.775	73%	0.726	S	S	*	*				93	147.5	62.7	-166.7	13.5	0	0	0	113.3
974	K	29.4	Very low	28.9	Very low	168 Å²	168	134.8 Å²	134.8	73%	0.73	73%	0.728	S	S	*	*			trans	89.2	147.6	179.8	-68.6	-155.8	166.5	-146.4	0	117.7
975	Q	30.5	Very low	28.7	Very low	133 Å²	133	135.2 Å²	135.2	62%	0.621	73%	0.73	S	S	*	*			cis	-169.6	110.5	-16.1	171.7	-171.6	-80.3	0	0	112.7
976	T	29.9	Very low	28.6	Very low	116 Å²	116	134.3 Å²	134.3	71%	0.712	73%	0.732	S	S	*	*			trans	73.2	154.7	147.3	-39	0	0	0	0	114.2
977	L	31.6	Very low	28.6	Very low	157 Å²	157	133 Å²	133	82%	0.822	73%	0.733	S	S	*	*			cis	-140.7	140.2	41.2	-147.3	113.2	0	0	0	116.2
978	T	27.5	Very low	28.5	Very low	110 Å²	110	130.9 Å²	130.9	68%	0.675	73%	0.725	S	S	*	*			trans	-92.7	162.2	171.9	-34.1	0	0	0	0	110.1
979	N	33	Very low	28.6	Very low	144 Å²	144	130.1 Å²	130.1	77%	0.77	71%	0.709	S	S	*	*				-168.2	143.3	127.1	-101.3	-8.9	0	0	0	114.9
980	S	28.8	Very low	28.7	Very low	88 Å²	88	129.3 Å²	129.3	62%	0.615	70%	0.696	S	S	*	*			trans	66.1	113.5	154.7	-55.9	0	0	0	0	119.3
981	L	29.6	Very low	29.1	Very low	140 Å²	140	128.1 Å²	128.1	73%	0.733	69%	0.691	S	S	*	*				85.2	139.6	55.6	-82.7	47.8	0	0	0	111.1
982	M	29.5	Very low	29.2	Very low	129 Å²	129	124.9 Å²	124.9	64%	0.635	68%	0.677	S	S	*	*			cis	-158.6	140.4	10.9	-138	141.6	178.8	0	0	112.1
983	E	28.9	Very low	28.9	Very low	154 Å²	154	122.6 Å²	122.6	72%	0.72	67%	0.666	S	S	*	*			trans	54.1	160.4	135.8	-68.4	165.3	-158	0	0	121.3
984	L	28.3	Very low	28.8	Very low	130 Å²	130	122.9 Å²	122.9	68%	0.681	67%	0.667	S	S	*	*			cis	-145.7	135.4	5.8	-159.1	69.6	0	0	0	113.6
985	E	26.9	Very low	28.6	Very low	165 Å²	165	119.1 Å²	119.1	77%	0.771	66%	0.662	S	S	*	*			trans	15.3	162.2	150.1	-49.8	-177.1	137.2	0	0	127.7
986	C	28.9	Very low	28.4	Very low	101 Å²	101	119.1 Å²	119.1	68%	0.682	67%	0.671	S	S	*	*			trans	96.1	75.4	139.9	-79.3	0	0	0	0	124
987	T	25.4	Very low	28.3	Very low	120 Å²	120	120.4 Å²	120.4	74%	0.736	67%	0.674	S	S	*	*				61.7	140	115.2	52.6	0	0	0	0	125.4
988	T	25.9	Very low	28.1	Very low	96 Å²	96	119.9 Å²	119.9	59%	0.589	68%	0.677	S	S	*	*			trans	87.7	105.4	141.7	42.8	0	0	0	0	123.9	W1159	T988-W1159 HydrophobicContact CG2-CH2 4.32Å
989	H	27	Very low	28.2	Very low	98 Å²	98	120 Å²	120	45%	0.454	68%	0.682	S	S	.	*			trans	61.7	104	142.5	-59	-79.5	0	0	0	124	N1158 W1159	H989-N1158 PolarHBondContact O-ND2 2.93Å; H989-W1159 HydrophobicContact CB-CZ2 4.39Å; H989-W1159 AromaticContact CD2-CE2 3.77Å; H989-W1159 AromaticContact CD2-CH2 3.85Å; H989-W1159 AromaticContact CD2-CZ2 3.15Å; H989-W1159 WeakPolarHBondContact CD2-CZ2 3.24Å; H989-W1159 AromaticContact CG-CZ2 3.97Å; H989-W1159 AromaticContact NE2-CZ2 3.72Å
990	L	28.5	Very low	28.2	Very low	98 Å²	98	118 Å²	118	51%	0.513	69%	0.685	S	S	.	*				148.2	-81.4	93.9	-68.8	40.7	0	0	0	122	R1157	L990-R1157 PolarHBondContact O-NH2 3.16Å
991	P	34.9	Very low	28.4	Very low	101 Å²	101	120.5 Å²	120.5	66%	0.656	69%	0.692	S	S	*	*			trans	-77.1	-169.4	-135.7	24.7	-28.1	0	0	0	119.2
992	L	28.3	Very low	28.4	Very low	99 Å²	99	119.7 Å²	119.7	52%	0.518	69%	0.688	S	S	.	*			trans	-128.2	143.4	-165.2	-120.7	164.6	0	0	0	112	S1155	L992-S1155 VanDerWaalsContact CD1-OG 3.3Å; L992-S1155 WeakPolarHBondContact CD1-OG 3.46Å
993	S	25.2	Very low	28.4	Very low	83 Å²	83	120.4 Å²	120.4	58%	0.58	69%	0.69	S	S	*	*			trans	62.6	130.3	143.2	61.5	0	0	0	0	124.3
994	L	27	Very low	28.5	Very low	151 Å²	151	121.9 Å²	121.9	79%	0.791	69%	0.69	S	S	*	*			trans	72.5	103.6	146.6	-89.4	78.5	0	0	0	121
995	S	25.7	Very low	28.4	Very low	89 Å²	89	122 Å²	122	62%	0.622	69%	0.691	S	S	*	*				30.1	127.2	120.2	63.1	0	0	0	0	120.3
996	T	26.1	Very low	28.5	Very low	133 Å²	133	120.3 Å²	120.3	82%	0.816	69%	0.687	S	S	*	*				-161.4	165.9	91.3	13.9	0	0	0	0	112.1
997	D	26.8	Very low	28.6	Very low	143 Å²	143	123.6 Å²	123.6	77%	0.765	69%	0.69	S	S	*	*			trans	-65.3	156.1	-170.8	-46.7	-90.9	0	0	0	114.6
998	T	28.6	Very low	28.8	Very low	145 Å²	145	122.9 Å²	122.9	89%	0.89	69%	0.69	S	S	*	*				-156.8	134	121.9	-1.2	0	0	0	0	112.2
999	S	29.7	Very low	28.9	Very low	112 Å²	112	127.1 Å²	127.1	78%	0.783	70%	0.7	S	S	*	*			trans	-79.5	140.2	168.8	56	0	0	0	0	111.6
1000	A	32.9	Very low	28.9	Very low	102 Å²	102	125.7 Å²	125.7	84%	0.843	70%	0.701	S	S	*	*			trans	-176.5	99	140.1	0	0	0	0	0	109.2
1001	D	31.5	Very low	28.9	Very low	141 Å²	141	128.9 Å²	128.9	75%	0.754	71%	0.714	S	S	*	*			trans	-99.5	129	169.9	-157.8	4.8	0	0	0	109.6
1002	N	30.2	Very low	28.6	Very low	123 Å²	123	128.1 Å²	128.1	66%	0.658	71%	0.711	S	S	*	*			trans	62.3	153.5	174.3	-60.2	-63.5	0	0	0	117
1003	H	29.4	Very low	28.5	Very low	145 Å²	145	127.7 Å²	127.7	67%	0.671	71%	0.709	S	S	*	*			cis	-155.1	161.1	18.1	-143.2	-58.4	0	0	0	111.4
1004	Y	30.5	Very low	28.7	Very low	185 Å²	185	130.1 Å²	130.1	73%	0.725	72%	0.715	S	S	*	*			trans	79.4	99	169.3	-76.9	-95.2	0	0	0	120.3
1005	L	28.1	Very low	28.8	Very low	133 Å²	133	127 Å²	127	70%	0.696	71%	0.706	S	S	*	*				44.8	131.7	107.7	-70.8	161.7	0	0	0	117.7
1006	N	27.8	Very low	29	Very low	128 Å²	128	129.6 Å²	129.6	68%	0.684	71%	0.713	S	S	*	*			cis	-173.7	171	31.8	-154.7	-19.5	0	0	0	111.8
1007	K	31.2	Very low	29.1	Very low	170 Å²	170	127.6 Å²	127.6	74%	0.739	71%	0.71	S	S	*	*			trans	68.1	108.5	156.8	-72.5	-172	179.7	-179.7	0	120.9
1008	S	30.1	Very low	29.3	Very low	106 Å²	106	128.8 Å²	128.8	74%	0.741	71%	0.711	S	S	*	*				77.9	142.7	113	-63.3	0	0	0	0	120.2
1009	F	27.1	Very low	29.3	Very low	184 Å²	184	127.6 Å²	127.6	81%	0.807	70%	0.699	S	S	*	*			cis	-168.5	164.8	-18.2	-157.6	-127.6	0	0	0	108.8
1010	S	28	Very low	29.2	Very low	68 Å²	68	128.3 Å²	128.3	48%	0.476	69%	0.693	S	S	.	*			trans	57.1	112.1	157.5	-77	0	0	0	0	120.7
1011	Q	27.8	Very low	28.8	Very low	165 Å²	165	130 Å²	130	77%	0.771	68%	0.684	S	S	*	*				58	145.4	102.4	-69.1	165.4	-48.5	0	0	120.2
1012	S	27.9	Very low	28.6	Very low	86 Å²	86	133.1 Å²	133.1	60%	0.601	69%	0.686	S	S	*	*			cis	176	162.6	-8.8	52.2	0	0	0	0	111.9
1013	L	28.1	Very low	28.4	Very low	89 Å²	89	133.3 Å²	133.3	47%	0.466	69%	0.687	S	S	.	*			trans	74.4	148.7	137.7	-81.1	161.7	0	0	0	121.5	I673	I673-L1013 HydrophobicContact CD1-CD2 4.29Å
1014	D	28.7	Very low	28.4	Very low	134 Å²	134	133.6 Å²	133.6	72%	0.717	69%	0.693	S	S	*	*			trans	72.7	139.2	149.4	-65	-23.9	0	0	0	122.1
1015	S	29.3	Very low	28.2	Very low	86 Å²	86	129 Å²	129	60%	0.601	68%	0.684	S	S	*	*			cis	-166.4	167.2	-18	59.1	0	0	0	0	112.8
1016	N	29.1	Very low	28.2	Very low	144 Å²	144	129.6 Å²	129.6	77%	0.77	69%	0.693	S	S	*	*			trans	63.2	98.2	143.6	-65.6	-23.5	0	0	0	122.1
1017	A	29.3	Very low	28.2	Very low	91 Å²	91	129 Å²	129	75%	0.752	69%	0.694	S	S	*	*				76.6	169.4	99.6	0	0	0	0	0	122.5
1018	E	30.1	Very low	28.2	Very low	167 Å²	167	127.8 Å²	127.8	78%	0.78	70%	0.696	S	S	*	*			trans	87	93	163.2	-60	-144.3	-169.9	0	0	121
1019	N	27.6	Very low	28.2	Very low	121 Å²	121	130 Å²	130	65%	0.647	69%	0.694	S	S	*	*				91	126.3	108.3	-72.1	-27.7	0	0	0	123.2
1020	L	27.8	Very low	28.3	Very low	126 Å²	126	127.9 Å²	127.9	66%	0.66	69%	0.687	S	S	*	*			trans	70.9	128.7	137.2	-89.2	68.5	0	0	0	122.3
1021	E	26	Very low	28.3	Very low	137 Å²	137	129.9 Å²	129.9	64%	0.64	70%	0.696	S	S	*	*			trans	54.4	126	132.8	-63.2	175.4	172.1	0	0	121
1022	Y	26.8	Very low	28.4	Very low	207 Å²	207	127.9 Å²	127.9	81%	0.812	69%	0.691	S	S	*	*				-161.2	156.3	82.2	-120.4	-85.1	0	0	0	115.4
1023	L	26.9	Very low	28.4	Very low	127 Å²	127	131.6 Å²	131.6	67%	0.665	70%	0.699	S	S	*	*			trans	-92.4	151.8	-177.6	-175	75.1	0	0	0	112.3	V1025	L1023-V1025 HydrophobicContact CD1-CG2 4.2Å; L1023-V1025 HydrophobicContact CD2-CG2 3.87Å; L1023-V1025 HydrophobicContact CG-CG2 3.8Å
1024	N	27.4	Very low	28.4	Very low	151 Å²	151	134.7 Å²	134.7	81%	0.807	72%	0.715	S	S	*	*			trans	177.3	110.6	139	-89.9	-45.6	0	0	0	109.1
1025	V	27.5	Very low	28.2	Very low	88 Å²	88	137 Å²	137	53%	0.533	72%	0.722	S	S	.	*				74.2	107.7	59.5	178.8	0	0	0	0	113.9	L1023	L1023-V1025 HydrophobicContact CD1-CG2 4.2Å; L1023-V1025 HydrophobicContact CD2-CG2 3.87Å; L1023-V1025 HydrophobicContact CG-CG2 3.8Å
1026	V	28.3	Very low	28.1	Very low	147 Å²	147	142.9 Å²	142.9	89%	0.891	74%	0.737	S	S	*	*			trans	-135.9	126.6	140.9	177.2	0	0	0	0	106.6
1027	T	27.9	Very low	28	Very low	114 Å²	114	145 Å²	145	70%	0.699	74%	0.739	S	S	*	*			trans	-146.5	130.5	179.5	50.7	0	0	0	0	110.7
1028	D	30.1	Very low	27.9	Very low	145 Å²	145	148.4 Å²	148.4	78%	0.775	75%	0.745	S	S	*	*			trans	-132.9	123.4	153.6	-93.6	-49.2	0	0	0	105.3
1029	H	30.8	Very low	27.7	Very low	152 Å²	152	146.7 Å²	146.7	70%	0.704	75%	0.745	S	S	*	*				66.4	130.5	80.6	-83.4	3.6	0	0	0	112.9
1030	Q	29.3	Very low	27.7	Very low	140 Å²	140	147.1 Å²	147.1	65%	0.654	76%	0.756	S	S	*	*			cis	-163.6	144.7	7.6	-137.2	173.1	47.2	0	0	111.3
1031	T	27.9	Very low	27.6	Very low	110 Å²	110	148.4 Å²	148.4	68%	0.675	76%	0.763	S	S	*	*			trans	55.5	143.6	151.8	45.2	0	0	0	0	120.4
1032	N	29.6	Very low	27.6	Very low	124 Å²	124	147.3 Å²	147.3	66%	0.663	77%	0.768	S	S	*	*			cis	-150.7	145.6	20.4	-106.9	-34.7	0	0	0	113.8
1033	Q	28	Very low	27.6	Very low	163 Å²	163	147.2 Å²	147.2	76%	0.762	77%	0.772	S	S	*	*			trans	9.9	121.3	142.4	-47.7	175.8	9.8	0	0	119.8
1034	L	27.7	Very low	27.6	Very low	155 Å²	155	149.7 Å²	149.7	81%	0.812	78%	0.78	S	S	*	*				170.8	123.5	104.4	-96.4	156.4	0	0	0	112.7
1035	Q	24.2	Very low	27.6	Very low	183 Å²	183	149.1 Å²	149.1	86%	0.855	78%	0.776	S	S	*	*			trans	-127.8	131.5	156.1	-78.9	-171	-6.7	0	0	108.1
1036	F	28.7	Very low	27.6	Very low	208 Å²	208	150.5 Å²	150.5	91%	0.912	78%	0.781	S	S	*	*			trans	-156.8	137.3	152.5	-100.3	-69.6	0	0	0	110.2
1037	K	25.7	Very low	27.6	Very low	189 Å²	189	150.5 Å²	150.5	82%	0.822	77%	0.771	S	S	*	*			trans	-70.2	149.7	169.7	-64.1	174.7	178.1	176.1	0	109.7
1038	N	28.2	Very low	27.5	Very low	162 Å²	162	152.6 Å²	152.6	87%	0.866	77%	0.773	S	S	*	*				-169.4	155	119.6	-97.2	-24.3	0	0	0	114.6
1039	V	25.7	Very low	27.3	Very low	132 Å²	132	153.4 Å²	153.4	80%	0.8	78%	0.776	S	S	*	*			trans	-69.5	143.3	-170.9	176.2	0	0	0	0	113.4
1040	C	27	Very low	27.1	Very low	129 Å²	129	152.6 Å²	152.6	87%	0.872	78%	0.782	S	S	*	*			trans	-154.8	157.6	147	-144	0	0	0	0	112.8
1041	L	25.7	Very low	26.9	Very low	153 Å²	153	152.5 Å²	152.5	80%	0.801	79%	0.791	S	S	*	*			trans	-88.7	168	-172.3	-87.1	164.5	0	0	0	113
1042	P	26.2	Very low	27.1	Very low	115 Å²	115	154.8 Å²	154.8	75%	0.747	80%	0.796	S	S	*	*			trans	-80.7	147.3	-148.2	31.5	-37.6	0	0	0	115.4
1043	K	27	Very low	26.9	Very low	205 Å²	205	154.1 Å²	154.1	89%	0.891	80%	0.798	S	S	*	*			trans	-143.5	155.4	165.1	-71	-166.7	175.8	-179.2	0	111.8
1044	Q	26.3	Very low	26.9	Very low	178 Å²	178	152.7 Å²	152.7	83%	0.832	80%	0.795	S	S	*	*			trans	-64.5	161	177.3	-54.3	153.6	-67.7	0	0	110.6
1045	L	27.8	Very low	26.7	Very low	140 Å²	140	151.7 Å²	151.7	73%	0.733	79%	0.789	S	S	*	*				-176.4	152.2	72.5	-157.3	78.4	0	0	0	113.7
1046	N	27.5	Very low	26.8	Very low	117 Å²	117	151 Å²	151	63%	0.626	79%	0.785	S	S	*	*			trans	77.3	138	145.5	-97.4	27.8	0	0	0	124.7
1047	E	28.8	Very low	26.6	Very low	146 Å²	146	147.5 Å²	147.5	68%	0.682	78%	0.776	S	S	*	*			trans	81.2	121.9	140.7	-74.8	-176.8	-111.5	0	0	120.9
1048	Q	26	Very low	26.5	Very low	159 Å²	159	142.7 Å²	142.7	74%	0.743	76%	0.758	S	S	*	*	S	Bend	cis	-143.8	126.5	-7.8	-74.5	-178.3	16.5	0	0	112.3
1049	L	25.6	Very low	26.5	Very low	161 Å²	161	137.2 Å²	137.2	84%	0.843	73%	0.731	S	S	*	*	S	Bend		-159.7	90.7	124.7	-141.4	78.3	0	0	0	112.1
1050	T	25.4	Very low	26.5	Very low	135 Å²	135	133.9 Å²	133.9	83%	0.828	71%	0.707	S	S	*	*			trans	39.1	84.5	159.6	51.6	0	0	0	0	118.3
1051	T	26.3	Very low	26.5	Very low	138 Å²	138	134.5 Å²	134.5	85%	0.847	70%	0.701	S	S	*	*			trans	-72.7	135.3	163.4	-23	0	0	0	0	111.5
1052	M	31.5	Very low	26.7	Very low	159 Å²	159	131.3 Å²	131.3	78%	0.783	69%	0.691	S	S	*	*			trans	12.7	137.7	146.1	-157.8	176.4	-173.3	0	0	119.5
1053	P	26.6	Very low	26.7	Very low	109 Å²	109	131.5 Å²	131.5	71%	0.708	70%	0.695	S	S	*	*				-133.3	136.2	122.2	12.7	8.4	0	0	0	115.2
1054	I	26.3	Very low	26.7	Very low	134 Å²	134	127.5 Å²	127.5	69%	0.687	69%	0.688	S	S	*	*			trans	68.5	110.3	130.3	-59.1	171.3	0	0	0	118.6
1055	I	25.4	Very low	26.8	Very low	133 Å²	133	128.1 Å²	128.1	68%	0.682	69%	0.691	S	S	*	*				40.8	138.4	122.9	-48.3	171.2	0	0	0	118.9
1056	E	25.5	Very low	26.7	Very low	169 Å²	169	126.6 Å²	126.6	79%	0.79	70%	0.699	S	S	*	*			trans	-17.1	131.4	151.9	-56.3	147.6	137.6	0	0	113.1
1057	D	23.6	Very low	26.5	Very low	134 Å²	134	126 Å²	126	72%	0.717	70%	0.703	S	S	*	*				-175.9	171.6	65.4	-136.8	-13.5	0	0	0	111.6
1058	I	25.3	Very low	26.4	Very low	88 Å²	88	125.1 Å²	125.1	45%	0.451	71%	0.708	S	S	.	*			trans	28.3	120.6	142.1	-68.3	164.1	0	0	0	118.2	I1379 H1380	I1058-I1379 WeakPolarHBondContact CG2-O 3.4Å; I1058-H1380 PolarHBondContact O-CE1 2.87Å; I1058-H1380 PolarHBondContact O-ND1 3.45Å
1059	T	26.4	Very low	26.4	Very low	48 Å²	48	124.4 Å²	124.4	29%	0.294	71%	0.709	S	S	.	*			cis	-175	154.5	2.8	16.9	0	0	0	0	110.1	H1380	T1059-H1380 PolarHBondContact N-CE1 2.93Å; T1059-H1380 PolarHBondContact N-ND1 3.48Å; T1059-H1380 PolarHBondContact O-CD2 3.48Å; T1059-H1380 VanDerWaalsContact O-CD2 3.3Å; T1059-H1380 WeakPolarHBondContact OG1-CA 3.4Å; T1059-H1380 WeakPolarHBondContact OG1-CB 3.42Å; T1059-H1380 VanDerWaalsContact OG1-CG 3.25Å; T1059-H1380 PolarHBondContact OG1-ND1 2.73Å
1060	E	27	Very low	26.7	Very low	62 Å²	62	125.6 Å²	125.6	29%	0.29	71%	0.708	S	S	.	*			trans	48.3	138.4	141	-52.2	147.7	-166.3	0	0	124.1	T1377 I1378	E1060-T1377 HydrophobicContact CB-CG2 3.92Å; E1060-T1377 HydrophobicContact CG-CG2 3.81Å; E1060-T1377 VanDerWaalsContact OE1-CA 3.25Å; E1060-T1377 WeakPolarHBondContact OE1-CA 3.5Å; E1060-I1378 WeakPolarHBondContact OE1-CA 3.27Å; E1060-I1378 PolarHBondContact OE1-N 2.89Å; E1060-I1378 WeakPolarHBondContact OE2-CA 3.4Å; E1060-I1378 VanDerWaalsContact OE2-CG1 3.26Å; E1060-I1378 WeakPolarHBondContact OE2-CG1 3.32Å; E1060-I1378 PolarHBondContact OE2-N 3.46Å
1061	L	26.1	Very low	26.8	Very low	142 Å²	142	127.8 Å²	127.8	74%	0.743	71%	0.706	S	S	*	*				-166.2	143.8	116.6	-113.8	167.5	0	0	0	114.2
1062	S	30.6	Very low	27	Very low	85 Å²	85	130 Å²	130	59%	0.594	71%	0.706	S	S	*	*			trans	44.9	98.8	160	60.6	0	0	0	0	119.3
1063	S	26.4	Very low	27	Very low	120 Å²	120	130.9 Å²	130.9	84%	0.839	71%	0.708	S	S	*	*			trans	-72.1	133.6	147.7	54.6	0	0	0	0	110.6
1064	T	26.3	Very low	27.1	Very low	120 Å²	120	134.7 Å²	134.7	74%	0.736	71%	0.714	S	S	*	*			trans	-155.7	151.1	169.1	-41.9	0	0	0	0	109.9
1065	Q	28	Very low	27.3	Very low	191 Å²	191	139.5 Å²	139.5	89%	0.893	72%	0.723	S	S	*	*	S	Bend	trans	73.4	56.6	177	-51.5	-167.5	12.2	0	0	117.6
1066	A	25.8	Very low	27.4	Very low	108 Å²	108	139.9 Å²	139.9	89%	0.893	73%	0.727	S	S	*	*			trans	-141.1	51.1	152.7	0	0	0	0	0	111.1
1067	S	25.2	Very low	27.8	Very low	104 Å²	104	137.8 Å²	137.8	73%	0.727	73%	0.728	S	S	*	*			trans	-144	140.3	178.5	-178.5	0	0	0	0	111.5
1068	T	25.4	Very low	27.9	Very low	128 Å²	128	138 Å²	138	79%	0.785	73%	0.728	S	S	*	*			trans	81.2	148.9	-173.6	74.1	0	0	0	0	116.9
1069	L	26.5	Very low	28.2	Very low	145 Å²	145	141 Å²	141	76%	0.759	74%	0.744	S	S	*	*			trans	69.3	111.8	-172.1	-48.9	-179.7	0	0	0	113.7
1070	F	31.5	Very low	28.3	Very low	185 Å²	185	145.1 Å²	145.1	81%	0.811	77%	0.769	S	S	*	*			cis	-135.2	151.8	2.7	-113.7	-82.3	0	0	0	112.8
1071	K	27.4	Very low	28.6	Very low	182 Å²	182	148 Å²	148	79%	0.791	79%	0.793	S	S	*	*			trans	-82.5	165.6	166.5	-66.8	176	177	175.8	0	109.8
1072	Q	30.9	Very low	28.7	Very low	184 Å²	184	147.8 Å²	147.8	86%	0.86	79%	0.793	S	S	*	*			trans	74.4	143.2	174.4	-55.9	152.9	-18	0	0	112.3
1073	Q	31.7	Very low	28.8	Very low	177 Å²	177	150.8 Å²	150.8	83%	0.827	80%	0.797	S	S	*	*			cis	-144.3	143.5	22.7	-150.6	167.1	20.6	0	0	112
1074	K	27.2	Very low	29	Very low	190 Å²	190	149.3 Å²	149.3	83%	0.826	79%	0.792	S	S	*	*			trans	-72.6	144	163.4	-80.1	-173	171.6	-169.6	0	109.8
1075	R	30.6	Very low	29.3	Very low	234 Å²	234	153 Å²	153	88%	0.883	80%	0.801	S	S	*	*			trans	-171.4	131.3	132.6	-107	163	-174.7	177.8	0.2	112
1076	D	27.6	Very low	29.4	Very low	142 Å²	142	151.2 Å²	151.2	76%	0.759	80%	0.797	S	S	*	*			trans	-69.6	166.6	163.1	-33.8	-95	0	0	0	109.3
1077	P	33.6	Very low	29.8	Very low	125 Å²	125	152.2 Å²	152.2	81%	0.812	79%	0.792	S	S	*	*				-148.1	139.7	77.5	36.6	-17.8	0	0	0	116.8
1078	L	27.5	Very low	29.9	Very low	137 Å²	137	158.4 Å²	158.4	72%	0.717	80%	0.799	S	S	*	*			trans	-79.4	146.1	142	-164.1	84.3	0	0	0	108.1
1079	I	30.7	Very low	30.4	Very low	153 Å²	153	159.6 Å²	159.6	79%	0.785	80%	0.8	S	S	*	*			trans	177.1	122.5	142.5	-94.5	152.4	0	0	0	110.3
1080	T	27.8	Very low	30.6	Very low	133 Å²	133	159.7 Å²	159.7	82%	0.816	80%	0.801	S	S	*	*			trans	-93.4	137.7	156	43.9	0	0	0	0	109.7
1081	P	33.9	Very low	30.6	Very low	123 Å²	123	158.1 Å²	158.1	80%	0.799	80%	0.796	S	S	*	*			trans	-102	134.6	158.9	34.3	-26.6	0	0	0	110.9
1082	D	28.2	Very low	30.7	Very low	137 Å²	137	159.4 Å²	159.4	73%	0.733	80%	0.796	S	S	*	*			trans	-117.2	166.1	174.5	-168.3	-5.4	0	0	0	108.9
1083	H	33.2	Very low	30.8	Very low	148 Å²	148	158.8 Å²	158.8	69%	0.685	80%	0.797	S	S	*	*			trans	81.6	97.9	169.5	-61.3	8.8	0	0	0	118.4
1084	A	30.7	Very low	30.6	Very low	90 Å²	90	155.1 Å²	155.1	74%	0.744	79%	0.792	S	S	*	*				57.1	128.6	114.6	0	0	0	0	0	121.5
1085	H	32.5	Very low	30.9	Very low	198 Å²	198	153.1 Å²	153.1	92%	0.917	80%	0.795	S	S	*	*			trans	-153.4	140.7	131.4	-109.2	-71.7	0	0	0	111.6
1086	D	30.1	Very low	31	Very low	153 Å²	153	145.2 Å²	145.2	82%	0.818	79%	0.786	S	S	*	*			trans	-68.8	128.7	171.2	-93.1	-62.9	0	0	0	112.2
1087	V	33.1	Very low	31.2	Very low	128 Å²	128	143.4 Å²	143.4	78%	0.776	78%	0.784	S	S	*	*			trans	-145.5	121	147.6	-176.6	0	0	0	0	109.5	I1089	V1087-I1089 HydrophobicContact CG1-CG1 4.2Å
1088	R	28.6	Very low	31.6	Very low	234 Å²	234	143.2 Å²	143.2	88%	0.883	78%	0.784	S	S	*	*			trans	-91.9	129.9	162.3	-65.7	177.8	178.3	-180	-2.3	109.7
1089	I	35.4	Very low	31.7	Very low	154 Å²	154	144.5 Å²	144.5	79%	0.79	79%	0.791	S	S	*	*			trans	-143.9	133.1	153.1	-61.5	-174.5	0	0	0	108.3	V1087	V1087-I1089 HydrophobicContact CG1-CG1 4.2Å
1090	D	29.6	Very low	31.8	Very low	146 Å²	146	140.4 Å²	140.4	78%	0.781	79%	0.786	S	S	*	*			trans	-80.2	148	171.2	-59.2	-87.2	0	0	0	111.8
1091	E	32.3	Very low	32	Very low	153 Å²	153	139.5 Å²	139.5	72%	0.715	79%	0.785	S	S	*	*				179.8	134.7	111.7	-94.8	-153.8	116.4	0	0	114.8
1092	R	29.3	Very low	32	Very low	209 Å²	209	141.5 Å²	141.5	79%	0.789	79%	0.788	S	S	*	*			trans	10.8	128.7	142.8	-61.6	168	170.8	149.6	-10.5	120.6
1093	L	33.2	Very low	32.1	Very low	170 Å²	170	139.7 Å²	139.7	89%	0.89	79%	0.786	S	S	*	*				169.2	113.1	126.1	-89.3	161.5	0	0	0	106.4
1094	S	27.8	Very low	32	Very low	101 Å²	101	138.2 Å²	138.2	71%	0.706	78%	0.783	S	S	*	*				85.6	133.3	51.4	-163.1	0	0	0	0	114.2
1095	V	32.7	Very low	32	Very low	147 Å²	147	141.3 Å²	141.3	89%	0.891	78%	0.782	S	S	*	*			trans	69.4	136.2	179.2	-163.9	0	0	0	0	114.7
1096	G	32.5	Very low	32.1	Very low	68 Å²	68	138.8 Å²	138.8	70%	0.701	78%	0.775	S	S	*	*			cis	178.5	166	-6.2	0	0	0	0	0	112.6
1097	S	32	Very low	32.3	Very low	104 Å²	104	138.6 Å²	138.6	73%	0.727	77%	0.769	S	S	*	*			trans	-85.9	169.3	170.7	-171.7	0	0	0	0	110.6
1098	P	42.1	Very low	32.4	Very low	122 Å²	122	137.3 Å²	137.3	79%	0.792	76%	0.758	S	S	*	*				-147.5	157.1	99.8	38.4	-23.1	0	0	0	116.7
1099	N	30.1	Very low	32.5	Very low	163 Å²	163	132.2 Å²	132.2	87%	0.872	75%	0.748	S	S	*	*			trans	-89.9	159.9	155.8	-78	-30.1	0	0	0	110.7
1100	G	33.2	Very low	32.3	Very low	67 Å²	67	133.4 Å²	133.4	69%	0.691	75%	0.75	S	S	*	*			trans	172.4	121.3	158.8	0	0	0	0	0	110.9
1101	S	30.6	Very low	32.3	Very low	114 Å²	114	130.9 Å²	130.9	80%	0.797	74%	0.744	S	S	*	*			cis	85.1	96.5	30.6	87	0	0	0	0	115.5
1102	I	34.3	Very low	32.3	Very low	165 Å²	165	130.1 Å²	130.1	85%	0.846	75%	0.75	S	S	*	*			trans	-167	111.8	153.7	-84.7	133.2	0	0	0	101.9
1103	S	29.9	Very low	32.8	Very low	100 Å²	100	125 Å²	125	70%	0.699	74%	0.743	S	S	*	*			cis	86.4	138.2	31.2	-141.2	0	0	0	0	114.4
1104	D	31.9	Very low	32.7	Very low	116 Å²	116	121.8 Å²	121.8	62%	0.62	74%	0.735	S	S	*	*			trans	87.1	103.4	156.5	-72.1	46.1	0	0	0	122.1
1105	Q	31.6	Very low	32.9	Very low	156 Å²	156	122.6 Å²	122.6	73%	0.729	74%	0.736	S	S	*	*				98.1	150.5	120.2	-71.3	-176.4	50.9	0	0	122.3
1106	L	34.6	Very low	33.1	Very low	145 Å²	145	123.7 Å²	123.7	76%	0.759	73%	0.732	S	S	*	*			trans	68.5	152.2	169.5	-59.7	122	0	0	0	118.3
1107	E	34.4	Very low	33.2	Very low	148 Å²	148	126.1 Å²	126.1	69%	0.692	73%	0.732	S	S	*	*			cis	-174.2	160.6	-47.5	-123.5	-162.1	133.8	0	0	108.4
1108	N	33.7	Very low	33.3	Very low	102 Å²	102	129 Å²	129	55%	0.545	73%	0.732	S	S	.	*			trans	57	105.1	149.8	-70.8	-42.7	0	0	0	121.9
1109	N	30.4	Very low	33	Very low	127 Å²	127	129.5 Å²	129.5	68%	0.679	72%	0.723	S	S	*	*				83.5	149.8	117.1	-62.7	-29.1	0	0	0	122.5
1110	Q	33	Very low	33.2	Very low	179 Å²	179	128.3 Å²	128.3	84%	0.836	72%	0.716	S	S	*	*			trans	67.4	136.7	161.1	-68.1	160.1	26.2	0	0	117.5
1111	S	28.8	Very low	33.2	Very low	93 Å²	93	129.3 Å²	129.3	65%	0.65	71%	0.712	S	S	*	*			cis	149.5	135.5	-26.9	54.1	0	0	0	0	108.2
1112	V	32.9	Very low	33.1	Very low	137 Å²	137	128.6 Å²	128.6	83%	0.83	71%	0.707	S	S	*	*			trans	70.3	154.9	155.7	172.2	0	0	0	0	114.9
1113	P	38.8	Very low	32.8	Very low	101 Å²	101	125.2 Å²	125.2	66%	0.656	70%	0.698	S	S	*	*			cis	-127.5	171	-8.6	33.1	-14.2	0	0	0	116.6
1114	S	32.3	Very low	32.9	Very low	103 Å²	103	127 Å²	127	72%	0.72	70%	0.699	S	S	*	*			trans	67.9	164.3	134.3	64.2	0	0	0	0	124.3
1115	T	31.4	Very low	32.7	Very low	118 Å²	118	126.8 Å²	126.8	72%	0.724	70%	0.703	S	S	*	*			cis	-174.8	162	-37.4	-62.4	0	0	0	0	106.8
1116	Q	36.1	Very low	32.7	Very low	170 Å²	170	128.1 Å²	128.1	79%	0.794	71%	0.709	S	S	*	*			trans	78.7	150.9	169.1	-39.8	-177.6	37.4	0	0	113.8
1117	V	34.5	Very low	32.4	Very low	118 Å²	118	127.5 Å²	127.5	72%	0.715	71%	0.712	S	S	*	*			cis	-131.7	121.6	13.5	177.6	0	0	0	0	106.9
1118	K	34.3	Very low	32.3	Very low	165 Å²	165	125.7 Å²	125.7	72%	0.717	72%	0.715	S	S	*	*				46.3	143.9	99.4	-73.5	178.8	152.9	-141.2	0	114.8
1119	Q	35.8	Very low	32.1	Very low	132 Å²	132	127.8 Å²	127.8	62%	0.617	72%	0.722	S	S	*	*			cis	-153	178.8	1.1	-119.2	165.9	-115.5	0	0	105.3
1120	I	35.1	Very low	32.1	Very low	139 Å²	139	129.2 Å²	129.2	71%	0.713	72%	0.724	S	S	*	*			cis	-160.6	161	16.2	-136.2	158	0	0	0	104.1
1121	S	32.2	Very low	32	Very low	87 Å²	87	123.4 Å²	123.4	61%	0.608	70%	0.699	S	S	*	*			cis	-165.3	143.5	-19.8	-109	0	0	0	0	105.4
1122	S	28.9	Very low	32.1	Very low	99 Å²	99	125.3 Å²	125.3	69%	0.692	70%	0.699	S	S	*	*				57.7	129.8	68	85.8	0	0	0	0	114.6
1123	S	28.6	Very low	31.8	Very low	94 Å²	94	126.7 Å²	126.7	66%	0.657	69%	0.694	S	S	*	*			cis	-175.2	177.6	-3.7	45.3	0	0	0	0	110.8
1124	N	31.8	Very low	31.6	Very low	137 Å²	137	127.4 Å²	127.4	73%	0.733	70%	0.698	S	S	*	*			trans	126.1	105.1	149.4	-63.7	7.4	0	0	0	111.1
1125	T	27.7	Very low	31.4	Very low	112 Å²	112	130.6 Å²	130.6	69%	0.687	71%	0.707	S	S	*	*				76.6	101.3	61	64.5	0	0	0	0	114.4
1126	E	32	Very low	31.2	Very low	184 Å²	184	135.4 Å²	135.4	86%	0.86	71%	0.713	S	S	*	*			trans	161.5	115.5	144.1	-90.2	158.7	-166	0	0	106.6
1127	T	28	Very low	30.8	Very low	133 Å²	133	135.3 Å²	135.3	82%	0.816	72%	0.717	S	S	*	*			cis	88.5	61	28.3	77.3	0	0	0	0	118
1128	S	31.9	Very low	30.4	Very low	110 Å²	110	138.8 Å²	138.8	77%	0.769	72%	0.722	S	S	*	*			trans	-178	119	146.6	49.5	0	0	0	0	106.7
1129	H	29.5	Very low	30	Very low	146 Å²	146	135.4 Å²	135.4	68%	0.676	72%	0.72	S	S	*	*			cis	63.7	80.7	40	-133.6	-53.9	0	0	0	112.9
1130	E	31.1	Very low	29.6	Very low	157 Å²	157	135.6 Å²	135.6	73%	0.734	73%	0.725	S	S	*	*			trans	-155	98.9	143.9	-118.6	169.5	-137.5	0	0	110.8
1131	D	31.4	Very low	29.3	Very low	56 Å²	56	136.6 Å²	136.6	30%	0.299	73%	0.731	S	S	.	*				71.2	139.5	123.2	-64.5	21.1	0	0	0	124.4	S1936 T1937 S1938	D1131-S1936 WeakPolarHBondContact CA-O 3.23Å; D1131-S1936 WeakPolarHBondContact CB-O 3.21Å; D1131-S1936 VanDerWaalsContact CG-OG 3.26Å; D1131-S1936 WeakPolarHBondContact OD1-CB 3.1Å; D1131-S1936 PolarHBondContact OD1-OG 3.46Å; D1131-S1936 WeakPolarHBondContact OD2-CB 3.32Å; D1131-S1936 PolarHBondContact OD2-OG 3.01Å; D1131-T1937 WeakPolarHBondContact OD2-CA 3Å; D1131-T1937 PolarHBondContact OD2-N 3.37Å; D1131-S1938 VanDerWaalsContact CB-N 3.35Å; D1131-S1938 PolarHBondContact OD2-N 3.33Å; D1131-S1938 VanDerWaalsContact OD2-N 3.1Å
1132	M	29.1	Very low	29.2	Very low	134 Å²	134	137.5 Å²	137.5	66%	0.66	74%	0.737	S	S	*	*	B	Isolated β-bridge	trans	-79.6	148.9	174.5	-56.7	-179.5	-176.6	0	0	113.4	S1936	M1132-S1936 PolarHBondContact N-O 3.2Å
1133	K	27.5	Very low	29.3	Very low	166 Å²	166	139.5 Å²	139.5	72%	0.722	74%	0.74	S	S	*	*			trans	-154.9	131.3	131.4	-119.2	172.6	-166.7	155.5	0	112.7	S1938	K1133-S1938 PolarHBondContact NZ-OG 3.19Å
1134	P	34.7	Very low	29.4	Very low	116 Å²	116	140.4 Å²	140.4	75%	0.753	74%	0.742	S	S	*	*			trans	-90.6	149.2	170.2	35.4	-32.6	0	0	0	111.4
1135	L	28.6	Very low	29.4	Very low	170 Å²	170	143.4 Å²	143.4	89%	0.89	74%	0.743	S	S	*	*			trans	-146.2	134.4	163.8	-105	171.9	0	0	0	111
1136	Y	27.2	Very low	29.5	Very low	218 Å²	218	144.2 Å²	144.2	86%	0.855	74%	0.743	S	S	*	*			trans	-70.5	145.5	160.3	-83.6	-117.8	0	0	0	109.2
1137	L	27.9	Very low	29.5	Very low	169 Å²	169	143.8 Å²	143.8	89%	0.885	75%	0.746	S	S	*	*				-168.6	169.7	126.5	-106.9	165	0	0	0	113.1
1138	K	25	Very low	29.6	Very low	190 Å²	190	144.8 Å²	144.8	83%	0.826	75%	0.746	S	S	*	*			trans	-68.4	176	174	-76.3	-177.9	168.5	-172.5	0	112.3
1139	S	25.7	Very low	29.5	Very low	94 Å²	94	146.7 Å²	146.7	66%	0.657	75%	0.748	S	S	*	*			trans	116.2	106.7	144.8	-77.5	0	0	0	0	117.6
1140	D	27	Very low	29.5	Very low	136 Å²	136	150 Å²	150	73%	0.727	76%	0.756	S	S	*	*				72.8	108.7	121.8	-45.8	-32	0	0	0	120.5
1141	L	29.7	Very low	29.4	Very low	161 Å²	161	150.7 Å²	150.7	84%	0.843	76%	0.763	S	S	*	*			trans	11.8	124.2	140.7	-73.6	64.5	0	0	0	117.8
1142	S	30	Very low	29.5	Very low	106 Å²	106	155.3 Å²	155.3	74%	0.741	79%	0.787	S	S	*	*				175.4	153	83.4	46.3	0	0	0	0	115.4
1143	N	30.5	Very low	29.5	Very low	140 Å²	140	155.1 Å²	155.1	75%	0.749	79%	0.789	S	S	*	*			trans	67.9	76.1	152.7	-67.7	-22.2	0	0	0	122.4
1144	T	31	Very low	29.7	Very low	113 Å²	113	153.7 Å²	153.7	69%	0.693	79%	0.789	S	S	*	*				58	126	106.2	57.2	0	0	0	0	122.5
1145	R	31.2	Very low	29.4	Very low	201 Å²	201	151.6 Å²	151.6	76%	0.758	78%	0.777	S	S	*	*			trans	147.7	136.8	131.7	-82.3	172	-174.2	-162.5	1.6	110.4
1146	N	31.1	Very low	29.5	Very low	129 Å²	129	152.1 Å²	152.1	69%	0.69	77%	0.767	S	S	*	*			cis	-164.9	121.6	-13	-127.6	40.4	0	0	0	107.6
1147	L	31.7	Very low	29.7	Very low	175 Å²	175	146.1 Å²	146.1	92%	0.916	74%	0.743	S	S	*	*			trans	-167.3	67.7	164.8	-139	142.3	0	0	0	112.7
1148	D	29.9	Very low	29.9	Very low	154 Å²	154	141.9 Å²	141.9	82%	0.824	72%	0.722	S	S	*	*			trans	-109.3	138.8	177.1	-66.9	-67.5	0	0	0	111.5
1149	D	29.3	Very low	30.1	Very low	150 Å²	150	139.9 Å²	139.9	80%	0.802	71%	0.709	S	S	*	*			trans	-155	144.8	164.4	-134.1	-23.9	0	0	0	109.3
1150	Y	29.9	Very low	30.3	Very low	216 Å²	216	139.8 Å²	139.8	85%	0.847	70%	0.704	S	S	*	*			trans	63.1	95	-176.4	-69.2	-86	0	0	0	119.6
1151	L	29.9	Very low	30.4	Very low	170 Å²	170	141 Å²	141	89%	0.89	71%	0.71	S	S	*	*			trans	-152.4	174.4	142.3	-114.4	175.7	0	0	0	111.2
1152	L	32.6	Very low	30.3	Very low	153 Å²	153	136.9 Å²	136.9	80%	0.801	70%	0.699	S	S	*	*			trans	-72.4	142.1	178.5	-72.8	65.9	0	0	0	111.1
1153	D	29.2	Very low	30.2	Very low	131 Å²	131	139.7 Å²	139.7	70%	0.701	71%	0.705	S	S	*	*				171.5	167.3	89.3	-163.4	26.7	0	0	0	113.9
1154	N	30.8	Very low	30	Very low	135 Å²	135	138 Å²	138	72%	0.722	70%	0.704	S	S	*	*			trans	23.2	138.5	157.1	-88	-56.8	0	0	0	125.2
1155	S	28.2	Very low	29.8	Very low	72 Å²	72	136.5 Å²	136.5	50%	0.503	70%	0.698	S	S	.	*			trans	92.9	82.3	137.4	-166	0	0	0	0	123.7	L992	L992-S1155 VanDerWaalsContact CD1-OG 3.3Å; L992-S1155 WeakPolarHBondContact CD1-OG 3.46Å
1156	R	31.4	Very low	29.7	Very low	181 Å²	181	134.7 Å²	134.7	68%	0.683	70%	0.699	S	S	*	*				61.1	92.8	108.5	-97.7	-173.1	159.5	-174.8	1.4	122.7
1157	R	31.6	Very low	29.7	Very low	93 Å²	93	134.7 Å²	134.7	35%	0.351	70%	0.698	S	S	.	*				101.9	162.6	123.6	-46.3	178.6	-135.7	81.1	-29	121.1	L990	L990-R1157 PolarHBondContact O-NH2 3.16Å
1158	N	31.6	Very low	29.6	Very low	80 Å²	80	131.7 Å²	131.7	43%	0.428	69%	0.687	S	S	.	*			trans	82.1	128.3	155	-76	27.4	0	0	0	120	H989	H989-N1158 PolarHBondContact O-ND2 2.93Å
1159	W	30.2	Very low	29.6	Very low	148 Å²	148	129.9 Å²	129.9	56%	0.561	68%	0.677	S	S	*	*			cis	-162.2	126.9	-15.8	-136.7	44.6	0	0	0	114.6	T988 H989	T988-W1159 HydrophobicContact CG2-CH2 4.32Å; H989-W1159 HydrophobicContact CB-CZ2 4.39Å; H989-W1159 AromaticContact CD2-CE2 3.77Å; H989-W1159 AromaticContact CD2-CH2 3.85Å; H989-W1159 AromaticContact CD2-CZ2 3.15Å; H989-W1159 WeakPolarHBondContact CD2-CZ2 3.24Å; H989-W1159 AromaticContact CG-CZ2 3.97Å; H989-W1159 AromaticContact NE2-CZ2 3.72Å
1160	T	28.9	Very low	29.7	Very low	91 Å²	91	130.8 Å²	130.8	56%	0.558	67%	0.674	S	S	*	*			trans	64.9	162.6	130	-46.8	0	0	0	0	122.8
1161	L	29.7	Very low	29.7	Very low	162 Å²	162	126.7 Å²	126.7	85%	0.848	67%	0.665	S	S	*	*			trans	90.2	132.2	168	-63.4	-179.5	0	0	0	117.2
1162	A	26.6	Very low	29.8	Very low	75 Å²	75	124.8 Å²	124.8	62%	0.62	66%	0.656	S	S	*	*			cis	-157.9	176.7	-0.3	0	0	0	0	0	114.2
1163	L	28.1	Very low	29.8	Very low	165 Å²	165	124.1 Å²	124.1	86%	0.864	65%	0.654	S	S	*	*			trans	73.4	144.6	165.9	-51.8	169.7	0	0	0	115.4
1164	S	27.3	Very low	30	Very low	103 Å²	103	122.3 Å²	122.3	72%	0.72	65%	0.651	S	S	*	*			cis	-169.2	167.3	-8.7	-102.5	0	0	0	0	108.1
1165	S	27.2	Very low	30.1	Very low	83 Å²	83	120.9 Å²	120.9	58%	0.58	65%	0.651	S	S	*	*			cis	-163.4	174.8	-7.4	46.4	0	0	0	0	109.6
1166	E	29.2	Very low	30.4	Very low	163 Å²	163	125.1 Å²	125.1	76%	0.762	66%	0.661	S	S	*	*			trans	69.7	146	154.9	-75.6	159.3	106.9	0	0	119.5
1167	L	30.8	Very low	30.4	Very low	128 Å²	128	126.4 Å²	126.4	67%	0.67	67%	0.666	S	S	*	*			cis	-152.4	101.2	1.2	-147	150.6	0	0	0	114.6
1168	T	28.4	Very low	30.3	Very low	112 Å²	112	129 Å²	129	69%	0.687	68%	0.68	S	S	*	*			trans	45	141.8	132.6	-24.7	0	0	0	0	124.4
1169	N	30.6	Very low	30.2	Very low	117 Å²	117	133.6 Å²	133.6	63%	0.626	69%	0.692	S	S	*	*			trans	98.7	137.2	157.2	-55.1	-79.7	0	0	0	118
1170	K	31.4	Very low	30.2	Very low	169 Å²	169	132.5 Å²	132.5	74%	0.735	70%	0.697	S	S	*	*			cis	-167.4	130.9	-3.7	-113.3	176.3	179.4	176.8	0	114.9
1171	I	30.7	Very low	30.1	Very low	129 Å²	129	136.9 Å²	136.9	66%	0.662	71%	0.709	S	S	*	*			trans	64.1	100.4	130.5	-61	175.1	0	0	0	122.2
1172	D	31.9	Very low	30	Very low	131 Å²	131	134.8 Å²	134.8	70%	0.701	70%	0.699	S	S	*	*				69.4	143.4	114.1	-53.8	-16.3	0	0	0	129.7
1173	N	31.7	Very low	30.1	Very low	139 Å²	139	138.3 Å²	138.3	74%	0.743	70%	0.702	S	S	*	*			trans	98	79.4	133.5	-76	-23.5	0	0	0	126.1
1174	S	33.1	Very low	30.1	Very low	92 Å²	92	136.3 Å²	136.3	64%	0.643	69%	0.692	S	S	*	*				66.4	119.3	107.3	72.8	0	0	0	0	126.9
1175	S	34.2	Very low	30.2	Very low	105 Å²	105	135 Å²	135	73%	0.734	68%	0.68	S	S	*	*			trans	74.5	165.3	137.2	82.3	0	0	0	0	120.7
1176	K	34.5	Very low	30.2	Very low	162 Å²	162	137.6 Å²	137.6	70%	0.704	68%	0.68	S	S	*	*			cis	-168	133.2	13.9	-146.7	159.5	-174.7	165.5	0	114.9
1177	R	30.6	Very low	30.2	Very low	208 Å²	208	135.5 Å²	135.5	79%	0.785	67%	0.671	S	S	*	*			trans	63	161.2	155.8	-69.5	-173	-65.2	-160.1	4.9	119.8
1178	K	29.4	Very low	30.3	Very low	148 Å²	148	136.7 Å²	136.7	64%	0.643	67%	0.674	S	S	*	*			cis	-162.6	153.4	-12.7	-123	-174.1	170.3	-160.6	0	113
1179	Y	29.2	Very low	30.5	Very low	175 Å²	175	135.9 Å²	135.9	69%	0.686	67%	0.673	S	S	*	*			trans	64.9	117.7	150.1	-72.6	-41.5	0	0	0	127.3
1180	D	31.4	Very low	30.8	Very low	126 Å²	126	136.6 Å²	136.6	67%	0.674	68%	0.677	S	S	*	*				69	125.8	114	-64.4	8.3	0	0	0	129.2
1181	F	27.2	Very low	31	Very low	182 Å²	182	135 Å²	135	80%	0.798	68%	0.677	S	S	*	*			trans	80	139.3	135.9	-90	-100.7	0	0	0	127.4
1182	D	26.3	Very low	31.1	Very low	118 Å²	118	133.7 Å²	133.7	63%	0.631	68%	0.679	S	S	*	*			trans	79.3	113.4	155.4	-80.4	-48	0	0	0	126.7
1183	Q	28	Very low	31.4	Very low	150 Å²	150	135.8 Å²	135.8	70%	0.701	68%	0.684	S	S	*	*			trans	60.4	133.5	133.9	-68.9	-178.9	49.8	0	0	126.1
1184	L	28.1	Very low	31.4	Very low	122 Å²	122	133 Å²	133	64%	0.639	67%	0.666	S	S	*	*			trans	45.9	161	135.4	-83.6	65.2	0	0	0	122.2	N708	N708-L1184 VanDerWaalsContact ND2-C 3.26Å; N708-L1184 WeakPolarHBondContact ND2-CA 3.4Å; N708-L1184 PolarHBondContact ND2-N 3.44Å
1185	T	30.2	Very low	31.6	Very low	76 Å²	76	132.7 Å²	132.7	47%	0.466	66%	0.662	S	S	.	*			cis	-173.8	168.4	-34.5	-113.5	0	0	0	0	108.7	N708 V709	N708-T1185 PolarHBondContact OD1-OG1 3.5Å; V709-T1185 HydrophobicContact CG2-CG2 4.22Å; V709-T1185 WeakPolarHBondContact CG2-OG1 3.11Å
1186	K	28.1	Very low	31.6	Very low	138 Å²	138	131.5 Å²	131.5	60%	0.6	65%	0.653	S	S	*	*			trans	91.6	154.8	-172.7	-64.6	165	152.4	-85.5	0	114.1	V709	V709-K1186 VanDerWaalsContact CG2-N 3.26Å
1187	E	29.6	Very low	31.5	Very low	119 Å²	119	128.6 Å²	128.6	56%	0.556	65%	0.65	S	S	*	*			cis	-161.6	148.1	-8.1	-116.5	157.3	-180	0	0	112.7
1188	M	31.9	Very low	31.5	Very low	152 Å²	152	125.1 Å²	125.1	75%	0.749	65%	0.646	S	S	*	*			trans	46.7	152.5	140	-73	-177	-171.4	0	0	123.4
1189	S	33.3	Very low	31.6	Very low	95 Å²	95	124.7 Å²	124.7	66%	0.664	65%	0.651	S	S	*	*			cis	-174.2	177.9	-7.6	-179.2	0	0	0	0	112.3
1190	N	35.8	Very low	31.7	Very low	133 Å²	133	123.2 Å²	123.2	71%	0.711	65%	0.65	S	S	*	*			trans	87	143.1	162.9	-55.1	13.8	0	0	0	117.8
1191	D	35.6	Very low	31.5	Very low	136 Å²	136	122.3 Å²	122.3	73%	0.727	64%	0.644	S	S	*	*			cis	-177.2	167.5	-12.5	-94.1	-36	0	0	0	109.3
1192	S	33.6	Very low	31.7	Very low	100 Å²	100	120.6 Å²	120.6	70%	0.699	64%	0.643	S	S	*	*			cis	-173.1	-164.1	-21.7	65.5	0	0	0	0	112.2
1193	E	37.1	Very low	31.8	Very low	175 Å²	175	123.6 Å²	123.6	82%	0.818	65%	0.65	S	S	*	*			trans	77.4	90.6	164.6	-56.8	-149.4	120.5	0	0	125.8
1194	K	33	Very low	31.9	Very low	80 Å²	80	124.3 Å²	124.3	35%	0.348	66%	0.658	S	S	.	*				53.2	167.8	105.7	-85.4	-169.5	170	57.4	0	125.9	E716	E716-K1194 IonicContact OE1-NZ 2.61Å; E716-K1194 PolarHBondContact OE1-NZ 2.84Å; E716-K1194 WeakPolarHBondContact OE2-CE 3.38Å; E716-K1194 WeakPolarHBondContact OE2-CG 3.49Å; E716-K1194 IonicContact OE2-NZ 2.65Å; E716-K1194 PolarHBondContact OE2-NZ 2.67Å
1195	P	37.1	Very low	32	Very low	86 Å²	86	122.9 Å²	122.9	56%	0.558	66%	0.659	S	S	*	*			cis	-146.3	171.1	-31.3	38.7	-19.6	0	0	0	119.1
1196	S	33.4	Very low	31.9	Very low	80 Å²	80	124.7 Å²	124.7	56%	0.559	67%	0.669	S	S	*	*			trans	67.9	152.6	140.9	62.6	0	0	0	0	123
1197	T	33	Very low	31.9	Very low	102 Å²	102	125.9 Å²	125.9	63%	0.626	68%	0.677	S	S	*	*			cis	-168.4	158.4	-7.2	21.1	0	0	0	0	114.9	L718	L718-T1197 HydrophobicContact CD1-CG2 4Å
1198	D	31.2	Very low	32	Very low	134 Å²	134	129.4 Å²	129.4	72%	0.717	69%	0.691	S	S	*	*			trans	84.7	140.5	135	-75.8	-0.2	0	0	0	129.9
1199	L	30.1	Very low	31.7	Very low	140 Å²	140	131 Å²	131	73%	0.733	69%	0.694	S	S	*	*			trans	67.6	154.9	148.9	-90.5	83.9	0	0	0	123
1200	E	30.8	Very low	31.5	Very low	144 Å²	144	132.7 Å²	132.7	67%	0.673	70%	0.699	S	S	*	*			cis	-175.8	169.5	-31.5	-125.1	-160	133.3	0	0	115.3
1201	I	29.2	Very low	31.1	Very low	106 Å²	106	130.8 Å²	130.8	54%	0.544	70%	0.696	S	S	.	*			trans	77.5	99.6	145.9	-71.9	162.4	0	0	0	124.3
1202	N	29.9	Very low	30.7	Very low	146 Å²	146	128.9 Å²	128.9	78%	0.781	69%	0.694	S	S	*	*				23.9	145.4	111.4	-68.4	-51.1	0	0	0	125.3
1203	K	29.4	Very low	30.4	Very low	182 Å²	182	130.7 Å²	130.7	79%	0.791	70%	0.695	S	S	*	*			trans	-179.5	126.2	134.2	-101.1	151.9	-167.4	155	0	118.3
1204	L	29.8	Very low	29.9	Very low	164 Å²	164	126.4 Å²	126.4	86%	0.859	68%	0.675	S	S	*	*				38.3	159.1	124.8	-91	70	0	0	0	122.8
1205	S	29.3	Very low	29.6	Very low	93 Å²	93	128.8 Å²	128.8	65%	0.65	69%	0.691	S	S	*	*			cis	-164.9	135.6	18.9	126.4	0	0	0	0	116.4
1206	T	28.7	Very low	29.1	Very low	113 Å²	113	129 Å²	129	69%	0.693	69%	0.694	S	S	*	*				41.1	142.8	125.7	20.3	0	0	0	0	127.6
1207	E	28.3	Very low	28.8	Very low	164 Å²	164	133.3 Å²	133.3	77%	0.766	71%	0.705	S	S	*	*			trans	80.7	114.6	142.6	-79	-169.8	-151.9	0	0	124.5
1208	K	31	Very low	28.4	Very low	193 Å²	193	133.1 Å²	133.1	84%	0.839	71%	0.709	S	S	*	*				-173.4	102.6	105.8	-105.8	179.8	-179.9	176.3	0	117.3
1209	K	27	Very low	28.2	Very low	186 Å²	186	134 Å²	134	81%	0.809	71%	0.712	S	S	*	*				43.8	141	114.6	-135.5	175.6	-171.9	167.6	0	122.8
1210	V	28.3	Very low	27.9	Very low	129 Å²	129	132 Å²	132	78%	0.782	71%	0.706	S	S	*	*			trans	83.6	134.9	160.5	-172.2	0	0	0	0	116.3
1211	S	27.3	Very low	27.6	Very low	93 Å²	93	132.9 Å²	132.9	65%	0.65	71%	0.708	S	S	*	*			cis	-172.6	145.5	-29.5	57.6	0	0	0	0	110.5
1212	S	27.1	Very low	27.6	Very low	96 Å²	96	135.5 Å²	135.5	67%	0.671	72%	0.722	S	S	*	*			trans	50.1	147.8	145.9	93.3	0	0	0	0	120.5
1213	D	26.9	Very low	27.5	Very low	138 Å²	138	133.2 Å²	133.2	74%	0.738	71%	0.707	S	S	*	*			cis	-154	173.1	21	-94.7	-55.4	0	0	0	114.3
1214	E	27.2	Very low	27.5	Very low	85 Å²	85	133.2 Å²	133.2	40%	0.397	71%	0.714	S	S	.	*			trans	51.9	76.5	150.2	-69.2	-165.6	149.9	0	0	124	C1367 S1368 L1369	E1214-C1367 VanDerWaalsContact CD-C 3.48Å; E1214-C1367 PolarHBondContact OE1-N 2.88Å; E1214-C1367 VanDerWaalsContact OE2-C 3.26Å; E1214-C1367 WeakPolarHBondContact OE2-CA 3.28Å; E1214-C1367 VanDerWaalsContact OE2-CB 3.24Å; E1214-C1367 WeakPolarHBondContact OE2-CB 3.48Å; E1214-C1367 PolarHBondContact OE2-N 3.21Å; E1214-S1368 CarbonylContact O-C 3.4Å; E1214-S1368 WeakPolarHBondContact O-CA 3.46Å; E1214-L1369 PolarHBondContact O-N 3.05Å
1215	I	26.9	Very low	27.4	Very low	131 Å²	131	130.8 Å²	130.8	67%	0.672	70%	0.698	S	S	*	*				53.1	114.4	104.4	-62.2	173.4	0	0	0	120.1	S1368	I1215-S1368 VanDerWaalsContact O-CA 3.3Å; I1215-S1368 WeakPolarHBondContact O-CA 3.41Å; I1215-S1368 WeakPolarHBondContact O-CB 3.49Å
1216	S	27.5	Very low	27.4	Very low	90 Å²	90	131.7 Å²	131.7	63%	0.629	71%	0.705	S	S	*	*			trans	52.1	126.4	140.3	-56.2	0	0	0	0	123.3
1217	Q	26.9	Very low	27.5	Very low	170 Å²	170	133.2 Å²	133.2	79%	0.794	70%	0.704	S	S	*	*				-157.5	129.3	106.1	-120	148.8	109.9	0	0	116.4
1218	S	23.8	Very low	27.4	Very low	99 Å²	99	130.2 Å²	130.2	69%	0.692	70%	0.702	S	S	*	*			trans	42.6	140.3	144.2	59.3	0	0	0	0	123.3
1219	L	26.6	Very low	27.3	Very low	152 Å²	152	128.4 Å²	128.4	80%	0.796	71%	0.706	S	S	*	*			trans	-19.1	145.6	141.9	-74.3	64	0	0	0	113.5
1220	T	24.1	Very low	27.3	Very low	98 Å²	98	126.4 Å²	126.4	60%	0.601	70%	0.7	S	S	*	*				-173.1	163.6	68.6	-45.7	0	0	0	0	110.1
1221	F	24	Very low	27.3	Very low	162 Å²	162	126.4 Å²	126.4	71%	0.711	70%	0.7	S	S	*	*			trans	73.5	155.8	174.1	-52.7	-67.1	0	0	0	113	Q1223	F1221-Q1223 HydrophobicContact CB-CB 4.23Å; F1221-Q1223 HydrophobicContact CD1-CB 4.1Å; F1221-Q1223 HydrophobicContact CD1-CG 4.49Å; F1221-Q1223 VanDerWaalsContact CD1-OE1 3.27Å
1222	L	30.3	Very low	27.3	Very low	161 Å²	161	126.4 Å²	126.4	84%	0.843	70%	0.7	S	S	*	*			cis	-117.5	138.8	24.7	-61.9	155.4	0	0	0	112.4
1223	Q	26.9	Very low	27.5	Very low	99 Å²	99	127.7 Å²	127.7	46%	0.463	71%	0.707	S	S	.	*			cis	87	98.4	32.4	-169.3	174.9	-16.2	0	0	113.7	F1221 H1225	F1221-Q1223 HydrophobicContact CB-CB 4.23Å; F1221-Q1223 HydrophobicContact CD1-CB 4.1Å; F1221-Q1223 HydrophobicContact CD1-CG 4.49Å; F1221-Q1223 VanDerWaalsContact CD1-OE1 3.27Å; Q1223-H1225 PolarHBondContact NE2-CD2 2.96Å; Q1223-H1225 VanDerWaalsContact NE2-CD2 3.29Å; Q1223-H1225 PolarHBondContact NE2-NE2 3.05Å
1224	L	29.7	Very low	27.7	Very low	181 Å²	181	127 Å²	127	95%	0.948	70%	0.704	S	S	*	*			trans	-90.2	107	161.1	-98.5	165	0	0	0	109.4
1225	H	27.3	Very low	27.8	Very low	113 Å²	113	130 Å²	130	52%	0.523	72%	0.715	S	S	.	*			trans	-66.2	144.6	165.8	-93.8	-114.3	0	0	0	111	Q1223 E1227	Q1223-H1225 PolarHBondContact NE2-CD2 2.96Å; Q1223-H1225 VanDerWaalsContact NE2-CD2 3.29Å; Q1223-H1225 PolarHBondContact NE2-NE2 3.05Å; H1225-E1227 IonicContact CE1-OE1 2.67Å; H1225-E1227 IonicContact CG-OE1 3.44Å; H1225-E1227 IonicContact ND1-OE1 2.75Å; H1225-E1227 PolarHBondContact ND1-OE1 3.23Å
1226	S	30.3	Very low	28	Very low	113 Å²	113	131.5 Å²	131.5	79%	0.79	72%	0.717	S	S	*	*				162.2	154.6	122	47.3	0	0	0	0	112.1
1227	E	30	Very low	28.2	Very low	145 Å²	145	134.3 Å²	134.3	68%	0.678	72%	0.72	S	S	*	*				-156.9	163.1	-50.7	-136.6	141.4	-131.4	0	0	109.1	H1225	H1225-E1227 IonicContact CE1-OE1 2.67Å; H1225-E1227 IonicContact CG-OE1 3.44Å; H1225-E1227 IonicContact ND1-OE1 2.75Å; H1225-E1227 PolarHBondContact ND1-OE1 3.23Å
1228	S	26.7	Very low	28.2	Very low	101 Å²	101	131.6 Å²	131.6	71%	0.706	72%	0.715	S	S	*	*			trans	43.5	104.6	167.5	62.1	0	0	0	0	119.7
1229	V	29.8	Very low	28.8	Very low	155 Å²	155	131.8 Å²	131.8	94%	0.939	71%	0.714	S	S	*	*				-128	125.7	112.2	-179.7	0	0	0	0	106.7
1230	E	26.1	Very low	28.9	Very low	143 Å²	143	130.3 Å²	130.3	67%	0.668	71%	0.712	S	S	*	*			trans	-123.7	156.1	-170.6	-140.7	-163	162.9	0	0	110.4
1231	V	27.9	Very low	29.1	Very low	130 Å²	130	135.4 Å²	135.4	79%	0.788	73%	0.726	S	S	*	*			trans	68.9	142.6	159.4	177.5	0	0	0	0	115.9
1232	S	28.1	Very low	29.3	Very low	92 Å²	92	132.5 Å²	132.5	64%	0.643	72%	0.724	S	S	*	*			cis	-128.9	151.6	0.8	65.2	0	0	0	0	112.5
1233	C	29.8	Very low	29.6	Very low	123 Å²	123	133.7 Å²	133.7	83%	0.831	73%	0.725	S	S	*	*			trans	-108.6	125.7	154.5	-73.6	0	0	0	0	108.5
1234	N	31.8	Very low	29.7	Very low	125 Å²	125	135.4 Å²	135.4	67%	0.668	74%	0.737	S	S	*	*			trans	-122.6	110.4	151.4	-84.7	-50.8	0	0	0	108.6
1235	K	29.9	Very low	30	Very low	146 Å²	146	137.8 Å²	137.8	64%	0.635	73%	0.734	S	S	*	*				80.6	102.9	50.3	-178.6	-161.5	-175.6	-177.4	0	111
1236	F	30.9	Very low	30	Very low	164 Å²	164	139.3 Å²	139.3	72%	0.719	74%	0.741	S	S	*	*				179.8	113.3	118.9	-100.7	-74.4	0	0	0	112.5
1237	H	32.1	Very low	30.2	Very low	149 Å²	149	143.1 Å²	143.1	69%	0.69	74%	0.744	S	S	*	*			trans	33	115.3	140	-73.2	-80.6	0	0	0	123.1
1238	T	27.1	Very low	30.1	Very low	112 Å²	112	140.9 Å²	140.9	69%	0.687	74%	0.744	S	S	*	*				23.2	154.5	105.6	61.8	0	0	0	0	120.7
1239	P	35.9	Very low	30.4	Very low	103 Å²	103	144.2 Å²	144.2	67%	0.669	75%	0.751	S	S	*	*			cis	-142.3	-179.7	-3.4	31.9	-8.2	0	0	0	116.7
1240	T	27.4	Very low	30.7	Very low	122 Å²	122	143.3 Å²	143.3	75%	0.748	74%	0.74	S	S	*	*			trans	46.2	112.8	147.9	51.5	0	0	0	0	120.8
1241	K	30	Very low	30.9	Very low	205 Å²	205	143.9 Å²	143.9	89%	0.891	75%	0.748	S	S	*	*				-172.3	160.9	104.3	-104.9	176	-178	-179.5	0	114.2
1242	C	28.5	Very low	31.1	Very low	100 Å²	100	146.4 Å²	146.4	68%	0.676	75%	0.751	S	S	*	*			trans	-23	137.1	170.5	-47.5	0	0	0	0	118.1
1243	H	34.8	Very low	31.4	Very low	187 Å²	187	149.2 Å²	149.2	87%	0.866	76%	0.759	S	S	*	*				-155.5	150.6	101.3	-109.3	-65	0	0	0	112.7
1244	N	30.4	Very low	31.3	Very low	135 Å²	135	151.6 Å²	151.6	72%	0.722	76%	0.762	S	S	*	*			trans	-68.1	146.6	176.8	-51.1	3.1	0	0	0	110.9
1245	R	34.3	Very low	31.3	Very low	230 Å²	230	150.9 Å²	150.9	87%	0.868	77%	0.767	S	S	*	*			trans	-151.6	114.4	139.5	-149.3	170.2	-166.6	168.1	4	109.6
1246	E	28.9	Very low	31.2	Very low	145 Å²	145	148.3 Å²	148.3	68%	0.678	77%	0.767	S	S	*	*			trans	-65.1	150.9	168.6	-58.1	96.3	147.4	0	0	110.6
1247	F	33.1	Very low	31.1	Very low	194 Å²	194	147 Å²	147	85%	0.851	77%	0.767	S	S	*	*			trans	-145.2	97.4	138.5	-107.5	-72.1	0	0	0	108.9
1248	S	29.1	Very low	31	Very low	97 Å²	97	145.4 Å²	145.4	68%	0.678	77%	0.768	S	S	*	*			trans	-83.7	133.9	169	49.8	0	0	0	0	110.2
1249	M	33.5	Very low	31.3	Very low	172 Å²	172	144.8 Å²	144.8	85%	0.847	77%	0.768	S	S	*	*			trans	-167.4	133.3	159.5	-103.5	175.7	-177.5	0	0	108.4
1250	N	35.1	Very low	31	Very low	135 Å²	135	144.6 Å²	144.6	72%	0.722	77%	0.769	S	S	*	*			cis	-160	115.1	-22.6	-122.2	30.9	0	0	0	105.5
1251	D	30.5	Very low	31	Very low	156 Å²	156	144.6 Å²	144.6	83%	0.834	77%	0.769	S	S	*	*			trans	-107.3	166.1	161.7	-75.9	-50.4	0	0	0	107.6
1252	E	32.5	Very low	31.1	Very low	183 Å²	183	144.3 Å²	144.3	86%	0.855	77%	0.768	S	S	*	*			trans	83.1	129.9	-163	-55.4	172.2	172.1	0	0	112.2
1253	D	32.7	Very low	31.1	Very low	151 Å²	151	144.7 Å²	144.7	81%	0.807	77%	0.767	S	S	*	*			cis	-126.3	142.5	19.6	-88.8	-52.4	0	0	0	115.3
1254	I	29.1	Very low	30.9	Very low	173 Å²	173	142 Å²	142	89%	0.887	76%	0.759	S	S	*	*			trans	-99.7	118.5	153.7	-63.4	170	0	0	0	106.9
1255	S	32.3	Very low	31	Very low	110 Å²	110	142.4 Å²	142.4	77%	0.769	76%	0.756	S	S	*	*			trans	-155.6	142.1	157.8	-146.5	0	0	0	0	113.6
1256	S	27.9	Very low	30.9	Very low	91 Å²	91	137.8 Å²	137.8	64%	0.636	75%	0.748	S	S	*	*			trans	-70.8	-176.7	161.1	58.8	0	0	0	0	109.5
1257	D	27.4	Very low	31.1	Very low	136 Å²	136	137 Å²	137	73%	0.727	74%	0.744	S	S	*	*			cis	-171.6	-178.2	30.5	-141.4	-44.4	0	0	0	112.8
1258	V	30.8	Very low	31	Very low	117 Å²	117	132.5 Å²	132.5	71%	0.709	73%	0.729	S	S	*	*			trans	80.4	144.4	144.6	159.1	0	0	0	0	120.5
1259	S	32.9	Very low	31.2	Very low	98 Å²	98	135.3 Å²	135.3	69%	0.685	73%	0.732	S	S	*	*			trans	91.3	72.2	156.1	65.3	0	0	0	0	121.6
1260	S	30.2	Very low	31	Very low	99 Å²	99	134.6 Å²	134.6	69%	0.692	73%	0.726	S	S	*	*				50.6	111.9	107.8	69.2	0	0	0	0	121.4
1261	T	27.4	Very low	30.9	Very low	122 Å²	122	133.3 Å²	133.3	75%	0.748	72%	0.719	S	S	*	*				35.7	108.7	127.5	47.9	0	0	0	0	121.2
1262	K	32.2	Very low	30.9	Very low	200 Å²	200	132.9 Å²	132.9	87%	0.87	71%	0.712	S	S	*	*				-155.9	130.4	114.4	-98.5	148.8	-177.3	-178.9	0	107.8
1263	V	28.7	Very low	30.8	Very low	108 Å²	108	130.5 Å²	130.5	66%	0.655	70%	0.704	S	S	*	*			cis	74.9	133.8	49.3	178.8	0	0	0	0	110.8
1264	D	29.7	Very low	30.5	Very low	129 Å²	129	128.1 Å²	128.1	69%	0.69	70%	0.696	S	S	*	*			trans	69.5	141.8	-178.8	-63	-35.2	0	0	0	115.7
1265	H	32.9	Very low	30.7	Very low	144 Å²	144	127 Å²	127	67%	0.667	69%	0.692	S	S	*	*			cis	-164.5	155.5	9.9	-126.9	17.7	0	0	0	112.8
1266	L	32.1	Very low	30.4	Very low	134 Å²	134	126.2 Å²	126.2	70%	0.702	69%	0.686	S	S	*	*			trans	76.2	149.9	143.5	-63.1	166.1	0	0	0	123.5
1267	Q	32.7	Very low	30.5	Very low	128 Å²	128	130.7 Å²	130.7	60%	0.598	70%	0.696	S	S	*	*			trans	70.8	86.7	149.4	-99	41.5	36.4	0	0	121.6
1268	D	31.6	Very low	30.6	Very low	100 Å²	100	132.6 Å²	132.6	54%	0.535	70%	0.701	S	S	.	*				93.8	137.8	97.8	-88.6	17.2	0	0	0	122
1269	Q	34	Very low	30.7	Very low	156 Å²	156	131.8 Å²	131.8	73%	0.729	70%	0.698	S	S	*	*			trans	70.1	142.5	141.1	-71.2	171.8	48.9	0	0	118.9
1270	H	29.3	Very low	30.5	Very low	156 Å²	156	135.7 Å²	135.7	72%	0.722	70%	0.703	S	S	*	*			cis	-172	-173.1	-29.2	-138	-106.2	0	0	0	105.8
1271	D	32.2	Very low	30.5	Very low	108 Å²	108	136.8 Å²	136.8	58%	0.578	71%	0.706	S	S	*	*			trans	63.7	94	140.2	-70.1	-16.1	0	0	0	120.6
1272	Q	29.8	Very low	30.7	Very low	148 Å²	148	133.8 Å²	133.8	69%	0.692	69%	0.693	S	S	*	*				100.2	151.1	96.8	-91.7	178.5	64.9	0	0	120.7
1273	L	31.6	Very low	30.5	Very low	132 Å²	132	128 Å²	128	69%	0.691	68%	0.677	S	S	*	*			trans	64.4	98.2	150.4	-67.3	164.3	0	0	0	118
1274	T	26.4	Very low	30.6	Very low	102 Å²	102	127.6 Å²	127.6	63%	0.626	68%	0.675	S	S	*	*				15.8	132.2	111.4	59.7	0	0	0	0	117.1
1275	N	32.3	Very low	30.6	Very low	150 Å²	150	125.6 Å²	125.6	80%	0.802	68%	0.677	S	S	*	*				-161.6	158.5	101.5	-94.8	-21.7	0	0	0	113.4
1276	S	25.5	Very low	30.4	Very low	92 Å²	92	126.1 Å²	126.1	64%	0.643	68%	0.684	S	S	*	*			trans	-52.7	152.1	163.3	50	0	0	0	0	112.9
1277	E	30.8	Very low	30.2	Very low	185 Å²	185	124.1 Å²	124.1	86%	0.864	68%	0.681	S	S	*	*				-162.1	137.5	98.8	-102.7	166.9	-168.1	0	0	113.4
1278	E	29	Very low	29.9	Very low	176 Å²	176	125.7 Å²	125.7	82%	0.822	69%	0.693	S	S	*	*			trans	-57.6	172.5	158.4	-86.7	-168.7	143.3	0	0	110.5
1279	P	34.4	Very low	29.7	Very low	101 Å²	101	126.5 Å²	126.5	66%	0.656	71%	0.706	S	S	*	*			cis	-166.7	-169.4	46.4	48.6	-25.4	0	0	0	121.2
1280	F	28.4	Very low	29.2	Very low	180 Å²	180	123.6 Å²	123.6	79%	0.789	70%	0.704	S	S	*	*			trans	59.8	109.1	158.8	-76.6	-76.7	0	0	0	117.7
1281	V	29.8	Very low	29.1	Very low	122 Å²	122	123.6 Å²	123.6	74%	0.739	71%	0.709	S	S	*	*			cis	64.9	119.4	46.9	-174.5	0	0	0	0	114.1
1282	A	30.4	Very low	28.8	Very low	59 Å²	59	123.5 Å²	123.5	49%	0.488	71%	0.712	S	S	.	*			trans	-173.9	92.9	141.3	0	0	0	0	0	110.5	R593	R593-A1282 PolarHBondContact NH1-O 2.76Å; R593-A1282 PolarHBondContact NH2-O 3.47Å
1283	S	29.3	Very low	28.7	Very low	77 Å²	77	123.1 Å²	123.1	54%	0.538	71%	0.714	S	S	.	*			trans	37.7	163.4	136.4	-44.9	0	0	0	0	121.8	R593	R593-S1283 PolarHBondContact NH1-O 2.6Å
1284	T	29.4	Very low	28.3	Very low	100 Å²	100	122.5 Å²	122.5	61%	0.613	71%	0.711	S	S	*	*			cis	-129.4	-143.7	1	-24.5	0	0	0	0	108.7	L594	L594-T1284 WeakPolarHBondContact CD1-O 3.44Å
1285	A	29.8	Very low	28.3	Very low	88 Å²	88	126.8 Å²	126.8	73%	0.727	72%	0.717	S	S	*	*			cis	-149	155.7	7.6	0	0	0	0	0	114.7
1286	L	30	Very low	28.1	Very low	154 Å²	154	126.5 Å²	126.5	81%	0.806	71%	0.71	S	S	*	*			trans	-7.7	146.3	149.4	-59.4	172	0	0	0	119.9
1287	S	27.7	Very low	28.4	Very low	93 Å²	93	127 Å²	127	65%	0.65	71%	0.71	S	S	*	*			cis	-171.8	145.5	-4.5	47.9	0	0	0	0	114.5
1288	L	25.8	Very low	28.3	Very low	161 Å²	161	126 Å²	126	84%	0.843	71%	0.705	S	S	*	*			trans	35	133.2	132.6	-55.9	162.3	0	0	0	118.5
1289	S	27.6	Very low	28.3	Very low	116 Å²	116	120.6 Å²	120.6	81%	0.811	70%	0.696	S	S	*	*				-161	153.7	55.5	60.7	0	0	0	0	116
1290	S	24.1	Very low	28	Very low	96 Å²	96	121.4 Å²	121.4	67%	0.671	70%	0.699	S	S	*	*			trans	-85.2	147.7	172	54.9	0	0	0	0	114.7
1291	N	27.8	Very low	28	Very low	155 Å²	155	118.8 Å²	118.8	83%	0.829	69%	0.693	S	S	*	*			trans	-163.4	123.1	140.2	-86.9	-37.5	0	0	0	107.1
1292	V	24.7	Very low	27.7	Very low	106 Å²	106	118.9 Å²	118.9	64%	0.642	68%	0.684	S	S	*	*				76	84	55.4	-177.4	0	0	0	0	113.1
1293	N	27.1	Very low	27.5	Very low	140 Å²	140	126.4 Å²	126.4	75%	0.749	70%	0.702	S	S	*	*			trans	175.6	118	133.6	-84.8	-27.2	0	0	0	106.8
1294	I	25.1	Very low	27.4	Very low	119 Å²	119	127.5 Å²	127.5	61%	0.61	71%	0.705	S	S	*	*				63.6	94.8	62.8	-53.5	168.3	0	0	0	111.6
1295	Y	26.2	Very low	27.2	Very low	193 Å²	193	130 Å²	130	76%	0.757	71%	0.713	S	S	*	*				-176.9	144.3	109.3	-99	-59	0	0	0	114.1
1296	H	28.3	Very low	27.3	Very low	143 Å²	143	134 Å²	134	66%	0.662	72%	0.717	S	S	*	*			trans	45.6	121.5	159	-66.1	-60.8	0	0	0	119.8
1297	T	29.8	Very low	27.3	Very low	104 Å²	104	131.2 Å²	131.2	64%	0.638	71%	0.708	S	S	*	*				63.2	147.8	57.1	79.1	0	0	0	0	114.1
1298	E	29.9	Very low	27.3	Very low	164 Å²	164	133.8 Å²	133.8	77%	0.766	71%	0.713	S	S	*	*			cis	-102.8	171.2	-6.9	-73.3	78.4	-118.1	0	0	111.5
1299	G	29.3	Very low	27.5	Very low	61 Å²	61	131.3 Å²	131.3	63%	0.629	70%	0.701	S	S	*	*			cis	122.9	149.1	-2.8	0	0	0	0	0	114.3
1300	T	28.7	Very low	27.4	Very low	118 Å²	118	129.1 Å²	129.1	72%	0.724	68%	0.678	S	S	*	*			trans	65	139.2	145.7	59.5	0	0	0	0	119.8
1301	N	26.9	Very low	27.5	Very low	125 Å²	125	127.4 Å²	127.4	67%	0.668	66%	0.661	S	S	*	*			cis	-158.7	162	4.9	-103.4	-12.8	0	0	0	113.3
1302	F	24.2	Very low	27.7	Very low	125 Å²	125	125.2 Å²	125.2	55%	0.548	65%	0.654	S	S	.	*			trans	-23.6	161	154.8	-53.3	-100.6	0	0	0	118.8
1303	Y	25.6	Very low	27.7	Very low	217 Å²	217	123.5 Å²	123.5	85%	0.851	64%	0.643	S	S	*	*				-161.7	163.8	114.9	-108.5	-70.6	0	0	0	113.8
1304	V	27.8	Very low	27.8	Very low	100 Å²	100	123.1 Å²	123.1	61%	0.606	64%	0.64	S	S	*	*			trans	-131.5	-179	-177.8	-177.9	0	0	0	0	107.8
1305	I	25.5	Very low	27.8	Very low	151 Å²	151	122.9 Å²	122.9	77%	0.774	64%	0.64	S	S	*	*			trans	83.7	143.4	163.1	-27.8	170.8	0	0	0	116.4
1306	E	30.4	Very low	28	Very low	174 Å²	174	118.7 Å²	118.7	81%	0.813	64%	0.639	S	S	*	*			trans	-68.9	-160.1	152.9	-35	171.5	101.7	0	0	110.4
1307	P	31.1	Very low	28.1	Very low	95 Å²	95	117.5 Å²	117.5	62%	0.617	64%	0.642	S	S	*	*			cis	-123.1	-155.3	-32.7	28.6	-6.4	0	0	0	109.7
1308	L	27.9	Very low	28	Very low	147 Å²	147	118.2 Å²	118.2	77%	0.77	64%	0.642	S	S	*	*			trans	72.1	139.5	151.9	-72.3	165.3	0	0	0	121.4
1309	N	28.8	Very low	27.8	Very low	109 Å²	109	117.2 Å²	117.2	58%	0.583	64%	0.641	S	S	*	*			trans	58	110.4	147.4	-76.7	42.3	0	0	0	122.7
1310	E	27.2	Very low	27.7	Very low	69 Å²	69	119.1 Å²	119.1	32%	0.322	64%	0.641	S	S	.	*				46.2	100.7	110.3	-58.6	179.1	160.4	0	0	117.1	S1486	E1310-S1486 PolarHBondContact OE1-OG 3.31Å
1311	N	25.9	Very low	27.5	Very low	61 Å²	61	123.3 Å²	123.3	33%	0.326	64%	0.643	S	S	.	*				165.1	127.5	98.6	-82.8	-59.6	0	0	0	111.3	R1482 S1483 E1484	N1311-R1482 HydrophobicContact CB-CB 4.42Å; N1311-R1482 WeakPolarHBondContact ND2-CG 3.06Å; N1311-S1483 WeakPolarHBondContact OD1-CA 3.19Å; N1311-S1483 PolarHBondContact OD1-N 2.71Å; N1311-S1483 VanDerWaalsContact OD1-N 3.17Å; N1311-S1483 PolarHBondContact OD1-O 3.14Å; N1311-E1484 PolarHBondContact OD1-N 3.29Å
1312	T	31.7	Very low	27.4	Very low	109 Å²	109	123.8 Å²	123.8	67%	0.669	65%	0.645	S	S	*	*			cis	67.9	101.6	41.8	-44.2	0	0	0	0	114
1313	T	24.4	Very low	27.7	Very low	70 Å²	70	123.4 Å²	123.4	43%	0.429	65%	0.653	S	S	.	*			trans	173.7	145.6	151.4	36.3	0	0	0	0	111.1	T1481 R1482	T1313-T1481 WeakPolarHBondContact CG2-O 3.47Å; T1313-T1481 PolarHBondContact OG1-O 3.48Å; T1313-R1482 PolarHBondContact OG1-N 3.06Å
1314	I	28.5	Very low	27.6	Very low	131 Å²	131	119.9 Å²	119.9	67%	0.672	64%	0.644	S	S	*	*			cis	-160	159.4	-18	-133.1	171.4	0	0	0	110.4
1315	D	26.7	Very low	27.5	Very low	114 Å²	114	122 Å²	122	61%	0.61	65%	0.646	S	S	*	*			trans	60.6	156.5	167.3	-87.3	-37.8	0	0	0	119.2
1316	S	28.7	Very low	27.5	Very low	106 Å²	106	121.9 Å²	121.9	74%	0.741	65%	0.645	S	S	*	*	S	Bend	cis	-138.3	152.4	5.7	104.9	0	0	0	0	111.7
1317	T	31.7	Very low	27.2	Very low	118 Å²	118	117.4 Å²	117.4	72%	0.724	63%	0.634	S	S	*	*			cis	-138	145.9	-1.7	-48.2	0	0	0	0	110.5
1318	N	27.1	Very low	27	Very low	118 Å²	118	119.5 Å²	119.5	63%	0.631	64%	0.638	S	S	*	*			trans	-45.1	178.9	167.5	-83.9	-81.9	0	0	0	117.5
1319	L	25.7	Very low	26.8	Very low	144 Å²	144	117.5 Å²	117.5	75%	0.754	64%	0.636	S	S	*	*			trans	85.1	143.3	152.9	-110.5	70.3	0	0	0	115.9
1320	T	26.2	Very low	26.7	Very low	101 Å²	101	115.8 Å²	115.8	62%	0.62	63%	0.633	S	S	*	*			cis	-150.6	128.1	15.8	-32.1	0	0	0	0	113.2
1321	R	26.1	Very low	26.7	Very low	205 Å²	205	119.7 Å²	119.7	77%	0.774	66%	0.656	S	S	*	*			trans	46.7	141.2	133.2	-80.7	177.1	161.6	150.6	-4	123
1322	L	24.2	Very low	26.7	Very low	135 Å²	135	121 Å²	121	71%	0.707	67%	0.67	S	S	*	*			trans	67.9	124.6	134.2	-64.7	170.8	0	0	0	116.7
1323	T	29.6	Very low	26.5	Very low	118 Å²	118	122 Å²	122	72%	0.724	67%	0.671	S	S	*	*				64.4	147.2	75.4	-46.3	0	0	0	0	113.2
1324	E	25.1	Very low	26.6	Very low	143 Å²	143	125 Å²	125	67%	0.668	68%	0.684	S	S	*	*			trans	82	149.6	179.2	-56.8	-161.5	97.7	0	0	116.9
1325	K	25.4	Very low	26.7	Very low	145 Å²	145	124 Å²	124	63%	0.63	68%	0.68	S	S	*	*			trans	70.9	108.8	143.8	-76.5	153.8	-169.9	158	0	119.3
1326	L	25.9	Very low	26.8	Very low	147 Å²	147	125.4 Å²	125.4	77%	0.77	69%	0.688	S	S	*	*				76.3	90.7	122	-62.8	170.6	0	0	0	115.1
1327	S	24.2	Very low	26.8	Very low	81 Å²	81	126 Å²	126	57%	0.566	68%	0.683	S	S	*	*				83.1	165.3	66.7	70.9	0	0	0	0	113.4
1328	I	25.4	Very low	26.6	Very low	138 Å²	138	126.5 Å²	126.5	71%	0.708	68%	0.68	S	S	*	*			trans	64.5	77.7	157	-67.8	165	0	0	0	110.8
1329	S	25.3	Very low	26.8	Very low	105 Å²	105	127.9 Å²	127.9	73%	0.734	69%	0.688	S	S	*	*				76.3	-173.7	88.8	75.3	0	0	0	0	110.3
1330	S	26.1	Very low	27	Very low	74 Å²	74	124.5 Å²	124.5	52%	0.517	68%	0.68	S	S	.	*			cis	-159.4	155.4	22.9	-25.1	0	0	0	0	111.6
1331	N	25.9	Very low	27.1	Very low	151 Å²	151	127.1 Å²	127.1	81%	0.807	69%	0.69	S	S	*	*			trans	73.5	142.7	143.2	-61.6	-7.5	0	0	0	117.9
1332	S	26.2	Very low	27.3	Very low	89 Å²	89	121 Å²	121	62%	0.622	68%	0.684	S	S	*	*			cis	-171.9	151.5	-10.3	46	0	0	0	0	112.2
1333	L	27.4	Very low	27.6	Very low	130 Å²	130	121.7 Å²	121.7	68%	0.681	68%	0.683	S	S	*	*				33.9	126.6	127.8	-49.9	163.2	0	0	0	116.8
1334	N	28.1	Very low	27.6	Very low	132 Å²	132	124.5 Å²	124.5	71%	0.706	69%	0.686	S	S	*	*				-154.6	144.7	52.7	-88.4	-67.5	0	0	0	109.8
1335	N	29	Very low	27.7	Very low	110 Å²	110	122.8 Å²	122.8	59%	0.588	68%	0.681	S	S	*	*				52.6	104.2	73.9	-52.2	-32.9	0	0	0	109.8
1336	N	29	Very low	27.8	Very low	143 Å²	143	124.9 Å²	124.9	77%	0.765	69%	0.69	S	S	*	*				172.7	157.1	79.4	-99.7	1.8	0	0	0	108.3
1337	D	28.5	Very low	27.9	Very low	120 Å²	120	122.1 Å²	122.1	64%	0.642	68%	0.679	S	S	*	*			cis	-169.1	178.6	-16.1	-149.2	-17.8	0	0	0	108.5
1338	L	29.2	Very low	28.1	Very low	127 Å²	127	124.5 Å²	124.5	67%	0.665	69%	0.69	S	S	*	*			trans	59.2	109.8	151.3	-93.2	125.8	0	0	0	121.2
1339	D	29.6	Very low	28.3	Very low	148 Å²	148	123.3 Å²	123.3	79%	0.791	68%	0.684	S	S	*	*				71.6	149.3	116.2	-88.8	-5.3	0	0	0	122.4
1340	A	30.2	Very low	28.4	Very low	73 Å²	73	127.6 Å²	127.6	60%	0.603	69%	0.69	S	S	*	*			cis	-150.1	162.3	2.1	0	0	0	0	0	114.1
1341	D	29	Very low	28.5	Very low	155 Å²	155	130.8 Å²	130.8	83%	0.829	71%	0.706	S	S	*	*			trans	64	99.6	144.3	-78.3	-28.2	0	0	0	122.9
1342	A	30.8	Very low	28.6	Very low	78 Å²	78	131.6 Å²	131.6	65%	0.645	71%	0.705	S	S	*	*				89.8	121.5	110.6	0	0	0	0	0	119.3
1343	H	29.9	Very low	28.6	Very low	148 Å²	148	134.4 Å²	134.4	69%	0.685	71%	0.713	S	S	*	*				62	131.3	67.6	-88	-110.5	0	0	0	113.2
1344	F	28.3	Very low	28.6	Very low	178 Å²	178	135.7 Å²	135.7	78%	0.781	72%	0.72	S	S	*	*			cis	-150.6	159.9	49.9	-116.6	-85.5	0	0	0	115.9
1345	N	28.3	Very low	28.7	Very low	107 Å²	107	134 Å²	134	57%	0.572	72%	0.719	S	S	*	*			trans	-26.9	153.7	169.9	-60.9	-29	0	0	0	119.6
1346	K	27.7	Very low	28.6	Very low	188 Å²	188	136.5 Å²	136.5	82%	0.817	73%	0.731	S	S	*	*			cis	79.3	151.5	34.3	-165.3	-173.6	176.2	179.9	0	113.7
1347	V	27.7	Very low	28.7	Very low	89 Å²	89	136 Å²	136	54%	0.539	73%	0.728	S	S	.	*			trans	80.2	104.8	175.9	-168.2	0	0	0	0	112.7
1348	V	29.1	Very low	28.6	Very low	131 Å²	131	133.9 Å²	133.9	79%	0.794	72%	0.723	S	S	*	*				76.8	130.9	61.5	178.4	0	0	0	0	113.2
1349	I	28.1	Very low	28.4	Very low	113 Å²	113	138.7 Å²	138.7	58%	0.579	73%	0.732	S	S	*	*				179.8	147.3	124.8	-91.3	166.3	0	0	0	110.1	N1692	I1349-N1692 HydrophobicContact CD1-CB 4.4Å; I1349-N1692 WeakPolarHBondContact CD1-ND2 3.31Å
1350	K	28.9	Very low	28.6	Very low	196 Å²	196	138.3 Å²	138.3	85%	0.852	74%	0.735	S	S	*	*			trans	-89.4	147	168.3	-64.3	177	-179.7	176	0	110.4
1351	T	28.3	Very low	28.5	Very low	141 Å²	141	144.1 Å²	144.1	87%	0.865	75%	0.746	S	S	*	*			trans	-148.9	158.2	152.1	0.7	0	0	0	0	110.4
1352	E	26.8	Very low	28.3	Very low	168 Å²	168	143.6 Å²	143.6	79%	0.785	74%	0.744	S	S	*	*			trans	-107.4	161.4	-169.8	-56.7	173.9	125.4	0	0	112
1353	N	27.1	Very low	28.2	Very low	147 Å²	147	147.6 Å²	147.6	79%	0.786	75%	0.753	S	S	*	*			trans	63.4	136.9	166.3	-50.3	-37.2	0	0	0	115
1354	D	27.6	Very low	28.2	Very low	157 Å²	157	147.9 Å²	147.9	84%	0.84	76%	0.759	S	S	*	*			cis	-146.7	-176.2	41.2	-129	-42.9	0	0	0	113.9
1355	S	29.6	Very low	28.1	Very low	96 Å²	96	146.1 Å²	146.1	67%	0.671	75%	0.753	S	S	*	*			trans	-93.3	-167.8	-177	73.2	0	0	0	0	115
1356	I	27.7	Very low	28	Very low	164 Å²	164	150.3 Å²	150.3	84%	0.841	76%	0.761	S	S	*	*			trans	86.3	130.7	-178.1	-52.4	159.9	0	0	0	113.1
1357	D	29.7	Very low	28	Very low	132 Å²	132	145.3 Å²	145.3	71%	0.706	75%	0.748	S	S	*	*			cis	-134.3	168.1	-6.7	-161.8	-7.5	0	0	0	110.7
1358	S	26.5	Very low	27.9	Very low	76 Å²	76	143.1 Å²	143.1	53%	0.531	74%	0.737	S	S	.	*			trans	-65.7	167.6	164.3	66.6	0	0	0	0	115.1
1359	R	26.3	Very low	27.8	Very low	228 Å²	228	142.3 Å²	142.3	86%	0.86	73%	0.728	S	S	*	*			trans	78.2	140.4	177.1	-46.4	154.7	-174.5	-160.5	-0.1	112.5
1360	V	33	Very low	27.8	Very low	139 Å²	139	144.1 Å²	144.1	84%	0.842	73%	0.734	S	S	*	*			cis	-116.5	132.5	11.3	176.5	0	0	0	0	111
1361	K	28.3	Very low	27.7	Very low	196 Å²	196	140.8 Å²	140.8	85%	0.852	73%	0.725	S	S	*	*			trans	-133.7	93.3	168.7	179.8	-175.7	-179.6	175.8	0	108.7
1362	D	25.3	Very low	27.7	Very low	144 Å²	144	142.3 Å²	142.3	77%	0.77	73%	0.725	S	S	*	*			trans	-174.8	166.5	159.5	-101.4	-25.7	0	0	0	109.5
1363	L	27.8	Very low	27.7	Very low	161 Å²	161	140 Å²	140	84%	0.843	72%	0.718	S	S	*	*			trans	71.3	121.9	-168.1	-54.8	164	0	0	0	113.4
1364	L	30.7	Very low	27.6	Very low	154 Å²	154	139.1 Å²	139.1	81%	0.806	72%	0.718	S	S	*	*			cis	-144.6	135.6	-16.7	-73.6	156.8	0	0	0	102.9
1365	Q	25.9	Very low	27.6	Very low	142 Å²	142	137.7 Å²	137.7	66%	0.664	71%	0.709	S	S	*	*			cis	70.9	103.7	27.4	-129.4	-156.5	34.3	0	0	116.9
1366	R	25.7	Very low	27.4	Very low	195 Å²	195	138.9 Å²	138.9	74%	0.736	72%	0.718	S	S	*	*			trans	77.2	142.3	167.9	-41	-179.5	-149.5	-167.2	5.5	112.9
1367	C	27	Very low	27.2	Very low	82 Å²	82	133.3 Å²	133.3	55%	0.554	69%	0.692	S	S	*	*			cis	-130.1	-171.3	30	-83.1	0	0	0	0	115.6	E1214	E1214-C1367 VanDerWaalsContact CD-C 3.48Å; E1214-C1367 PolarHBondContact OE1-N 2.88Å; E1214-C1367 VanDerWaalsContact OE2-C 3.26Å; E1214-C1367 WeakPolarHBondContact OE2-CA 3.28Å; E1214-C1367 VanDerWaalsContact OE2-CB 3.24Å; E1214-C1367 WeakPolarHBondContact OE2-CB 3.48Å; E1214-C1367 PolarHBondContact OE2-N 3.21Å
1368	S	26.5	Very low	27	Very low	43 Å²	43	132.9 Å²	132.9	30%	0.301	69%	0.688	S	S	.	*			trans	-123.9	160.9	163.8	57.5	0	0	0	0	107	E1214 I1215	E1214-S1368 CarbonylContact O-C 3.4Å; E1214-S1368 WeakPolarHBondContact O-CA 3.46Å; I1215-S1368 VanDerWaalsContact O-CA 3.3Å; I1215-S1368 WeakPolarHBondContact O-CA 3.41Å; I1215-S1368 WeakPolarHBondContact O-CB 3.49Å
1369	L	27.3	Very low	27.1	Very low	114 Å²	114	136 Å²	136	60%	0.597	70%	0.697	S	S	*	*				-174.3	124.9	120.9	-136	60.3	0	0	0	116	E1214	E1214-L1369 PolarHBondContact O-N 3.05Å
1370	E	27.1	Very low	27.1	Very low	151 Å²	151	129.2 Å²	129.2	71%	0.706	68%	0.675	S	S	*	*			trans	49.1	125.2	139.8	-67.3	161.7	-168.3	0	0	122.6
1371	D	27.2	Very low	26.7	Very low	127 Å²	127	128.1 Å²	128.1	68%	0.679	66%	0.663	S	S	*	*				51.9	115.4	129	-59.4	9.8	0	0	0	121.4
1372	M	28.4	Very low	26.6	Very low	173 Å²	173	124.1 Å²	124.1	85%	0.852	66%	0.655	S	S	*	*				-159.2	122.5	88.6	-81.3	-127.5	-87.6	0	0	109.4
1373	N	26.1	Very low	26.8	Very low	119 Å²	119	128.1 Å²	128.1	64%	0.636	66%	0.66	S	S	*	*				63.3	134.2	74.5	-87.8	-49.5	0	0	0	114.5
1374	T	26.1	Very low	26.8	Very low	128 Å²	128	124.8 Å²	124.8	79%	0.785	65%	0.649	S	S	*	*			trans	63.3	144.8	-178.1	48.5	0	0	0	0	116.8
1375	L	28.5	Very low	26.7	Very low	127 Å²	127	122.4 Å²	122.4	67%	0.665	65%	0.646	S	S	*	*			cis	-133	138.4	5.8	-114.6	137.1	0	0	0	110.8	T1377	L1375-T1377 HydrophobicContact CD2-CG2 4.28Å; L1375-T1377 PolarHBondContact O-N 3.07Å
1376	S	25.3	Very low	26.8	Very low	122 Å²	122	120.7 Å²	120.7	85%	0.853	65%	0.649	S	S	*	*	S	Bend	trans	-75.6	36.3	172	-175.3	0	0	0	0	111.6
1377	T	23.4	Very low	26.9	Very low	47 Å²	47	118 Å²	118	29%	0.288	65%	0.648	S	S	.	*			trans	-161	105	-163	-64.5	0	0	0	0	112.4	E1060 L1375	E1060-T1377 HydrophobicContact CB-CG2 3.92Å; E1060-T1377 HydrophobicContact CG-CG2 3.81Å; E1060-T1377 VanDerWaalsContact OE1-CA 3.25Å; E1060-T1377 WeakPolarHBondContact OE1-CA 3.5Å; L1375-T1377 HydrophobicContact CD2-CG2 4.28Å; L1375-T1377 PolarHBondContact O-N 3.07Å
1378	I	24.7	Very low	26.9	Very low	123 Å²	123	121.9 Å²	121.9	63%	0.631	66%	0.658	S	S	*	*			trans	132.7	94.6	151.6	-66.1	161.6	0	0	0	114	E1060	E1060-I1378 WeakPolarHBondContact OE1-CA 3.27Å; E1060-I1378 PolarHBondContact OE1-N 2.89Å; E1060-I1378 WeakPolarHBondContact OE2-CA 3.4Å; E1060-I1378 VanDerWaalsContact OE2-CG1 3.26Å; E1060-I1378 WeakPolarHBondContact OE2-CG1 3.32Å; E1060-I1378 PolarHBondContact OE2-N 3.46Å
1379	I	29.3	Very low	26.8	Very low	141 Å²	141	124.6 Å²	124.6	72%	0.723	68%	0.677	S	S	*	*				-141.9	104.5	104.2	-57.4	-167.9	0	0	0	109.7	I1058	I1058-I1379 WeakPolarHBondContact CG2-O 3.4Å
1380	H	24.6	Very low	26.8	Very low	86 Å²	86	127.3 Å²	127.3	40%	0.398	69%	0.691	S	S	.	*			trans	-98	157.1	163.6	-161.9	20.6	0	0	0	109.4	I1058 T1059	I1058-H1380 PolarHBondContact O-CE1 2.87Å; I1058-H1380 PolarHBondContact O-ND1 3.45Å; T1059-H1380 PolarHBondContact N-CE1 2.93Å; T1059-H1380 PolarHBondContact N-ND1 3.48Å; T1059-H1380 PolarHBondContact O-CD2 3.48Å; T1059-H1380 VanDerWaalsContact O-CD2 3.3Å; T1059-H1380 WeakPolarHBondContact OG1-CA 3.4Å; T1059-H1380 WeakPolarHBondContact OG1-CB 3.42Å; T1059-H1380 VanDerWaalsContact OG1-CG 3.25Å; T1059-H1380 PolarHBondContact OG1-ND1 2.73Å
1381	I	25.2	Very low	26.7	Very low	115 Å²	115	129.1 Å²	129.1	59%	0.59	70%	0.7	S	S	*	*			trans	68.1	117.2	165.5	-56.5	147.3	0	0	0	113.7
1382	V	26.1	Very low	26.8	Very low	112 Å²	112	127.1 Å²	127.1	68%	0.679	70%	0.701	S	S	*	*				-163.7	135.3	75.6	169.8	0	0	0	0	105.8
1383	R	29.7	Very low	26.8	Very low	229 Å²	229	125 Å²	125	86%	0.864	70%	0.697	S	S	*	*			cis	-160.5	127.7	45.6	-134.1	155.2	-161.8	153	1.8	106.8
1384	S	27.9	Very low	26.9	Very low	90 Å²	90	127.2 Å²	127.2	63%	0.629	71%	0.709	S	S	*	*			cis	83.3	81.8	16.3	-34	0	0	0	0	116.4
1385	S	29.2	Very low	27	Very low	104 Å²	104	128.9 Å²	128.9	73%	0.727	71%	0.708	S	S	*	*			trans	-173.4	95.6	148.2	52.5	0	0	0	0	109.3
1386	S	27.6	Very low	26.9	Very low	106 Å²	106	129 Å²	129	74%	0.741	71%	0.709	S	S	*	*				71.9	135	86.3	69.9	0	0	0	0	113
1387	I	28	Very low	27	Very low	139 Å²	139	130.6 Å²	130.6	71%	0.713	71%	0.708	S	S	*	*				-153.9	135.8	54.8	-81.9	179.5	0	0	0	112.3
1388	Q	26.9	Very low	27.3	Very low	164 Å²	164	135 Å²	135	77%	0.766	73%	0.729	S	S	*	*			trans	25.7	121.5	141.9	-65.1	158.7	-21.7	0	0	119.4
1389	S	25.2	Very low	27.4	Very low	99 Å²	99	136.8 Å²	136.8	69%	0.692	74%	0.739	S	S	*	*				82.2	132.1	54.4	79	0	0	0	0	115.8
1390	L	25.8	Very low	27.3	Very low	171 Å²	171	133.5 Å²	133.5	90%	0.895	73%	0.733	S	S	*	*				-168.2	159.5	125.4	-108.3	158.3	0	0	0	112.2
1391	Q	26.4	Very low	27.5	Very low	190 Å²	190	139.1 Å²	139.1	89%	0.888	76%	0.756	S	S	*	*			trans	-104.2	130.6	179.1	-61.5	166	-85.8	0	0	110.7
1392	A	28.1	Very low	27.7	Very low	84 Å²	84	139 Å²	139	69%	0.694	76%	0.761	S	S	*	*			trans	-163.4	131	151.4	0	0	0	0	0	105.5
1393	T	27.9	Very low	27.7	Very low	128 Å²	128	140.1 Å²	140.1	79%	0.785	76%	0.763	S	S	*	*				53.1	80.6	51.7	72.6	0	0	0	0	113.5
1394	D	28.9	Very low	27.6	Very low	166 Å²	166	139.3 Å²	139.3	89%	0.888	76%	0.76	S	S	*	*				-158.1	168.2	114.5	-106.8	-27.9	0	0	0	111.5
1395	E	27.3	Very low	27.5	Very low	163 Å²	163	140.9 Å²	140.9	76%	0.762	76%	0.76	S	S	*	*			trans	-85.1	173.4	-176.5	-52.7	-173.6	165.8	0	0	114
1396	N	27.3	Very low	27.4	Very low	129 Å²	129	143.2 Å²	143.2	69%	0.69	76%	0.76	S	S	*	*			trans	39.3	104.1	138.3	-70.7	-44.1	0	0	0	118.5
1397	L	28.3	Very low	27.5	Very low	157 Å²	157	148.1 Å²	148.1	82%	0.822	76%	0.764	S	S	*	*				-173.3	139.6	124.1	-120.9	60.6	0	0	0	114.1
1398	L	28.4	Very low	27.6	Very low	139 Å²	139	145.7 Å²	145.7	73%	0.728	76%	0.759	S	S	*	*			trans	40.7	118.6	143.5	-67.5	169.6	0	0	0	119.1
1399	L	28.3	Very low	27.7	Very low	160 Å²	160	145.2 Å²	145.2	84%	0.838	76%	0.756	S	S	*	*				57.1	135.1	53.8	-151.7	83.9	0	0	0	114.4
1400	A	26.2	Very low	27.7	Very low	73 Å²	73	145.5 Å²	145.5	60%	0.603	75%	0.75	S	S	*	*			trans	67.2	86.4	167.8	0	0	0	0	0	119.1
1401	K	29.1	Very low	27.9	Very low	204 Å²	204	144.1 Å²	144.1	89%	0.887	74%	0.739	S	S	*	*				-169.1	100.4	125.2	-95.9	143.2	-170.8	169.7	0	107.3
1402	V	28.8	Very low	28	Very low	112 Å²	112	141.7 Å²	141.7	68%	0.679	73%	0.732	S	S	*	*				52.4	110.9	50.9	-173.1	0	0	0	0	111
1403	D	27.2	Very low	28.1	Very low	136 Å²	136	142.4 Å²	142.4	73%	0.727	73%	0.727	S	S	*	*			trans	46.8	132	167.9	-53.6	-20.1	0	0	0	118.4
1404	R	26.4	Very low	28.2	Very low	212 Å²	212	143.2 Å²	143.2	80%	0.8	73%	0.727	S	S	*	*				-178.2	126.7	85.3	-95	-176.1	-175.6	-151.1	-5.4	113.8
1405	L	26	Very low	28.4	Very low	123 Å²	123	139.5 Å²	139.5	64%	0.644	71%	0.714	S	S	*	*			trans	68.4	167.4	143.3	-55.2	167.9	0	0	0	114.6
1406	Q	26.8	Very low	28.7	Very low	152 Å²	152	139.3 Å²	139.3	71%	0.71	71%	0.713	S	S	*	*			cis	-145.9	146.3	5.8	-148.4	134.9	-2.8	0	0	112.5
1407	Y	30.4	Very low	29	Very low	210 Å²	210	140.3 Å²	140.3	82%	0.824	71%	0.714	S	S	*	*			trans	-17.8	153.2	135.4	-86.4	-67.3	0	0	0	115.8
1408	S	31	Very low	29.2	Very low	88 Å²	88	136.9 Å²	136.9	62%	0.615	70%	0.703	S	S	*	*			cis	-171.7	176.6	17.4	38.5	0	0	0	0	111.2
1409	H	27.1	Very low	29.3	Very low	153 Å²	153	138.6 Å²	138.6	71%	0.708	71%	0.705	S	S	*	*			trans	78	139.5	136.6	-115.2	-0.2	0	0	0	117.8
1410	N	27	Very low	29.5	Very low	105 Å²	105	137.6 Å²	137.6	56%	0.561	70%	0.697	S	S	*	*			trans	67.3	144.5	135.6	-67.7	-3.1	0	0	0	118
1411	Q	28.9	Very low	29.8	Very low	142 Å²	142	140.2 Å²	140.2	66%	0.664	70%	0.701	S	S	*	*			cis	-167.1	165.3	10.9	-125	167.1	42.9	0	0	108.7
1412	L	28.7	Very low	30.1	Very low	140 Å²	140	136 Å²	136	73%	0.733	69%	0.693	S	S	*	*			trans	62.6	142.7	151.4	-93.3	65.6	0	0	0	117.8
1413	T	29.6	Very low	30.2	Very low	99 Å²	99	136.2 Å²	136.2	61%	0.607	69%	0.694	S	S	*	*			cis	-169.1	160.9	-16.1	3.7	0	0	0	0	108.6
1414	N	31.3	Very low	30.4	Very low	144 Å²	144	133.4 Å²	133.4	77%	0.77	69%	0.69	S	S	*	*			trans	69.5	144.8	148.7	-66.2	-6.8	0	0	0	117.6
1415	S	31.7	Very low	30.6	Very low	88 Å²	88	131.2 Å²	131.2	62%	0.615	69%	0.689	S	S	*	*			cis	-166	153.3	-4.4	38	0	0	0	0	111.8
1416	E	35.2	Very low	30.8	Very low	160 Å²	160	130.7 Å²	130.7	75%	0.748	70%	0.695	S	S	*	*			trans	70.1	145.1	156.5	-63.5	169	149.8	0	0	117.7
1417	Q	33.1	Very low	30.9	Very low	150 Å²	150	130.1 Å²	130.1	70%	0.701	70%	0.696	S	S	*	*			cis	-153.2	134.8	-10.5	-120.9	164.4	43.3	0	0	111
1418	S	31.3	Very low	30.8	Very low	85 Å²	85	124.4 Å²	124.4	59%	0.594	69%	0.687	S	S	*	*			trans	21.5	145.5	138.6	62.7	0	0	0	0	121.5
1419	F	31.3	Very low	30.5	Very low	175 Å²	175	125.2 Å²	125.2	77%	0.768	69%	0.693	S	S	*	*				-157.4	123.7	56.8	-128.5	-96.7	0	0	0	115.2
1420	M	32.3	Very low	30.7	Very low	138 Å²	138	124.3 Å²	124.3	68%	0.68	69%	0.693	S	S	*	*			trans	62.9	136.9	141.2	-68.3	-63.1	-168.4	0	0	125.5
1421	N	33.2	Very low	30.8	Very low	129 Å²	129	124.3 Å²	124.3	69%	0.69	70%	0.697	S	S	*	*			trans	72.6	142.1	141.1	-65.4	-5.1	0	0	0	120.1
1422	T	34	Very low	30.9	Very low	115 Å²	115	124.1 Å²	124.1	71%	0.706	70%	0.7	S	S	*	*			cis	-170.4	158.7	-9.6	28	0	0	0	0	109
1423	T	31.1	Very low	30.8	Very low	117 Å²	117	124.8 Å²	124.8	72%	0.718	70%	0.697	S	S	*	*			cis	-168.8	156.3	-40.5	-46.3	0	0	0	0	106.7
1424	A	31.2	Very low	30.9	Very low	76 Å²	76	129.4 Å²	129.4	63%	0.628	71%	0.705	S	S	*	*			trans	71.2	152.5	151.6	0	0	0	0	0	119.3
1425	E	31.4	Very low	30.7	Very low	167 Å²	167	127.2 Å²	127.2	78%	0.78	70%	0.7	S	S	*	*			cis	-156.9	164.2	-14.6	-119.1	158.5	-151.5	0	0	112
1426	S	29.8	Very low	30.6	Very low	112 Å²	112	128.1 Å²	128.1	78%	0.783	70%	0.702	S	S	*	*			trans	-131.8	113.9	171.5	57.9	0	0	0	0	111
1427	L	30.4	Very low	30.2	Very low	140 Å²	140	128 Å²	128	73%	0.733	71%	0.706	S	S	*	*			trans	-140.7	123.6	174.1	-67	173.3	0	0	0	106.8
1428	S	26.3	Very low	30.1	Very low	90 Å²	90	124.6 Å²	124.6	63%	0.629	71%	0.711	S	S	*	*			cis	95.2	123.5	38	77.8	0	0	0	0	113.1
1429	S	26.4	Very low	29.9	Very low	104 Å²	104	126.9 Å²	126.9	73%	0.727	72%	0.721	S	S	*	*			trans	68.3	151	179.3	85.5	0	0	0	0	114.1
1430	N	29.9	Very low	29.7	Very low	134 Å²	134	123 Å²	123	72%	0.717	72%	0.716	S	S	*	*			cis	-161.5	142.4	31.8	-113.8	-33.6	0	0	0	113
1431	V	30	Very low	29.5	Very low	105 Å²	105	124.6 Å²	124.6	64%	0.636	73%	0.726	S	S	*	*				56.5	125.2	128.2	174.7	0	0	0	0	122.1
1432	N	31.1	Very low	29.2	Very low	139 Å²	139	123.6 Å²	123.6	74%	0.743	73%	0.729	S	S	*	*			trans	68.7	126.4	154.7	-72.7	-21.1	0	0	0	119
1433	K	27.2	Very low	28.9	Very low	154 Å²	154	124 Å²	124	67%	0.67	73%	0.731	S	S	*	*			cis	97.9	140.7	49.3	-176	-179	-176	175.4	0	111.1
1434	Y	30.9	Very low	28.9	Very low	196 Å²	196	125.7 Å²	125.7	77%	0.769	73%	0.734	S	S	*	*			trans	77.1	147	-173	-57.4	-76.4	0	0	0	115.1
1435	C	27.7	Very low	29.2	Very low	98 Å²	98	130.9 Å²	130.9	66%	0.662	75%	0.745	S	S	*	*			cis	-170.2	170.1	-32.2	-121	0	0	0	0	110.3
1436	T	28.6	Very low	29.4	Very low	106 Å²	106	128.6 Å²	128.6	65%	0.65	75%	0.745	S	S	*	*			trans	50.9	118.3	150.2	52.2	0	0	0	0	120.8
1437	D	27.7	Very low	29.5	Very low	159 Å²	159	129.2 Å²	129.2	85%	0.85	75%	0.746	S	S	*	*				65.7	139.1	129.7	-41.6	-21.7	0	0	0	120.4
1438	G	30.8	Very low	29.5	Very low	77 Å²	77	128.5 Å²	128.5	79%	0.794	75%	0.753	S	S	*	*			trans	161.6	82.2	173.6	0	0	0	0	0	115.2
1439	T	27.5	Very low	29.7	Very low	133 Å²	133	127.7 Å²	127.7	82%	0.816	76%	0.759	S	S	*	*			trans	-53.7	139.8	177.5	-7.8	0	0	0	0	114.8
1440	S	26.2	Very low	30	Very low	95 Å²	95	130.6 Å²	130.6	66%	0.664	77%	0.766	S	S	*	*			trans	27.3	136	139.9	64.3	0	0	0	0	121.7
1441	I	28	Very low	30.1	Very low	170 Å²	170	129.5 Å²	129.5	87%	0.872	77%	0.767	S	S	*	*				-161.4	155.1	127.1	-103	150.9	0	0	0	109.9
1442	S	26.8	Very low	30	Very low	108 Å²	108	130 Å²	130	76%	0.755	78%	0.775	S	S	*	*			trans	-106.7	-133.8	-172.4	58.1	0	0	0	0	112.6
1443	V	28.6	Very low	29.9	Very low	125 Å²	125	130.8 Å²	130.8	76%	0.758	78%	0.777	S	S	*	*			trans	68	139.2	177.8	-124.1	0	0	0	0	113.8
1444	I	31.4	Very low	29.9	Very low	151 Å²	151	130.3 Å²	130.3	77%	0.774	78%	0.782	S	S	*	*			cis	-142.6	141.9	18.9	-57.8	160.9	0	0	0	111.4
1445	E	37.7	Very low	29.8	Very low	185 Å²	185	129 Å²	129	86%	0.864	79%	0.785	S	S	*	*			trans	-101.6	145.4	154.6	-81.5	-170.7	139.5	0	0	111.1
1446	P	34.9	Very low	29.7	Very low	119 Å²	119	130.4 Å²	130.4	77%	0.773	78%	0.782	S	S	*	*			trans	-99.6	154.4	162.3	36	-28.8	0	0	0	112.5
1447	P	32.5	Very low	29.6	Very low	126 Å²	126	132.7 Å²	132.7	82%	0.818	78%	0.783	S	S	*	*			trans	-113.6	166.5	-142.9	40.8	-34.7	0	0	0	116.9
1448	S	30	Very low	29.6	Very low	124 Å²	124	132.3 Å²	132.3	87%	0.867	78%	0.78	S	S	*	*			trans	-69	144.3	167.5	58.8	0	0	0	0	113.3
1449	G	30.6	Very low	29.7	Very low	73 Å²	73	135.3 Å²	135.3	75%	0.753	78%	0.776	S	S	*	*			trans	-139.2	99.8	170.9	0	0	0	0	0	112.9
1450	N	31.2	Very low	30	Very low	165 Å²	165	137.5 Å²	137.5	88%	0.882	78%	0.777	S	S	*	*			trans	-70.3	154.1	163.9	-90.1	-22.2	0	0	0	110.2
1451	P	33.4	Very low	30.3	Very low	112 Å²	112	137.6 Å²	137.6	73%	0.727	78%	0.775	S	S	*	*				-136.2	141.5	110.4	36.6	-27.4	0	0	0	113.7
1452	S	26.5	Very low	30.3	Very low	115 Å²	115	134.7 Å²	134.7	80%	0.804	77%	0.766	S	S	*	*			trans	-72.2	129.2	161.9	54.1	0	0	0	0	110.3
1453	I	29.5	Very low	30.3	Very low	156 Å²	156	133.6 Å²	133.6	80%	0.8	76%	0.763	S	S	*	*			trans	-129.1	123.2	159.1	-64.9	-174.3	0	0	0	108.6
1454	D	26.9	Very low	30.2	Very low	144 Å²	144	136 Å²	136	77%	0.77	77%	0.766	S	S	*	*			trans	-82.1	130.9	172.1	173.7	19	0	0	0	109.7
1455	M	28.9	Very low	30.1	Very low	168 Å²	168	134 Å²	134	83%	0.828	77%	0.765	S	S	*	*			trans	-164.7	116	146.5	-113.3	-162	-67.7	0	0	113.2
1456	E	25.9	Very low	29.5	Very low	128 Å²	128	131.8 Å²	131.8	60%	0.598	76%	0.759	S	S	*	*			trans	12.5	135.3	132.8	-71.3	-156.7	127.3	0	0	121
1457	K	27.5	Very low	29.1	Very low	154 Å²	154	132.2 Å²	132.2	67%	0.67	76%	0.755	S	S	*	*			trans	60.1	127.8	143.5	-56.8	158.9	-174.6	150.2	0	118.3
1458	L	28.1	Very low	28.8	Very low	150 Å²	150	133.4 Å²	133.4	79%	0.785	75%	0.754	S	S	*	*				-171.8	134.9	105.7	-118.1	73.5	0	0	0	112.2
1459	I	32.8	Very low	28.6	Very low	141 Å²	141	134.3 Å²	134.3	72%	0.723	75%	0.748	S	S	*	*			trans	63.5	83.5	148.1	-57.9	173.1	0	0	0	117.9
1460	Q	32.1	Very low	28.3	Very low	179 Å²	179	135.7 Å²	135.7	84%	0.836	75%	0.747	S	S	*	*				-59.7	159.1	123.8	-145.6	-174.6	31.4	0	0	109
1461	P	32.6	Very low	28.1	Very low	96 Å²	96	134 Å²	134	62%	0.623	74%	0.736	S	S	*	*				-157.1	160.4	94.2	42.2	-24	0	0	0	117.8
1462	T	27.9	Very low	27.8	Very low	110 Å²	110	136 Å²	136	68%	0.675	74%	0.736	S	S	*	*			trans	38	133.7	141	61.7	0	0	0	0	122
1463	A	28	Very low	27.8	Very low	84 Å²	84	134.4 Å²	134.4	69%	0.694	72%	0.724	S	S	*	*			cis	82.9	155.6	33.7	0	0	0	0	0	116.3
1464	E	26.8	Very low	27.6	Very low	175 Å²	175	133.3 Å²	133.3	82%	0.818	72%	0.72	S	S	*	*			trans	65.6	132.5	175.4	-63.2	160.6	-146.2	0	0	115
1465	S	28.7	Very low	27.7	Very low	109 Å²	109	133.3 Å²	133.3	76%	0.762	72%	0.72	S	S	*	*			cis	-154.9	140.2	43.9	38.7	0	0	0	0	109.6
1466	L	25.6	Very low	27.5	Very low	140 Å²	140	130.8 Å²	130.8	73%	0.733	72%	0.715	S	S	*	*				66.5	114.9	73.2	-80	167.2	0	0	0	116.2
1467	N	25	Very low	27.5	Very low	127 Å²	127	133.3 Å²	133.3	68%	0.679	72%	0.724	S	S	*	*			trans	73.6	136.6	148.1	-58.1	-22.3	0	0	0	121.3
1468	N	26.3	Very low	27.5	Very low	151 Å²	151	132.1 Å²	132.1	81%	0.807	73%	0.725	S	S	*	*			trans	71.4	152.7	160.5	-52.4	-34.4	0	0	0	115.8
1469	L	26.6	Very low	27.5	Very low	143 Å²	143	130.7 Å²	130.7	75%	0.749	72%	0.716	S	S	*	*			cis	-143.9	152.8	8.3	-161.6	73.3	0	0	0	110.6	I1471	L1469-I1471 HydrophobicContact CD2-CD1 4.1Å
1470	S	24.9	Very low	27.2	Very low	102 Å²	102	130.2 Å²	130.2	71%	0.713	72%	0.715	S	S	*	*			trans	-65.1	159.2	159.6	173.4	0	0	0	0	111
1471	I	26.4	Very low	27	Very low	129 Å²	129	125.6 Å²	125.6	66%	0.662	70%	0.7	S	S	*	*			trans	172.8	138.9	132.5	-93.2	156.7	0	0	0	113	L1469	L1469-I1471 HydrophobicContact CD2-CD1 4.1Å
1472	H	26.5	Very low	26.8	Very low	155 Å²	155	128.9 Å²	128.9	72%	0.718	70%	0.7	S	S	*	*			trans	27.2	121.2	160.9	-62.6	-51.2	0	0	0	120.6
1473	S	26.4	Very low	26.8	Very low	81 Å²	81	126.7 Å²	126.7	57%	0.566	69%	0.689	S	S	*	*				71.7	127.5	50.9	85.9	0	0	0	0	115.9
1474	N	26.8	Very low	26.8	Very low	134 Å²	134	126.3 Å²	126.3	72%	0.717	67%	0.672	S	S	*	*			trans	142.3	152.7	135.9	-70.6	-18.8	0	0	0	114.3
1475	N	27.3	Very low	26.9	Very low	143 Å²	143	127 Å²	127	77%	0.765	67%	0.673	S	S	*	*			trans	70.1	105.9	167.8	-50.8	-29.3	0	0	0	114.4
1476	T	24.7	Very low	26.8	Very low	116 Å²	116	125.4 Å²	125.4	71%	0.712	66%	0.662	S	S	*	*			cis	65.9	99.5	36.3	-38.5	0	0	0	0	113.3
1477	F	27	Very low	26.9	Very low	181 Å²	181	123.9 Å²	123.9	79%	0.794	66%	0.663	S	S	*	*			trans	-170	111.3	140.7	-100.7	-73.9	0	0	0	105.3	I1479	F1477-I1479 HydrophobicContact CD1-CD1 4.36Å; F1477-I1479 HydrophobicContact CE1-CD1 4.45Å
1478	N	27	Very low	27	Very low	129 Å²	129	126 Å²	126	69%	0.69	67%	0.669	S	S	*	*			cis	75.7	154.5	42.5	-161.9	29.2	0	0	0	113.3
1479	I	28.5	Very low	27	Very low	119 Å²	119	125.6 Å²	125.6	61%	0.61	67%	0.666	S	S	*	*			trans	84.1	106.3	-175.1	-55.1	169	0	0	0	110.7	F1477	F1477-I1479 HydrophobicContact CD1-CD1 4.36Å; F1477-I1479 HydrophobicContact CE1-CD1 4.45Å
1480	D	27.3	Very low	27	Very low	131 Å²	131	124.6 Å²	124.6	70%	0.701	66%	0.662	S	S	*	*				74	149.4	71.9	-82.6	-45.7	0	0	0	113
1481	T	27.1	Very low	27.1	Very low	83 Å²	83	125.7 Å²	125.7	51%	0.509	66%	0.663	S	S	.	*			cis	-158.3	131.9	13.5	-2.7	0	0	0	0	110.6	T1313	T1313-T1481 WeakPolarHBondContact CG2-O 3.47Å; T1313-T1481 PolarHBondContact OG1-O 3.48Å
1482	R	28.9	Very low	27.1	Very low	165 Å²	165	124.7 Å²	124.7	62%	0.623	66%	0.663	S	S	*	*				41.3	116.6	122.8	-167.5	-171	-178.8	138.7	6.3	120.2	N1311 T1313 E1484	N1311-R1482 HydrophobicContact CB-CB 4.42Å; N1311-R1482 WeakPolarHBondContact ND2-CG 3.06Å; T1313-R1482 PolarHBondContact OG1-N 3.06Å; R1482-E1484 IonicContact CZ-OE1 3.38Å; R1482-E1484 IonicContact NE-OE1 2.93Å; R1482-E1484 PolarHBondContact NE-OE1 2.87Å; R1482-E1484 IonicContact NH2-OE1 2.91Å; R1482-E1484 PolarHBondContact NH2-OE1 2.97Å
1483	S	27.4	Very low	27.2	Very low	63 Å²	63	123.4 Å²	123.4	44%	0.441	67%	0.67	S	S	.	*				-170.1	120	125.6	62.8	0	0	0	0	114.7	N1311	N1311-S1483 WeakPolarHBondContact OD1-CA 3.19Å; N1311-S1483 PolarHBondContact OD1-N 2.71Å; N1311-S1483 VanDerWaalsContact OD1-N 3.17Å; N1311-S1483 PolarHBondContact OD1-O 3.14Å
1484	E	28.7	Very low	27.2	Very low	76 Å²	76	127.2 Å²	127.2	36%	0.355	68%	0.677	S	S	.	*				23.2	136.3	124.1	-64.7	145.1	-142.7	0	0	116.4	N1311 R1482	N1311-E1484 PolarHBondContact OD1-N 3.29Å; R1482-E1484 IonicContact CZ-OE1 3.38Å; R1482-E1484 IonicContact NE-OE1 2.93Å; R1482-E1484 PolarHBondContact NE-OE1 2.87Å; R1482-E1484 IonicContact NH2-OE1 2.91Å; R1482-E1484 PolarHBondContact NH2-OE1 2.97Å
1485	F	27.7	Very low	27.2	Very low	189 Å²	189	127.2 Å²	127.2	83%	0.829	68%	0.677	S	S	*	*				-150.8	133.3	68.1	-101.8	-89.3	0	0	0	115.9
1486	S	27.8	Very low	27.1	Very low	76 Å²	76	127.3 Å²	127.3	53%	0.531	67%	0.673	S	S	.	*			trans	-76.8	149.3	161.9	-71.1	0	0	0	0	113.5	E1310	E1310-S1486 PolarHBondContact OE1-OG 3.31Å
1487	S	27.6	Very low	27.2	Very low	108 Å²	108	128.1 Å²	128.1	76%	0.755	67%	0.672	S	S	*	*			trans	-173	118.6	144.6	15.9	0	0	0	0	108.6
1488	Q	26.9	Very low	27.2	Very low	173 Å²	173	125.8 Å²	125.8	81%	0.808	67%	0.666	S	S	*	*			cis	94.4	155.5	47.3	-80.7	-166.1	-23.2	0	0	114.1
1489	L	25.8	Very low	27.1	Very low	142 Å²	142	127.2 Å²	127.2	74%	0.743	67%	0.669	S	S	*	*			trans	70.9	129.4	178.8	-55.5	101.6	0	0	0	116.2
1490	D	25.8	Very low	27	Very low	122 Å²	122	127.4 Å²	127.4	65%	0.652	67%	0.671	S	S	*	*			cis	-154.5	142.5	-13.6	-106	-11	0	0	0	106.8
1491	V	27.1	Very low	26.9	Very low	124 Å²	124	126.7 Å²	126.7	75%	0.752	67%	0.667	S	S	*	*				58.4	120.6	70.8	-174.4	0	0	0	0	109.7
1492	V	26.4	Very low	26.9	Very low	108 Å²	108	130.4 Å²	130.4	66%	0.655	68%	0.679	S	S	*	*			cis	-139.6	128.3	46.9	177.3	0	0	0	0	111.3	K1494	V1492-K1494 HydrophobicContact CG1-CB 3.75Å; V1492-K1494 HydrophobicContact CG1-CD 4.29Å; V1492-K1494 HydrophobicContact CG1-CG 3.96Å
1493	C	29.3	Very low	26.7	Very low	129 Å²	129	126.6 Å²	126.6	87%	0.872	68%	0.682	S	S	*	*			trans	-90.1	138.7	141.1	-77	0	0	0	0	107.3
1494	K	25.8	Very low	26.6	Very low	161 Å²	161	135.2 Å²	135.2	70%	0.7	71%	0.705	S	S	*	*			trans	-139.8	106	169.8	-119.4	-177.4	168.6	-76.2	0	110.4	V1492 E1496	V1492-K1494 HydrophobicContact CG1-CB 3.75Å; V1492-K1494 HydrophobicContact CG1-CD 4.29Å; V1492-K1494 HydrophobicContact CG1-CG 3.96Å; K1494-E1496 IonicContact NZ-OE2 2.64Å; K1494-E1496 PolarHBondContact NZ-OE2 2.96Å
1495	D	26.7	Very low	26.4	Very low	133 Å²	133	137.3 Å²	137.3	71%	0.711	72%	0.723	S	S	*	*			trans	-52.1	152.9	148.1	-45.3	-91.6	0	0	0	110
1496	E	26	Very low	26.3	Very low	146 Å²	146	135.4 Å²	135.4	68%	0.682	72%	0.72	S	S	*	*				177.8	105.6	113.9	-90.6	177.5	131.9	0	0	106.1	K1494	K1494-E1496 IonicContact NZ-OE2 2.64Å; K1494-E1496 PolarHBondContact NZ-OE2 2.96Å
1497	L	25.9	Very low	26.4	Very low	132 Å²	132	137.4 Å²	137.4	69%	0.691	73%	0.732	S	S	*	*				80.6	134.1	85.7	-82.8	-175.4	0	0	0	111.9
1498	I	27	Very low	26.3	Very low	133 Å²	133	139 Å²	139	68%	0.682	73%	0.731	S	S	*	*			trans	71.4	148.7	147.4	-68.3	168.1	0	0	0	113.3
1499	E	26.5	Very low	26.2	Very low	158 Å²	158	137.6 Å²	137.6	74%	0.738	73%	0.728	S	S	*	*			cis	-139.6	154	16.4	-144.8	130.9	-134.5	0	0	111.3
1500	D	26	Very low	26.3	Very low	124 Å²	124	136.3 Å²	136.3	66%	0.663	73%	0.726	S	S	*	*			trans	55.2	112.5	132.5	-86.5	25.3	0	0	0	124.8
1501	N	25.7	Very low	26.5	Very low	115 Å²	115	134.6 Å²	134.6	62%	0.615	73%	0.729	S	S	*	*				83.6	155.2	110.5	-87.9	-43	0	0	0	122.4
1502	H	26.2	Very low	26.6	Very low	162 Å²	162	138.4 Å²	138.4	75%	0.75	73%	0.731	S	S	*	*			trans	61.2	85.7	162.2	-58.1	-22.9	0	0	0	115.6
1503	A	24.6	Very low	26.8	Very low	85 Å²	85	140.3 Å²	140.3	70%	0.702	73%	0.731	S	S	*	*				68.8	141.6	71.9	0	0	0	0	0	114.5
1504	R	24.4	Very low	27	Very low	243 Å²	243	140.3 Å²	140.3	92%	0.917	72%	0.718	S	S	*	*			trans	69.5	155.8	-165.1	-41.1	167	-178.1	168.1	1.5	110.7
1505	T	25.9	Very low	27.4	Very low	121 Å²	121	140.6 Å²	140.6	74%	0.742	72%	0.722	S	S	*	*			cis	-143	148.7	8.7	-39.3	0	0	0	0	109.7	P1507	T1505-P1507 VanDerWaalsContact O-CD 3.26Å; T1505-P1507 WeakPolarHBondContact O-CD 3.49Å
1506	I	26	Very low	27.8	Very low	148 Å²	148	140.1 Å²	140.1	76%	0.759	72%	0.723	S	S	*	*			trans	-64.9	120.2	165.8	-63.6	166	0	0	0	108.7	L1508	I1506-L1508 PolarHBondContact O-N 3.24Å
1507	P	29.3	Very low	28.1	Very low	119 Å²	119	138.9 Å²	138.9	77%	0.773	73%	0.73	S	S	*	*			trans	-97.5	80.3	172.2	24.3	-6.6	0	0	0	109.7	T1505	T1505-P1507 VanDerWaalsContact O-CD 3.26Å; T1505-P1507 WeakPolarHBondContact O-CD 3.49Å
1508	L	24.4	Very low	28.6	Very low	142 Å²	142	136.3 Å²	136.3	74%	0.743	74%	0.735	S	S	*	*			trans	-75.1	150	155.7	-109.8	167.2	0	0	0	108.5	I1506	I1506-L1508 PolarHBondContact O-N 3.24Å
1509	L	26	Very low	28.9	Very low	142 Å²	142	135.7 Å²	135.7	74%	0.743	74%	0.737	S	S	*	*			trans	67.3	156.9	-172.3	-67.5	69.3	0	0	0	112.7
1510	T	28.4	Very low	29.1	Very low	116 Å²	116	135.3 Å²	135.3	71%	0.712	74%	0.737	S	S	*	*			cis	-141.8	160.4	15.5	-23.8	0	0	0	0	109.5
1511	A	28	Very low	29.5	Very low	85 Å²	85	137 Å²	137	70%	0.702	74%	0.741	S	S	*	*				-161.8	123.7	88.2	0	0	0	0	0	113
1512	Y	29.3	Very low	29.9	Very low	204 Å²	204	134.7 Å²	134.7	80%	0.8	75%	0.745	S	S	*	*			trans	50.8	138.6	146.3	-68.9	-84.6	0	0	0	120.4
1513	K	31.6	Very low	30.3	Very low	149 Å²	149	133.7 Å²	133.7	65%	0.648	74%	0.743	S	S	*	*			cis	-155.5	153.7	29	-129.6	179.7	-173.2	-73.3	0	111
1514	E	32.5	Very low	30.9	Very low	129 Å²	129	136.5 Å²	136.5	60%	0.603	75%	0.746	S	S	*	*			trans	34.3	136.9	141.4	-70	149.8	-152.8	0	0	120.4
1515	E	35.2	Very low	31.4	Very low	167 Å²	167	128.4 Å²	128.4	78%	0.78	73%	0.727	S	S	*	*			cis	-166.8	146.9	23.5	-128.5	176.3	177.8	0	0	114.6
1516	V	34.4	Very low	31.8	Very low	122 Å²	122	129.8 Å²	129.8	74%	0.739	73%	0.73	S	S	*	*			trans	52.6	102.2	139.8	172.8	0	0	0	0	122.4
1517	C	32.7	Very low	32.2	Very low	121 Å²	121	127.2 Å²	127.2	82%	0.818	73%	0.725	S	S	*	*				51.7	128.1	113.9	-143.3	0	0	0	0	122.9
1518	G	35.6	Very low	32.5	Very low	77 Å²	77	130.4 Å²	130.4	79%	0.794	73%	0.727	S	S	*	*			trans	-174.1	122.1	161.7	0	0	0	0	0	112.6
1519	T	34.9	Very low	32.9	Very low	120 Å²	120	129 Å²	129	74%	0.736	73%	0.725	S	S	*	*			trans	-121.9	163.5	-160.1	46.8	0	0	0	0	116.8
1520	M	31	Very low	33.2	Very low	150 Å²	150	127.4 Å²	127.4	74%	0.739	72%	0.72	S	S	*	*			trans	83.7	124.3	150.1	-80.9	178	178.9	0	0	122.8
1521	H	32.6	Very low	33.3	Very low	159 Å²	159	128.4 Å²	128.4	74%	0.736	72%	0.721	S	S	*	*			trans	58.9	137.7	138.2	-55.1	-34	0	0	0	121.2
1522	G	34.5	Very low	33.5	Very low	68 Å²	68	129.1 Å²	129.1	70%	0.701	72%	0.721	S	S	*	*			cis	153.6	-171.3	-7.2	0	0	0	0	0	114.5
1523	I	35.1	Very low	33.5	Very low	140 Å²	140	127.9 Å²	127.9	72%	0.718	73%	0.727	S	S	*	*			trans	82.6	116.2	148.7	-61.4	170.4	0	0	0	119.2
1524	N	36.3	Very low	33.6	Very low	144 Å²	144	124.7 Å²	124.7	77%	0.77	74%	0.737	S	S	*	*			trans	72.2	151.8	148.5	-73.9	-11.4	0	0	0	121.1
1525	S	34.9	Very low	33.5	Very low	73 Å²	73	126.3 Å²	126.3	51%	0.51	75%	0.748	S	S	.	*			cis	-168.6	151	-11.9	-114.2	0	0	0	0	111
1526	N	34.4	Very low	33.4	Very low	151 Å²	151	127.5 Å²	127.5	81%	0.807	75%	0.754	S	S	*	*			trans	50.8	155.7	140	-51.3	-28.2	0	0	0	119.6
1527	S	35.3	Very low	33.1	Very low	94 Å²	94	126.6 Å²	126.6	66%	0.657	75%	0.753	S	S	*	*			cis	-166.8	152.1	26.9	70.9	0	0	0	0	113.5
1528	K	35	Very low	33	Very low	185 Å²	185	126 Å²	126	80%	0.804	75%	0.75	S	S	*	*				62.8	146.1	126.9	-77.9	-172.4	176.5	-171.3	0	121.1
1529	T	32.8	Very low	32.8	Very low	114 Å²	114	127.6 Å²	127.6	70%	0.699	75%	0.749	S	S	*	*			cis	-173.7	171.7	-15.2	14	0	0	0	0	110.5
1530	V	33.2	Very low	32.5	Very low	108 Å²	108	129.3 Å²	129.3	66%	0.655	75%	0.753	S	S	*	*			trans	83.6	93.3	140.5	162.5	0	0	0	0	119.1
1531	D	29.9	Very low	32.5	Very low	136 Å²	136	126 Å²	126	73%	0.727	74%	0.744	S	S	*	*				68.8	152.9	112.2	-46.5	-18.3	0	0	0	125.5
1532	S	32	Very low	32.6	Very low	101 Å²	101	128.3 Å²	128.3	71%	0.706	75%	0.746	S	S	*	*			trans	90.5	97.5	138.3	60.8	0	0	0	0	120.9
1533	L	30	Very low	32.5	Very low	177 Å²	177	131.2 Å²	131.2	93%	0.927	75%	0.745	S	S	*	*				41	118.1	113.4	-69.9	160.4	0	0	0	118.7
1534	G	33.2	Very low	32.5	Very low	82 Å²	82	131.2 Å²	131.2	85%	0.845	74%	0.742	S	S	*	*			trans	-155.7	111.6	162.1	0	0	0	0	0	111.5
1535	I	29.6	Very low	32.5	Very low	164 Å²	164	130.2 Å²	130.2	84%	0.841	73%	0.733	S	S	*	*			trans	-95	134.5	171.5	-60.7	165.9	0	0	0	107.5
1536	E	33.5	Very low	32.5	Very low	192 Å²	192	135.5 Å²	135.5	90%	0.897	74%	0.741	S	S	*	*			trans	-176.5	177.6	133.6	-105.2	174.5	-154.2	0	0	112.1
1537	S	29.7	Very low	32.5	Very low	103 Å²	103	134.9 Å²	134.9	72%	0.72	74%	0.738	S	S	*	*			trans	-137.2	167.7	-157.1	69.3	0	0	0	0	114.6
1538	S	30.1	Very low	32.6	Very low	108 Å²	108	134 Å²	134	76%	0.755	74%	0.736	S	S	*	*			trans	72.8	120.7	162.3	78.4	0	0	0	0	119.6
1539	S	30.8	Very low	32.5	Very low	110 Å²	110	131.7 Å²	131.7	77%	0.769	73%	0.733	S	S	*	*				161.8	123.2	127.3	-75.5	0	0	0	0	109.6
1540	L	29.4	Very low	32.7	Very low	156 Å²	156	133.2 Å²	133.2	82%	0.817	74%	0.737	S	S	*	*				83.2	140.5	51.3	-168.3	153.1	0	0	0	112.5
1541	S	30.9	Very low	32.9	Very low	81 Å²	81	134.2 Å²	134.2	57%	0.566	74%	0.738	S	S	*	*			trans	98.5	144.7	-171.8	-56.9	0	0	0	0	112.7
1542	R	32.9	Very low	33	Very low	207 Å²	207	133.8 Å²	133.8	78%	0.781	74%	0.736	S	S	*	*			cis	-165.7	168.8	-1.3	-116.5	168.5	-130.4	-166.2	-2.5	106.7
1543	L	33.3	Very low	33.1	Very low	130 Å²	130	135.4 Å²	135.4	68%	0.681	74%	0.737	S	S	*	*			cis	-154.4	138.2	26.9	-100.7	124.3	0	0	0	107
1544	H	36.1	Very low	33.3	Very low	140 Å²	140	136.4 Å²	136.4	65%	0.648	73%	0.73	S	S	*	*				71.6	147.2	112.5	-71.1	16.8	0	0	0	116.4
1545	E	35.3	Very low	33	Very low	122 Å²	122	140.5 Å²	140.5	57%	0.57	73%	0.729	S	S	*	*			cis	-165.6	168	6.5	-118.2	168	175.4	0	0	109.6
1546	R	35	Very low	33.1	Very low	184 Å²	184	136.7 Å²	136.7	69%	0.694	72%	0.722	S	S	*	*			cis	-153.1	163.9	-8	-157.1	176.5	-87.8	171.8	-0.9	108.5
1547	N	35.1	Very low	32.8	Very low	138 Å²	138	131.8 Å²	131.8	74%	0.738	71%	0.709	S	S	*	*			trans	-30.3	172	164.8	-33.9	2.5	0	0	0	116.7
1548	A	36.3	Very low	32.8	Very low	75 Å²	75	134.4 Å²	134.4	62%	0.62	72%	0.715	S	S	*	*			cis	-156.4	143.7	9.6	0	0	0	0	0	107.1
1549	D	33.7	Very low	32.9	Very low	137 Å²	137	133.2 Å²	133.2	73%	0.733	71%	0.712	S	S	*	*				76.4	161.3	80.1	-56.7	-48.8	0	0	0	114.6
1550	D	37.2	Very low	33.1	Very low	146 Å²	146	134.3 Å²	134.3	78%	0.781	71%	0.709	S	S	*	*			trans	74.3	112.8	167.5	-55.3	-19	0	0	0	121.1
1551	D	36.3	Very low	33.2	Very low	129 Å²	129	133.1 Å²	133.1	69%	0.69	70%	0.702	S	S	*	*				82	100.3	126.3	-71.9	3.1	0	0	0	123.5
1552	N	33.4	Very low	33.4	Very low	128 Å²	128	136.4 Å²	136.4	68%	0.684	71%	0.712	S	S	*	*				75	160.4	110.4	-63.4	-32.4	0	0	0	122.5
1553	D	33.8	Very low	33.3	Very low	135 Å²	135	131.3 Å²	131.3	72%	0.722	70%	0.704	S	S	*	*			trans	78.8	123.6	151.7	-74.2	-25.1	0	0	0	122
1554	Y	33	Very low	33.3	Very low	198 Å²	198	132.6 Å²	132.6	78%	0.776	71%	0.71	S	S	*	*			trans	58.6	105.2	144.7	-78.8	-109.4	0	0	0	118.1
1555	M	28.3	Very low	33	Very low	167 Å²	167	130 Å²	130	82%	0.823	70%	0.704	S	S	*	*				74.8	143.7	70	-75.8	-79.5	-173.7	0	0	114.5
1556	A	29.9	Very low	32.7	Very low	84 Å²	84	129.8 Å²	129.8	69%	0.694	71%	0.711	S	S	*	*			trans	94.5	127.9	148.6	0	0	0	0	0	119.4
1557	S	29.1	Very low	32.4	Very low	90 Å²	90	125.9 Å²	125.9	63%	0.629	71%	0.707	S	S	*	*			trans	76.2	90.9	135.2	60.8	0	0	0	0	120.4
1558	D	29.8	Very low	32	Very low	157 Å²	157	124.4 Å²	124.4	84%	0.84	70%	0.704	S	S	*	*				71.9	167	106.5	-54.4	-31.8	0	0	0	120.6
1559	A	31.5	Very low	31.7	Very low	83 Å²	83	125.4 Å²	125.4	69%	0.686	70%	0.702	S	S	*	*			trans	68.1	128.3	176.2	0	0	0	0	0	115.5
1560	N	34.5	Very low	31.3	Very low	133 Å²	133	124.5 Å²	124.5	71%	0.711	70%	0.702	S	S	*	*			cis	-155.3	131.2	2.5	-110.6	-6.3	0	0	0	108.7
1561	I	30.9	Very low	30.9	Very low	132 Å²	132	122.2 Å²	122.2	68%	0.677	69%	0.693	S	S	*	*				77.9	146.1	96.9	-76.9	-177.7	0	0	0	113.6
1562	I	36.6	Very low	30.5	Very low	150 Å²	150	121.6 Å²	121.6	77%	0.769	69%	0.694	S	S	*	*			trans	71	90.2	-173.7	-63.9	151.6	0	0	0	109.8
1563	T	30	Very low	30.3	Very low	99 Å²	99	120.6 Å²	120.6	61%	0.607	69%	0.693	S	S	*	*			cis	59.3	91.7	27.5	-34.9	0	0	0	0	112.4	T1565	T1563-T1565 WeakPolarHBondContact CG2-OG1 3.36Å
1564	I	33.9	Very low	30.1	Very low	158 Å²	158	119.8 Å²	119.8	81%	0.81	69%	0.693	S	S	*	*				-150.8	114.8	110.3	-97.5	148.8	0	0	0	106.8
1565	T	29	Very low	30	Very low	85 Å²	85	115.6 Å²	115.6	52%	0.521	69%	0.688	S	S	.	*				79.6	87.2	60.4	-65.2	0	0	0	0	109.2	T1563	T1563-T1565 WeakPolarHBondContact CG2-OG1 3.36Å
1566	T	28.7	Very low	30.2	Very low	117 Å²	117	113 Å²	113	72%	0.718	68%	0.682	S	S	*	*				91.3	158	113.9	55.9	0	0	0	0	113.8
1567	T	28.8	Very low	30.3	Very low	102 Å²	102	115.1 Å²	115.1	63%	0.626	68%	0.681	S	S	*	*			cis	-141.9	170.9	-10.2	19.9	0	0	0	0	105.4
1568	T	27.9	Very low	30.4	Very low	108 Å²	108	116.5 Å²	116.5	66%	0.663	68%	0.682	S	S	*	*				51.3	150.5	56.3	-4.9	0	0	0	0	110.5
1569	T	28.4	Very low	30.5	Very low	96 Å²	96	115.2 Å²	115.2	59%	0.589	68%	0.675	S	S	*	*			cis	-146.3	127.3	13	-41.6	0	0	0	0	103.7
1570	T	27.3	Very low	30.6	Very low	118 Å²	118	117.3 Å²	117.3	72%	0.724	68%	0.675	S	S	*	*				55.8	167.2	79.4	-29.4	0	0	0	0	113
1571	T	28	Very low	30.5	Very low	97 Å²	97	113.6 Å²	113.6	60%	0.595	66%	0.657	S	S	*	*			trans	63.6	87.1	165.9	42	0	0	0	0	116.1
1572	T	28.6	Very low	30.9	Very low	116 Å²	116	111 Å²	111	71%	0.712	65%	0.649	S	S	*	*				87	176.6	77.3	57.2	0	0	0	0	113.5
1573	T	28.6	Very low	30.7	Very low	108 Å²	108	108.4 Å²	108.4	66%	0.663	64%	0.644	S	S	*	*			trans	80.4	85.8	145.3	31.9	0	0	0	0	118.5
1574	T	30	Very low	31	Very low	117 Å²	117	108 Å²	108	72%	0.718	65%	0.65	S	S	*	*				91	142.6	108.9	47.2	0	0	0	0	121.7
1575	T	30.5	Very low	31.4	Very low	110 Å²	110	104.5 Å²	104.5	68%	0.675	65%	0.645	S	S	*	*			trans	73	87.3	141.2	47.9	0	0	0	0	120
1576	T	31.6	Very low	32	Very low	114 Å²	114	104.8 Å²	104.8	70%	0.699	65%	0.648	S	S	*	*				70.5	146.2	112	55	0	0	0	0	122.1
1577	N	32.3	Very low	32.7	Very low	127 Å²	127	103.7 Å²	103.7	68%	0.679	64%	0.638	S	S	*	*			trans	91.2	98.8	146.1	-69.9	-3.4	0	0	0	119.9
1578	N	32	Very low	33.1	Very low	119 Å²	119	102.8 Å²	102.8	64%	0.636	63%	0.63	S	S	*	*				94.6	105.3	116.6	-64.1	-2.7	0	0	0	119.8
1579	N	31.9	Very low	33.5	Very low	130 Å²	130	100.3 Å²	100.3	70%	0.695	61%	0.612	S	S	*	*				88	137.9	126.6	-58.1	-3.1	0	0	0	119.8
1580	N	32.7	Very low	34	Very low	127 Å²	127	100 Å²	100	68%	0.679	61%	0.61	S	S	*	*			trans	85.4	99.1	155.3	-52.9	-27	0	0	0	119	N819	N819-N1580 PolarHBondContact ND2-O 3.41Å
1581	T	33.8	Very low	34.6	Very low	56 Å²	56	100.4 Å²	100.4	34%	0.344	61%	0.607	S	S	.	*				49.6	139.3	95.5	-50.8	0	0	0	0	119.1	Q817 Q818 N819	Q817-T1581 PolarHBondContact OE1-OG1 3.16Å; Q818-T1581 VanDerWaalsContact OE1-CG2 3.32Å; Q818-T1581 PolarHBondContact OE1-OG1 2.74Å; N819-T1581 VanDerWaalsContact ND2-C 3.31Å; N819-T1581 PolarHBondContact ND2-N 2.96Å
1582	P	38.3	Very low	35	Very low	78 Å²	78	100.8 Å²	100.8	51%	0.506	61%	0.611	S	S	.	*			cis	-136.3	-173	-22.4	37	-17.6	0	0	0	114.9	N819	N819-P1582 WeakPolarHBondContact OD1-CA 3.41Å
1583	S	32.9	Very low	35.2	Very low	94 Å²	94	106.5 Å²	106.5	66%	0.657	62%	0.621	S	S	*	*				123.3	139.7	123.9	-153.5	0	0	0	0	119.9
1584	A	36.2	Very low	35.4	Very low	90 Å²	90	107.1 Å²	107.1	74%	0.744	62%	0.62	S	S	*	*			trans	46.3	114.5	155.4	0	0	0	0	0	120.2
1585	A	40.9	Very low	35.4	Very low	86 Å²	86	106.7 Å²	106.7	71%	0.711	62%	0.622	S	S	*	*			cis	96	-168.3	49.6	0	0	0	0	0	113.6
1586	P	43.4	Very low	35.4	Very low	90 Å²	90	107.5 Å²	107.5	58%	0.584	63%	0.627	S	S	*	*				-93	151.2	-121.3	14.8	6	0	0	0	114.9	K527	K527-P1586 HydrophobicContact CD-CB 3.77Å
1587	N	41.6	Very low	35.3	Very low	95 Å²	95	106.8 Å²	106.8	51%	0.508	62%	0.618	S	S	.	*				-172.1	170	96.4	-96.5	49	0	0	0	109.1	K527	K527-N1587 WeakPolarHBondContact CE-O 3.49Å; K527-N1587 PolarHBondContact NZ-O 3.4Å
1588	D	38	Very low	35.2	Very low	82 Å²	82	105 Å²	105	44%	0.439	62%	0.616	S	S	.	*			cis	-170.7	177.3	-1.7	-76	-19.7	0	0	0	109.1	Q525	Q525-D1588 HydrophobicContact CG-CB 4.09Å; Q525-D1588 WeakPolarHBondContact CG-OD1 3.47Å; Q525-D1588 PolarHBondContact NE2-OD1 2.75Å; Q525-D1588 PolarHBondContact NE2-OD2 3.23Å; Q525-D1588 VanDerWaalsContact NE2-OD2 3.1Å
1589	D	37.3	Very low	34.9	Very low	57 Å²	57	107.4 Å²	107.4	31%	0.305	63%	0.627	S	S	.	*			cis	-156.5	169.4	-46.3	-161.1	29.5	0	0	0	116.1	H524 Q525 S526	H524-D1589 IonicContact CE1-OD2 3.34Å; H524-D1589 PolarHBondContact CE1-OD2 3.12Å; H524-D1589 IonicContact CG-OD2 3.88Å; H524-D1589 IonicContact ND1-OD2 2.57Å; H524-D1589 PolarHBondContact ND1-OD2 3Å; Q525-D1589 WeakPolarHBondContact CA-OD1 3.28Å; Q525-D1589 HydrophobicContact CG-CB 3.41Å; Q525-D1589 VanDerWaalsContact CG-CB 3.41Å; Q525-D1589 WeakPolarHBondContact CG-OD2 3.42Å; Q525-D1589 VanDerWaalsContact N-CG 3.34Å; Q525-D1589 PolarHBondContact N-OD1 3.33Å; Q525-D1589 PolarHBondContact N-OD2 3.29Å; S526-D1589 WeakPolarHBondContact CB-OD1 3.3Å; S526-D1589 PolarHBondContact OG-OD1 2.84Å
1590	T	38.9	Very low	34.6	Very low	88 Å²	88	107.3 Å²	107.3	54%	0.54	63%	0.632	S	S	.	*			trans	-52.6	146.6	163.9	-38.2	0	0	0	0	118.7
1591	I	38.3	Very low	34.4	Very low	128 Å²	128	109.2 Å²	109.2	66%	0.656	63%	0.634	S	S	*	*				-174.7	145.1	112.8	-94.2	170.4	0	0	0	110.8
1592	P	36.5	Very low	34.1	Very low	105 Å²	105	112.3 Å²	112.3	68%	0.682	65%	0.653	S	S	*	*			trans	-125.9	178.9	-156.5	42.2	-26.7	0	0	0	116.6
1593	Y	33.3	Very low	33.7	Very low	236 Å²	236	113.1 Å²	113.1	93%	0.925	65%	0.653	S	S	*	*			trans	-152.2	160.7	156.6	-107.9	-73.2	0	0	0	109.3
1594	D	32.8	Very low	33.6	Very low	121 Å²	121	114.9 Å²	114.9	65%	0.647	65%	0.649	S	S	*	*				-149.5	128.3	-87.6	-177.2	17.1	0	0	0	109
1595	S	30.1	Very low	33.3	Very low	108 Å²	108	112.4 Å²	112.4	76%	0.755	63%	0.625	S	S	*	*			trans	-172.8	76.1	-179.2	-61.9	0	0	0	0	110.7	I1597	S1595-I1597 WeakPolarHBondContact O-CG1 3.37Å
1596	T	30.8	Very low	32.9	Very low	126 Å²	126	114 Å²	114	77%	0.773	62%	0.621	S	S	*	*			trans	-71.1	143	167.1	40.9	0	0	0	0	110.5
1597	I	30.1	Very low	32.3	Very low	100 Å²	100	115.7 Å²	115.7	51%	0.513	62%	0.624	S	S	.	*			cis	75.2	134.1	12.7	-43.9	175.4	0	0	0	115.9	S1595	S1595-I1597 WeakPolarHBondContact O-CG1 3.37Å
1598	S	29.1	Very low	31.8	Very low	90 Å²	90	118.2 Å²	118.2	63%	0.629	64%	0.637	S	S	*	*			trans	74.7	131.5	174.8	-51.9	0	0	0	0	115.8
1599	L	25.8	Very low	31.7	Very low	168 Å²	168	121.2 Å²	121.2	88%	0.88	65%	0.652	S	S	*	*			cis	61	81.3	-0.2	-121.1	175.2	0	0	0	116.2
1600	T	26.9	Very low	31.3	Very low	128 Å²	128	123.2 Å²	123.2	79%	0.785	67%	0.671	S	S	*	*			trans	-140.5	143.3	167	37.5	0	0	0	0	111.1
1601	F	27.8	Very low	30.9	Very low	167 Å²	167	123.6 Å²	123.6	73%	0.732	68%	0.677	S	S	*	*			trans	-85.1	170.2	180	-110.1	-128.7	0	0	0	113
1602	T	28.4	Very low	30.6	Very low	121 Å²	121	123.1 Å²	123.1	74%	0.742	68%	0.676	S	S	*	*			trans	65.6	161.9	153.3	52.5	0	0	0	0	117.5
1603	D	29.9	Very low	30.6	Very low	96 Å²	96	125.2 Å²	125.2	51%	0.513	68%	0.68	S	S	.	*			cis	-159.5	179.1	17.6	-153.2	-0.8	0	0	0	115.5	Q677	Q677-D1603 PolarHBondContact NE2-O 2.87Å
1604	K	29.5	Very low	30.5	Very low	130 Å²	130	117.7 Å²	117.7	57%	0.565	66%	0.661	S	S	*	*			trans	69.4	118.5	153.6	-71	158.7	179.5	73.4	0	120.8	Q677	Q677-K1604 VanDerWaalsContact CD-O 3.25Å; Q677-K1604 PolarHBondContact NE2-O 2.85Å; Q677-K1604 PolarHBondContact OE1-O 2.98Å
1605	T	30.3	Very low	30.3	Very low	39 Å²	39	117.5 Å²	117.5	24%	0.239	66%	0.661	C	S	.	*				179	139.8	89.5	39.8	0	0	0	0	114.4	K678	K678-T1605 WeakPolarHBondContact CB-O 3.36Å; K678-T1605 WeakPolarHBondContact CD-O 3.47Å; K678-T1605 WeakPolarHBondContact CG-O 3.48Å
1606	N	33.3	Very low	30.5	Very low	119 Å²	119	120.8 Å²	120.8	64%	0.636	66%	0.664	S	S	*	*			trans	72.3	84	153.9	-51.6	-14.7	0	0	0	120.3	K678	K678-N1606 WeakPolarHBondContact CD-O 3.25Å
1607	I	30.1	Very low	30.4	Very low	126 Å²	126	121.4 Å²	121.4	65%	0.646	66%	0.661	S	S	*	*				84.9	152.8	50.2	-53	157.3	0	0	0	111.7
1608	L	30.6	Very low	30.5	Very low	147 Å²	147	125.5 Å²	125.5	77%	0.77	68%	0.678	S	S	*	*			trans	80.7	131	-178.2	-56.6	169	0	0	0	114.2
1609	L	35.9	Very low	30.6	Very low	145 Å²	145	128.1 Å²	128.1	76%	0.759	68%	0.684	S	S	*	*			cis	-141.1	140.6	-3.2	-87.2	133	0	0	0	107
1610	S	29	Very low	30.9	Very low	100 Å²	100	126.3 Å²	126.3	70%	0.699	68%	0.675	S	S	*	*			cis	66.6	105.6	29.3	-166.1	0	0	0	0	114.9
1611	S	31.4	Very low	30.9	Very low	96 Å²	96	126 Å²	126	67%	0.671	66%	0.663	S	S	*	*			trans	176.4	138.3	152.1	-91.4	0	0	0	0	108.7
1612	D	31.6	Very low	31.2	Very low	118 Å²	118	123.5 Å²	123.5	63%	0.631	66%	0.657	S	S	*	*			cis	-170.8	159.5	-6.9	-116.3	-31.3	0	0	0	112.1
1613	I	35.5	Very low	31.3	Very low	149 Å²	149	124 Å²	124	76%	0.764	66%	0.655	S	S	*	*			trans	65.2	139.8	139.7	-71.4	167.6	0	0	0	118.9
1614	S	31.4	Very low	31.3	Very low	77 Å²	77	124.1 Å²	124.1	54%	0.538	66%	0.664	S	S	.	*			cis	-171.3	145.5	-8.4	158.5	0	0	0	0	110.6
1615	D	29.8	Very low	31.4	Very low	118 Å²	118	125.7 Å²	125.7	63%	0.631	68%	0.678	S	S	*	*			trans	26.6	131.1	141.5	-42.3	-55.9	0	0	0	122.2
1616	H	33.4	Very low	31.5	Very low	176 Å²	176	128.6 Å²	128.6	82%	0.815	70%	0.697	S	S	*	*				173.8	104.4	119.2	-90.7	-65.2	0	0	0	106.8
1617	I	29.4	Very low	31.4	Very low	139 Å²	139	129.2 Å²	129.2	71%	0.713	71%	0.706	S	S	*	*				55.4	90.2	68.3	-50.1	176.3	0	0	0	112.3
1618	E	32.4	Very low	31.6	Very low	187 Å²	187	128.5 Å²	128.5	87%	0.874	71%	0.709	S	S	*	*				-154.4	119.6	129.4	-122.6	177.5	-159.1	0	0	111
1619	L	30.3	Very low	32.2	Very low	145 Å²	145	127 Å²	127	76%	0.759	71%	0.708	S	S	*	*			trans	-105	132.5	172.8	-84.7	165.9	0	0	0	108.5
1620	N	31.1	Very low	32.1	Very low	130 Å²	130	126 Å²	126	70%	0.695	71%	0.71	S	S	*	*			trans	-143.2	74	177.1	-152.2	-18.6	0	0	0	112.7	N1622	N1620-N1622 PolarHBondContact OD1-ND2 3.13Å
1621	F	28.3	Very low	32.2	Very low	120 Å²	120	124.7 Å²	124.7	53%	0.526	71%	0.713	S	S	.	*			trans	-96.9	123.8	167.3	-88.4	-80.1	0	0	0	110.5	D809	D809-F1621 HydrophobicContact CB-CE2 4.48Å; D809-F1621 WeakPolarHBondContact OD1-CE2 3.49Å; D809-F1621 WeakPolarHBondContact OD1-CZ 3.13Å; D809-F1621 WeakPolarHBondContact OD2-CE1 3.48Å; D809-F1621 WeakPolarHBondContact OD2-CZ 3.38Å
1622	N	33	Very low	32.2	Very low	115 Å²	115	130.7 Å²	130.7	62%	0.615	72%	0.721	S	S	*	*			trans	-138.4	114.4	-177.9	-102.1	-66.5	0	0	0	111.9	N1620	N1620-N1622 PolarHBondContact OD1-ND2 3.13Å
1623	N	31.7	Very low	32.2	Very low	131 Å²	131	130.5 Å²	130.5	70%	0.701	72%	0.72	S	S	*	*			trans	69.1	119	155.1	-54.7	-54.2	0	0	0	117.2
1624	S	30.3	Very low	32	Very low	99 Å²	99	130 Å²	130	69%	0.692	72%	0.719	S	S	*	*				72	132.4	80.8	-55.3	0	0	0	0	111.8
1625	L	31.6	Very low	32.1	Very low	163 Å²	163	135.2 Å²	135.2	85%	0.853	74%	0.735	S	S	*	*			cis	-163.4	154.6	41.9	-169.1	71.7	0	0	0	111.5
1626	P	31.8	Very low	32.1	Very low	100 Å²	100	136.1 Å²	136.1	65%	0.649	73%	0.734	S	S	*	*			trans	-105.5	-177.6	-179.8	39.2	-34.5	0	0	0	115.9
1627	T	30.9	Very low	31.9	Very low	133 Å²	133	134 Å²	134	82%	0.816	73%	0.729	S	S	*	*			trans	81.1	159.3	171.4	75.2	0	0	0	0	117.8
1628	P	35	Very low	31.9	Very low	110 Å²	110	131.8 Å²	131.8	71%	0.714	72%	0.718	S	S	*	*			cis	-130.5	173.6	-24	34.4	-16.9	0	0	0	114.6
1629	P	42.9	Very low	31.7	Very low	116 Å²	116	132.3 Å²	132.3	75%	0.753	71%	0.714	S	S	*	*			trans	-89.5	152.6	168.5	36.1	-34.8	0	0	0	114
1630	P	33.4	Very low	31.6	Very low	124 Å²	124	127.9 Å²	127.9	81%	0.805	70%	0.695	S	S	*	*				-116.3	176.5	120.8	-3.9	25.5	0	0	0	110.6
1631	G	30.7	Very low	31.5	Very low	73 Å²	73	126.3 Å²	126.3	75%	0.753	69%	0.687	S	S	*	*			cis	79.7	135	42.8	0	0	0	0	0	110
1632	R	31	Very low	31.6	Very low	221 Å²	221	123.8 Å²	123.8	83%	0.834	68%	0.681	S	S	*	*			cis	-164.9	177.1	3.5	-157.8	-170.2	-152.7	154.1	3.6	107.1
1633	D	33.2	Very low	31.5	Very low	115 Å²	115	121.4 Å²	121.4	62%	0.615	67%	0.671	S	S	*	*			trans	70.1	115.6	161.8	-54.7	-45.2	0	0	0	115.3
1634	N	31.3	Very low	31.4	Very low	138 Å²	138	123 Å²	123	74%	0.738	67%	0.672	S	S	*	*				64.4	93.2	77.2	-61.3	-43.3	0	0	0	112.7
1635	E	32.8	Very low	31.4	Very low	187 Å²	187	125 Å²	125	87%	0.874	67%	0.674	S	S	*	*				-174.6	124.6	108.3	-94.9	170.4	-163.8	0	0	108.7
1636	H	29.9	Very low	31.3	Very low	136 Å²	136	122 Å²	122	63%	0.63	67%	0.667	S	S	*	*				76.7	93.4	88.1	-147.6	-73.8	0	0	0	111	D1638	H1636-D1638 IonicContact CE1-OD2 2.63Å
1637	L	30	Very low	31.3	Very low	132 Å²	132	122.7 Å²	122.7	69%	0.691	67%	0.669	S	S	*	*				74.4	142.7	81	-92.5	160.2	0	0	0	113.7
1638	D	27.4	Very low	31.2	Very low	93 Å²	93	123.3 Å²	123.3	50%	0.497	67%	0.667	S	S	.	*			trans	64.2	178	167.8	-42.4	-44.8	0	0	0	115.1	H1636	H1636-D1638 IonicContact CE1-OD2 2.63Å
1639	Y	29	Very low	31.3	Very low	197 Å²	197	125 Å²	125	77%	0.773	67%	0.669	S	S	*	*			cis	-147.3	163.6	5.2	-100.4	-47.3	0	0	0	106.4
1640	S	28.6	Very low	30.5	Very low	53 Å²	53	124 Å²	124	37%	0.371	67%	0.665	S	S	.	*			cis	178.9	170.4	-3.5	57	0	0	0	0	112.7	T564	T564-S1640 CarbonylContact O-C 3.45Å
1641	N	28.9	Very low	30.3	Very low	97 Å²	97	127.7 Å²	127.7	52%	0.519	67%	0.668	S	S	.	*			trans	87.1	153	134	-82.6	-43.6	0	0	0	121.7	T564 S565	T564-N1641 CarbonylContact C-O 3.21Å; T564-N1641 WeakPolarHBondContact CA-O 3.47Å; T564-N1641 PolarHBondContact N-O 2.82Å; T564-N1641 PolarHBondContact OG1-O 3.45Å; S565-N1641 PolarHBondContact OG-O 2.97Å; S565-N1641 VanDerWaalsContact OG-O 3.11Å
1642	T	31.3	Very low	30.2	Very low	66 Å²	66	129 Å²	129	41%	0.405	66%	0.658	S	S	.	*			trans	57.4	159.4	-165.9	58.9	0	0	0	0	112.3	H563 T564 S565	H563-T1642 CarbonylContact C-O 3.51Å; H563-T1642 WeakPolarHBondContact CA-O 3.45Å; H563-T1642 WeakPolarHBondContact CB-O 3.47Å; H563-T1642 VanDerWaalsContact CG-O 3.32Å; H563-T1642 VanDerWaalsContact ND1-C 3.26Å; H563-T1642 PolarHBondContact ND1-O 3.22Å; T564-T1642 PolarHBondContact N-O 2.94Å; T564-T1642 PolarHBondContact OG1-O 3.27Å; T564-T1642 PolarHBondContact OG1-OG1 3.16Å; S565-T1642 PolarHBondContact OG-OG1 2.93Å
1643	T	29.6	Very low	30.2	Very low	65 Å²	65	124.9 Å²	124.9	40%	0.399	65%	0.652	S	S	.	*			cis	92.1	125.3	7.8	78.2	0	0	0	0	115.2
1644	K	30.4	Very low	30	Very low	166 Å²	166	120.6 Å²	120.6	72%	0.722	63%	0.632	S	S	*	*			cis	-164.1	175.9	19.3	-127.3	152.9	-154.8	157.4	0	112.2
1645	N	29.7	Very low	29.8	Very low	140 Å²	140	116.7 Å²	116.7	75%	0.749	61%	0.611	S	S	*	*				5.7	143.4	128.2	-57.8	17.6	0	0	0	116.2
1646	S	28.7	Very low	29.6	Very low	101 Å²	101	110.5 Å²	110.5	71%	0.706	58%	0.582	S	S	*	*			cis	178.5	-153.1	4.5	47.2	0	0	0	0	108.1
1647	V	32.5	Very low	29.5	Very low	113 Å²	113	109.5 Å²	109.5	69%	0.685	58%	0.58	S	S	*	*			trans	75.9	102	-179.9	-167.2	0	0	0	0	109.8
1648	N	28.7	Very low	29.5	Very low	147 Å²	147	107.4 Å²	107.4	79%	0.786	57%	0.57	S	S	*	*				63.5	151.7	75.3	-69.1	-16.2	0	0	0	113
1649	I	36.6	Very low	29.4	Very low	146 Å²	146	112.6 Å²	112.6	75%	0.749	59%	0.588	S	S	*	*			trans	71.7	76.2	-165.6	-44.7	160.7	0	0	0	109.5
1650	S	26.5	Very low	29.5	Very low	94 Å²	94	107.1 Å²	107.1	66%	0.657	57%	0.572	S	S	*	*				55.6	99	52.9	88.5	0	0	0	0	114.1
1651	F	30.6	Very low	29.8	Very low	201 Å²	201	108.6 Å²	108.6	88%	0.882	58%	0.581	S	S	*	*			trans	-164.4	144.4	132.5	-95.8	-63.3	0	0	0	109.6
1652	N	27.4	Very low	29.8	Very low	100 Å²	100	107.5 Å²	107.5	54%	0.535	58%	0.578	S	S	.	*			trans	-73.5	136.3	-166	-55.3	-15.7	0	0	0	112	S207	S207-N1652 PolarHBondContact OG-ND2 3.36Å
1653	N	30.8	Very low	30.1	Very low	135 Å²	135	108.7 Å²	108.7	72%	0.722	58%	0.58	S	S	*	*			trans	-146.2	46.1	175.5	-142.5	-17.1	0	0	0	114.6	K280	K280-N1653 WeakPolarHBondContact CE-O 3.46Å; K280-N1653 PolarHBondContact NZ-O 3.49Å
1654	S	28.5	Very low	30.2	Very low	26 Å²	26	109.4 Å²	109.4	18%	0.182	59%	0.588	C	S	.	*			trans	-57.3	161.6	172.8	-36.4	0	0	0	0	112.7	T278 R279	T278-S1654 WeakPolarHBondContact CG2-OG 3.33Å; R279-S1654 VanDerWaalsContact NE-C 3.25Å; R279-S1654 PolarHBondContact NH1-O 3.32Å
1655	L	29	Very low	30.1	Very low	56 Å²	56	111.5 Å²	111.5	29%	0.293	60%	0.598	S	S	.	*			trans	-140.6	109.7	169.2	-157.2	169.6	0	0	0	113	R279 K280 H281	R279-L1655 CarbonylContact C-O 3.53Å; R279-L1655 WeakPolarHBondContact CA-O 3.47Å; R279-L1655 VanDerWaalsContact CB-C 3.43Å; R279-L1655 VanDerWaalsContact CB-O 3.3Å; R279-L1655 WeakPolarHBondContact CB-O 3.33Å; R279-L1655 VanDerWaalsContact NE-N 3.2Å; R279-L1655 PolarHBondContact O-N 3.12Å; R279-L1655 VanDerWaalsContact O-N 3.07Å; K280-L1655 WeakPolarHBondContact CA-O 3.45Å; K280-L1655 HydrophobicContact CB-CB 4.49Å; K280-L1655 HydrophobicContact CD-CB 3.63Å; K280-L1655 HydrophobicContact CD-CD1 4.4Å; K280-L1655 HydrophobicContact CG-CB 3.76Å; K280-L1655 PolarHBondContact N-O 2.86Å; H281-L1655 VanDerWaalsContact CD2-CD1 3.49Å; H281-L1655 WeakPolarHBondContact CD2-CD1 3.47Å; H281-L1655 WeakPolarHBondContact NE2-CD2 3.41Å
1656	E	28.6	Very low	30.1	Very low	56 Å²	56	111.7 Å²	111.7	26%	0.262	60%	0.598	S	S	.	*			trans	-70.9	137.1	-171.2	-127.2	117.3	-147.7	0	0	112.3	R279 D1658	R279-E1656 VanDerWaalsContact CD-OE1 3.3Å; R279-E1656 WeakPolarHBondContact CD-OE1 3.28Å; R279-E1656 WeakPolarHBondContact CD-OE2 3.43Å; R279-E1656 HydrophobicContact CG-CB 3.94Å; R279-E1656 VanDerWaalsContact CG-CD 3.46Å; R279-E1656 HydrophobicContact CG-CG 3.62Å; R279-E1656 VanDerWaalsContact CG-OE1 3.31Å; R279-E1656 WeakPolarHBondContact CG-OE1 3.5Å; R279-E1656 IonicContact CZ-OE2 3.78Å; R279-E1656 VanDerWaalsContact CZ-OE2 3.31Å; R279-E1656 IonicContact NE-OE2 3.05Å; R279-E1656 PolarHBondContact NE-OE2 2.94Å; R279-E1656 IonicContact NH2-OE2 2.98Å; R279-E1656 PolarHBondContact NH2-OE2 3.45Å; E1656-D1658 HydrophobicContact CB-CB 3.98Å; E1656-D1658 WeakPolarHBondContact CB-OD2 3.4Å; E1656-D1658 HydrophobicContact CG-CB 4.05Å; E1656-D1658 VanDerWaalsContact CG-CG 3.44Å; E1656-D1658 VanDerWaalsContact CG-OD2 3.29Å; E1656-D1658 WeakPolarHBondContact CG-OD2 3.42Å; E1656-D1658 PolarHBondContact O-N 3.25Å
1657	L	27.6	Very low	30	Very low	116 Å²	116	111.4 Å²	111.4	61%	0.607	60%	0.596	S	S	*	*			trans	-89.3	67	148.4	-88.6	169.6	0	0	0	107.5	F1659	L1657-F1659 PolarHBondContact O-N 3.22Å
1658	D	28.4	Very low	29.7	Very low	87 Å²	87	116.6 Å²	116.6	47%	0.465	60%	0.604	S	S	.	*			trans	-67.6	109.6	172.7	-106.8	-40.4	0	0	0	109.2	E1656 N1660	E1656-D1658 HydrophobicContact CB-CB 3.98Å; E1656-D1658 WeakPolarHBondContact CB-OD2 3.4Å; E1656-D1658 HydrophobicContact CG-CB 4.05Å; E1656-D1658 VanDerWaalsContact CG-CG 3.44Å; E1656-D1658 VanDerWaalsContact CG-OD2 3.29Å; E1656-D1658 WeakPolarHBondContact CG-OD2 3.42Å; E1656-D1658 PolarHBondContact O-N 3.25Å; D1658-N1660 VanDerWaalsContact C-N 3.28Å; D1658-N1660 HydrophobicContact CB-CB 4.39Å; D1658-N1660 WeakPolarHBondContact OD1-CB 3.22Å
1659	F	26.5	Very low	29.8	Very low	203 Å²	203	117.2 Å²	117.2	89%	0.89	61%	0.607	S	S	*	*			trans	-98.8	58.6	151.5	-86.7	-77	0	0	0	109.3	L1657	L1657-F1659 PolarHBondContact O-N 3.22Å
1660	N	29.9	Very low	29.4	Very low	81 Å²	81	118.3 Å²	118.3	43%	0.433	61%	0.611	S	S	.	*			trans	-124.9	108.6	-178.3	-162.1	-5.3	0	0	0	109.3	Y180 D1658 T1662	Y180-N1660 VanDerWaalsContact OH-CG 3.31Å; Y180-N1660 PolarHBondContact OH-ND2 2.79Å; Y180-N1660 PolarHBondContact OH-OD1 3.06Å; D1658-N1660 VanDerWaalsContact C-N 3.28Å; D1658-N1660 HydrophobicContact CB-CB 4.39Å; D1658-N1660 WeakPolarHBondContact OD1-CB 3.22Å; N1660-T1662 PolarHBondContact O-N 3.37Å
1661	P	35.5	Very low	29.4	Very low	85 Å²	85	121.2 Å²	121.2	55%	0.552	61%	0.614	S	S	*	*			trans	-83.9	112.8	-165.6	30.7	-34.1	0	0	0	113.1	P176	P176-P1661 HydrophobicContact CB-CB 4.46Å; P176-P1661 HydrophobicContact CB-CG 4.37Å; P176-P1661 WeakPolarHBondContact CB-O 3.4Å
1662	T	30.2	Very low	29.4	Very low	73 Å²	73	122.5 Å²	122.5	45%	0.448	62%	0.615	S	S	.	*			trans	-154.6	109.6	166.5	-26.6	0	0	0	0	107.7	T177 N1660	T177-T1662 HydrophobicContact CG2-CG2 3.77Å; N1660-T1662 PolarHBondContact O-N 3.37Å
1663	I	36.3	Very low	29.3	Very low	91 Å²	91	123.5 Å²	123.5	47%	0.467	62%	0.616	S	S	.	*				61.3	130.1	68.4	-53.8	-174.9	0	0	0	114.3	P176 T177	P176-I1663 HydrophobicContact CB-CD1 3.94Å; P176-I1663 VanDerWaalsContact CD-CD1 3.47Å; P176-I1663 HydrophobicContact CG-CD1 3.77Å; T177-I1663 HydrophobicContact CG2-CB 4.03Å; T177-I1663 HydrophobicContact CG2-CG2 3.71Å; T177-I1663 VanDerWaalsContact OG1-CG2 3.31Å; T177-I1663 WeakPolarHBondContact OG1-CG2 3.49Å
1664	S	31.1	Very low	29.4	Very low	81 Å²	81	127.6 Å²	127.6	57%	0.566	62%	0.623	S	S	*	*			trans	80.8	55.8	167.8	-66.9	0	0	0	0	120.6
1665	K	29.1	Very low	29.3	Very low	210 Å²	210	133.7 Å²	133.7	91%	0.913	65%	0.649	S	S	*	*				-133.1	112.1	113	-72.7	-171.5	179.1	-177.4	0	106.1
1666	L	28.9	Very low	29.2	Very low	144 Å²	144	140.3 Å²	140.3	75%	0.754	68%	0.676	S	S	*	*			cis	74.1	113.4	28.9	-141	92.5	0	0	0	113.9
1667	S	27.6	Very low	29.3	Very low	95 Å²	95	142.5 Å²	142.5	66%	0.664	69%	0.693	S	S	*	*			trans	77.8	122.2	166.1	-52.6	0	0	0	0	118.7
1668	Y	26.8	Very low	29.4	Very low	221 Å²	221	144.3 Å²	144.3	87%	0.867	70%	0.703	S	S	*	*			trans	61.1	120.2	173.8	-56.8	-84.9	0	0	0	115.6
1669	L	31	Very low	29.6	Very low	160 Å²	160	146.8 Å²	146.8	84%	0.838	72%	0.716	S	S	*	*			cis	-127.4	141.7	23.2	-82.7	154.9	0	0	0	113.2
1670	M	27.3	Very low	29.8	Very low	169 Å²	169	143.3 Å²	143.3	83%	0.833	71%	0.707	S	S	*	*			trans	-88.4	-179.6	149.7	-65.1	-165.4	-54.8	0	0	108.6
1671	Q	26.9	Very low	29.9	Very low	155 Å²	155	146 Å²	146	72%	0.724	72%	0.722	S	S	*	*			trans	70.7	82.4	-177.8	-53.7	178.1	-82.7	0	0	113.1
1672	Y	29.9	Very low	29.8	Very low	229 Å²	229	147.8 Å²	147.8	90%	0.898	73%	0.726	S	S	*	*				-116.7	124.7	114.6	-106.3	-86.7	0	0	0	107.6
1673	E	26.1	Very low	29.7	Very low	121 Å²	121	150.1 Å²	150.1	57%	0.565	74%	0.735	S	S	*	*			trans	-59.6	137.6	162.3	-67.9	80.7	-174	0	0	109.1	E1675	E1673-E1675 HydrophobicContact CB-CG 4.34Å
1674	Y	31.6	Very low	29.4	Very low	221 Å²	221	155.4 Å²	155.4	87%	0.867	75%	0.75	S	S	*	*			trans	-116.3	99.3	145.7	-124.4	-82.3	0	0	0	106.4	F1676	Y1674-F1676 PolarHBondContact O-N 2.66Å
1675	E	27.3	Very low	29.2	Very low	154 Å²	154	163.7 Å²	163.7	72%	0.72	77%	0.769	S	S	*	*			trans	-65.4	102.1	171.7	-62.8	176.3	119.7	0	0	107.9	E1673 T1677	E1673-E1675 HydrophobicContact CB-CG 4.34Å; E1675-T1677 HydrophobicContact CB-CG2 4.24Å; E1675-T1677 PolarHBondContact O-N 3.42Å
1676	F	27.7	Very low	29.1	Very low	195 Å²	195	160.6 Å²	160.6	86%	0.855	76%	0.761	S	S	*	*			trans	-75.4	91.7	143.5	-97	-86.8	0	0	0	106.3	Y1674 D1678	Y1674-F1676 PolarHBondContact O-N 2.66Å; F1676-D1678 PolarHBondContact O-N 3.18Å
1677	T	30.3	Very low	29.2	Very low	101 Å²	101	159.4 Å²	159.4	62%	0.62	76%	0.756	S	S	*	*			trans	-63.3	86.9	157.7	50.3	0	0	0	0	107.3	E1675 N1679	E1675-T1677 HydrophobicContact CB-CG2 4.24Å; E1675-T1677 PolarHBondContact O-N 3.42Å; T1677-N1679 VanDerWaalsContact C-N 3.27Å; T1677-N1679 PolarHBondContact O-N 2.94Å
1678	D	29.8	Very low	29.3	Very low	155 Å²	155	160.9 Å²	160.9	83%	0.829	76%	0.763	S	S	*	*			trans	-65.3	94.1	165.8	-163.1	9.1	0	0	0	106.4	F1676	F1676-D1678 PolarHBondContact O-N 3.18Å
1679	N	32.1	Very low	29.2	Very low	139 Å²	139	153.5 Å²	153.5	74%	0.743	75%	0.754	S	S	*	*			trans	-119.1	73.7	-167	-151.8	34.4	0	0	0	109.2	T1677	T1677-N1679 VanDerWaalsContact C-N 3.27Å; T1677-N1679 PolarHBondContact O-N 2.94Å
1680	D	30	Very low	29.1	Very low	129 Å²	129	150.5 Å²	150.5	69%	0.69	75%	0.747	S	S	*	*			trans	27.9	124.4	153.2	-67.9	-38.6	0	0	0	118.2
1681	N	32.9	Very low	29.4	Very low	139 Å²	139	148.9 Å²	148.9	74%	0.743	74%	0.741	S	S	*	*				-162	131.4	106.8	-109.5	-76.1	0	0	0	114.6
1682	N	32.3	Very low	29.6	Very low	122 Å²	122	146.5 Å²	146.5	65%	0.652	73%	0.733	S	S	*	*			trans	67.5	107.2	160.6	-55.7	-50	0	0	0	118.1
1683	I	28.6	Very low	29.9	Very low	122 Å²	122	143.1 Å²	143.1	63%	0.626	72%	0.723	S	S	*	*				67.5	119.2	60.6	-56.2	166.2	0	0	0	108.9
1684	Y	30.5	Very low	30.4	Very low	201 Å²	201	144.2 Å²	144.2	79%	0.788	73%	0.733	S	S	*	*				-127.6	126.4	53.2	-74.4	-94.4	0	0	0	116.9	I1686	Y1684-I1686 HydrophobicContact CD1-CD1 3.99Å; Y1684-I1686 HydrophobicContact CD1-CG1 4.1Å
1685	W	26.2	Very low	30.6	Very low	255 Å²	255	140 Å²	140	97%	0.966	72%	0.724	S	S	*	*			trans	-100.4	140.9	143.7	-75.2	77.1	0	0	0	108
1686	I	27.8	Very low	30.9	Very low	145 Å²	145	142.3 Å²	142.3	74%	0.744	73%	0.731	S	S	*	*			trans	-128.2	121.3	170.4	-64.6	-175.5	0	0	0	110.6	Y1684	Y1684-I1686 HydrophobicContact CD1-CD1 3.99Å; Y1684-I1686 HydrophobicContact CD1-CG1 4.1Å
1687	D	29.5	Very low	31.2	Very low	120 Å²	120	138 Å²	138	64%	0.642	72%	0.721	S	S	*	*			trans	-54.4	158.4	171.9	-165.2	40.3	0	0	0	112.8	G1689	D1687-G1689 PolarHBondContact OD1-N 3Å; D1687-G1689 PolarHBondContact OD2-N 2.75Å
1688	P	30.2	Very low	31.3	Very low	125 Å²	125	140.9 Å²	140.9	81%	0.812	73%	0.731	S	S	*	*				-143.7	115.3	92.3	32.7	-14.5	0	0	0	115
1689	G	25.6	Very low	31.4	Very low	67 Å²	67	137.7 Å²	137.7	69%	0.691	73%	0.726	S	S	*	*			trans	-116.3	6	178.4	0	0	0	0	0	115.5	D1687	D1687-G1689 PolarHBondContact OD1-N 3Å; D1687-G1689 PolarHBondContact OD2-N 2.75Å
1690	S	28.8	Very low	31.2	Very low	96 Å²	96	139.7 Å²	139.7	67%	0.671	73%	0.731	S	S	*	*			trans	-81.6	160.6	176	80.9	0	0	0	0	112
1691	L	32.5	Very low	31.5	Very low	136 Å²	136	138.4 Å²	138.4	71%	0.712	73%	0.73	S	S	*	*			cis	-154.8	146.9	11.3	-151.4	154.9	0	0	0	108.2	K1693	L1691-K1693 HydrophobicContact CD2-CB 4.34Å; L1691-K1693 HydrophobicContact CD2-CD 4.25Å; L1691-K1693 HydrophobicContact CD2-CG 4.11Å
1692	N	31.3	Very low	31.1	Very low	104 Å²	104	138.8 Å²	138.8	56%	0.556	73%	0.729	S	S	*	*			trans	-135.8	127.5	165.4	-169.7	73.2	0	0	0	112.8	I1349	I1349-N1692 HydrophobicContact CD1-CB 4.4Å; I1349-N1692 WeakPolarHBondContact CD1-ND2 3.31Å
1693	K	37.3	Very low	30.8	Very low	158 Å²	158	143.1 Å²	143.1	69%	0.687	74%	0.736	S	S	*	*			trans	-152.7	154.3	175.8	-85.1	-174.2	-178	175.4	0	106.8	L1691	L1691-K1693 HydrophobicContact CD2-CB 4.34Å; L1691-K1693 HydrophobicContact CD2-CD 4.25Å; L1691-K1693 HydrophobicContact CD2-CG 4.11Å
1694	D	35.3	Very low	30.6	Very low	144 Å²	144	142.6 Å²	142.6	77%	0.77	74%	0.743	S	S	*	*			cis	-141.6	175	25.8	-118.5	-42.4	0	0	0	115.1
1695	I	36.5	Very low	30.5	Very low	133 Å²	133	140.3 Å²	140.3	68%	0.682	74%	0.743	S	S	*	*			trans	-107.4	143.2	-172	-65	162.3	0	0	0	112.4	T1697	I1695-T1697 WeakPolarHBondContact CG2-OG1 3.08Å
1696	K	33.4	Very low	30.8	Very low	202 Å²	202	132.6 Å²	132.6	88%	0.878	73%	0.734	S	S	*	*			trans	-166.2	113.7	142.4	-99.2	138.4	-171.4	169.9	0	109.5
1697	T	33.4	Very low	31	Very low	105 Å²	105	132 Å²	132	64%	0.644	73%	0.731	S	S	*	*				77.5	119.9	53.2	-53.6	0	0	0	0	113.4	I1695	I1695-T1697 WeakPolarHBondContact CG2-OG1 3.08Å
1698	I	33.3	Very low	31.3	Very low	162 Å²	162	132.8 Å²	132.8	83%	0.831	74%	0.735	S	S	*	*			trans	173.9	131.7	131.2	-89	155.9	0	0	0	112.8
1699	A	32.1	Very low	31.6	Very low	87 Å²	87	133.4 Å²	133.4	72%	0.719	73%	0.731	S	S	*	*			trans	48.7	109.3	153.7	0	0	0	0	0	124.5
1700	Q	28.5	Very low	32	Very low	181 Å²	181	134.7 Å²	134.7	85%	0.846	73%	0.73	S	S	*	*				4	167.7	108.9	-80.7	-168	6.7	0	0	121.1
1701	P	35.2	Very low	32.3	Very low	102 Å²	102	136.4 Å²	136.4	66%	0.662	73%	0.731	S	S	*	*			cis	-143.1	-165	-25.2	38.8	-18.2	0	0	0	114.9
1702	M	24.6	Very low	32.4	Very low	148 Å²	148	137.8 Å²	137.8	73%	0.729	73%	0.733	S	S	*	*			trans	78.6	122.5	150.1	-83.1	-158.5	-179.7	0	0	123.7
1703	R	25.6	Very low	32.5	Very low	213 Å²	213	141 Å²	141	80%	0.804	75%	0.745	S	S	*	*			trans	74.8	167.1	132.5	-70.1	-177.4	171.5	-168.1	-1.9	121.4
1704	S	25.9	Very low	32.6	Very low	111 Å²	111	139.2 Å²	139.2	78%	0.776	75%	0.75	S	S	*	*			trans	67.8	126.7	-176.8	41.5	0	0	0	0	115.9
1705	I	27.5	Very low	32.6	Very low	152 Å²	152	138.8 Å²	138.8	78%	0.779	74%	0.743	S	S	*	*			cis	97.4	101	31.7	-64.6	161	0	0	0	113.2	I1707	I1705-I1707 HydrophobicContact CG2-CD1 3.88Å; I1705-I1707 HydrophobicContact CG2-CG1 4.43Å
1706	A	31.5	Very low	32.3	Very low	93 Å²	93	141.4 Å²	141.4	77%	0.769	74%	0.744	S	S	*	*			trans	-175.1	121.6	144.5	0	0	0	0	0	105.8
1707	I	31.8	Very low	32.2	Very low	133 Å²	133	137.7 Å²	137.7	68%	0.682	74%	0.739	S	S	*	*			cis	76	94.3	42.3	-53.5	173.2	0	0	0	112.8	I1705	I1705-I1707 HydrophobicContact CG2-CD1 3.88Å; I1705-I1707 HydrophobicContact CG2-CG1 4.43Å
1708	D	36.4	Very low	32.1	Very low	136 Å²	136	138.1 Å²	138.1	73%	0.727	75%	0.746	S	S	*	*				-172.8	115.2	124.8	-98.1	-19.4	0	0	0	107.5
1709	N	35.9	Very low	31.9	Very low	139 Å²	139	135.1 Å²	135.1	74%	0.743	74%	0.74	S	S	*	*				81.7	132.4	84.3	-82.5	-28.9	0	0	0	113.7
1710	S	35.2	Very low	31.7	Very low	94 Å²	94	137.6 Å²	137.6	66%	0.657	74%	0.739	S	S	*	*			cis	-168.7	172	-4.6	49.5	0	0	0	0	113.2
1711	L	34	Very low	32	Very low	132 Å²	132	140.1 Å²	140.1	69%	0.691	74%	0.742	S	S	*	*			trans	99.1	109.6	137.5	-135.8	68.4	0	0	0	121.2
1712	E	36.5	Very low	31.9	Very low	164 Å²	164	141.2 Å²	141.2	77%	0.766	74%	0.743	S	S	*	*			trans	60.6	155.5	141.1	-70.4	166.5	-156.1	0	0	122.7
1713	Q	33	Very low	32.2	Very low	172 Å²	172	140 Å²	140	80%	0.804	74%	0.744	S	S	*	*				-162.8	155.4	-54.7	-121.7	-162.5	11.9	0	0	108.9
1714	P	38.5	Very low	32.7	Very low	120 Å²	120	140.4 Å²	140.4	78%	0.779	75%	0.745	S	S	*	*			trans	-110	115.5	-177.8	35.9	-25.4	0	0	0	114.1
1715	E	35	Very low	33.1	Very low	136 Å²	136	138.8 Å²	138.8	64%	0.636	73%	0.734	S	S	*	*			trans	-136.9	119.1	172.3	-83.4	-108.9	121.8	0	0	113.9
1716	R	31.8	Very low	33.4	Very low	188 Å²	188	138.7 Å²	138.7	71%	0.709	73%	0.731	S	S	*	*				55.3	127	125.9	-69.6	-172.5	172.4	133.1	2.7	123.2
1717	T	29.9	Very low	33.5	Very low	124 Å²	124	141.6 Å²	141.6	76%	0.761	73%	0.728	S	S	*	*				77.7	165.5	129.7	63.1	0	0	0	0	121.4
1718	S	32.1	Very low	33.4	Very low	113 Å²	113	142.1 Å²	142.1	79%	0.79	73%	0.731	S	S	*	*			trans	95.3	92.5	161.5	-54.2	0	0	0	0	117.2
1719	S	28.7	Very low	33	Very low	100 Å²	100	141 Å²	141	70%	0.699	73%	0.734	S	S	*	*			trans	-62.8	169.8	157.7	54.6	0	0	0	0	113
1720	I	28.9	Very low	32.9	Very low	139 Å²	139	139.8 Å²	139.8	71%	0.713	73%	0.732	S	S	*	*			trans	78.6	107	169.2	-50.5	157.8	0	0	0	114.1
1721	Y	34.3	Very low	32.8	Very low	233 Å²	233	141.3 Å²	141.3	91%	0.914	74%	0.737	S	S	*	*				-150.1	164.7	106.5	-112	-77.5	0	0	0	110.8
1722	N	32.6	Very low	32.9	Very low	125 Å²	125	140.8 Å²	140.8	67%	0.668	74%	0.741	S	S	*	*			trans	-137	150.4	-153.3	-172.8	13.8	0	0	0	111.8
1723	T	31.3	Very low	32.6	Very low	123 Å²	123	138.3 Å²	138.3	76%	0.755	74%	0.737	S	S	*	*			trans	66.1	155.8	168.6	34	0	0	0	0	116.1
1724	R	35.3	Very low	32.5	Very low	221 Å²	221	135.8 Å²	135.8	83%	0.834	73%	0.734	S	S	*	*				-156.8	159.4	51.7	-147.4	-171.5	-169.9	173.4	3.3	116
1725	S	35.5	Very low	32.2	Very low	77 Å²	77	136.7 Å²	136.7	54%	0.538	74%	0.737	S	S	.	*			trans	75.8	109.3	159.2	-65.3	0	0	0	0	116
1726	Q	33.9	Very low	32.1	Very low	151 Å²	151	134.3 Å²	134.3	71%	0.706	74%	0.741	S	S	*	*				79.5	137.1	72.8	-71.6	159.4	-28.8	0	0	111.1
1727	Q	32	Very low	32.3	Very low	154 Å²	154	129.8 Å²	129.8	72%	0.72	74%	0.744	S	S	*	*			cis	-165.9	157.7	8.5	-124.1	164.7	-11.4	0	0	111.5
1728	L	31.3	Very low	32.5	Very low	143 Å²	143	129.3 Å²	129.3	75%	0.749	74%	0.741	S	S	*	*			trans	60.1	138.7	164.5	-84.3	61.4	0	0	0	116.9
1729	S	26.7	Very low	32.6	Very low	112 Å²	112	130.2 Å²	130.2	78%	0.783	74%	0.742	S	S	*	*			cis	79.9	156.9	22.2	-157.6	0	0	0	0	116.3
1730	V	34.3	Very low	33	Very low	114 Å²	114	129 Å²	129	69%	0.691	74%	0.738	S	S	*	*			trans	89.6	81.2	172.9	-168.6	0	0	0	0	117.7
1731	V	33.3	Very low	33.1	Very low	126 Å²	126	129 Å²	129	76%	0.764	74%	0.738	S	S	*	*				-8.2	133	127.7	169.6	0	0	0	0	115.5
1732	P	37.1	Very low	33.1	Very low	122 Å²	122	126.5 Å²	126.5	79%	0.792	74%	0.735	S	S	*	*				-142.1	145.7	110.6	37.4	-24.2	0	0	0	116.5
1733	T	29.6	Very low	33.2	Very low	111 Å²	111	127.6 Å²	127.6	68%	0.681	74%	0.741	S	S	*	*			trans	-82.8	153.1	162.1	43.7	0	0	0	0	112
1734	T	30.6	Very low	33.5	Very low	120 Å²	120	126.9 Å²	126.9	74%	0.736	74%	0.738	S	S	*	*			trans	65.9	154.6	149	49.2	0	0	0	0	121
1735	T	31.7	Very low	33.2	Very low	138 Å²	138	124 Å²	124	85%	0.847	74%	0.737	S	S	*	*			trans	66.4	137.4	162.6	49	0	0	0	0	118.5
1736	A	32.9	Very low	33.5	Very low	87 Å²	87	125.3 Å²	125.3	72%	0.719	74%	0.744	S	S	*	*			cis	-163.5	157.8	-11.5	0	0	0	0	0	112.2
1737	A	36	Very low	33.7	Very low	92 Å²	92	123.7 Å²	123.7	76%	0.76	75%	0.747	S	S	*	*			trans	65.5	165.7	155.1	0	0	0	0	0	116.6
1738	T	33.9	Very low	33.5	Very low	115 Å²	115	121.7 Å²	121.7	71%	0.706	75%	0.745	S	S	*	*			cis	-151.6	146.2	-0.2	-27	0	0	0	0	109.7
1739	T	34.7	Very low	33.4	Very low	131 Å²	131	120.8 Å²	120.8	80%	0.804	74%	0.741	S	S	*	*			trans	59.5	150	159.5	36	0	0	0	0	118.4
1740	A	36.4	Very low	33.5	Very low	75 Å²	75	122.6 Å²	122.6	62%	0.62	74%	0.737	S	S	*	*			cis	-141.7	153.7	-2.7	0	0	0	0	0	108.3
1741	I	32.7	Very low	33.3	Very low	139 Å²	139	124.4 Å²	124.4	71%	0.713	74%	0.741	S	S	*	*				47.7	112.3	89.7	-46.7	172.9	0	0	0	109.9
1742	Q	33.7	Very low	33.3	Very low	180 Å²	180	128.1 Å²	128.1	84%	0.841	74%	0.743	S	S	*	*			cis	-163.5	155.6	40.2	-136.4	151.6	-3.7	0	0	112.6
1743	N	34.6	Very low	33.1	Very low	149 Å²	149	128.5 Å²	128.5	80%	0.797	74%	0.737	S	S	*	*			trans	-69.1	171	150.5	-63.5	-23.4	0	0	0	108.8
1744	P	37.5	Very low	33.2	Very low	108 Å²	108	129.6 Å²	129.6	70%	0.701	74%	0.739	S	S	*	*			cis	-149.2	-150.2	21.6	37.9	-12.3	0	0	0	115.7
1745	I	29.6	Very low	33.2	Very low	159 Å²	159	131 Å²	131	82%	0.815	74%	0.737	S	S	*	*			trans	75.4	155.7	158.4	46.6	179.8	0	0	0	120.3
1746	P	42.1	Very low	33.3	Very low	106 Å²	106	130.3 Å²	130.3	69%	0.688	73%	0.728	S	S	*	*			trans	-102	-171.7	-157.4	43.8	-37.8	0	0	0	113.2
1747	P	37.1	Very low	33.6	Very low	116 Å²	116	135.5 Å²	135.5	75%	0.753	73%	0.73	S	S	*	*				-144.7	179.1	88.8	46.6	-31.1	0	0	0	112
1748	V	28.1	Very low	33.5	Very low	112 Å²	112	138.4 Å²	138.4	68%	0.679	73%	0.731	S	S	*	*			cis	78	140.3	20.2	176.3	0	0	0	0	114.3
1749	N	29.9	Very low	33.4	Very low	124 Å²	124	135.9 Å²	135.9	66%	0.663	72%	0.719	S	S	*	*			trans	62.5	154.4	179.3	-68.6	23.4	0	0	0	116.4
1750	E	28.5	Very low	33.4	Very low	150 Å²	150	137.7 Å²	137.7	70%	0.701	72%	0.717	S	S	*	*			cis	-176.9	-162	-23.3	-104.4	166.3	164	0	0	103.9
1751	I	30.1	Very low	33.3	Very low	153 Å²	153	141.4 Å²	141.4	79%	0.785	73%	0.726	S	S	*	*			trans	73.7	123.8	157.2	-52.3	174.9	0	0	0	115.1
1752	Y	32	Very low	33.5	Very low	204 Å²	204	139.5 Å²	139.5	80%	0.8	73%	0.725	S	S	*	*			cis	-149.3	167.3	-8.9	-146.8	-124.7	0	0	0	110.8
1753	I	32.7	Very low	33.6	Very low	129 Å²	129	138 Å²	138	66%	0.662	72%	0.722	S	S	*	*			trans	-78.7	151.3	166.5	-67.7	158.1	0	0	0	109	E1755	I1753-E1755 HydrophobicContact CG2-CG 4.08Å
1754	D	33.1	Very low	33.8	Very low	135 Å²	135	137 Å²	137	72%	0.722	72%	0.717	S	S	*	*			trans	-175.1	122.5	137.8	-93	-2.8	0	0	0	104.9
1755	E	30	Very low	33.9	Very low	150 Å²	150	137.4 Å²	137.4	70%	0.701	71%	0.713	S	S	*	*			cis	105.3	133.5	43.6	-86.1	-162.3	178	0	0	111.7	I1753	I1753-E1755 HydrophobicContact CG2-CG 4.08Å
1756	D	34.8	Very low	34.4	Very low	122 Å²	122	135.7 Å²	135.7	65%	0.652	70%	0.7	S	S	*	*			trans	69.6	163.1	154.7	-77.4	10.9	0	0	0	123.6
1757	Y	38.1	Very low	34.3	Very low	196 Å²	196	135.9 Å²	135.9	77%	0.769	70%	0.695	S	S	*	*			trans	55.4	92	-179.9	-68.3	-85	0	0	0	115.3
1758	I	34.2	Very low	34.6	Very low	153 Å²	153	138.9 Å²	138.9	79%	0.785	70%	0.696	S	S	*	*			cis	49.8	141.8	34.8	-61.5	-177.8	0	0	0	112.8
1759	S	32.6	Very low	35	Very low	63 Å²	63	143 Å²	143	44%	0.441	71%	0.705	S	S	.	*			trans	96.2	150.4	161.3	81	0	0	0	0	119.1
1760	H	33.9	Very low	35.4	Very low	168 Å²	168	140.6 Å²	140.6	78%	0.778	71%	0.709	S	S	*	*			trans	67.7	132.3	156.3	-54.8	-38	0	0	0	117.2
1761	L	35.1	Very low	35.8	Very low	153 Å²	153	140.8 Å²	140.8	80%	0.801	71%	0.713	S	S	*	*			cis	-132.9	146.8	4.1	-81.9	107.4	0	0	0	110.6
1762	S	35.2	Very low	36.2	Very low	100 Å²	100	141.6 Å²	141.6	70%	0.699	72%	0.718	S	S	*	*				54.5	116.6	92.9	-130.9	0	0	0	0	113.5
1763	L	35.8	Very low	36.5	Very low	147 Å²	147	135.2 Å²	135.2	77%	0.77	71%	0.714	S	S	*	*			cis	67.5	97.3	36.1	-150.4	179	0	0	0	112.2	D1765	L1763-D1765 HydrophobicContact CD2-CB 4.49Å
1764	D	39.1	Very low	36.9	Very low	130 Å²	130	134.6 Å²	134.6	70%	0.695	72%	0.719	S	S	*	*			trans	-162.8	96.9	160.4	-148.3	36.9	0	0	0	105.3	K1766	D1764-K1766 IonicContact OD1-NZ 2.65Å; D1764-K1766 PolarHBondContact OD1-NZ 3.47Å; D1764-K1766 IonicContact OD2-NZ 2.7Å; D1764-K1766 PolarHBondContact OD2-NZ 2.95Å
1765	D	40	Very low	37.2	Very low	115 Å²	115	136.7 Å²	136.7	62%	0.615	72%	0.722	S	S	*	*				60.7	120.5	69.6	-178.3	47	0	0	0	114.5	L1763	L1763-D1765 HydrophobicContact CD2-CB 4.49Å
1766	K	40.7	Very low	37.7	Very low	123 Å²	123	135.9 Å²	135.9	54%	0.535	72%	0.721	S	S	.	*				176.4	143.4	128.4	-96.2	152	-146.1	75.7	0	115.6	D1764	D1764-K1766 IonicContact OD1-NZ 2.65Å; D1764-K1766 PolarHBondContact OD1-NZ 3.47Å; D1764-K1766 IonicContact OD2-NZ 2.7Å; D1764-K1766 PolarHBondContact OD2-NZ 2.95Å
1767	N	40.1	Very low	38.1	Very low	111 Å²	111	135.6 Å²	135.6	59%	0.594	72%	0.719	S	S	*	*			trans	77.1	106.9	151.8	-60.6	-32.1	0	0	0	118.4
1768	K	41.9	Very low	38.2	Very low	179 Å²	179	133.4 Å²	133.4	78%	0.778	71%	0.714	S	S	*	*				87.3	133.2	78.9	-80.8	165.7	-162.9	146.4	0	112.4
1769	K	38.2	Very low	38.5	Very low	199 Å²	199	132.1 Å²	132.1	87%	0.865	71%	0.708	S	S	*	*			cis	-159.4	142.9	30.3	-116.2	165.3	-178.4	-179.3	0	112.6
1770	G	37.1	Very low	38.8	Very low	72 Å²	72	134.7 Å²	134.7	74%	0.742	72%	0.717	S	S	*	*			trans	77.4	160.8	141.9	0	0	0	0	0	119.6
1771	I	37.5	Very low	39.1	Very low	154 Å²	154	134.4 Å²	134.4	79%	0.79	72%	0.716	S	S	*	*			cis	-159.7	129.8	-2.8	-120.2	155.9	0	0	0	110.1
1772	L	38.9	Very low	39.1	Very low	170 Å²	170	135.9 Å²	135.9	89%	0.89	72%	0.719	S	S	*	*			trans	48.7	138.7	169.9	-71.7	79.1	0	0	0	118.6
1773	G	38.1	Very low	39.2	Very low	70 Å²	70	140.7 Å²	140.7	72%	0.722	73%	0.73	S	S	*	*			cis	127	163.8	4.9	0	0	0	0	0	111.4
1774	P	41.5	Very low	39.4	Very low	117 Å²	117	143 Å²	143	76%	0.76	74%	0.735	S	S	*	*			cis	-144.7	-168.6	-14	43.5	-24.5	0	0	0	115.5
1775	K	38.7	Very low	39.3	Very low	179 Å²	179	141.8 Å²	141.8	78%	0.778	74%	0.736	S	S	*	*			trans	89.3	114.9	146.9	-79	179.5	172	-175.1	0	123.4
1776	I	41.2	Very low	39.2	Very low	132 Å²	132	144.2 Å²	144.2	68%	0.677	75%	0.749	S	S	*	*				102.8	109.7	120.3	-73.8	171.9	0	0	0	120
1777	D	42	Very low	39	Very low	117 Å²	117	147.7 Å²	147.7	63%	0.626	77%	0.767	S	S	*	*			trans	58.8	148.8	135.9	-69.3	15.1	0	0	0	122.9
1778	K	40	Very low	39	Very low	149 Å²	149	153.5 Å²	153.5	65%	0.648	78%	0.781	S	S	*	*			cis	-169.1	165.3	-22.5	-118.6	-174.9	-162.8	77.6	0	109
1779	N	41.8	Very low	38.9	Very low	126 Å²	126	154.6 Å²	154.6	67%	0.674	79%	0.786	S	S	*	*			trans	68.5	109.2	152.3	-63.3	7.4	0	0	0	120.8
1780	N	38.9	Very low	39.2	Very low	118 Å²	118	154.5 Å²	154.5	63%	0.631	79%	0.785	S	S	*	*				74.4	119.8	116.4	-68.9	35.6	0	0	0	123.6
1781	E	38.9	Very low	40	Very low	162 Å²	162	159.2 Å²	159.2	76%	0.757	79%	0.786	S	S	*	*				84.3	120.1	121.7	-68.1	163.1	162.7	0	0	121.8
1782	E	36	Very low	41.8	Very low	183 Å²	183	154.6 Å²	154.6	86%	0.855	77%	0.767	S	S	*	*			trans	47.6	103.9	141.8	-54.6	-157.8	127	0	0	121.1
1783	Q	36.8	Very low	43.2	Very low	201 Å²	201	151.4 Å²	151.4	94%	0.939	76%	0.759	S	S	*	*				-151.8	131.4	119.5	-113.6	170.1	34.6	0	0	112.1
1784	K	39.4	Very low	45.2	Very low	197 Å²	197	149.7 Å²	149.7	86%	0.857	74%	0.741	S	S	*	*			trans	-98	166.6	172.3	-88.4	-178.8	176.1	173.5	0	110.9
1785	S	37.7	Very low	46.7	Very low	103 Å²	103	146 Å²	146	72%	0.72	72%	0.721	S	S	*	*			trans	57.8	100.5	166.6	54.4	0	0	0	0	118
1786	N	38.5	Very low	48.3	Very low	167 Å²	167	145.1 Å²	145.1	89%	0.893	71%	0.714	S	S	*	*				-178.6	73.1	126.1	-94.9	-36.6	0	0	0	112.1	R1788	N1786-R1788 PolarHBondContact O-N 2.9Å
1787	Q	36	Very low	49.7	Very low	195 Å²	195	141.8 Å²	141.8	91%	0.911	70%	0.702	S	S	*	*			trans	-91.3	97	168.1	-81.8	-170.7	-16.2	0	0	110.9	F1789	Q1787-F1789 PolarHBondContact O-N 2.99Å
1788	R	39.3	Very low	51.3	Low	233 Å²	233	141.6 Å²	141.6	88%	0.879	70%	0.7	S	S	*	*			trans	-62	125.8	158.9	-83.8	179.9	165.9	173.3	-5.3	108.8	N1786 K1790	N1786-R1788 PolarHBondContact O-N 2.9Å; R1788-K1790 PolarHBondContact O-N 3.28Å
1789	F	40.4	Very low	52.9	Low	203 Å²	203	140.2 Å²	140.2	89%	0.89	70%	0.695	S	S	*	*			trans	-57.9	121	167.1	-95.3	-95.7	0	0	0	109.9	Q1787	Q1787-F1789 PolarHBondContact O-N 2.99Å
1790	K	45.6	Very low	54.6	Low	196 Å²	196	136.3 Å²	136.3	85%	0.852	68%	0.676	S	S	*	*			trans	-101	108.6	170.3	-70.1	-176.9	179.2	179.4	0	108.4	R1788	R1788-K1790 PolarHBondContact O-N 3.28Å
1791	F	54.1	Low	56.4	Low	172 Å²	172	134.1 Å²	134.1	75%	0.754	67%	0.669	S	S	*	*			trans	-60.3	136.8	166.4	-84.1	-92.2	0	0	0	109.8	A1795	F1791-A1795 HydrophobicContact CD1-CB 3.97Å
1792	S	74.6	Confident	58.2	Low	56 Å²	56	131 Å²	131	39%	0.392	65%	0.654	S	S	.	*			trans	-75.8	154.1	172.2	70.9	0	0	0	0	110.3	G1794 A1795 Y1796	S1792-G1794 PolarHBondContact O-N 3.16Å; S1792-A1795 PolarHBondContact O-N 3.41Å; S1792-A1795 PolarHBondContact OG-N 3.46Å; S1792-Y1796 PolarHBondContact O-N 2.97Å
1793	S	67.3	Low	60.2	Low	104 Å²	104	127.3 Å²	127.3	73%	0.727	64%	0.635	S	S	*	*	H	α-helix	trans	-61.7	-27.2	175.9	55.6	0	0	0	0	112.7	S1797	S1793-S1797 VanDerWaalsContact O-CB 3.24Å; S1793-S1797 WeakPolarHBondContact O-CB 3.42Å; S1793-S1797 PolarHBondContact O-N 2.97Å
1794	G	80.8	Confident	62	Low	34 Å²	34	122.1 Å²	122.1	35%	0.351	61%	0.614	S	S	.	*	H	α-helix	trans	-64.2	-43.6	171.6	0	0	0	0	0	112.7	S1792 S1797 L1798	S1792-G1794 PolarHBondContact O-N 3.16Å; G1794-S1797 PolarHBondContact O-N 3.42Å; G1794-L1798 WeakPolarHBondContact O-CB 3.47Å; G1794-L1798 PolarHBondContact O-N 3.18Å
1795	A	72.7	Confident	63.6	Low	40 Å²	40	117 Å²	117	33%	0.331	60%	0.595	S	S	.	*	H	α-helix	trans	-67	-41.6	176.2	0	0	0	0	0	112	F1791 S1792 L1798 F1799	F1791-A1795 HydrophobicContact CD1-CB 3.97Å; S1792-A1795 PolarHBondContact O-N 3.41Å; S1792-A1795 PolarHBondContact OG-N 3.46Å; A1795-L1798 PolarHBondContact O-N 3.32Å; A1795-F1799 WeakPolarHBondContact O-CB 3.03Å; A1795-F1799 PolarHBondContact O-N 2.95Å
1796	Y	71.4	Confident	65.6	Low	160 Å²	160	114.1 Å²	114.1	63%	0.627	58%	0.577	S	S	*	*	H	α-helix	trans	-62.6	-46.6	174.8	-172	-91.6	0	0	0	111.8	S1792 L1798 F1799 T1800	S1792-Y1796 PolarHBondContact O-N 2.97Å; Y1796-L1798 PolarHBondContact O-N 2.81Å; Y1796-F1799 PolarHBondContact O-N 3.08Å; Y1796-T1800 HydrophobicContact CD1-CG2 4.17Å; Y1796-T1800 HydrophobicContact CE1-CG2 3.72Å; Y1796-T1800 PolarHBondContact O-N 2.86Å; Y1796-T1800 PolarHBondContact O-OG1 3.2Å; Y1796-T1800 VanDerWaalsContact O-OG1 3.12Å
1797	S	71.6	Confident	67.3	Low	61 Å²	61	109.7 Å²	109.7	43%	0.427	56%	0.556	S	S	.	*	H	α-helix	trans	-58.3	-47	176.7	174.2	0	0	0	0	112	S1793 G1794 F1799 T1800 S1801	S1793-S1797 VanDerWaalsContact O-CB 3.24Å; S1793-S1797 WeakPolarHBondContact O-CB 3.42Å; S1793-S1797 PolarHBondContact O-N 2.97Å; G1794-S1797 PolarHBondContact O-N 3.42Å; S1797-F1799 PolarHBondContact O-N 3.03Å; S1797-T1800 WeakPolarHBondContact CA-OG1 3.43Å; S1797-T1800 PolarHBondContact O-N 2.85Å; S1797-T1800 PolarHBondContact O-OG1 2.83Å; S1797-S1801 PolarHBondContact O-N 2.93Å; S1797-S1801 PolarHBondContact O-OG 3.21Å
1798	L	75.1	Confident	69.2	Low	113 Å²	113	106.1 Å²	106.1	59%	0.592	54%	0.543	S	S	*	.	H	α-helix	trans	-64.1	-40.8	178.8	-166.4	153.1	0	0	0	111.5	G1794 A1795 Y1796 S1801 F1802	G1794-L1798 WeakPolarHBondContact O-CB 3.47Å; G1794-L1798 PolarHBondContact O-N 3.18Å; A1795-L1798 PolarHBondContact O-N 3.32Å; Y1796-L1798 PolarHBondContact O-N 2.81Å; L1798-S1801 PolarHBondContact O-N 3.37Å; L1798-F1802 WeakPolarHBondContact O-CB 3.46Å; L1798-F1802 PolarHBondContact O-N 3.15Å
1799	F	75	Confident	70.7	Confident	121 Å²	121	99.3 Å²	99.3	53%	0.531	52%	0.518	S	S	.	.	H	α-helix	trans	-61.3	-46.2	173.6	-174.5	-95.4	0	0	0	112	A1795 Y1796 S1797 F1802 F1803	A1795-F1799 WeakPolarHBondContact O-CB 3.03Å; A1795-F1799 PolarHBondContact O-N 2.95Å; Y1796-F1799 PolarHBondContact O-N 3.08Å; S1797-F1799 PolarHBondContact O-N 3.03Å; F1799-F1802 PolarHBondContact O-N 2.93Å; F1799-F1803 HydrophobicContact CD1-CD2 4.26Å; F1799-F1803 AromaticContact CE1-CD2 3.66Å; F1799-F1803 HydrophobicContact CE1-CD2 3.66Å; F1799-F1803 AromaticContact CE1-CE2 3.87Å; F1799-F1803 HydrophobicContact CE1-CE2 3.87Å; F1799-F1803 HydrophobicContact CE2-CD2 4.24Å; F1799-F1803 HydrophobicContact CE2-CE2 4.21Å; F1799-F1803 AromaticContact CZ-CD2 3.66Å; F1799-F1803 HydrophobicContact CZ-CD2 3.66Å; F1799-F1803 AromaticContact CZ-CE2 3.5Å; F1799-F1803 HydrophobicContact CZ-CE2 3.5Å; F1799-F1803 VanDerWaalsContact CZ-CE2 3.5Å; F1799-F1803 WeakPolarHBondContact O-CB 3.3Å; F1799-F1803 PolarHBondContact O-N 3.15Å
1800	T	75.6	Confident	72.3	Confident	44 Å²	44	92.1 Å²	92.1	27%	0.27	49%	0.49	S	S	.	.	H	α-helix	trans	-65.1	-38.6	176.5	47.4	0	0	0	0	113.2	Y1796 S1797 F1803 N1804	Y1796-T1800 HydrophobicContact CD1-CG2 4.17Å; Y1796-T1800 HydrophobicContact CE1-CG2 3.72Å; Y1796-T1800 PolarHBondContact O-N 2.86Å; Y1796-T1800 PolarHBondContact O-OG1 3.2Å; Y1796-T1800 VanDerWaalsContact O-OG1 3.12Å; S1797-T1800 WeakPolarHBondContact CA-OG1 3.43Å; S1797-T1800 PolarHBondContact O-N 2.85Å; S1797-T1800 PolarHBondContact O-OG1 2.83Å; T1800-F1803 PolarHBondContact O-N 3.35Å; T1800-N1804 WeakPolarHBondContact O-CB 3.3Å; T1800-N1804 VanDerWaalsContact O-CG 3.31Å; T1800-N1804 PolarHBondContact O-N 2.85Å
1801	S	76.9	Confident	73.7	Confident	72 Å²	72	85.8 Å²	85.8	50%	0.503	47%	0.47	S	S	.	.	H	α-helix	trans	-66	-40	175.8	-65.3	0	0	0	0	111.9	S1797 L1798 N1804 L1805	S1797-S1801 PolarHBondContact O-N 2.93Å; S1797-S1801 PolarHBondContact O-OG 3.21Å; L1798-S1801 PolarHBondContact O-N 3.37Å; S1801-N1804 PolarHBondContact O-N 3.39Å; S1801-L1805 WeakPolarHBondContact O-CB 3.16Å; S1801-L1805 PolarHBondContact O-N 3.49Å
1802	F	77.3	Confident	74.5	Confident	97 Å²	97	84.8 Å²	84.8	43%	0.425	46%	0.461	S	S	.	.	H	α-helix	trans	-63.8	-43.3	173.3	-177.5	-95	0	0	0	111.7	L1798 F1799 N1804 L1805 A1806 W1867	L1798-F1802 WeakPolarHBondContact O-CB 3.46Å; L1798-F1802 PolarHBondContact O-N 3.15Å; F1799-F1802 PolarHBondContact O-N 2.93Å; F1802-N1804 PolarHBondContact O-N 2.85Å; F1802-L1805 PolarHBondContact O-N 3.44Å; F1802-A1806 WeakPolarHBondContact O-CB 3.2Å; F1802-A1806 PolarHBondContact O-N 2.7Å; F1802-W1867 AromaticContact CE1-CH2 3.93Å; F1802-W1867 HydrophobicContact CE1-CH2 3.93Å; F1802-W1867 HydrophobicContact CE1-CZ3 4.08Å; F1802-W1867 HydrophobicContact CZ-CE3 4.46Å; F1802-W1867 AromaticContact CZ-CH2 3.88Å; F1802-W1867 HydrophobicContact CZ-CH2 3.88Å; F1802-W1867 AromaticContact CZ-CZ3 3.65Å; F1802-W1867 HydrophobicContact CZ-CZ3 3.65Å
1803	F	78.9	Confident	74.3	Confident	105 Å²	105	85.3 Å²	85.3	46%	0.461	46%	0.457	S	S	.	.	H	α-helix	trans	-62.7	-40.5	176.8	-119.7	-90.2	0	0	0	112.5	F1799 T1800 A1806 T1807	F1799-F1803 HydrophobicContact CD1-CD2 4.26Å; F1799-F1803 AromaticContact CE1-CD2 3.66Å; F1799-F1803 HydrophobicContact CE1-CD2 3.66Å; F1799-F1803 AromaticContact CE1-CE2 3.87Å; F1799-F1803 HydrophobicContact CE1-CE2 3.87Å; F1799-F1803 HydrophobicContact CE2-CD2 4.24Å; F1799-F1803 HydrophobicContact CE2-CE2 4.21Å; F1799-F1803 AromaticContact CZ-CD2 3.66Å; F1799-F1803 HydrophobicContact CZ-CD2 3.66Å; F1799-F1803 AromaticContact CZ-CE2 3.5Å; F1799-F1803 HydrophobicContact CZ-CE2 3.5Å; F1799-F1803 VanDerWaalsContact CZ-CE2 3.5Å; F1799-F1803 WeakPolarHBondContact O-CB 3.3Å; F1799-F1803 PolarHBondContact O-N 3.15Å; T1800-F1803 PolarHBondContact O-N 3.35Å; F1803-A1806 PolarHBondContact O-N 3.32Å; F1803-T1807 HydrophobicContact CD1-CG2 3.84Å; F1803-T1807 HydrophobicContact CE1-CG2 4.14Å; F1803-T1807 WeakPolarHBondContact O-CB 3.37Å; F1803-T1807 WeakPolarHBondContact O-CG2 3.32Å; F1803-T1807 PolarHBondContact O-N 3.42Å; F1803-T1807 PolarHBondContact O-OG1 3.48Å
1804	N	74.9	Confident	74.6	Confident	92 Å²	92	85.4 Å²	85.4	49%	0.492	45%	0.448	S	S	.	.	H	α-helix	trans	-66.3	-41.3	175.7	-72	-14.2	0	0	0	111.8	T1800 S1801 F1802 L1808 Y1809	T1800-N1804 WeakPolarHBondContact O-CB 3.3Å; T1800-N1804 VanDerWaalsContact O-CG 3.31Å; T1800-N1804 PolarHBondContact O-N 2.85Å; S1801-N1804 PolarHBondContact O-N 3.39Å; F1802-N1804 PolarHBondContact O-N 2.85Å; N1804-L1808 WeakPolarHBondContact O-CB 3.42Å; N1804-L1808 PolarHBondContact O-N 3.12Å; N1804-Y1809 PolarHBondContact O-N 3.15Å
1805	L	73.1	Confident	74.3	Confident	90 Å²	90	91.5 Å²	91.5	47%	0.471	46%	0.462	S	S	.	.	I	π-helix	trans	-60.8	-47	174.6	-173.3	73.7	0	0	0	111.2	S1801 F1802 Y1809 V1810	S1801-L1805 WeakPolarHBondContact O-CB 3.16Å; S1801-L1805 PolarHBondContact O-N 3.49Å; F1802-L1805 PolarHBondContact O-N 3.44Å; L1805-Y1809 HydrophobicContact CD1-CD1 3.75Å; L1805-Y1809 HydrophobicContact CD1-CE1 4.49Å; L1805-Y1809 HydrophobicContact CD1-CG 4.01Å; L1805-Y1809 WeakPolarHBondContact O-CB 3.24Å; L1805-Y1809 PolarHBondContact O-N 3.21Å; L1805-V1810 PolarHBondContact O-N 2.84Å
1806	A	78.6	Confident	74.3	Confident	42 Å²	42	96.1 Å²	96.1	35%	0.347	47%	0.471	S	S	.	.	I	π-helix	trans	-71.9	-33.7	-177.4	0	0	0	0	0	114	F1802 F1803 P1811	F1802-A1806 WeakPolarHBondContact O-CB 3.2Å; F1802-A1806 PolarHBondContact O-N 2.7Å; F1803-A1806 PolarHBondContact O-N 3.32Å; A1806-P1811 WeakPolarHBondContact O-CD 3.45Å
1807	T	74.8	Confident	74	Confident	73 Å²	73	93.5 Å²	93.5	45%	0.448	47%	0.467	S	S	.	.	I	π-helix	trans	-98.7	-25.1	-174.6	60	0	0	0	0	114.8	F1803	F1803-T1807 HydrophobicContact CD1-CG2 3.84Å; F1803-T1807 HydrophobicContact CE1-CG2 4.14Å; F1803-T1807 WeakPolarHBondContact O-CB 3.37Å; F1803-T1807 WeakPolarHBondContact O-CG2 3.32Å; F1803-T1807 PolarHBondContact O-N 3.42Å; F1803-T1807 PolarHBondContact O-OG1 3.48Å
1808	L	74.9	Confident	74	Confident	120 Å²	120	97.6 Å²	97.6	63%	0.628	47%	0.474	S	S	*	.	I	π-helix	trans	-111.3	-46.4	-179.2	-60.9	172.2	0	0	0	112.8	N1804 R1812	N1804-L1808 WeakPolarHBondContact O-CB 3.42Å; N1804-L1808 PolarHBondContact O-N 3.12Å; L1808-R1812 VanDerWaalsContact O-CB 3.22Å; L1808-R1812 WeakPolarHBondContact O-CB 3.37Å; L1808-R1812 PolarHBondContact O-N 2.78Å
1809	Y	71.1	Confident	73.9	Confident	90 Å²	90	92.9 Å²	92.9	35%	0.353	45%	0.452	S	S	.	.	I	π-helix	trans	-79.2	-50.9	-171.4	-164.7	-100.5	0	0	0	112.3	N1804 L1805 R1812 H1813 F1857	N1804-Y1809 PolarHBondContact O-N 3.15Å; L1805-Y1809 HydrophobicContact CD1-CD1 3.75Å; L1805-Y1809 HydrophobicContact CD1-CE1 4.49Å; L1805-Y1809 HydrophobicContact CD1-CG 4.01Å; L1805-Y1809 WeakPolarHBondContact O-CB 3.24Å; L1805-Y1809 PolarHBondContact O-N 3.21Å; Y1809-R1812 PolarHBondContact O-N 3.42Å; Y1809-H1813 AromaticContact CD1-CD2 3.87Å; Y1809-H1813 AromaticContact CE1-CD2 3.33Å; Y1809-H1813 WeakPolarHBondContact CE1-CD2 3.14Å; Y1809-H1813 AromaticContact CE1-NE2 3.49Å; Y1809-H1813 WeakPolarHBondContact CE1-NE2 3.29Å; Y1809-H1813 AromaticContact CE2-NE2 3.72Å; Y1809-H1813 AromaticContact CZ-CD2 3.55Å; Y1809-H1813 AromaticContact CZ-NE2 3.14Å; Y1809-H1813 PolarHBondContact O-N 3.15Å; Y1809-H1813 PolarHBondContact OH-NE2 3.2Å; Y1809-F1857 HydrophobicContact CE1-CE2 4.26Å
1810	V	73.8	Confident	73.7	Confident	52 Å²	52	89.4 Å²	89.4	32%	0.315	45%	0.446	S	S	.	.	H	α-helix	trans	-61.3	-47.6	-179.6	172.2	0	0	0	0	112.4	L1805 R1812 H1813 I1814	L1805-V1810 PolarHBondContact O-N 2.84Å; V1810-R1812 PolarHBondContact O-N 3.44Å; V1810-H1813 PolarHBondContact O-N 3.31Å; V1810-I1814 HydrophobicContact CG1-CD1 3.7Å; V1810-I1814 HydrophobicContact CG1-CG1 4.39Å; V1810-I1814 WeakPolarHBondContact O-CG1 3.37Å; V1810-I1814 PolarHBondContact O-N 3.19Å
1811	P	75.8	Confident	73.4	Confident	64 Å²	64	91.3 Å²	91.3	42%	0.416	46%	0.458	S	S	.	.	H	α-helix	trans	-65	-35.2	177.6	-25	37.9	0	0	0	113.4	A1806 I1814 Y1815	A1806-P1811 WeakPolarHBondContact O-CD 3.45Å; P1811-I1814 PolarHBondContact O-N 2.81Å; P1811-Y1815 WeakPolarHBondContact O-CB 3.38Å; P1811-Y1815 PolarHBondContact O-N 2.95Å
1812	R	70.7	Confident	73.1	Confident	151 Å²	151	94.8 Å²	94.8	57%	0.57	46%	0.464	S	S	*	.	H	α-helix	trans	-65.9	-40.2	177	-175.6	174.6	-178.9	172.8	0.2	112.2	L1808 Y1809 V1810 Y1815 W1816	L1808-R1812 VanDerWaalsContact O-CB 3.22Å; L1808-R1812 WeakPolarHBondContact O-CB 3.37Å; L1808-R1812 PolarHBondContact O-N 2.78Å; Y1809-R1812 PolarHBondContact O-N 3.42Å; V1810-R1812 PolarHBondContact O-N 3.44Å; R1812-Y1815 PolarHBondContact O-N 2.95Å; R1812-W1816 PolarHBondContact O-N 3.19Å
1813	H	70.7	Confident	72.9	Confident	66 Å²	66	92 Å²	92	31%	0.306	46%	0.455	S	S	.	.	H	α-helix	trans	-75.9	-32.2	176.2	-80.3	-18.3	0	0	0	113.3	Y1809 V1810 Y1815 W1816 L1817	Y1809-H1813 AromaticContact CD1-CD2 3.87Å; Y1809-H1813 AromaticContact CE1-CD2 3.33Å; Y1809-H1813 WeakPolarHBondContact CE1-CD2 3.14Å; Y1809-H1813 AromaticContact CE1-NE2 3.49Å; Y1809-H1813 WeakPolarHBondContact CE1-NE2 3.29Å; Y1809-H1813 AromaticContact CE2-NE2 3.72Å; Y1809-H1813 AromaticContact CZ-CD2 3.55Å; Y1809-H1813 AromaticContact CZ-NE2 3.14Å; Y1809-H1813 PolarHBondContact O-N 3.15Å; Y1809-H1813 PolarHBondContact OH-NE2 3.2Å; V1810-H1813 PolarHBondContact O-N 3.31Å; H1813-Y1815 VanDerWaalsContact C-N 3.34Å; H1813-W1816 PolarHBondContact O-N 2.71Å; H1813-L1817 VanDerWaalsContact O-CB 3.24Å; H1813-L1817 WeakPolarHBondContact O-CB 3.44Å; H1813-L1817 PolarHBondContact O-N 3.29Å
1814	I	73.7	Confident	72.5	Confident	106 Å²	106	90.1 Å²	90.1	54%	0.544	45%	0.453	S	S	.	.	H	α-helix	trans	-63.5	-42.6	168.8	-69.6	170.2	0	0	0	110.1	V1810 P1811 L1817 Y1818	V1810-I1814 HydrophobicContact CG1-CD1 3.7Å; V1810-I1814 HydrophobicContact CG1-CG1 4.39Å; V1810-I1814 WeakPolarHBondContact O-CG1 3.37Å; V1810-I1814 PolarHBondContact O-N 3.19Å; P1811-I1814 PolarHBondContact O-N 2.81Å; I1814-L1817 PolarHBondContact O-N 2.89Å; I1814-Y1818 VanDerWaalsContact O-CB 3.23Å; I1814-Y1818 WeakPolarHBondContact O-CB 3.25Å; I1814-Y1818 PolarHBondContact O-N 3Å
1815	Y	72.9	Confident	71.9	Confident	163 Å²	163	94 Å²	94	64%	0.639	46%	0.461	S	S	*	.	H	α-helix	trans	-63.2	-43	174.9	-177.4	-91.5	0	0	0	112.4	P1811 R1812 H1813 Y1818 G1819	P1811-Y1815 WeakPolarHBondContact O-CB 3.38Å; P1811-Y1815 PolarHBondContact O-N 2.95Å; R1812-Y1815 PolarHBondContact O-N 2.95Å; H1813-Y1815 VanDerWaalsContact C-N 3.34Å; Y1815-Y1818 PolarHBondContact O-N 3.13Å; Y1815-G1819 PolarHBondContact O-N 2.97Å
1816	W	72.4	Confident	71.8	Confident	137 Å²	137	94.7 Å²	94.7	52%	0.519	46%	0.462	S	S	.	.	H	α-helix	trans	-66.5	-41.8	176.8	-171.5	84.6	0	0	0	112.5	R1812 H1813 G1819 A1820 F1828	R1812-W1816 PolarHBondContact O-N 3.19Å; H1813-W1816 PolarHBondContact O-N 2.71Å; W1816-G1819 PolarHBondContact O-N 3.08Å; W1816-A1820 WeakPolarHBondContact O-CB 3.26Å; W1816-A1820 PolarHBondContact O-N 3.09Å; W1816-F1828 HydrophobicContact CZ2-CZ 4.22Å
1817	L	66.1	Low	71.5	Confident	105 Å²	105	98.1 Å²	98.1	55%	0.55	47%	0.471	S	S	.	.	H	α-helix	trans	-62.9	-43	174.4	-178.7	65.5	0	0	0	111.5	H1813 I1814 A1820 T1821	H1813-L1817 VanDerWaalsContact O-CB 3.24Å; H1813-L1817 WeakPolarHBondContact O-CB 3.44Å; H1813-L1817 PolarHBondContact O-N 3.29Å; I1814-L1817 PolarHBondContact O-N 2.89Å; L1817-A1820 PolarHBondContact O-N 2.91Å; L1817-T1821 HydrophobicContact CD1-CG2 4.32Å; L1817-T1821 WeakPolarHBondContact O-CB 3.35Å; L1817-T1821 WeakPolarHBondContact O-CG2 3.2Å; L1817-T1821 PolarHBondContact O-N 2.99Å; L1817-T1821 PolarHBondContact O-OG1 2.88Å
1818	Y	72.3	Confident	71.2	Confident	147 Å²	147	96.7 Å²	96.7	58%	0.576	46%	0.459	S	S	*	.	H	α-helix	trans	-62.8	-45.8	175.2	-171.6	-88.5	0	0	0	111	I1814 Y1815 A1820 T1821 F1822	I1814-Y1818 VanDerWaalsContact O-CB 3.23Å; I1814-Y1818 WeakPolarHBondContact O-CB 3.25Å; I1814-Y1818 PolarHBondContact O-N 3Å; Y1815-Y1818 PolarHBondContact O-N 3.13Å; Y1818-A1820 PolarHBondContact O-N 3.3Å; Y1818-T1821 PolarHBondContact O-N 3.09Å; Y1818-T1821 PolarHBondContact O-OG1 2.71Å; Y1818-F1822 HydrophobicContact CD1-CD2 4.21Å; Y1818-F1822 AromaticContact CD2-CD2 3.48Å; Y1818-F1822 HydrophobicContact CD2-CD2 3.48Å; Y1818-F1822 VanDerWaalsContact CD2-CD2 3.48Å; Y1818-F1822 AromaticContact CD2-CE2 3.66Å; Y1818-F1822 HydrophobicContact CD2-CE2 3.66Å; Y1818-F1822 HydrophobicContact CE1-CB 4.42Å; Y1818-F1822 HydrophobicContact CE1-CD2 4.25Å; Y1818-F1822 AromaticContact CE2-CD2 3.53Å; Y1818-F1822 HydrophobicContact CE2-CD2 3.53Å; Y1818-F1822 AromaticContact CE2-CE2 3.73Å; Y1818-F1822 HydrophobicContact CE2-CE2 3.73Å; Y1818-F1822 HydrophobicContact CE2-CG 4.38Å; Y1818-F1822 AromaticContact CG-CD2 3.84Å; Y1818-F1822 HydrophobicContact CG-CD2 3.84Å; Y1818-F1822 HydrophobicContact CG-CE2 4.39Å; Y1818-F1822 AromaticContact CZ-CD2 3.93Å; Y1818-F1822 WeakPolarHBondContact O-CD2 3.4Å; Y1818-F1822 PolarHBondContact O-N 3.04Å
1819	G	73.3	Confident	70.9	Confident	13 Å²	13	95.9 Å²	95.9	13%	0.134	45%	0.451	C	S	.	.	H	α-helix	trans	-59	-46.3	174.2	0	0	0	0	0	112.6	Y1815 W1816 T1821 T1823	Y1815-G1819 PolarHBondContact O-N 2.97Å; W1816-G1819 PolarHBondContact O-N 3.08Å; G1819-T1821 VanDerWaalsContact C-N 3.27Å; G1819-T1821 PolarHBondContact O-N 3.48Å; G1819-T1823 WeakPolarHBondContact O-CB 3.26Å; G1819-T1823 PolarHBondContact O-N 3.3Å; G1819-T1823 PolarHBondContact O-OG1 2.88Å; G1819-T1823 VanDerWaalsContact O-OG1 3.04Å
1820	A	68.9	Low	70.8	Confident	49 Å²	49	101.2 Å²	101.2	41%	0.405	47%	0.471	S	S	.	.	H	α-helix	trans	-71.3	-15.2	179.2	0	0	0	0	0	114.5	W1816 L1817 Y1818 F1828	W1816-A1820 WeakPolarHBondContact O-CB 3.26Å; W1816-A1820 PolarHBondContact O-N 3.09Å; L1817-A1820 PolarHBondContact O-N 2.91Å; Y1818-A1820 PolarHBondContact O-N 3.3Å; A1820-F1828 HydrophobicContact CB-CE2 4.08Å; A1820-F1828 HydrophobicContact CB-CZ 4.47Å
1821	T	69.3	Low	70.4	Confident	84 Å²	84	103.4 Å²	103.4	52%	0.515	48%	0.479	S	S	.	.	H	α-helix	trans	-105.7	-21.5	179.7	47.9	0	0	0	0	114.4	L1817 Y1818 G1819	L1817-T1821 HydrophobicContact CD1-CG2 4.32Å; L1817-T1821 WeakPolarHBondContact O-CB 3.35Å; L1817-T1821 WeakPolarHBondContact O-CG2 3.2Å; L1817-T1821 PolarHBondContact O-N 2.99Å; L1817-T1821 PolarHBondContact O-OG1 2.88Å; Y1818-T1821 PolarHBondContact O-N 3.09Å; Y1818-T1821 PolarHBondContact O-OG1 2.71Å; G1819-T1821 VanDerWaalsContact C-N 3.27Å; G1819-T1821 PolarHBondContact O-N 3.48Å
1822	F	72.3	Confident	69.4	Low	144 Å²	144	106 Å²	106	63%	0.632	49%	0.487	S	S	*	.	H	α-helix	trans	-124.4	-14.7	-176.2	-60.9	-71.2	0	0	0	115.2	Y1818	Y1818-F1822 HydrophobicContact CD1-CD2 4.21Å; Y1818-F1822 AromaticContact CD2-CD2 3.48Å; Y1818-F1822 HydrophobicContact CD2-CD2 3.48Å; Y1818-F1822 VanDerWaalsContact CD2-CD2 3.48Å; Y1818-F1822 AromaticContact CD2-CE2 3.66Å; Y1818-F1822 HydrophobicContact CD2-CE2 3.66Å; Y1818-F1822 HydrophobicContact CE1-CB 4.42Å; Y1818-F1822 HydrophobicContact CE1-CD2 4.25Å; Y1818-F1822 AromaticContact CE2-CD2 3.53Å; Y1818-F1822 HydrophobicContact CE2-CD2 3.53Å; Y1818-F1822 AromaticContact CE2-CE2 3.73Å; Y1818-F1822 HydrophobicContact CE2-CE2 3.73Å; Y1818-F1822 HydrophobicContact CE2-CG 4.38Å; Y1818-F1822 AromaticContact CG-CD2 3.84Å; Y1818-F1822 HydrophobicContact CG-CD2 3.84Å; Y1818-F1822 HydrophobicContact CG-CE2 4.39Å; Y1818-F1822 AromaticContact CZ-CD2 3.93Å; Y1818-F1822 WeakPolarHBondContact O-CD2 3.4Å; Y1818-F1822 PolarHBondContact O-N 3.04Å
1823	T	72.3	Confident	69.3	Low	38 Å²	38	103 Å²	103	23%	0.233	49%	0.494	C	S	.	.	S	Bend	trans	-85.4	134	176.8	-51.3	0	0	0	0	110.6	G1819 Q1827	G1819-T1823 WeakPolarHBondContact O-CB 3.26Å; G1819-T1823 PolarHBondContact O-N 3.3Å; G1819-T1823 PolarHBondContact O-OG1 2.88Å; G1819-T1823 VanDerWaalsContact O-OG1 3.04Å; T1823-Q1827 HydrophobicContact CG2-CB 3.53Å
1824	P	71.2	Confident	68.5	Low	66 Å²	66	103 Å²	103	43%	0.429	51%	0.512	S	S	.	.			trans	-54.5	146.1	172.7	-26.6	35.3	0	0	0	112.5	E1826 Q1827 F1828	P1824-E1826 PolarHBondContact O-N 2.76Å; P1824-E1826 VanDerWaalsContact O-N 3.17Å; P1824-Q1827 PolarHBondContact O-N 2.93Å; P1824-F1828 PolarHBondContact O-N 3.02Å
1825	R	61.5	Low	67	Low	174 Å²	174	102.6 Å²	102.6	66%	0.657	52%	0.518	S	S	*	.	H	α-helix	trans	-56.8	-38.1	-172	179.8	173.2	178.4	-165.9	-1.1	112.5	F1828 H1829	R1825-F1828 PolarHBondContact O-N 3.32Å; R1825-H1829 PolarHBondContact NE-NE2 2.81Å; R1825-H1829 PolarHBondContact O-CD2 3.37Å; R1825-H1829 PolarHBondContact O-N 3.13Å
1826	E	71.8	Confident	65	Low	105 Å²	105	98.5 Å²	98.5	49%	0.491	53%	0.525	S	S	.	.	H	α-helix	trans	-68	-40.7	179.6	-53.7	67.8	-145.1	0	0	111	M547 P1824 R1830	M547-E1826 VanDerWaalsContact CE-OE1 3.24Å; M547-E1826 WeakPolarHBondContact CE-OE1 3.43Å; P1824-E1826 PolarHBondContact O-N 2.76Å; P1824-E1826 VanDerWaalsContact O-N 3.17Å; E1826-R1830 WeakPolarHBondContact O-CB 3.47Å; E1826-R1830 WeakPolarHBondContact O-CG 3.48Å; E1826-R1830 PolarHBondContact O-N 2.79Å
1827	Q	71.6	Confident	63.2	Low	113 Å²	113	98.5 Å²	98.5	53%	0.528	53%	0.533	S	S	.	.	H	α-helix	trans	-70.7	-38.3	174.5	-80.8	-170	-5	0	0	111.9	T1823 P1824 R1830 M1831	T1823-Q1827 HydrophobicContact CG2-CB 3.53Å; P1824-Q1827 PolarHBondContact O-N 2.93Å; Q1827-R1830 PolarHBondContact O-N 3.22Å; Q1827-M1831 WeakPolarHBondContact O-CG 3.26Å; Q1827-M1831 PolarHBondContact O-N 2.81Å
1828	F	67.8	Low	61.7	Low	44 Å²	44	102.7 Å²	102.7	19%	0.193	55%	0.55	C	S	.	.	H	α-helix	trans	-62.6	-45.9	174.4	-175	-94.7	0	0	0	111.1	W1816 A1820 P1824 R1825 R1830 M1831 M1832	W1816-F1828 HydrophobicContact CZ2-CZ 4.22Å; A1820-F1828 HydrophobicContact CB-CE2 4.08Å; A1820-F1828 HydrophobicContact CB-CZ 4.47Å; P1824-F1828 PolarHBondContact O-N 3.02Å; R1825-F1828 PolarHBondContact O-N 3.32Å; F1828-R1830 PolarHBondContact O-N 2.92Å; F1828-M1831 PolarHBondContact O-N 3.01Å; F1828-M1832 HydrophobicContact CD1-CG 4.11Å; F1828-M1832 HydrophobicContact CE1-CG 3.85Å; F1828-M1832 HydrophobicContact CE1-SD 4.2Å; F1828-M1832 HydrophobicContact CZ-CG 4.24Å; F1828-M1832 HydrophobicContact CZ-SD 4.18Å; F1828-M1832 WeakPolarHBondContact O-CG 3.45Å; F1828-M1832 PolarHBondContact O-N 3.23Å
1829	H	69.5	Low	60	Low	103 Å²	103	101.1 Å²	101.1	48%	0.477	55%	0.55	S	S	.	*	H	α-helix	trans	-63.2	-37.8	172.9	-77	-67.2	0	0	0	112.6	R1825 M1832 A1833	R1825-H1829 PolarHBondContact NE-NE2 2.81Å; R1825-H1829 PolarHBondContact O-CD2 3.37Å; R1825-H1829 PolarHBondContact O-N 3.13Å; H1829-M1832 PolarHBondContact O-N 3.19Å; H1829-A1833 WeakPolarHBondContact O-CB 2.93Å; H1829-A1833 PolarHBondContact O-N 3.09Å
1830	R	68.2	Low	58.2	Low	201 Å²	201	111.4 Å²	111.4	76%	0.758	59%	0.587	S	S	*	*	H	α-helix	trans	-66	-37.7	173.3	-79.2	-176.3	177.3	-170.6	0.4	113.3	E1826 Q1827 F1828 A1833 G1834	E1826-R1830 WeakPolarHBondContact O-CB 3.47Å; E1826-R1830 WeakPolarHBondContact O-CG 3.48Å; E1826-R1830 PolarHBondContact O-N 2.79Å; Q1827-R1830 PolarHBondContact O-N 3.22Å; F1828-R1830 PolarHBondContact O-N 2.92Å; R1830-A1833 PolarHBondContact O-N 3.11Å; R1830-G1834 PolarHBondContact O-N 3.14Å
1831	M	66.5	Low	56.9	Low	98 Å²	98	113.3 Å²	113.3	48%	0.483	60%	0.597	S	S	.	*	H	α-helix	trans	-65	-42.9	172.6	-75.9	-172.8	174	0	0	111.4	Q1827 F1828 A1833 G1834 C1835	Q1827-M1831 WeakPolarHBondContact O-CG 3.26Å; Q1827-M1831 PolarHBondContact O-N 2.81Å; F1828-M1831 PolarHBondContact O-N 3.01Å; M1831-A1833 VanDerWaalsContact C-N 3.35Å; M1831-A1833 PolarHBondContact O-N 2.9Å; M1831-G1834 PolarHBondContact O-N 3.07Å; M1831-C1835 WeakPolarHBondContact O-CB 3.39Å; M1831-C1835 PolarHBondContact O-N 3.33Å; M1831-C1835 PolarHBondContact O-SG 3.06Å
1832	M	54.1	Low	55.7	Low	119 Å²	119	115.2 Å²	115.2	59%	0.586	61%	0.608	S	S	*	*	H	α-helix	trans	-62.5	-39.6	175.6	-68.3	-82.2	-73.5	0	0	112.1	F1828 H1829	F1828-M1832 HydrophobicContact CD1-CG 4.11Å; F1828-M1832 HydrophobicContact CE1-CG 3.85Å; F1828-M1832 HydrophobicContact CE1-SD 4.2Å; F1828-M1832 HydrophobicContact CZ-CG 4.24Å; F1828-M1832 HydrophobicContact CZ-SD 4.18Å; F1828-M1832 WeakPolarHBondContact O-CG 3.45Å; F1828-M1832 PolarHBondContact O-N 3.23Å; H1829-M1832 PolarHBondContact O-N 3.19Å
1833	A	68.7	Low	54.5	Low	88 Å²	88	115.8 Å²	115.8	73%	0.727	61%	0.613	S	S	*	*	H	α-helix	trans	-76.1	-34	178.2	0	0	0	0	0	113.6	H1829 R1830 M1831	H1829-A1833 WeakPolarHBondContact O-CB 2.93Å; H1829-A1833 PolarHBondContact O-N 3.09Å; R1830-A1833 PolarHBondContact O-N 3.11Å; M1831-A1833 VanDerWaalsContact C-N 3.35Å; M1831-A1833 PolarHBondContact O-N 2.9Å
1834	G	53.3	Low	53.8	Low	66 Å²	66	119.6 Å²	119.6	68%	0.68	63%	0.631	S	S	*	*	H	α-helix	trans	-78.5	-26.6	179.3	0	0	0	0	0	114.2	R1830 M1831 G1836	R1830-G1834 PolarHBondContact O-N 3.14Å; M1831-G1834 PolarHBondContact O-N 3.07Å; G1834-G1836 VanDerWaalsContact C-N 3.29Å; G1834-G1836 PolarHBondContact O-N 3.46Å; G1834-G1836 VanDerWaalsContact O-N 3.07Å
1835	C	42.4	Very low	52.9	Low	97 Å²	97	120.4 Å²	120.4	66%	0.655	64%	0.638	S	S	*	*			trans	-86	62.9	179.2	-72	0	0	0	0	112.9	M1831 M1837	M1831-C1835 WeakPolarHBondContact O-CB 3.39Å; M1831-C1835 PolarHBondContact O-N 3.33Å; M1831-C1835 PolarHBondContact O-SG 3.06Å; C1835-M1837 VanDerWaalsContact C-N 3.35Å; C1835-M1837 PolarHBondContact O-N 3.11Å
1836	G	32.4	Very low	52.9	Low	78 Å²	78	116.9 Å²	116.9	80%	0.804	63%	0.629	S	S	*	*			trans	-63.5	88.7	168.7	0	0	0	0	0	112.1	G1834	G1834-G1836 VanDerWaalsContact C-N 3.29Å; G1834-G1836 PolarHBondContact O-N 3.46Å; G1834-G1836 VanDerWaalsContact O-N 3.07Å
1837	M	34.5	Very low	52.4	Low	136 Å²	136	115.8 Å²	115.8	67%	0.67	63%	0.631	S	S	*	*			trans	-124	121	169.6	-77	-141.5	-57.3	0	0	111	C1835 L1839	C1835-M1837 VanDerWaalsContact C-N 3.35Å; C1835-M1837 PolarHBondContact O-N 3.11Å; M1837-L1839 PolarHBondContact O-N 3.21Å
1838	E	33.6	Very low	52.3	Low	194 Å²	194	116.2 Å²	116.2	91%	0.907	64%	0.636	S	S	*	*			trans	-70.4	73.4	170.1	-63	-176	133	0	0	111.3	Y1840	E1838-Y1840 PolarHBondContact O-N 2.82Å
1839	L	37.2	Very low	52.4	Low	113 Å²	113	117.7 Å²	117.7	59%	0.592	65%	0.647	S	S	*	*			trans	-72.6	109.1	159.6	-84.2	166.3	0	0	0	108	M1837 S1841	M1837-L1839 PolarHBondContact O-N 3.21Å; L1839-S1841 WeakPolarHBondContact O-CA 3.47Å; L1839-S1841 WeakPolarHBondContact O-CB 3.16Å; L1839-S1841 PolarHBondContact O-N 3.05Å
1840	Y	35.6	Very low	52.4	Low	230 Å²	230	116.1 Å²	116.1	90%	0.902	64%	0.644	S	S	*	*			trans	-42.2	108.8	177.3	-93	-98.5	0	0	0	111.3	E1838 V1842	E1838-Y1840 PolarHBondContact O-N 2.82Å; Y1840-V1842 PolarHBondContact O-N 2.82Å
1841	S	40.9	Very low	52.6	Low	89 Å²	89	108.7 Å²	108.7	62%	0.622	63%	0.626	S	S	*	*			trans	-102.3	21.7	-149.6	45.8	0	0	0	0	114.6	L1839 S1845	L1839-S1841 WeakPolarHBondContact O-CA 3.47Å; L1839-S1841 WeakPolarHBondContact O-CB 3.16Å; L1839-S1841 PolarHBondContact O-N 3.05Å; S1841-S1845 VanDerWaalsContact O-CB 3.27Å; S1841-S1845 WeakPolarHBondContact O-CB 3.2Å; S1841-S1845 PolarHBondContact O-OG 2.98Å
1842	V	44.7	Very low	53.2	Low	124 Å²	124	106 Å²	106	75%	0.752	62%	0.622	S	S	*	*	S	Bend	trans	-80.8	-33.3	-169.8	-174.5	0	0	0	0	113.5	Y1840 S1845	Y1840-V1842 PolarHBondContact O-N 2.82Å; V1842-S1845 PolarHBondContact O-OG 2.71Å
1843	E	47.1	Very low	54.3	Low	155 Å²	155	102.9 Å²	102.9	72%	0.724	61%	0.608	S	S	*	*	S	Bend	trans	-97	-42.4	-175.2	-65.9	-173.1	155.1	0	0	113.9	S1845 H1846 N1849	E1843-S1845 VanDerWaalsContact C-N 3.3Å; E1843-S1845 PolarHBondContact O-N 3.27Å; E1843-H1846 PolarHBondContact O-N 3.25Å; E1843-N1849 PolarHBondContact O-ND2 3.46Å
1844	L	57.5	Low	54.4	Low	118 Å²	118	105.1 Å²	105.1	62%	0.618	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.6	-6.4	-177.4	-77.7	173.1	0	0	0	114.6	H1846 I1853	L1844-H1846 VanDerWaalsContact C-N 3.27Å; L1844-I1853 HydrophobicContact CD2-CD1 3.76Å
1845	S	51.1	Low	55.5	Low	83 Å²	83	106.8 Å²	106.8	58%	0.58	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.1	-18.5	171.3	46.1	0	0	0	0	113	S1841 V1842 E1843	S1841-S1845 VanDerWaalsContact O-CB 3.27Å; S1841-S1845 WeakPolarHBondContact O-CB 3.2Å; S1841-S1845 PolarHBondContact O-OG 2.98Å; V1842-S1845 PolarHBondContact O-OG 2.71Å; E1843-S1845 VanDerWaalsContact C-N 3.3Å; E1843-S1845 PolarHBondContact O-N 3.27Å
1846	H	62.2	Low	57.3	Low	100 Å²	100	104 Å²	104	46%	0.463	58%	0.581	S	S	.	*	S	Bend	trans	-80.3	123.2	178.5	-152.4	-83.8	0	0	0	111.2	E1843 L1844 L1848 N1849	E1843-H1846 PolarHBondContact O-N 3.25Å; L1844-H1846 VanDerWaalsContact C-N 3.27Å; H1846-L1848 PolarHBondContact O-N 3.14Å; H1846-L1848 VanDerWaalsContact O-N 3.16Å; H1846-N1849 PolarHBondContact O-N 2.72Å
1847	P	61.5	Low	59.3	Low	82 Å²	82	104.3 Å²	104.3	53%	0.532	56%	0.56	S	S	.	*	H	α-helix	trans	-61.9	-30.4	-173.3	22.3	-33	0	0	0	113.3	N1849 V1850 A1851	P1847-N1849 PolarHBondContact O-N 3.13Å; P1847-V1850 PolarHBondContact O-N 3.02Å; P1847-A1851 PolarHBondContact O-N 2.84Å
1848	L	68.6	Low	61.1	Low	122 Å²	122	102.5 Å²	102.5	64%	0.639	56%	0.557	S	S	*	*	H	α-helix	trans	-57.7	-32.9	173.1	-61.9	179.9	0	0	0	113.3	H1846 A1851 G1852	H1846-L1848 PolarHBondContact O-N 3.14Å; H1846-L1848 VanDerWaalsContact O-N 3.16Å; L1848-A1851 PolarHBondContact O-N 2.93Å; L1848-G1852 PolarHBondContact O-N 3.41Å
1849	N	70.6	Confident	63.2	Low	76 Å²	76	98.9 Å²	98.9	41%	0.406	54%	0.543	S	S	.	.	H	α-helix	trans	-76.7	-34.6	-179.8	-71.7	-23.8	0	0	0	111.5	E1843 H1846 P1847 G1852 I1853	E1843-N1849 PolarHBondContact O-ND2 3.46Å; H1846-N1849 PolarHBondContact O-N 2.72Å; P1847-N1849 PolarHBondContact O-N 3.13Å; N1849-G1852 PolarHBondContact O-N 3.46Å; N1849-I1853 WeakPolarHBondContact O-CG1 3.16Å; N1849-I1853 PolarHBondContact O-N 3.33Å; N1849-I1853 VanDerWaalsContact O-N 3.12Å
1850	V	70.2	Confident	65.1	Low	70 Å²	70	95.1 Å²	95.1	42%	0.424	53%	0.528	S	S	.	.	H	α-helix	trans	-65	-44.8	170	-176.9	0	0	0	0	110.4	P1847 G1852 I1853 F1854	P1847-V1850 PolarHBondContact O-N 3.02Å; V1850-G1852 PolarHBondContact O-N 3.25Å; V1850-I1853 PolarHBondContact O-N 3.29Å; V1850-F1854 HydrophobicContact CG1-CD2 4.32Å; V1850-F1854 PolarHBondContact O-N 3.41Å; V1850-F1854 VanDerWaalsContact O-N 3.1Å
1851	A	70.9	Confident	67	Low	45 Å²	45	86.8 Å²	86.8	37%	0.372	50%	0.504	S	S	.	.	H	α-helix	trans	-61.3	-43.2	175.2	0	0	0	0	0	112.2	P1847 L1848 I1853 F1854 I1855	P1847-A1851 PolarHBondContact O-N 2.84Å; L1848-A1851 PolarHBondContact O-N 2.93Å; A1851-I1853 VanDerWaalsContact C-N 3.33Å; A1851-I1853 PolarHBondContact O-N 3.01Å; A1851-F1854 PolarHBondContact O-N 3.4Å; A1851-F1854 VanDerWaalsContact O-N 3.15Å; A1851-I1855 VanDerWaalsContact O-CG1 3.32Å; A1851-I1855 WeakPolarHBondContact O-CG1 3.19Å; A1851-I1855 PolarHBondContact O-N 3.02Å
1852	G	80	Confident	68.5	Low	40 Å²	40	86.4 Å²	86.4	41%	0.412	50%	0.499	S	S	.	.	H	α-helix	trans	-59.3	-39.4	175.9	0	0	0	0	0	113.3	L1848 N1849 V1850 G1856	L1848-G1852 PolarHBondContact O-N 3.41Å; N1849-G1852 PolarHBondContact O-N 3.46Å; V1850-G1852 PolarHBondContact O-N 3.25Å; G1852-G1856 PolarHBondContact O-N 3.44Å
1853	I	76.4	Confident	70	Confident	55 Å²	55	88.9 Å²	88.9	28%	0.282	50%	0.496	S	S	.	.	H	α-helix	trans	-65.7	-42.9	174	-68.8	165.2	0	0	0	111.1	L1844 N1849 V1850 A1851 G1856 F1857	L1844-I1853 HydrophobicContact CD2-CD1 3.76Å; N1849-I1853 WeakPolarHBondContact O-CG1 3.16Å; N1849-I1853 PolarHBondContact O-N 3.33Å; N1849-I1853 VanDerWaalsContact O-N 3.12Å; V1850-I1853 PolarHBondContact O-N 3.29Å; A1851-I1853 VanDerWaalsContact C-N 3.33Å; A1851-I1853 PolarHBondContact O-N 3.01Å; I1853-G1856 PolarHBondContact O-N 2.92Å; I1853-F1857 HydrophobicContact CG2-CD2 4.15Å; I1853-F1857 HydrophobicContact CG2-CE2 4.49Å; I1853-F1857 PolarHBondContact O-N 3.33Å
1854	F	72.4	Confident	71.4	Confident	135 Å²	135	86.1 Å²	86.1	59%	0.592	49%	0.486	S	S	*	.	H	α-helix	trans	-64.7	-41.9	176.4	-98.6	-85.8	0	0	0	112.8	V1850 A1851 F1857 T1858	V1850-F1854 HydrophobicContact CG1-CD2 4.32Å; V1850-F1854 PolarHBondContact O-N 3.41Å; V1850-F1854 VanDerWaalsContact O-N 3.1Å; A1851-F1854 PolarHBondContact O-N 3.4Å; A1851-F1854 VanDerWaalsContact O-N 3.15Å; F1854-F1857 PolarHBondContact O-N 2.8Å; F1854-T1858 WeakPolarHBondContact O-CB 3.49Å; F1854-T1858 PolarHBondContact O-N 2.64Å; F1854-T1858 PolarHBondContact O-OG1 2.83Å
1855	I	76.3	Confident	72.1	Confident	101 Å²	101	90.1 Å²	90.1	52%	0.518	49%	0.493	S	S	.	.	H	α-helix	trans	-61.7	-45.9	173.6	-68.8	164.7	0	0	0	109.8	A1851 F1857 T1858 L1859	A1851-I1855 VanDerWaalsContact O-CG1 3.32Å; A1851-I1855 WeakPolarHBondContact O-CG1 3.19Å; A1851-I1855 PolarHBondContact O-N 3.02Å; I1855-F1857 PolarHBondContact O-N 2.82Å; I1855-T1858 PolarHBondContact O-N 3.34Å; I1855-L1859 HydrophobicContact CG2-CD1 3.76Å; I1855-L1859 HydrophobicContact CG2-CG 4.33Å; I1855-L1859 WeakPolarHBondContact O-CB 3.41Å; I1855-L1859 WeakPolarHBondContact O-CG 3.43Å; I1855-L1859 PolarHBondContact O-N 3.25Å
1856	G	79.9	Confident	73.3	Confident	37 Å²	37	89.2 Å²	89.2	38%	0.381	48%	0.484	S	S	.	.	H	α-helix	trans	-57.4	-47.8	176.1	0	0	0	0	0	113.4	G1852 I1853 T1858 L1859 A1860	G1852-G1856 PolarHBondContact O-N 3.44Å; I1853-G1856 PolarHBondContact O-N 2.92Å; G1856-T1858 PolarHBondContact O-N 3.45Å; G1856-L1859 PolarHBondContact O-N 2.91Å; G1856-A1860 VanDerWaalsContact O-CB 3.25Å; G1856-A1860 WeakPolarHBondContact O-CB 3.49Å; G1856-A1860 PolarHBondContact O-N 2.93Å
1857	F	75	Confident	73.8	Confident	85 Å²	85	89.7 Å²	89.7	37%	0.373	48%	0.482	S	S	.	.	H	α-helix	trans	-63.3	-39.8	175.1	-101.1	-79	0	0	0	112.7	Y1809 I1853 F1854 I1855 A1860 S1861 L1864	Y1809-F1857 HydrophobicContact CE1-CE2 4.26Å; I1853-F1857 HydrophobicContact CG2-CD2 4.15Å; I1853-F1857 HydrophobicContact CG2-CE2 4.49Å; I1853-F1857 PolarHBondContact O-N 3.33Å; F1854-F1857 PolarHBondContact O-N 2.8Å; I1855-F1857 PolarHBondContact O-N 2.82Å; F1857-A1860 PolarHBondContact O-N 3.36Å; F1857-S1861 PolarHBondContact O-N 3.29Å; F1857-L1864 HydrophobicContact CD1-CD1 4.41Å
1858	T	70.9	Confident	74.4	Confident	98 Å²	98	89.4 Å²	89.4	60%	0.601	48%	0.48	S	S	*	.	H	α-helix	trans	-65.7	-43.1	179.7	-56.9	0	0	0	0	111.3	F1854 I1855 G1856 S1861	F1854-T1858 WeakPolarHBondContact O-CB 3.49Å; F1854-T1858 PolarHBondContact O-N 2.64Å; F1854-T1858 PolarHBondContact O-OG1 2.83Å; I1855-T1858 PolarHBondContact O-N 3.34Å; G1856-T1858 PolarHBondContact O-N 3.45Å; T1858-S1861 WeakPolarHBondContact O-CB 2.98Å
1859	L	79	Confident	74.6	Confident	118 Å²	118	92 Å²	92	62%	0.618	48%	0.482	S	S	*	.	H	α-helix	trans	-69.6	-30.9	174.9	-67.6	172.3	0	0	0	112.9	I1855 G1856 P1862	I1855-L1859 HydrophobicContact CG2-CD1 3.76Å; I1855-L1859 HydrophobicContact CG2-CG 4.33Å; I1855-L1859 WeakPolarHBondContact O-CB 3.41Å; I1855-L1859 WeakPolarHBondContact O-CG 3.43Å; I1855-L1859 PolarHBondContact O-N 3.25Å; G1856-L1859 PolarHBondContact O-N 2.91Å; L1859-P1862 WeakPolarHBondContact O-CD 3.48Å
1860	A	76.4	Confident	74.7	Confident	34 Å²	34	92.8 Å²	92.8	28%	0.281	49%	0.486	S	S	.	.	H	α-helix	trans	-78.4	-24.7	177.4	0	0	0	0	0	113.9	G1856 F1857 P1862 Y1863 L1864	G1856-A1860 VanDerWaalsContact O-CB 3.25Å; G1856-A1860 WeakPolarHBondContact O-CB 3.49Å; G1856-A1860 PolarHBondContact O-N 2.93Å; F1857-A1860 PolarHBondContact O-N 3.36Å; A1860-P1862 VanDerWaalsContact C-CD 3.43Å; A1860-Y1863 PolarHBondContact O-N 2.62Å; A1860-L1864 HydrophobicContact CB-CD1 4.14Å; A1860-L1864 HydrophobicContact CB-CG 4.4Å; A1860-L1864 PolarHBondContact O-N 3.47Å
1861	S	76.4	Confident	74.7	Confident	56 Å²	56	92.5 Å²	92.5	39%	0.392	48%	0.482	S	S	.	.	H	α-helix	trans	-46.6	-43.8	-175.9	178.5	0	0	0	0	115.5	F1857 T1858 Y1863 L1864 R1865	F1857-S1861 PolarHBondContact O-N 3.29Å; T1858-S1861 WeakPolarHBondContact O-CB 2.98Å; S1861-Y1863 VanDerWaalsContact C-N 3.33Å; S1861-Y1863 PolarHBondContact O-N 2.93Å; S1861-L1864 PolarHBondContact O-N 2.8Å; S1861-R1865 PolarHBondContact O-N 2.91Å
1862	P	70.6	Confident	74.7	Confident	80 Å²	80	93.3 Å²	93.3	52%	0.519	49%	0.485	S	S	.	.	H	α-helix	trans	-63.5	-35.5	177	-22.2	35.1	0	0	0	113.7	L1859 A1860	L1859-P1862 WeakPolarHBondContact O-CD 3.48Å; A1860-P1862 VanDerWaalsContact C-CD 3.43Å
1863	Y	76.5	Confident	74.6	Confident	176 Å²	176	93.2 Å²	93.2	69%	0.69	48%	0.484	S	S	*	.	H	α-helix	trans	-79.4	-34.6	179.3	-57.6	-81.4	0	0	0	111.9	A1860 S1861 R1865 T1866 W1867	A1860-Y1863 PolarHBondContact O-N 2.62Å; S1861-Y1863 VanDerWaalsContact C-N 3.33Å; S1861-Y1863 PolarHBondContact O-N 2.93Å; Y1863-R1865 PolarHBondContact O-N 2.84Å; Y1863-T1866 PolarHBondContact O-N 3.2Å; Y1863-T1866 PolarHBondContact O-OG1 3.31Å; Y1863-T1866 VanDerWaalsContact O-OG1 3.04Å; Y1863-W1867 PolarHBondContact O-N 3.2Å
1864	L	76.6	Confident	74.3	Confident	98 Å²	98	95.3 Å²	95.3	51%	0.513	50%	0.495	S	S	.	.	H	α-helix	trans	-62.4	-29	172.3	-68.2	172	0	0	0	111.9	F1857 A1860 S1861	F1857-L1864 HydrophobicContact CD1-CD1 4.41Å; A1860-L1864 HydrophobicContact CB-CD1 4.14Å; A1860-L1864 HydrophobicContact CB-CG 4.4Å; A1860-L1864 PolarHBondContact O-N 3.47Å; S1861-L1864 PolarHBondContact O-N 2.8Å
1865	R	72.3	Confident	74.3	Confident	201 Å²	201	93.9 Å²	93.9	76%	0.758	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.3	-25.1	171.7	-77.2	-176.9	170.7	-175.1	-2	114.4	S1861 Y1863	S1861-R1865 PolarHBondContact O-N 2.91Å; Y1863-R1865 PolarHBondContact O-N 2.84Å
1866	T	77.7	Confident	74.2	Confident	64 Å²	64	95.4 Å²	95.4	39%	0.393	50%	0.5	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.1	-15.3	-179.1	58.2	0	0	0	0	113.9	Y1863 P1868 Y1869 I1870	Y1863-T1866 PolarHBondContact O-N 3.2Å; Y1863-T1866 PolarHBondContact O-OG1 3.31Å; Y1863-T1866 VanDerWaalsContact O-OG1 3.04Å; T1866-P1868 VanDerWaalsContact C-CD 3.43Å; T1866-P1868 VanDerWaalsContact O-N 3.16Å; T1866-Y1869 PolarHBondContact O-N 3.15Å; T1866-I1870 PolarHBondContact O-N 3.09Å
1867	W	72	Confident	73.8	Confident	110 Å²	110	98.1 Å²	98.1	42%	0.417	51%	0.513	S	S	.	.	H	α-helix	trans	-41.6	-46.9	176.5	160.4	-102	0	0	0	115.4	F1802 Y1863 Y1869 I1870 L1871	F1802-W1867 AromaticContact CE1-CH2 3.93Å; F1802-W1867 HydrophobicContact CE1-CH2 3.93Å; F1802-W1867 HydrophobicContact CE1-CZ3 4.08Å; F1802-W1867 HydrophobicContact CZ-CE3 4.46Å; F1802-W1867 AromaticContact CZ-CH2 3.88Å; F1802-W1867 HydrophobicContact CZ-CH2 3.88Å; F1802-W1867 AromaticContact CZ-CZ3 3.65Å; F1802-W1867 HydrophobicContact CZ-CZ3 3.65Å; Y1863-W1867 PolarHBondContact O-N 3.2Å; W1867-Y1869 VanDerWaalsContact C-N 3.29Å; W1867-Y1869 PolarHBondContact O-N 2.74Å; W1867-I1870 PolarHBondContact O-N 2.93Å; W1867-L1871 HydrophobicContact CH2-CD1 3.81Å; W1867-L1871 HydrophobicContact CH2-CD2 4.46Å; W1867-L1871 HydrophobicContact CZ2-CD1 4.02Å; W1867-L1871 HydrophobicContact CZ2-CD2 3.81Å; W1867-L1871 HydrophobicContact CZ2-CG 4.36Å; W1867-L1871 HydrophobicContact CZ3-CD1 4.36Å; W1867-L1871 WeakPolarHBondContact O-CB 3.43Å; W1867-L1871 PolarHBondContact O-N 3.23Å
1868	P	73.5	Confident	72.7	Confident	76 Å²	76	96 Å²	96	49%	0.494	51%	0.51	S	S	.	.	H	α-helix	trans	-61.2	-34.8	-179.3	-24.8	35.8	0	0	0	113.8	T1866 S1872	T1866-P1868 VanDerWaalsContact C-CD 3.43Å; T1866-P1868 VanDerWaalsContact O-N 3.16Å; P1868-S1872 VanDerWaalsContact O-CB 3.3Å; P1868-S1872 WeakPolarHBondContact O-CB 3.49Å; P1868-S1872 PolarHBondContact O-N 3.05Å
1869	Y	74.2	Confident	71.6	Confident	176 Å²	176	100.8 Å²	100.8	69%	0.69	53%	0.525	S	S	*	.	H	α-helix	trans	-73.6	-38.6	177.1	-60.7	-82.1	0	0	0	111.6	T1866 W1867 S1872 G1873	T1866-Y1869 PolarHBondContact O-N 3.15Å; W1867-Y1869 VanDerWaalsContact C-N 3.29Å; W1867-Y1869 PolarHBondContact O-N 2.74Å; Y1869-S1872 PolarHBondContact O-N 3.02Å; Y1869-G1873 PolarHBondContact O-N 2.92Å
1870	I	72.8	Confident	69.9	Low	93 Å²	93	100.6 Å²	100.6	48%	0.477	52%	0.523	S	S	.	.	H	α-helix	trans	-64.5	-44	175.6	-61.5	170.1	0	0	0	110.2	T1866 W1867 G1873 L1874	T1866-I1870 PolarHBondContact O-N 3.09Å; W1867-I1870 PolarHBondContact O-N 2.93Å; I1870-G1873 PolarHBondContact O-N 2.85Å; I1870-L1874 HydrophobicContact CG2-CD1 4.29Å; I1870-L1874 PolarHBondContact O-N 3.01Å
1871	L	70.2	Confident	68.1	Low	65 Å²	65	105.7 Å²	105.7	34%	0.34	55%	0.546	S	S	.	.	H	α-helix	trans	-66.4	-40.5	177.6	-165.9	68.9	0	0	0	111.7	W1867 L1874 M1875	W1867-L1871 HydrophobicContact CH2-CD1 3.81Å; W1867-L1871 HydrophobicContact CH2-CD2 4.46Å; W1867-L1871 HydrophobicContact CZ2-CD1 4.02Å; W1867-L1871 HydrophobicContact CZ2-CD2 3.81Å; W1867-L1871 HydrophobicContact CZ2-CG 4.36Å; W1867-L1871 HydrophobicContact CZ3-CD1 4.36Å; W1867-L1871 WeakPolarHBondContact O-CB 3.43Å; W1867-L1871 PolarHBondContact O-N 3.23Å; L1871-L1874 PolarHBondContact O-N 2.82Å; L1871-M1875 WeakPolarHBondContact O-CG 3.22Å; L1871-M1875 PolarHBondContact O-N 2.76Å
1872	S	70.9	Confident	66.4	Low	62 Å²	62	109.7 Å²	109.7	43%	0.434	56%	0.562	S	S	.	*	H	α-helix	trans	-60.7	-42.5	171.7	-176.6	0	0	0	0	111.9	P1868 Y1869 M1875 N1876	P1868-S1872 VanDerWaalsContact O-CB 3.3Å; P1868-S1872 WeakPolarHBondContact O-CB 3.49Å; P1868-S1872 PolarHBondContact O-N 3.05Å; Y1869-S1872 PolarHBondContact O-N 3.02Å; S1872-M1875 PolarHBondContact O-N 3.31Å; S1872-N1876 VanDerWaalsContact O-CB 3.31Å; S1872-N1876 WeakPolarHBondContact O-CB 3.14Å; S1872-N1876 VanDerWaalsContact O-CG 3.31Å; S1872-N1876 PolarHBondContact O-N 3.47Å; S1872-N1876 PolarHBondContact O-ND2 2.9Å; S1872-N1876 PolarHBondContact OG-ND2 3.35Å
1873	G	76.1	Confident	64.9	Low	38 Å²	38	114.5 Å²	114.5	39%	0.392	58%	0.575	S	S	.	*	H	α-helix	trans	-61.7	-41.6	174.1	0	0	0	0	0	113.4	Y1869 I1870 S1877	Y1869-G1873 PolarHBondContact O-N 2.92Å; I1870-G1873 PolarHBondContact O-N 2.85Å; G1873-S1877 WeakPolarHBondContact O-CB 3.2Å; G1873-S1877 PolarHBondContact O-N 3.38Å; G1873-S1877 VanDerWaalsContact O-N 3.11Å; G1873-S1877 PolarHBondContact O-OG 3.28Å
1874	L	70.6	Confident	63.1	Low	98 Å²	98	112.2 Å²	112.2	51%	0.513	58%	0.575	S	S	.	*	H	α-helix	trans	-67.6	-42	175.8	-82.5	164.5	0	0	0	112.8	I1870 L1871 S1877 S1878	I1870-L1874 HydrophobicContact CG2-CD1 4.29Å; I1870-L1874 PolarHBondContact O-N 3.01Å; L1871-L1874 PolarHBondContact O-N 2.82Å; L1874-S1877 PolarHBondContact O-N 2.88Å; L1874-S1877 PolarHBondContact O-OG 2.64Å; L1874-S1878 WeakPolarHBondContact O-CB 3.35Å; L1874-S1878 PolarHBondContact O-N 2.67Å; L1874-S1878 PolarHBondContact O-OG 2.88Å
1875	M	73	Confident	61.3	Low	105 Å²	105	110.5 Å²	110.5	52%	0.517	57%	0.57	S	S	.	*	H	α-helix	trans	-67.3	-39.9	176.3	-69.7	-62.6	-155.5	0	0	112	L1871 S1872 S1877	L1871-M1875 WeakPolarHBondContact O-CG 3.22Å; L1871-M1875 PolarHBondContact O-N 2.76Å; S1872-M1875 PolarHBondContact O-N 3.31Å; M1875-S1877 VanDerWaalsContact C-N 3.28Å; M1875-S1877 PolarHBondContact O-N 2.97Å
1876	N	73.2	Confident	60	Low	133 Å²	133	108.1 Å²	108.1	71%	0.711	57%	0.571	S	S	*	*	H	α-helix	trans	-73.8	-14.6	177.2	-72.6	-41	0	0	0	114	S1872	S1872-N1876 VanDerWaalsContact O-CB 3.31Å; S1872-N1876 WeakPolarHBondContact O-CB 3.14Å; S1872-N1876 VanDerWaalsContact O-CG 3.31Å; S1872-N1876 PolarHBondContact O-N 3.47Å; S1872-N1876 PolarHBondContact O-ND2 2.9Å; S1872-N1876 PolarHBondContact OG-ND2 3.35Å
1877	S	71.4	Confident	58.5	Low	94 Å²	94	115.3 Å²	115.3	66%	0.657	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.6	2.2	178.7	56.5	0	0	0	0	114.2	G1873 L1874 M1875	G1873-S1877 WeakPolarHBondContact O-CB 3.2Å; G1873-S1877 PolarHBondContact O-N 3.38Å; G1873-S1877 VanDerWaalsContact O-N 3.11Å; G1873-S1877 PolarHBondContact O-OG 3.28Å; L1874-S1877 PolarHBondContact O-N 2.88Å; L1874-S1877 PolarHBondContact O-OG 2.64Å; M1875-S1877 VanDerWaalsContact C-N 3.28Å; M1875-S1877 PolarHBondContact O-N 2.97Å
1878	S	51.6	Low	57.5	Low	42 Å²	42	115 Å²	115	29%	0.294	59%	0.592	S	S	.	*			trans	-133	124	-179.9	64.5	0	0	0	0	112.3	L1874 I1880	L1874-S1878 WeakPolarHBondContact O-CB 3.35Å; L1874-S1878 PolarHBondContact O-N 2.67Å; L1874-S1878 PolarHBondContact O-OG 2.88Å; S1878-I1880 PolarHBondContact O-N 2.91Å
1879	E	48.7	Very low	56.4	Low	198 Å²	198	117.4 Å²	117.4	93%	0.925	60%	0.599	S	S	*	*			trans	-74.6	35.4	179.3	-59.1	-175.3	137.4	0	0	112.8	N1881	E1879-N1881 PolarHBondContact O-N 2.82Å
1880	I	43.6	Very low	55.3	Low	114 Å²	114	116 Å²	116	59%	0.585	60%	0.603	S	S	*	*			trans	-82.6	86.8	-172.3	-60.6	173.7	0	0	0	109.5	S1878 L1882	S1878-I1880 PolarHBondContact O-N 2.91Å; I1880-L1882 VanDerWaalsContact C-N 3.31Å; I1880-L1882 HydrophobicContact CG2-CD1 4.27Å; I1880-L1882 HydrophobicContact CG2-CG 3.99Å; I1880-L1882 PolarHBondContact O-N 3.29Å
1881	N	39.1	Very low	54.6	Low	141 Å²	141	120 Å²	120	75%	0.754	61%	0.613	S	S	*	*			trans	-66.1	89.8	162.7	-75.2	-68.4	0	0	0	109.7	E1879 F1883	E1879-N1881 PolarHBondContact O-N 2.82Å; N1881-F1883 PolarHBondContact O-N 2.84Å; N1881-F1883 VanDerWaalsContact O-N 3.1Å
1882	L	40.4	Very low	54.1	Low	140 Å²	140	121.5 Å²	121.5	73%	0.733	63%	0.626	S	S	*	*			trans	-70.6	99.5	174.3	-102.9	156.8	0	0	0	110.2	I1880	I1880-L1882 VanDerWaalsContact C-N 3.31Å; I1880-L1882 HydrophobicContact CG2-CD1 4.27Å; I1880-L1882 HydrophobicContact CG2-CG 3.99Å; I1880-L1882 PolarHBondContact O-N 3.29Å
1883	F	39.1	Very low	54	Low	181 Å²	181	124.8 Å²	124.8	79%	0.794	64%	0.637	S	S	*	*	P	Polyproline II helix	trans	-63.3	136.7	172.3	-86.6	-100.2	0	0	0	111.3	N1881 P1885	N1881-F1883 PolarHBondContact O-N 2.84Å; N1881-F1883 VanDerWaalsContact O-N 3.1Å; F1883-P1885 VanDerWaalsContact O-CD 3.3Å; F1883-P1885 WeakPolarHBondContact O-CD 3.5Å
1884	N	38.1	Very low	53.4	Low	128 Å²	128	126.1 Å²	126.1	68%	0.684	64%	0.635	S	S	*	*	P	Polyproline II helix	trans	-59.9	119.1	-178.8	-121.2	7.7	0	0	0	111.9
1885	P	38	Very low	53	Low	62 Å²	62	126.9 Å²	126.9	40%	0.403	64%	0.636	S	S	.	*	P	Polyproline II helix	trans	-75.9	133.9	167.6	-9.9	27.6	0	0	0	109.9	F1883 Y1887	F1883-P1885 VanDerWaalsContact O-CD 3.3Å; F1883-P1885 WeakPolarHBondContact O-CD 3.5Å; P1885-Y1887 PolarHBondContact O-N 2.85Å
1886	L	45	Very low	52.4	Low	150 Å²	150	128.7 Å²	128.7	79%	0.785	64%	0.643	S	S	*	*	G	3₁₀ helix	trans	-60.4	-14.3	-179.6	-111.2	73.6	0	0	0	115	W1888 I1889	L1886-W1888 VanDerWaalsContact C-N 3.27Å; L1886-W1888 PolarHBondContact O-N 3.19Å; L1886-I1889 WeakPolarHBondContact O-CD1 3.08Å
1887	Y	46.9	Very low	52.4	Low	216 Å²	216	126.4 Å²	126.4	85%	0.847	63%	0.63	S	S	*	*	G	3₁₀ helix	trans	-78.5	7	-172.7	-73.2	-81.4	0	0	0	115.6	P1885	P1885-Y1887 PolarHBondContact O-N 2.85Å
1888	W	51.9	Low	52.6	Low	104 Å²	104	122.7 Å²	122.7	39%	0.394	61%	0.607	S	S	.	*	G	3₁₀ helix	trans	-93.5	-3.8	-176.6	-73.5	12.3	0	0	0	114.7	L1886 D1890	L1886-W1888 VanDerWaalsContact C-N 3.27Å; L1886-W1888 PolarHBondContact O-N 3.19Å; W1888-D1890 PolarHBondContact O-N 3.24Å
1889	I	49.5	Very low	53.6	Low	126 Å²	126	123.6 Å²	123.6	65%	0.646	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.9	-35.3	-168.1	-63.8	171.1	0	0	0	113.1	L1886 R1891	L1886-I1889 WeakPolarHBondContact O-CD1 3.08Å; I1889-R1891 PolarHBondContact O-N 3.19Å
1890	D	51.7	Low	54.5	Low	147 Å²	147	119.4 Å²	119.4	79%	0.786	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.8	19.1	-169	-55.2	-52.3	0	0	0	115.3	W1888	W1888-D1890 PolarHBondContact O-N 3.24Å
1891	R	58.2	Low	56.1	Low	177 Å²	177	118.2 Å²	118.2	67%	0.668	59%	0.59	S	S	*	*			trans	-139.8	102.8	-179.5	-68.8	-171.2	-176.8	-101.9	-2.5	112.6	I1889 I1893 L1894 E1895	I1889-R1891 PolarHBondContact O-N 3.19Å; R1891-I1893 VanDerWaalsContact C-N 3.27Å; R1891-I1893 PolarHBondContact O-N 2.93Å; R1891-I1893 VanDerWaalsContact O-N 3.11Å; R1891-L1894 HydrophobicContact CB-CB 4.21Å; R1891-L1894 HydrophobicContact CB-CD1 4.15Å; R1891-L1894 HydrophobicContact CB-CG 4.32Å; R1891-L1894 WeakPolarHBondContact O-CA 3.44Å; R1891-L1894 PolarHBondContact O-N 2.82Å; R1891-E1895 PolarHBondContact O-N 2.77Å
1892	P	58.2	Low	57.3	Low	96 Å²	96	119.8 Å²	119.8	62%	0.623	59%	0.586	S	S	*	*	H	α-helix	trans	-63.2	-26.2	-171	22.9	-33.9	0	0	0	114.5	E1895 H1896	P1892-E1895 PolarHBondContact O-N 2.69Å; P1892-H1896 WeakPolarHBondContact O-CB 3.1Å; P1892-H1896 PolarHBondContact O-N 3.28Å
1893	I	70.3	Confident	58.9	Low	131 Å²	131	118 Å²	118	67%	0.672	58%	0.577	S	S	*	*	H	α-helix	trans	-68.5	-38.8	173.1	-63.8	175.3	0	0	0	111.3	R1891 H1896 I1897	R1891-I1893 VanDerWaalsContact C-N 3.27Å; R1891-I1893 PolarHBondContact O-N 2.93Å; R1891-I1893 VanDerWaalsContact O-N 3.11Å; I1893-H1896 PolarHBondContact O-N 2.84Å; I1893-I1897 HydrophobicContact CG2-CD1 4.05Å; I1893-I1897 VanDerWaalsContact O-CG1 3.29Å; I1893-I1897 WeakPolarHBondContact O-CG1 3.25Å; I1893-I1897 PolarHBondContact O-N 3.31Å
1894	L	62.3	Low	59.7	Low	65 Å²	65	113.9 Å²	113.9	34%	0.34	56%	0.562	S	S	.	*	H	α-helix	trans	-74.9	-32.7	175.7	-70.1	177.3	0	0	0	111.6	R1891 I1897 G1898	R1891-L1894 HydrophobicContact CB-CB 4.21Å; R1891-L1894 HydrophobicContact CB-CD1 4.15Å; R1891-L1894 HydrophobicContact CB-CG 4.32Å; R1891-L1894 WeakPolarHBondContact O-CA 3.44Å; R1891-L1894 PolarHBondContact O-N 2.82Å; L1894-I1897 PolarHBondContact O-N 2.65Å; L1894-G1898 PolarHBondContact O-N 3.18Å
1895	E	62	Low	60.3	Low	115 Å²	115	112 Å²	112	54%	0.537	56%	0.557	S	S	.	*	H	α-helix	trans	-60.5	-48	168.8	-172.2	-178.2	-161.5	0	0	110.9	R1891 P1892 I1897 G1898 C1899	R1891-E1895 PolarHBondContact O-N 2.77Å; P1892-E1895 PolarHBondContact O-N 2.69Å; E1895-I1897 PolarHBondContact O-N 2.76Å; E1895-G1898 CarbonylContact O-C 3.57Å; E1895-G1898 WeakPolarHBondContact O-CA 3.3Å; E1895-G1898 PolarHBondContact O-N 3.26Å; E1895-G1898 VanDerWaalsContact O-N 3.16Å; E1895-C1899 PolarHBondContact O-N 3.49Å; E1895-C1899 PolarHBondContact O-SG 3.25Å
1896	H	60.9	Low	60.8	Low	142 Å²	142	112.8 Å²	112.8	66%	0.657	56%	0.564	S	S	*	*	H	α-helix	trans	-61.3	-43.4	176.6	-116.8	59.6	0	0	0	112.9	P1892 I1893 G1898 C1899 L1900	P1892-H1896 WeakPolarHBondContact O-CB 3.1Å; P1892-H1896 PolarHBondContact O-N 3.28Å; I1893-H1896 PolarHBondContact O-N 2.84Å; H1896-G1898 VanDerWaalsContact C-N 3.34Å; H1896-C1899 PolarHBondContact O-N 2.67Å; H1896-L1900 WeakPolarHBondContact O-CB 3.41Å; H1896-L1900 PolarHBondContact O-N 2.9Å
1897	I	73.3	Confident	60.9	Low	85 Å²	85	109.5 Å²	109.5	44%	0.436	55%	0.553	S	S	.	*	H	α-helix	trans	-63.8	-41.1	174.5	-69.8	166.3	0	0	0	110.5	I1893 L1894 E1895 L1900 L1901	I1893-I1897 HydrophobicContact CG2-CD1 4.05Å; I1893-I1897 VanDerWaalsContact O-CG1 3.29Å; I1893-I1897 WeakPolarHBondContact O-CG1 3.25Å; I1893-I1897 PolarHBondContact O-N 3.31Å; L1894-I1897 PolarHBondContact O-N 2.65Å; E1895-I1897 PolarHBondContact O-N 2.76Å; I1897-L1900 PolarHBondContact O-N 2.92Å; I1897-L1901 HydrophobicContact CG2-CD1 3.9Å; I1897-L1901 HydrophobicContact CG2-CG 4.41Å; I1897-L1901 WeakPolarHBondContact O-CB 2.98Å; I1897-L1901 VanDerWaalsContact O-CG 3.31Å; I1897-L1901 WeakPolarHBondContact O-CG 3.18Å; I1897-L1901 PolarHBondContact O-N 3.27Å
1898	G	76.5	Confident	60.9	Low	17 Å²	17	105.7 Å²	105.7	18%	0.175	55%	0.547	C	S	.	.	H	α-helix	trans	-60.4	-47.3	174.8	0	0	0	0	0	112.3	L1894 E1895 H1896 L1900 L1901 Y1902	L1894-G1898 PolarHBondContact O-N 3.18Å; E1895-G1898 CarbonylContact O-C 3.57Å; E1895-G1898 WeakPolarHBondContact O-CA 3.3Å; E1895-G1898 PolarHBondContact O-N 3.26Å; E1895-G1898 VanDerWaalsContact O-N 3.16Å; H1896-G1898 VanDerWaalsContact C-N 3.34Å; G1898-L1900 PolarHBondContact O-N 2.71Å; G1898-L1901 PolarHBondContact O-N 3.43Å; G1898-Y1902 VanDerWaalsContact O-CB 3.28Å; G1898-Y1902 WeakPolarHBondContact O-CB 3.2Å; G1898-Y1902 PolarHBondContact O-N 3.38Å
1899	C	71.5	Confident	60.4	Low	61 Å²	61	111.4 Å²	111.4	41%	0.412	57%	0.568	S	S	.	*	H	α-helix	trans	-60.1	-43.6	174.2	-68.8	0	0	0	0	112	E1895 H1896 Y1902 I1903	E1895-C1899 PolarHBondContact O-N 3.49Å; E1895-C1899 PolarHBondContact O-SG 3.25Å; H1896-C1899 PolarHBondContact O-N 2.67Å; C1899-Y1902 PolarHBondContact O-N 2.71Å; C1899-Y1902 VanDerWaalsContact O-N 3.17Å; C1899-I1903 WeakPolarHBondContact O-CB 3.07Å; C1899-I1903 WeakPolarHBondContact O-CD1 3.46Å; C1899-I1903 VanDerWaalsContact O-CG1 3.23Å; C1899-I1903 WeakPolarHBondContact O-CG1 3.28Å; C1899-I1903 PolarHBondContact O-N 2.58Å
1900	L	68.7	Low	59.7	Low	109 Å²	109	114.7 Å²	114.7	57%	0.571	57%	0.572	S	S	*	*	H	α-helix	trans	-66	-41	179.7	-154.5	158.7	0	0	0	111.1	H1896 I1897 G1898 Y1902 I1903 L1904	H1896-L1900 WeakPolarHBondContact O-CB 3.41Å; H1896-L1900 PolarHBondContact O-N 2.9Å; I1897-L1900 PolarHBondContact O-N 2.92Å; G1898-L1900 PolarHBondContact O-N 2.71Å; L1900-Y1902 VanDerWaalsContact C-N 3.34Å; L1900-I1903 PolarHBondContact O-N 2.94Å; L1900-L1904 HydrophobicContact CD2-CD1 3.86Å; L1900-L1904 HydrophobicContact CD2-CG 4.38Å; L1900-L1904 WeakPolarHBondContact O-CG 3.39Å; L1900-L1904 PolarHBondContact O-N 3.02Å; L1900-L1904 VanDerWaalsContact O-N 3.12Å
1901	L	76.6	Confident	58.9	Low	89 Å²	89	118.6 Å²	118.6	47%	0.466	58%	0.576	S	S	.	*	H	α-helix	trans	-66.8	-29.3	171.4	-71.6	171.9	0	0	0	113.4	I1897 G1898 P1905	I1897-L1901 HydrophobicContact CG2-CD1 3.9Å; I1897-L1901 HydrophobicContact CG2-CG 4.41Å; I1897-L1901 WeakPolarHBondContact O-CB 2.98Å; I1897-L1901 VanDerWaalsContact O-CG 3.31Å; I1897-L1901 WeakPolarHBondContact O-CG 3.18Å; I1897-L1901 PolarHBondContact O-N 3.27Å; G1898-L1901 PolarHBondContact O-N 3.43Å; L1901-P1905 WeakPolarHBondContact O-CD 3.38Å
1902	Y	63.5	Low	57.6	Low	174 Å²	174	115.1 Å²	115.1	68%	0.682	58%	0.579	S	S	*	*	H	α-helix	trans	-78.5	-33.7	177.1	-163.9	-92.2	0	0	0	112.4	G1898 C1899 L1900 S1906	G1898-Y1902 VanDerWaalsContact O-CB 3.28Å; G1898-Y1902 WeakPolarHBondContact O-CB 3.2Å; G1898-Y1902 PolarHBondContact O-N 3.38Å; C1899-Y1902 PolarHBondContact O-N 2.71Å; C1899-Y1902 VanDerWaalsContact O-N 3.17Å; L1900-Y1902 VanDerWaalsContact C-N 3.34Å; Y1902-S1906 WeakPolarHBondContact O-CB 3.15Å; Y1902-S1906 PolarHBondContact O-OG 2.72Å
1903	I	74	Confident	56.3	Low	104 Å²	104	117 Å²	117	53%	0.533	59%	0.588	S	S	.	*	H	α-helix	trans	-74.4	-31.4	176.7	-69.2	163.8	0	0	0	111.5	C1899 L1900 S1906 S1907	C1899-I1903 WeakPolarHBondContact O-CB 3.07Å; C1899-I1903 WeakPolarHBondContact O-CD1 3.46Å; C1899-I1903 VanDerWaalsContact O-CG1 3.23Å; C1899-I1903 WeakPolarHBondContact O-CG1 3.28Å; C1899-I1903 PolarHBondContact O-N 2.58Å; L1900-I1903 PolarHBondContact O-N 2.94Å; I1903-S1906 PolarHBondContact O-N 3.1Å; I1903-S1907 WeakPolarHBondContact O-CB 3.18Å; I1903-S1907 PolarHBondContact O-N 2.73Å; I1903-S1907 PolarHBondContact O-OG 3.5Å
1904	L	57.4	Low	54.4	Low	94 Å²	94	116.5 Å²	116.5	49%	0.492	59%	0.592	S	S	.	*	H	α-helix	trans	-57.4	-52.8	-178.4	-90.7	164.5	0	0	0	114	L1900 S1907	L1900-L1904 HydrophobicContact CD2-CD1 3.86Å; L1900-L1904 HydrophobicContact CD2-CG 4.38Å; L1900-L1904 WeakPolarHBondContact O-CG 3.39Å; L1900-L1904 PolarHBondContact O-N 3.02Å; L1900-L1904 VanDerWaalsContact O-N 3.12Å; L1904-S1907 PolarHBondContact O-OG 2.67Å; L1904-S1907 VanDerWaalsContact O-OG 3.14Å
1905	P	49.8	Very low	53.1	Low	89 Å²	89	119.3 Å²	119.3	58%	0.578	61%	0.606	S	S	*	*	H	α-helix	trans	-66.1	-38.4	172.9	-22.2	33.1	0	0	0	112.9	L1901 S1907 I1908	L1901-P1905 WeakPolarHBondContact O-CD 3.38Å; P1905-S1907 VanDerWaalsContact C-N 3.32Å; P1905-S1907 PolarHBondContact O-N 3.35Å; P1905-I1908 PolarHBondContact O-N 2.72Å
1906	S	48.7	Very low	51.6	Low	77 Å²	77	118.7 Å²	118.7	54%	0.538	61%	0.609	S	S	.	*	H	α-helix	trans	-65.5	-33.6	-174.5	-59.2	0	0	0	0	112.9	Y1902 I1903 I1908	Y1902-S1906 WeakPolarHBondContact O-CB 3.15Å; Y1902-S1906 PolarHBondContact O-OG 2.72Å; I1903-S1906 PolarHBondContact O-N 3.1Å; S1906-I1908 VanDerWaalsContact C-N 3.31Å; S1906-I1908 PolarHBondContact O-N 2.84Å
1907	S	46.8	Very low	50.4	Low	81 Å²	81	116.6 Å²	116.6	57%	0.566	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.9	-7.4	-178.1	54.4	0	0	0	0	114.6	I1903 L1904 P1905 R1909	I1903-S1907 WeakPolarHBondContact O-CB 3.18Å; I1903-S1907 PolarHBondContact O-N 2.73Å; I1903-S1907 PolarHBondContact O-OG 3.5Å; L1904-S1907 PolarHBondContact O-OG 2.67Å; L1904-S1907 VanDerWaalsContact O-OG 3.14Å; P1905-S1907 VanDerWaalsContact C-N 3.32Å; P1905-S1907 PolarHBondContact O-N 3.35Å; S1907-R1909 PolarHBondContact O-N 3.44Å
1908	I	48.3	Very low	48.6	Very low	137 Å²	137	116.3 Å²	116.3	70%	0.703	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.3	-11.6	-179.5	-65.9	172.2	0	0	0	112.4	P1905 S1906	P1905-I1908 PolarHBondContact O-N 2.72Å; S1906-I1908 VanDerWaalsContact C-N 3.31Å; S1906-I1908 PolarHBondContact O-N 2.84Å
1909	R	41	Very low	46.5	Very low	223 Å²	223	123.9 Å²	123.9	84%	0.842	64%	0.637	S	S	*	*	S	Bend	trans	-97.4	95.1	175.7	-86.6	-170.8	168.2	-167.8	-2.4	114.9	S1907	S1907-R1909 PolarHBondContact O-N 3.44Å
1910	W	34.3	Very low	45.1	Very low	196 Å²	196	128.9 Å²	128.9	74%	0.742	65%	0.654	S	S	*	*	S	Bend	trans	67.8	114.5	144.2	-74.7	61.9	0	0	0	120.5	S1912	W1910-S1912 PolarHBondContact O-N 2.92Å
1911	R	35.4	Very low	43.6	Very low	229 Å²	229	130.3 Å²	130.3	86%	0.864	66%	0.658	S	S	*	*	S	Bend	trans	68.5	-6	141.1	-69.6	-168.8	173.8	-171.3	-4.2	121.5
1912	S	30.4	Very low	41.7	Very low	104 Å²	104	133.6 Å²	133.6	73%	0.727	67%	0.665	S	S	*	*			trans	-102.4	119.5	178.7	-60.4	0	0	0	0	113.2	W1910 V1914	W1910-S1912 PolarHBondContact O-N 2.92Å; S1912-V1914 PolarHBondContact O-N 3.38Å; S1912-V1914 VanDerWaalsContact O-N 3.13Å
1913	T	31.6	Very low	40.4	Very low	134 Å²	134	130.2 Å²	130.2	82%	0.822	67%	0.665	S	S	*	*			trans	-76.3	92	171.8	41.2	0	0	0	0	111.2	I1915	T1913-I1915 PolarHBondContact O-N 2.55Å
1914	V	30.4	Very low	38.8	Very low	122 Å²	122	135.2 Å²	135.2	74%	0.739	68%	0.677	S	S	*	*			trans	-79.7	98.5	167.4	-177.6	0	0	0	0	108.8	S1912 V1916	S1912-V1914 PolarHBondContact O-N 3.38Å; S1912-V1914 VanDerWaalsContact O-N 3.13Å; V1914-V1916 HydrophobicContact CG1-CG2 4.21Å; V1914-V1916 PolarHBondContact O-N 2.8Å
1915	I	33.7	Very low	37.8	Very low	124 Å²	124	134.5 Å²	134.5	64%	0.636	68%	0.68	S	S	*	*			trans	-83.8	102.8	177.4	-51.5	179.8	0	0	0	109.1	T1913 N1917	T1913-I1915 PolarHBondContact O-N 2.55Å; I1915-N1917 VanDerWaalsContact C-N 3.28Å; I1915-N1917 WeakPolarHBondContact CG2-OD1 3.39Å; I1915-N1917 PolarHBondContact O-N 2.89Å
1916	V	31.4	Very low	37.2	Very low	101 Å²	101	138.4 Å²	138.4	61%	0.612	70%	0.695	S	S	*	*			trans	-79.9	75.2	176.6	-173.3	0	0	0	0	109.8	V1914 S1918	V1914-V1916 HydrophobicContact CG1-CG2 4.21Å; V1914-V1916 PolarHBondContact O-N 2.8Å; V1916-S1918 WeakPolarHBondContact CG1-OG 3.19Å; V1916-S1918 PolarHBondContact O-N 2.61Å
1917	N	35.8	Very low	36.8	Very low	98 Å²	98	138.8 Å²	138.8	52%	0.524	70%	0.703	S	S	.	*	G	3₁₀ helix	trans	-67.7	-12.9	-177.8	-86.7	-17.8	0	0	0	114.8	I1915 F1919 Q1920	I1915-N1917 VanDerWaalsContact C-N 3.28Å; I1915-N1917 WeakPolarHBondContact CG2-OD1 3.39Å; I1915-N1917 PolarHBondContact O-N 2.89Å; N1917-F1919 PolarHBondContact O-N 2.83Å; N1917-Q1920 PolarHBondContact O-N 2.65Å; N1917-Q1920 VanDerWaalsContact O-N 3.16Å
1918	S	34.5	Very low	36.2	Very low	79 Å²	79	141.5 Å²	141.5	55%	0.552	71%	0.711	S	S	*	*	G	3₁₀ helix	trans	-59.1	-39.3	-170.4	48.6	0	0	0	0	114.2	V1916 Q1920	V1916-S1918 WeakPolarHBondContact CG1-OG 3.19Å; V1916-S1918 PolarHBondContact O-N 2.61Å; S1918-Q1920 PolarHBondContact O-N 2.91Å
1919	F	33.5	Very low	35.5	Very low	176 Å²	176	140.1 Å²	140.1	77%	0.772	71%	0.711	S	S	*	*	G	3₁₀ helix	trans	-69.5	-16.5	-179.1	-83.8	-80.9	0	0	0	114.4	N1917	N1917-F1919 PolarHBondContact O-N 2.83Å
1920	Q	42	Very low	35.2	Very low	166 Å²	166	137.4 Å²	137.4	78%	0.776	71%	0.712	S	S	*	*	G	3₁₀ helix	trans	-90.6	-3.8	-173.9	-145.7	175	21.1	0	0	114	N1917 S1918	N1917-Q1920 PolarHBondContact O-N 2.65Å; N1917-Q1920 VanDerWaalsContact O-N 3.16Å; S1918-Q1920 PolarHBondContact O-N 2.91Å
1921	Q	37.4	Very low	35.5	Very low	139 Å²	139	136.6 Å²	136.6	65%	0.65	72%	0.717	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.5	-33.4	-176.8	-68.6	-175	-29.3	0	0	114.5
1922	Y	35.6	Very low	35.6	Very low	159 Å²	159	133.5 Å²	133.5	62%	0.624	72%	0.716	S	S	*	*			trans	-140.3	69.9	-174.9	-66.8	-81.9	0	0	0	114.9	W1924 S1925	Y1922-W1924 PolarHBondContact O-N 2.93Å; Y1922-S1925 WeakPolarHBondContact CB-OG 3.07Å; Y1922-S1925 PolarHBondContact O-OG 2.89Å
1923	P	36.6	Very low	35.6	Very low	103 Å²	103	134.3 Å²	134.3	67%	0.669	72%	0.722	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.8	-20.6	167.7	27.4	-35.3	0	0	0	113.4
1924	W	40.5	Very low	35.8	Very low	209 Å²	209	131.7 Å²	131.7	79%	0.792	71%	0.709	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.5	-16.7	-174.7	-16.6	75.6	0	0	0	115	Y1922 L1926	Y1922-W1924 PolarHBondContact O-N 2.93Å; W1924-L1926 PolarHBondContact O-N 2.9Å
1925	S	37.1	Very low	36	Very low	78 Å²	78	131.2 Å²	131.2	55%	0.545	71%	0.711	S	S	.	*	T	Hydrogen-bonded Turn	trans	-87.8	8.1	-156.4	65.2	0	0	0	0	116.9	Y1922	Y1922-S1925 WeakPolarHBondContact CB-OG 3.07Å; Y1922-S1925 PolarHBondContact O-OG 2.89Å
1926	L	36.1	Very low	36.2	Very low	172 Å²	172	126.9 Å²	126.9	90%	0.901	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.5	0	-176.9	-84	163.2	0	0	0	114.4	W1924	W1924-L1926 PolarHBondContact O-N 2.9Å
1927	A	39.9	Very low	36.5	Very low	85 Å²	85	127.5 Å²	127.5	70%	0.702	70%	0.696	S	S	*	*	S	Bend	trans	-96.8	-16.3	-176.7	0	0	0	0	0	114.7
1928	N	34.9	Very low	36.3	Very low	138 Å²	138	124.8 Å²	124.8	74%	0.738	69%	0.685	S	S	*	*			trans	-96.7	118.4	174.2	-82	-1.8	0	0	0	110.4	L1930	N1928-L1930 PolarHBondContact O-N 3.3Å
1929	P	34	Very low	36.4	Very low	107 Å²	107	128.6 Å²	128.6	70%	0.695	70%	0.698	S	S	*	*			trans	-62.2	134.2	155	28.8	-32.1	0	0	0	108.5	E1931	P1929-E1931 VanDerWaalsContact C-N 3.26Å; P1929-E1931 PolarHBondContact O-N 3.17Å
1930	L	34.7	Very low	36.2	Very low	167 Å²	167	129.5 Å²	129.5	87%	0.874	73%	0.726	S	S	*	*			trans	-75.4	83.4	167.6	-77.7	95.6	0	0	0	108.9	N1928 L1932	N1928-L1930 PolarHBondContact O-N 3.3Å; L1930-L1932 PolarHBondContact O-N 2.95Å
1931	E	39.2	Very low	35.9	Very low	179 Å²	179	127.7 Å²	127.7	84%	0.836	72%	0.724	S	S	*	*			trans	-67.1	128.8	160.2	-66.5	-148.3	138.2	0	0	109.1	P1929 S1933	P1929-E1931 VanDerWaalsContact C-N 3.26Å; P1929-E1931 PolarHBondContact O-N 3.17Å; E1931-S1933 PolarHBondContact O-N 3.43Å
1932	L	37.3	Very low	35.8	Very low	163 Å²	163	127.1 Å²	127.1	85%	0.853	73%	0.728	S	S	*	*			trans	-70.3	121.7	-163.4	-72.7	130.3	0	0	0	111.4	L1930 S1934	L1930-L1932 PolarHBondContact O-N 2.95Å; L1932-S1934 PolarHBondContact O-N 3.27Å
1933	S	31.2	Very low	35.9	Very low	121 Å²	121	125.3 Å²	125.3	85%	0.846	73%	0.733	S	S	*	*			trans	-60.8	95.5	166.9	57.1	0	0	0	0	110.5	E1931	E1931-S1933 PolarHBondContact O-N 3.43Å
1934	S	36.9	Very low	35.8	Very low	79 Å²	79	126.6 Å²	126.6	55%	0.552	74%	0.737	S	S	*	*			trans	-99.4	118.1	166.3	39.5	0	0	0	0	107.8	L1932	L1932-S1934 PolarHBondContact O-N 3.27Å
1935	S	34.7	Very low	35.5	Very low	113 Å²	113	121.4 Å²	121.4	79%	0.79	73%	0.734	S	S	*	*			trans	-110.6	103.5	-161.8	56.9	0	0	0	0	112.5
1936	S	37.2	Very low	35.4	Very low	33 Å²	33	124.3 Å²	124.3	23%	0.231	75%	0.746	C	S	.	*			trans	-166.6	139.2	160	47.8	0	0	0	0	108.5	D1131 M1132	D1131-S1936 WeakPolarHBondContact CA-O 3.23Å; D1131-S1936 WeakPolarHBondContact CB-O 3.21Å; D1131-S1936 VanDerWaalsContact CG-OG 3.26Å; D1131-S1936 WeakPolarHBondContact OD1-CB 3.1Å; D1131-S1936 PolarHBondContact OD1-OG 3.46Å; D1131-S1936 WeakPolarHBondContact OD2-CB 3.32Å; D1131-S1936 PolarHBondContact OD2-OG 3.01Å; M1132-S1936 PolarHBondContact N-O 3.2Å
1937	T	37.4	Very low	35.4	Very low	113 Å²	113	120.9 Å²	120.9	69%	0.693	74%	0.735	S	S	*	*	B	Isolated β-bridge	cis	107	33.9	24.1	68.1	0	0	0	0	119.5	D1131	D1131-T1937 WeakPolarHBondContact OD2-CA 3Å; D1131-T1937 PolarHBondContact OD2-N 3.37Å
1938	S	31.9	Very low	35	Very low	41 Å²	41	123.7 Å²	123.7	29%	0.287	74%	0.738	S	S	.	*			trans	59.1	123.7	143.2	64.3	0	0	0	0	121.5	D1131 K1133	D1131-S1938 VanDerWaalsContact CB-N 3.35Å; D1131-S1938 PolarHBondContact OD2-N 3.33Å; D1131-S1938 VanDerWaalsContact OD2-N 3.1Å; K1133-S1938 PolarHBondContact NZ-OG 3.19Å
1939	L	36.7	Very low	35	Very low	159 Å²	159	122.5 Å²	122.5	83%	0.832	74%	0.738	S	S	*	*			trans	-159.4	45.7	148.9	-118.4	167.5	0	0	0	118.1
1940	S	29	Very low	35.1	Very low	195 Å²	195	123.9 Å²	123.9	100%	1.364	74%	0.742	S	S	*	*			trans	-151.9	0	151.9	71.4	0	0	0	0	112

Retrieved 1,940 of 1,940 residues in 1529.1 ms (Link to these results)

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