A0A096LZY3_POEFO Loading...

Family with sequence similarity 131 member Ab

AlphaFold DB , UniProt , Accession A0A096LZY3, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 345 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] 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
1M43.2Very low62.3Low239 Ų239152.7 Ų152.7100%1.17778%0.781SS**  0123.40-62.8-160.68000107.1
2L39.8Very low64.2Low162 Ų162153.7 Ų153.785%0.84878%0.779SS**PPolyproline II helixtrans-73.3147.3-177.4-75.679.5000111.1
3P50.2Low65.7Low125 Ų125147.5 Ų147.581%0.81275%0.746SS**PPolyproline II helixtrans-63.6137.8165.629.2-33.1000109.3
4K49.9Very low66.3Low195 Ų195143.5 Ų143.585%0.84873%0.726SS**PPolyproline II helixtrans-68.7140.4176.3-70163.3179.7167.40109R6K4-R6 PolarHBondContact O-N 2.95Å
5S49.3Very low67Low113 Ų113136.1 Ų136.179%0.7970%0.696SS**PPolyproline II helixtrans-53.2136.6174.761.20000110.4R7S5-R7 VanDerWaalsContact C-N 3.31Å; S5-R7 PolarHBondContact O-N 3.07Å
6R63.3Low67.3Low247 Ų247130.4 Ų130.493%0.93268%0.675SS**  trans-73.689.5179-70.5-177.6-176.8-102.54.2108.5K4 A8K4-R6 PolarHBondContact O-N 2.95Å; R6-A8 PolarHBondContact O-N 3.3Å
7R73.9Confident67.5Low191 Ų191128.8 Ų128.872%0.72167%0.667SS**PPolyproline II helixtrans-49.8129.2166.3-169.1-174.6-53.9100.95.9108.1S5 L9S5-R7 VanDerWaalsContact C-N 3.31Å; S5-R7 PolarHBondContact O-N 3.07Å; R7-L9 PolarHBondContact O-N 3.4Å; R7-L9 VanDerWaalsContact O-N 3.16Å
8A74.9Confident67.3Low90 Ų90125.7 Ų125.774%0.74466%0.663SS**PPolyproline II helixtrans-52.8123.417500000109R6 T10R6-A8 PolarHBondContact O-N 3.3Å; A8-T10 PolarHBondContact O-N 3Å
9L78.1Confident67.2Low96 Ų96127.9 Ų127.950%0.50366%0.662SS.*PPolyproline II helixtrans-69.8125.1-178-62178.3000108.6R7 E13 I14 L17R7-L9 PolarHBondContact O-N 3.4Å; R7-L9 VanDerWaalsContact O-N 3.16Å; L9-E13 HydrophobicContact CB-CB 4.22Å; L9-E13 HydrophobicContact CD2-CB 4.28Å; L9-I14 HydrophobicContact CB-CD1 4.24Å; L9-I14 HydrophobicContact CB-CG1 3.62Å; L9-I14 HydrophobicContact CD1-CG1 4.39Å; L9-I14 WeakPolarHBondContact O-CD1 3.45Å; L9-L17 HydrophobicContact CD1-CD2 4.3Å
10T83Confident66.7Low73 Ų73125.2 Ų125.245%0.44865%0.654SS.*PPolyproline II helixtrans-62.2156.817159.80000110.3A8 Q12 E13 I14A8-T10 PolarHBondContact O-N 3Å; T10-Q12 PolarHBondContact O-N 3.26Å; T10-Q12 VanDerWaalsContact O-N 3.11Å; T10-E13 WeakPolarHBondContact CB-OE2 3.42Å; T10-E13 WeakPolarHBondContact CG2-OE2 3.32Å; T10-E13 PolarHBondContact N-OE2 2.73Å; T10-E13 WeakPolarHBondContact O-CA 3.31Å; T10-E13 PolarHBondContact O-N 3.28Å; T10-E13 VanDerWaalsContact OG1-CG 3.3Å; T10-E13 WeakPolarHBondContact OG1-CG 3.31Å; T10-E13 PolarHBondContact OG1-N 2.79Å; T10-E13 PolarHBondContact OG1-OE2 3.5Å; T10-I14 WeakPolarHBondContact O-CG1 3.26Å; T10-I14 PolarHBondContact O-N 3.41Å
11I79.8Confident66.2Low149 Ų149122.8 Ų122.876%0.76465%0.648SS**Hα-helixtrans-54.6-34.6176.7-61.8170.5000110.9A15I11-A15 VanDerWaalsContact O-CB 3.23Å; I11-A15 WeakPolarHBondContact O-CB 3.27Å; I11-A15 PolarHBondContact O-N 3.47Å
12Q85.4Confident66.6Low164 Ų164117.8 Ų117.877%0.76663%0.625SS**Hα-helixtrans-68.3-38.6175.1-68.7-174.9-30.100113.1T10 A16T10-Q12 PolarHBondContact O-N 3.26Å; T10-Q12 VanDerWaalsContact O-N 3.11Å; Q12-A16 WeakPolarHBondContact O-CB 3.44Å; Q12-A16 PolarHBondContact O-N 3.35Å
13E82.8Confident67.1Low73 Ų73118.6 Ų118.634%0.34163%0.625SS.*Hα-helixtrans-70.1-38.9173.7-73163.612700112.1L9 T10 A16 L17L9-E13 HydrophobicContact CB-CB 4.22Å; L9-E13 HydrophobicContact CD2-CB 4.28Å; T10-E13 WeakPolarHBondContact CB-OE2 3.42Å; T10-E13 WeakPolarHBondContact CG2-OE2 3.32Å; T10-E13 PolarHBondContact N-OE2 2.73Å; T10-E13 WeakPolarHBondContact O-CA 3.31Å; T10-E13 PolarHBondContact O-N 3.28Å; T10-E13 VanDerWaalsContact OG1-CG 3.3Å; T10-E13 WeakPolarHBondContact OG1-CG 3.31Å; T10-E13 PolarHBondContact OG1-N 2.79Å; T10-E13 PolarHBondContact OG1-OE2 3.5Å; E13-A16 PolarHBondContact O-N 3.33Å; E13-L17 VanDerWaalsContact O-CB 3.31Å; E13-L17 WeakPolarHBondContact O-CB 3.34Å; E13-L17 PolarHBondContact O-N 3.36Å
14I74.1Confident67.2Low92 Ų92115.7 Ų115.747%0.47262%0.617SS.*Hα-helixtrans-62.7-47173.7-63.2170.4000110L9 T10 A16 L17 A18L9-I14 HydrophobicContact CB-CD1 4.24Å; L9-I14 HydrophobicContact CB-CG1 3.62Å; L9-I14 HydrophobicContact CD1-CG1 4.39Å; L9-I14 WeakPolarHBondContact O-CD1 3.45Å; T10-I14 WeakPolarHBondContact O-CG1 3.26Å; T10-I14 PolarHBondContact O-N 3.41Å; I14-A16 VanDerWaalsContact C-N 3.34Å; I14-A16 PolarHBondContact O-N 3.06Å; I14-L17 PolarHBondContact O-N 3.49Å; I14-A18 WeakPolarHBondContact O-CB 3.11Å; I14-A18 PolarHBondContact O-N 3.48Å
15A76.8Confident67.5Low33 Ų33110.5 Ų110.527%0.27360%0.598SS.*Hα-helixtrans-65.7-35.3176.200000112.3I11 R19I11-A15 VanDerWaalsContact O-CB 3.23Å; I11-A15 WeakPolarHBondContact O-CB 3.27Å; I11-A15 PolarHBondContact O-N 3.47Å; A15-R19 VanDerWaalsContact O-CG 3.31Å; A15-R19 WeakPolarHBondContact O-CG 3.39Å; A15-R19 PolarHBondContact O-N 3.42Å; A15-R19 VanDerWaalsContact O-N 3.12Å; A15-R19 PolarHBondContact O-NE 3.5Å
16A72.7Confident67.8Low44 Ų44108.3 Ų108.336%0.36458%0.583SS.*Hα-helixtrans-66.1-42.1172.800000111.7Q12 E13 I14 R19 S20Q12-A16 WeakPolarHBondContact O-CB 3.44Å; Q12-A16 PolarHBondContact O-N 3.35Å; E13-A16 PolarHBondContact O-N 3.33Å; I14-A16 VanDerWaalsContact C-N 3.34Å; I14-A16 PolarHBondContact O-N 3.06Å; A16-R19 PolarHBondContact O-N 3.01Å; A16-S20 WeakPolarHBondContact O-CB 3.22Å; A16-S20 PolarHBondContact O-N 3.4Å; A16-S20 PolarHBondContact O-OG 2.9Å
17L70.9Confident67.3Low104 Ų104102 Ų10255%0.54556%0.564SS.*Hα-helixtrans-64.2-44.2177.8-175.764.4000111.9L9 E13 I14 R19 S20 S21L9-L17 HydrophobicContact CD1-CD2 4.3Å; E13-L17 VanDerWaalsContact O-CB 3.31Å; E13-L17 WeakPolarHBondContact O-CB 3.34Å; E13-L17 PolarHBondContact O-N 3.36Å; I14-L17 PolarHBondContact O-N 3.49Å; L17-R19 VanDerWaalsContact C-N 3.32Å; L17-R19 PolarHBondContact O-N 3.29Å; L17-S20 WeakPolarHBondContact CA-OG 3.3Å; L17-S20 PolarHBondContact O-N 2.84Å; L17-S20 PolarHBondContact O-OG 3.48Å; L17-S21 PolarHBondContact O-N 3.15Å
18A64.2Low66.4Low72 Ų7297.8 Ų97.860%0.59556%0.559SS**Hα-helixtrans-58.7-42.6174.200000111.7I14I14-A18 WeakPolarHBondContact O-CB 3.11Å; I14-A18 PolarHBondContact O-N 3.48Å
19R65.5Low65.6Low169 Ų16997.5 Ų97.564%0.63855%0.548SS*.Hα-helixtrans-73.2-33.9175.9-68.9-176-56.9-109.5-0.7113.5A15 A16 L17A15-R19 VanDerWaalsContact O-CG 3.31Å; A15-R19 WeakPolarHBondContact O-CG 3.39Å; A15-R19 PolarHBondContact O-N 3.42Å; A15-R19 VanDerWaalsContact O-N 3.12Å; A15-R19 PolarHBondContact O-NE 3.5Å; A16-R19 PolarHBondContact O-N 3.01Å; L17-R19 VanDerWaalsContact C-N 3.32Å; L17-R19 PolarHBondContact O-N 3.29Å
20S56.2Low64.7Low72 Ų7298.4 Ų98.450%0.50355%0.547SS..Hα-helixtrans-73.5-28.7179.564.50000112.9A16 L17 L22A16-S20 WeakPolarHBondContact O-CB 3.22Å; A16-S20 PolarHBondContact O-N 3.4Å; A16-S20 PolarHBondContact O-OG 2.9Å; L17-S20 WeakPolarHBondContact CA-OG 3.3Å; L17-S20 PolarHBondContact O-N 2.84Å; L17-S20 PolarHBondContact O-OG 3.48Å; S20-L22 PolarHBondContact O-N 2.86Å
21S55.4Low63.6Low75 Ų75100.4 Ų100.452%0.52456%0.556SS.*Hα-helixtrans-59.2-29.8177.5-167.70000113.1L17 H23 G24L17-S21 PolarHBondContact O-N 3.15Å; S21-H23 PolarHBondContact O-N 3.26Å; S21-H23 VanDerWaalsContact O-N 3.14Å; S21-G24 PolarHBondContact O-N 3.5Å
22L51.5Low62.6Low134 Ų13496.9 Ų96.970%0.70254%0.536SS*.THydrogen-bonded Turntrans-65.3-21-173.2-164.662.7000114.6S20S20-L22 PolarHBondContact O-N 2.86Å
23H51.6Low61.4Low180 Ų18091.6 Ų91.683%0.83352%0.515SS*.THydrogen-bonded Turntrans-99.5-3.4176.2-65.986.9000113.5S21S21-H23 PolarHBondContact O-N 3.26Å; S21-H23 VanDerWaalsContact O-N 3.14Å
24G53Low60.3Low64 Ų6490.1 Ų90.166%0.6651%0.511SS*.THydrogen-bonded Turntrans-106.5-2-174.200000115.3S21 S26S21-G24 PolarHBondContact O-N 3.5Å; G24-S26 PolarHBondContact O-N 2.95Å
25I55Low59.7Low86 Ų8694.6 Ų94.644%0.44153%0.527SS..  trans-68.8105.7177.3-49.3176.3000108.2Q27 V29 K30I25-Q27 PolarHBondContact O-N 2.9Å; I25-V29 HydrophobicContact CG2-CB 4.15Å; I25-V29 HydrophobicContact CG2-CG1 4.36Å; I25-K30 HydrophobicContact CG2-CB 4.32Å
26S55.2Low58.8Low67 Ų6796.9 Ų96.947%0.46954%0.539SS..  trans-49.5135173.9176.40000110G24 V28 V29 K30G24-S26 PolarHBondContact O-N 2.95Å; S26-V28 PolarHBondContact O-N 3.08Å; S26-V28 PolarHBondContact OG-N 2.7Å; S26-V29 PolarHBondContact O-N 3.36Å; S26-K30 PolarHBondContact O-N 3.32Å
27Q54.2Low58.2Low114 Ų11498 Ų9853%0.53354%0.541SS..Hα-helixtrans-50.6-30.7178.5-174.674.710.300111.6I25 V29 K30 D31I25-Q27 PolarHBondContact O-N 2.9Å; Q27-V29 PolarHBondContact O-N 2.93Å; Q27-K30 PolarHBondContact O-N 3.31Å; Q27-D31 PolarHBondContact O-N 2.9Å
28V54.2Low57.7Low103 Ų10397.2 Ų97.262%0.62455%0.549SS*.Hα-helixtrans-61.5-38.6175.1-177.60000113.2S26 H32S26-V28 PolarHBondContact O-N 3.08Å; S26-V28 PolarHBondContact OG-N 2.7Å; V28-H32 PolarHBondContact O-CE1 3.36Å; V28-H32 PolarHBondContact O-ND1 2.88Å
29V58.4Low57.3Low83 Ų8398.9 Ų98.950%0.50355%0.546SS..Hα-helixtrans-81.8-34.8179.2-179.10000110.9I25 S26 Q27 D31 H32 V33I25-V29 HydrophobicContact CG2-CB 4.15Å; I25-V29 HydrophobicContact CG2-CG1 4.36Å; S26-V29 PolarHBondContact O-N 3.36Å; Q27-V29 PolarHBondContact O-N 2.93Å; V29-D31 PolarHBondContact O-N 3.49Å; V29-H32 PolarHBondContact O-N 2.89Å; V29-V33 PolarHBondContact O-N 3.39Å
30K58.8Low56.8Low115 Ų11594.9 Ų94.950%0.555%0.549SS..Hα-helixtrans-57.9-32.4-179.9176.1176.9158.2-165.30113.5I25 S26 Q27 H32 V33I25-K30 HydrophobicContact CG2-CB 4.32Å; S26-K30 PolarHBondContact O-N 3.32Å; Q27-K30 PolarHBondContact O-N 3.31Å; K30-H32 VanDerWaalsContact C-N 3.27Å; K30-H32 PolarHBondContact O-N 3.24Å; K30-V33 PolarHBondContact O-N 3.42Å
31D59.4Low57.1Low116 Ų11699 Ų9962%0.6256%0.561SS**THydrogen-bonded Turntrans-75.4-13.6176.2-66.1-18000113.5Q27 V29Q27-D31 PolarHBondContact O-N 2.9Å; V29-D31 PolarHBondContact O-N 3.49Å
32H58.6Low57.5Low75 Ų7599.1 Ų99.135%0.34757%0.574SS.*THydrogen-bonded Turntrans-102-8176.1-60.485.3000113.4V28 V29 K30 T34 E49V28-H32 PolarHBondContact O-CE1 3.36Å; V28-H32 PolarHBondContact O-ND1 2.88Å; V29-H32 PolarHBondContact O-N 2.89Å; K30-H32 VanDerWaalsContact C-N 3.27Å; K30-H32 PolarHBondContact O-N 3.24Å; H32-T34 PolarHBondContact O-N 2.9Å; H32-E49 PolarHBondContact O-N 3.48Å
33V60.3Low57.9Low53 Ų53100.1 Ų100.132%0.32157%0.568SS.*BIsolated β-bridgetrans-78.9112.8167.9177.40000106.6V29 K30V29-V33 PolarHBondContact O-N 3.39Å; K30-V33 PolarHBondContact O-N 3.42Å
34T61Low58.5Low42 Ų4295.8 Ų95.826%0.25855%0.554SS.*  trans-63.5155.7177.775.70000109.6H32 L47 E49H32-T34 PolarHBondContact O-N 2.9Å; T34-L47 WeakPolarHBondContact CB-O 3.44Å; T34-L47 HydrophobicContact CG2-CB 3.93Å; T34-L47 WeakPolarHBondContact CG2-O 3.45Å; T34-L47 PolarHBondContact N-O 3.27Å; T34-L47 VanDerWaalsContact OG1-CB 3.26Å; T34-L47 WeakPolarHBondContact OG1-CB 3.24Å; T34-L47 PolarHBondContact OG1-O 2.92Å; T34-E49 HydrophobicContact CG2-CG 4.33Å
35K61.1Low59Low186 Ų18694.1 Ų94.181%0.80953%0.534SS*.  trans-51.9143168.3-66.8178.7-179175.90109.3T37K35-T37 PolarHBondContact O-N 3.12Å
36P58.2Low59.3Low81 Ų8196.1 Ų96.153%0.52654%0.541SS..  trans-54.1115.7178.219.6-31.3000109.9A38 V44P36-A38 PolarHBondContact O-N 3.2Å; P36-V44 HydrophobicContact CB-CG1 3.38Å
37T60Low59.8Low68 Ų6897.7 Ų97.742%0.41754%0.544SS..EExtended strand (participates in β ladder)trans-81.6105.4175.4-56.50000107.1K35 M39 A45K35-T37 PolarHBondContact O-N 3.12Å; T37-M39 PolarHBondContact O-N 3.32Å; T37-A45 PolarHBondContact N-O 3.37Å; T37-A45 PolarHBondContact O-N 3.45Å; T37-A45 VanDerWaalsContact O-N 3.16Å
38A60.1Low60.1Low86 Ų8697.2 Ų97.271%0.71154%0.544SS*.EExtended strand (participates in β ladder)trans-66.8118.4173.100000109.2P36P36-A38 PolarHBondContact O-N 3.2Å
39M55Low60.4Low107 Ų10796.4 Ų96.453%0.52753%0.533SS..PPolyproline II helixtrans-96.1158.3171.4-58.7-178.769.500109.5T37 R43 A45T37-M39 PolarHBondContact O-N 3.32Å; M39-R43 WeakPolarHBondContact CB-O 3.36Å; M39-R43 PolarHBondContact N-O 3.44Å; M39-A45 HydrophobicContact CG-CB 4.49Å; M39-A45 HydrophobicContact SD-CB 3.9Å
40A56.3Low60.3Low85 Ų85102.9 Ų102.970%0.70255%0.549SS*.SBendtrans-57.6150.5172.400000111
41Q62.9Low60.1Low160 Ų160105 Ų10575%0.74856%0.558SS**SBendtrans69.932.6-172.7-48.3165.8-53.200115R43Q41-R43 PolarHBondContact O-N 3.01Å
42G62.6Low60.1Low77 Ų77102.6 Ų102.679%0.79456%0.56SS**SBendtrans71.25.916900000115.7
43R61Low59.7Low155 Ų155110 Ų11059%0.58559%0.585SS**  trans-81.9122.5178.3-69.2-175-76.2179.5-7.5110.2M39 Q41M39-R43 WeakPolarHBondContact CB-O 3.36Å; M39-R43 PolarHBondContact N-O 3.44Å; Q41-R43 PolarHBondContact O-N 3.01Å
44V62.9Low59.4Low88 Ų88112.7 Ų112.753%0.53361%0.605SS.*EExtended strand (participates in β ladder)trans-98.9116174174.30000108.9P36P36-V44 HydrophobicContact CB-CG1 3.38Å
45A63.4Low59.2Low30 Ų30119.1 Ų119.125%0.24863%0.63CS.*EExtended strand (participates in β ladder)trans-98.1133.5172.100000110.3T37 M39T37-A45 PolarHBondContact N-O 3.37Å; T37-A45 PolarHBondContact O-N 3.45Å; T37-A45 VanDerWaalsContact O-N 3.16Å; M39-A45 HydrophobicContact CG-CB 4.49Å; M39-A45 HydrophobicContact SD-CB 3.9Å
46H61.6Low58.9Low127 Ų127115.3 Ų115.359%0.58862%0.624SS**  trans-93.5106.4166.7-71.2-98.5000108.3
47L65.1Low58.7Low101 Ų101119.6 Ų119.653%0.52964%0.639SS.*  trans-75.8128.4164.1-96.165.6000107.9T34T34-L47 WeakPolarHBondContact CB-O 3.44Å; T34-L47 HydrophobicContact CG2-CB 3.93Å; T34-L47 WeakPolarHBondContact CG2-O 3.45Å; T34-L47 PolarHBondContact N-O 3.27Å; T34-L47 VanDerWaalsContact OG1-CB 3.26Å; T34-L47 WeakPolarHBondContact OG1-CB 3.24Å; T34-L47 PolarHBondContact OG1-O 2.92Å
48I62.2Low58.6Low103 Ų103120.8 Ų120.853%0.52864%0.643SS.*BIsolated β-bridgetrans-100117.3161.9-62.9174.9000104.8W50I48-W50 PolarHBondContact O-N 3.42Å; I48-W50 VanDerWaalsContact O-N 3.17Å
49E60.2Low58.7Low86 Ų86121 Ų12140%0.40264%0.636SS.*  trans-73108.4172.547.2166.1-159.300109H32 T34 K51H32-E49 PolarHBondContact O-N 3.48Å; T34-E49 HydrophobicContact CG2-CG 4.33Å; E49-K51 PolarHBondContact O-N 2.93Å; E49-K51 IonicContact OE1-NZ 2.73Å
50W55.3Low59Low219 Ų219120.9 Ų120.983%0.8364%0.643SS**  trans-73.267.9175-76.570.2000110.4I48 G52I48-W50 PolarHBondContact O-N 3.42Å; I48-W50 VanDerWaalsContact O-N 3.17Å; W50-G52 PolarHBondContact O-N 3.22Å
51K55.6Low59.2Low161 Ų161120.5 Ų120.570%0.764%0.639SS**THydrogen-bonded Turntrans-78.163.5-177.3-158.6174.6-169.2167.10110.7E49E49-K51 PolarHBondContact O-N 2.93Å; E49-K51 IonicContact OE1-NZ 2.73Å
52G58.2Low59Low64 Ų64114.6 Ų114.666%0.6662%0.618SS**THydrogen-bonded Turntrans-169.6-1.3-172.900000115.6W50 C54W50-G52 PolarHBondContact O-N 3.22Å; G52-C54 PolarHBondContact O-N 3.05Å; G52-C54 VanDerWaalsContact O-N 3.13Å
53W51.3Low58.9Low230 Ų230114.9 Ų114.987%0.87160%0.601SS**SBendtrans-64.3118164.4-146.4-74.4000107.6K55W53-K55 PolarHBondContact O-N 3.17Å; W53-K55 VanDerWaalsContact O-N 3.11Å
54C52.8Low59Low111 Ų111114 Ų11475%0.7560%0.603SS**PPolyproline II helixtrans-59.2121.1-176-69.30000108.6G52G52-C54 PolarHBondContact O-N 3.05Å; G52-C54 VanDerWaalsContact O-N 3.13Å
55K56.9Low59.1Low176 Ų176113.3 Ų113.377%0.76560%0.603SS**PPolyproline II helixtrans-60.1138.8160-66.2179.5178.5-179.90106.3W53 M57W53-K55 PolarHBondContact O-N 3.17Å; W53-K55 VanDerWaalsContact O-N 3.11Å; K55-M57 PolarHBondContact O-N 3.48Å
56P56.1Low59.2Low107 Ų107116.9 Ų116.970%0.69562%0.618SS**PPolyproline II helixtrans-48.5119.2167.1-25.934.9000108.1D58P56-D58 PolarHBondContact O-N 3.14Å
57M52.2Low59.4Low171 Ų171118.4 Ų118.484%0.84262%0.623SS**  trans-84-1-174.9-80.4-72.9-70.800111.8K55K55-M57 PolarHBondContact O-N 3.48Å
58D58.2Low59.8Low93 Ų93118.5 Ų118.550%0.49762%0.624SS.*SBendtrans-77.9128.4-176.9-47.5-60.7000109.5P56 L63P56-D58 PolarHBondContact O-N 3.14Å; D58-L63 HydrophobicContact CB-CD1 4.37Å; D58-L63 HydrophobicContact CB-CD2 3.94Å; D58-L63 HydrophobicContact CB-CG 3.89Å
59T63.8Low60.5Low91 Ų91116.9 Ų116.956%0.55862%0.622SS**  trans-66.1147.9173.355.20000108.8A61 A62 L63T59-A61 PolarHBondContact O-N 3.04Å; T59-A62 WeakPolarHBondContact O-CB 3.3Å; T59-A62 PolarHBondContact O-N 3.37Å; T59-L63 PolarHBondContact O-N 2.97Å
60P60.4Low61.5Low103 Ų103117 Ų11767%0.66962%0.619SS**Hα-helixtrans-57.3-29.8-175.519.9-32.1000113.2A62 L63 E64P60-A62 PolarHBondContact O-N 3.15Å; P60-L63 PolarHBondContact O-N 3.29Å; P60-E64 PolarHBondContact O-N 3.45Å
61A60.1Low62.9Low77 Ų77110.3 Ų110.364%0.63661%0.606SS**Hα-helixtrans-69.7-25.3174.900000114.5T59T59-A61 PolarHBondContact O-N 3.04Å
62A59.6Low64.5Low37 Ų37109.6 Ų109.631%0.30661%0.61SS.*Hα-helixtrans-74.3-45.2173.200000110.5T59 P60 E64 S65 D66T59-A62 WeakPolarHBondContact O-CB 3.3Å; T59-A62 PolarHBondContact O-N 3.37Å; P60-A62 PolarHBondContact O-N 3.15Å; A62-E64 VanDerWaalsContact C-N 3.34Å; A62-E64 PolarHBondContact O-N 3.44Å; A62-S65 WeakPolarHBondContact O-CB 3.3Å; A62-S65 PolarHBondContact O-N 2.86Å; A62-S65 VanDerWaalsContact O-N 3.08Å; A62-D66 PolarHBondContact O-N 2.66Å; A62-D66 VanDerWaalsContact O-N 3.12Å
63L60.2Low66.1Low82 Ų82107.8 Ų107.843%0.42959%0.585SS.*Hα-helixtrans-60.8-38.5178.4-67.9173000112.8D58 T59 P60 S65 D66 F67D58-L63 HydrophobicContact CB-CD1 4.37Å; D58-L63 HydrophobicContact CB-CD2 3.94Å; D58-L63 HydrophobicContact CB-CG 3.89Å; T59-L63 PolarHBondContact O-N 2.97Å; P60-L63 PolarHBondContact O-N 3.29Å; L63-S65 VanDerWaalsContact C-N 3.33Å; L63-S65 PolarHBondContact O-N 3.19Å; L63-D66 PolarHBondContact O-N 3Å; L63-F67 WeakPolarHBondContact O-CB 3.49Å; L63-F67 PolarHBondContact O-N 3.12Å
64E62.4Low68.1Low136 Ų136101 Ų10164%0.63657%0.569SS**Hα-helixtrans-67.7-31.1175.2-73.6-171.7-173.200113.2P60 A62 N68P60-E64 PolarHBondContact O-N 3.45Å; A62-E64 VanDerWaalsContact C-N 3.34Å; A62-E64 PolarHBondContact O-N 3.44Å; E64-N68 WeakPolarHBondContact O-CB 3.41Å; E64-N68 PolarHBondContact O-N 2.95Å; E64-N68 VanDerWaalsContact O-N 3.1Å; E64-N68 PolarHBondContact O-ND2 3.4Å; E64-N68 VanDerWaalsContact O-ND2 3.14Å
65S65.1Low70Confident75 Ų75103.5 Ų103.552%0.52457%0.57SS.*Hα-helixtrans-65.8-44.4173.1-174.10000111.2A62 L63 S69A62-S65 WeakPolarHBondContact O-CB 3.3Å; A62-S65 PolarHBondContact O-N 2.86Å; A62-S65 VanDerWaalsContact O-N 3.08Å; L63-S65 VanDerWaalsContact C-N 3.33Å; L63-S65 PolarHBondContact O-N 3.19Å; S65-S69 VanDerWaalsContact O-CB 3.25Å; S65-S69 WeakPolarHBondContact O-CB 3.11Å; S65-S69 PolarHBondContact O-N 2.81Å
66D65.1Low71.8Confident104 Ų10497.7 Ų97.756%0.55656%0.559SS**Hα-helixtrans-70.2-34.9179.6-67.1-26.2000111.9A62 L63 Y70A62-D66 PolarHBondContact O-N 2.66Å; A62-D66 VanDerWaalsContact O-N 3.12Å; L63-D66 PolarHBondContact O-N 3Å; D66-Y70 PolarHBondContact O-N 3.37Å
67F67Low73.7Confident160 Ų16096.7 Ų96.770%0.70255%0.545SS*.Hα-helixtrans-65.5-48.3175.7-129.1-88.6000112.1L63 Y70 S71L63-F67 WeakPolarHBondContact O-CB 3.49Å; L63-F67 PolarHBondContact O-N 3.12Å; F67-Y70 PolarHBondContact O-N 3.36Å; F67-S71 PolarHBondContact O-N 2.86Å; F67-S71 VanDerWaalsContact O-N 3.15Å; F67-S71 PolarHBondContact O-OG 3.49Å
68N73.7Confident75.7Confident103 Ų10391.4 Ų91.455%0.55152%0.519SS*.Hα-helixtrans-63.2-44.2175.8-71.2-31.1000111.1E64 Y70 S71 D72E64-N68 WeakPolarHBondContact O-CB 3.41Å; E64-N68 PolarHBondContact O-N 2.95Å; E64-N68 VanDerWaalsContact O-N 3.1Å; E64-N68 PolarHBondContact O-ND2 3.4Å; E64-N68 VanDerWaalsContact O-ND2 3.14Å; N68-Y70 PolarHBondContact O-N 3.13Å; N68-Y70 VanDerWaalsContact O-N 3.13Å; N68-S71 PolarHBondContact O-N 3.08Å; N68-S71 VanDerWaalsContact O-N 3.08Å; N68-D72 PolarHBondContact O-N 3.13Å; N68-D72 VanDerWaalsContact O-N 3.13Å
69S76.4Confident77.6Confident68 Ų6892.7 Ų92.748%0.47652%0.522SS..Hα-helixtrans-63.1-18.2176.5-175.40000114S65 L73S65-S69 VanDerWaalsContact O-CB 3.25Å; S65-S69 WeakPolarHBondContact O-CB 3.11Å; S65-S69 PolarHBondContact O-N 2.81Å; S69-L73 WeakPolarHBondContact O-CG 3.37Å
70Y81.3Confident79.1Confident88 Ų8891.2 Ų91.235%0.34552%0.518SS..Hα-helixtrans-85.7-36.9172.8-161.7-86.6000111.9D66 F67 N68 L73 Q78 R81D66-Y70 PolarHBondContact O-N 3.37Å; F67-Y70 PolarHBondContact O-N 3.36Å; N68-Y70 PolarHBondContact O-N 3.13Å; N68-Y70 VanDerWaalsContact O-N 3.13Å; Y70-L73 HydrophobicContact CD2-CD1 3.99Å; Y70-L73 HydrophobicContact CE2-CD1 4.4Å; Y70-L73 HydrophobicContact CG-CD1 4.18Å; Y70-L73 WeakPolarHBondContact O-CB 3.33Å; Y70-L73 WeakPolarHBondContact O-CD1 3.35Å; Y70-L73 WeakPolarHBondContact O-CG 3.43Å; Y70-L73 PolarHBondContact O-N 3.5Å; Y70-Q78 HydrophobicContact CD1-CG 4.1Å; Y70-Q78 HydrophobicContact CE1-CB 3.78Å; Y70-Q78 HydrophobicContact CE1-CG 3.64Å; Y70-Q78 PolarHBondContact O-NE2 3.08Å; Y70-Q78 PolarHBondContact OH-O 3.49Å; Y70-Q78 VanDerWaalsContact OH-O 3.04Å; Y70-R81 HydrophobicContact CE2-CB 3.94Å; Y70-R81 HydrophobicContact CE2-CG 4.47Å
71S83.9Confident80.8Confident79 Ų7991.9 Ų91.955%0.55251%0.508SS*.Hα-helixtrans-69.5-29.5179.1-61.20000113.8F67 N68 L73F67-S71 PolarHBondContact O-N 2.86Å; F67-S71 VanDerWaalsContact O-N 3.15Å; F67-S71 PolarHBondContact O-OG 3.49Å; N68-S71 PolarHBondContact O-N 3.08Å; N68-S71 VanDerWaalsContact O-N 3.08Å; S71-L73 PolarHBondContact O-N 3.14Å
72D90.7Very high82.5Confident146 Ų14694.4 Ų94.478%0.78150%0.504SS*.THydrogen-bonded Turntrans-73.3-8176-71.1-29.2000113.9N68N68-D72 PolarHBondContact O-N 3.13Å; N68-D72 VanDerWaalsContact O-N 3.13Å
73L91.5Very high84.3Confident27 Ų2795 Ų9514%0.14151%0.509CS..SBendtrans-79.9148.7-178.9-58.2171.6000112.1S69 Y70 S71 E77 Q78S69-L73 WeakPolarHBondContact O-CG 3.37Å; Y70-L73 HydrophobicContact CD2-CD1 3.99Å; Y70-L73 HydrophobicContact CE2-CD1 4.4Å; Y70-L73 HydrophobicContact CG-CD1 4.18Å; Y70-L73 WeakPolarHBondContact O-CB 3.33Å; Y70-L73 WeakPolarHBondContact O-CD1 3.35Å; Y70-L73 WeakPolarHBondContact O-CG 3.43Å; Y70-L73 PolarHBondContact O-N 3.5Å; S71-L73 PolarHBondContact O-N 3.14Å; L73-E77 HydrophobicContact CB-CB 4.15Å; L73-Q78 HydrophobicContact CB-CG 3.76Å; L73-Q78 HydrophobicContact CD1-CG 4.29Å; L73-Q78 PolarHBondContact O-NE2 3.35Å
74T93.6Very high86Confident86 Ų8694 Ų9453%0.52851%0.513SS..  trans-67152.517064.40000111.5G76 E77 Q78T74-G76 VanDerWaalsContact C-N 3.26Å; T74-G76 PolarHBondContact O-N 2.99Å; T74-E77 WeakPolarHBondContact CB-OE2 3.47Å; T74-E77 PolarHBondContact N-OE2 3.43Å; T74-E77 WeakPolarHBondContact O-CA 3.25Å; T74-E77 WeakPolarHBondContact O-CB 3.34Å; T74-E77 PolarHBondContact O-N 2.92Å; T74-E77 VanDerWaalsContact OG1-CD 3.3Å; T74-E77 VanDerWaalsContact OG1-CG 3.31Å; T74-E77 WeakPolarHBondContact OG1-CG 3.41Å; T74-E77 PolarHBondContact OG1-OE2 3.03Å; T74-Q78 PolarHBondContact O-N 3.39Å
75E92.3Very high87.6Confident165 Ų16589 Ų8977%0.77150%0.497SS*.Hα-helixtrans-49.3-44.6-180-176.8-178.5-167.100112.6E77 Q78 E79E75-E77 VanDerWaalsContact C-N 3.29Å; E75-E77 PolarHBondContact O-N 3.28Å; E75-Q78 PolarHBondContact O-N 3.04Å; E75-E79 WeakPolarHBondContact O-CB 3.35Å; E75-E79 PolarHBondContact O-N 3.37Å
76G95.4Very high89.2Confident53 Ų5389 Ų8955%0.54650%0.495SS..Hα-helixtrans-66.3-25.3177.400000114.6T74 A80T74-G76 VanDerWaalsContact C-N 3.26Å; T74-G76 PolarHBondContact O-N 2.99Å; G76-A80 VanDerWaalsContact O-CB 3.25Å; G76-A80 WeakPolarHBondContact O-CB 3.45Å; G76-A80 PolarHBondContact O-N 3.33Å; G76-A80 VanDerWaalsContact O-N 3.09Å
77E95.1Very high90.7Very high86 Ų8686.9 Ų86.940%0.40249%0.491SS..Hα-helixtrans-83.6-25.9174.4-70.1171.7120.600112.9L73 T74 E75 R81L73-E77 HydrophobicContact CB-CB 4.15Å; T74-E77 WeakPolarHBondContact CB-OE2 3.47Å; T74-E77 PolarHBondContact N-OE2 3.43Å; T74-E77 WeakPolarHBondContact O-CA 3.25Å; T74-E77 WeakPolarHBondContact O-CB 3.34Å; T74-E77 PolarHBondContact O-N 2.92Å; T74-E77 VanDerWaalsContact OG1-CD 3.3Å; T74-E77 VanDerWaalsContact OG1-CG 3.31Å; T74-E77 WeakPolarHBondContact OG1-CG 3.41Å; T74-E77 PolarHBondContact OG1-OE2 3.03Å; E75-E77 VanDerWaalsContact C-N 3.29Å; E75-E77 PolarHBondContact O-N 3.28Å; E77-R81 WeakPolarHBondContact O-CG 3.47Å; E77-R81 PolarHBondContact O-N 3.4Å; E77-R81 PolarHBondContact O-NH1 2.99Å; E77-R81 VanDerWaalsContact O-NH1 3.12Å
78Q95.1Very high92Very high61 Ų6185 Ų8529%0.28548%0.484SS..Hα-helixtrans-73.4-48.9169.2-61.5-176.328.700110Y70 L73 T74 E75 A80 R81 F82Y70-Q78 HydrophobicContact CD1-CG 4.1Å; Y70-Q78 HydrophobicContact CE1-CB 3.78Å; Y70-Q78 HydrophobicContact CE1-CG 3.64Å; Y70-Q78 PolarHBondContact O-NE2 3.08Å; Y70-Q78 PolarHBondContact OH-O 3.49Å; Y70-Q78 VanDerWaalsContact OH-O 3.04Å; L73-Q78 HydrophobicContact CB-CG 3.76Å; L73-Q78 HydrophobicContact CD1-CG 4.29Å; L73-Q78 PolarHBondContact O-NE2 3.35Å; T74-Q78 PolarHBondContact O-N 3.39Å; E75-Q78 PolarHBondContact O-N 3.04Å; Q78-A80 VanDerWaalsContact C-N 3.31Å; Q78-A80 PolarHBondContact O-N 3.39Å; Q78-R81 PolarHBondContact O-N 3.3Å; Q78-R81 VanDerWaalsContact O-N 3.09Å; Q78-F82 PolarHBondContact O-N 2.91Å
79E96.4Very high93.2Very high120 Ų12085.7 Ų85.756%0.56149%0.485SS*.Hα-helixtrans-55.2-45174.4-173.867.5-152.600111.3E75 R81 F82 A83E75-E79 WeakPolarHBondContact O-CB 3.35Å; E75-E79 PolarHBondContact O-N 3.37Å; E79-R81 PolarHBondContact O-N 3.47Å; E79-F82 PolarHBondContact O-N 3.12Å; E79-A83 WeakPolarHBondContact O-CB 3.49Å; E79-A83 PolarHBondContact O-N 3.25Å
80A96.3Very high94.1Very high59 Ų5989.4 Ų89.449%0.48849%0.492SS..Hα-helixtrans-63.9-37.9176.600000113.2G76 Q78 A84G76-A80 VanDerWaalsContact O-CB 3.25Å; G76-A80 WeakPolarHBondContact O-CB 3.45Å; G76-A80 PolarHBondContact O-N 3.33Å; G76-A80 VanDerWaalsContact O-N 3.09Å; Q78-A80 VanDerWaalsContact C-N 3.31Å; Q78-A80 PolarHBondContact O-N 3.39Å; A80-A84 VanDerWaalsContact O-CB 3.29Å; A80-A84 WeakPolarHBondContact O-CB 3.45Å; A80-A84 PolarHBondContact O-N 3.02Å
81R95.3Very high94.8Very high118 Ų11887.6 Ų87.645%0.44550%0.496SS..Hα-helixtrans-69.1-41.9174.9-79.3175.9175.879.8-12.3111.8Y70 E77 Q78 E79 A84 G85Y70-R81 HydrophobicContact CE2-CB 3.94Å; Y70-R81 HydrophobicContact CE2-CG 4.47Å; E77-R81 WeakPolarHBondContact O-CG 3.47Å; E77-R81 PolarHBondContact O-N 3.4Å; E77-R81 PolarHBondContact O-NH1 2.99Å; E77-R81 VanDerWaalsContact O-NH1 3.12Å; Q78-R81 PolarHBondContact O-N 3.3Å; Q78-R81 VanDerWaalsContact O-N 3.09Å; E79-R81 PolarHBondContact O-N 3.47Å; R81-A84 PolarHBondContact O-N 3.28Å; R81-G85 PolarHBondContact O-N 3.35Å
82F95.6Very high95.3Very high129 Ų12988 Ų8857%0.56649%0.491SS*.Hα-helixtrans-59.5-51.4173.8172.8-102.7000111.2Q78 E79 A84 G85 V86Q78-F82 PolarHBondContact O-N 2.91Å; E79-F82 PolarHBondContact O-N 3.12Å; F82-A84 VanDerWaalsContact C-N 3.31Å; F82-A84 PolarHBondContact O-N 3.33Å; F82-G85 PolarHBondContact O-N 3.34Å; F82-V86 HydrophobicContact CD1-CG2 4.42Å; F82-V86 HydrophobicContact CD2-CG2 4.34Å; F82-V86 HydrophobicContact CE1-CG2 3.99Å; F82-V86 HydrophobicContact CE2-CG2 3.9Å; F82-V86 HydrophobicContact CZ-CG2 3.7Å; F82-V86 WeakPolarHBondContact O-CG2 3.28Å; F82-V86 PolarHBondContact O-N 3.4Å
83A97.6Very high95.5Very high50 Ų5083.3 Ų83.341%0.41347%0.472SS..Hα-helixtrans-60.1-39.3177.800000112.5E79 V86 A87E79-A83 WeakPolarHBondContact O-CB 3.49Å; E79-A83 PolarHBondContact O-N 3.25Å; A83-V86 PolarHBondContact O-N 3.19Å; A83-A87 WeakPolarHBondContact O-CB 3.43Å; A83-A87 PolarHBondContact O-N 2.91Å
84A96Very high95.7Very high61 Ų6185.6 Ų85.650%0.50448%0.482SS..Hα-helixtrans-63.9-44.8174.300000112.3A80 R81 F82 A87 E88A80-A84 VanDerWaalsContact O-CB 3.29Å; A80-A84 WeakPolarHBondContact O-CB 3.45Å; A80-A84 PolarHBondContact O-N 3.02Å; R81-A84 PolarHBondContact O-N 3.28Å; F82-A84 VanDerWaalsContact C-N 3.31Å; F82-A84 PolarHBondContact O-N 3.33Å; A84-A87 PolarHBondContact O-N 2.87Å; A84-E88 PolarHBondContact O-N 3.17Å
85G96.3Very high95.6Very high30 Ų3084.2 Ų84.231%0.30948%0.479SS..Hα-helixtrans-63.5-40175.800000112.9R81 F82 E88 Q89R81-G85 PolarHBondContact O-N 3.35Å; F82-G85 PolarHBondContact O-N 3.34Å; G85-E88 PolarHBondContact O-N 3.05Å; G85-Q89 WeakPolarHBondContact O-CG 3.38Å; G85-Q89 PolarHBondContact O-N 3.29Å
86V98Very high95.7Very high77 Ų7782.3 Ų82.347%0.46747%0.469SS..Hα-helixtrans-63-42.6173.2171.80000111.1F82 A83 Q89 F90F82-V86 HydrophobicContact CD1-CG2 4.42Å; F82-V86 HydrophobicContact CD2-CG2 4.34Å; F82-V86 HydrophobicContact CE1-CG2 3.99Å; F82-V86 HydrophobicContact CE2-CG2 3.9Å; F82-V86 HydrophobicContact CZ-CG2 3.7Å; F82-V86 WeakPolarHBondContact O-CG2 3.28Å; F82-V86 PolarHBondContact O-N 3.4Å; A83-V86 PolarHBondContact O-N 3.19Å; V86-Q89 PolarHBondContact O-N 3.15Å; V86-F90 PolarHBondContact O-N 3.18Å
87A96.6Very high95.4Very high58 Ų5885.8 Ų85.848%0.47947%0.474SS..Hα-helixtrans-64.7-37.5176.300000112.4A83 A84 F90 A91A83-A87 WeakPolarHBondContact O-CB 3.43Å; A83-A87 PolarHBondContact O-N 2.91Å; A84-A87 PolarHBondContact O-N 2.87Å; A87-F90 PolarHBondContact O-N 2.94Å; A87-A91 WeakPolarHBondContact O-CB 3.28Å; A87-A91 PolarHBondContact O-N 3.46Å
88E95.4Very high95Very high120 Ų12088.7 Ų88.756%0.56148%0.481SS*.Hα-helixtrans-62.5-47.5173.1-174-175.3174.600111.4A84 G85 F90 A91 I92A84-E88 PolarHBondContact O-N 3.17Å; G85-E88 PolarHBondContact O-N 3.05Å; E88-F90 VanDerWaalsContact C-N 3.28Å; E88-F90 PolarHBondContact O-N 3.1Å; E88-A91 PolarHBondContact O-N 3.36Å; E88-A91 VanDerWaalsContact O-N 3.17Å; E88-I92 HydrophobicContact CG-CD1 3.97Å; E88-I92 WeakPolarHBondContact O-CG1 3.31Å; E88-I92 PolarHBondContact O-N 3.18Å
89Q97.9Very high94.4Very high119 Ų11989.1 Ų89.156%0.55650%0.495SS*.Hα-helixtrans-61.2-37.9176-66.1-52.5-58.700112.1G85 V86 I92 A93G85-Q89 WeakPolarHBondContact O-CG 3.38Å; G85-Q89 PolarHBondContact O-N 3.29Å; V86-Q89 PolarHBondContact O-N 3.15Å; Q89-I92 PolarHBondContact O-N 3.39Å; Q89-A93 WeakPolarHBondContact O-CB 3.4Å; Q89-A93 PolarHBondContact O-N 3.2Å
90F96.8Very high93.8Very high145 Ų14592.5 Ų92.564%0.63650%0.503SS*.Hα-helixtrans-64-45.3173.7-170.1-91000111.7V86 A87 E88 I92 A93 E94V86-F90 PolarHBondContact O-N 3.18Å; A87-F90 PolarHBondContact O-N 2.94Å; E88-F90 VanDerWaalsContact C-N 3.28Å; E88-F90 PolarHBondContact O-N 3.1Å; F90-I92 PolarHBondContact O-N 3.42Å; F90-A93 PolarHBondContact O-N 3.03Å; F90-E94 VanDerWaalsContact O-CB 3.27Å; F90-E94 WeakPolarHBondContact O-CB 3.38Å; F90-E94 PolarHBondContact O-N 2.92Å
91A95.6Very high92.3Very high51 Ų5194.1 Ų94.142%0.42151%0.51SS..Hα-helixtrans-63.1-39.8177.200000112.6A87 E88 E94 A95A87-A91 WeakPolarHBondContact O-CB 3.28Å; A87-A91 PolarHBondContact O-N 3.46Å; E88-A91 PolarHBondContact O-N 3.36Å; E88-A91 VanDerWaalsContact O-N 3.17Å; A91-E94 PolarHBondContact O-N 3.45Å; A91-A95 VanDerWaalsContact O-CB 3.25Å; A91-A95 WeakPolarHBondContact O-CB 3.34Å; A91-A95 PolarHBondContact O-N 3.05Å
92I93.1Very high90.6Very high88 Ų8893.2 Ų93.245%0.45152%0.523SS..Hα-helixtrans-63.8-45.9174.1-68.5166.5000110.6E88 Q89 F90 K96E88-I92 HydrophobicContact CG-CD1 3.97Å; E88-I92 WeakPolarHBondContact O-CG1 3.31Å; E88-I92 PolarHBondContact O-N 3.18Å; Q89-I92 PolarHBondContact O-N 3.39Å; F90-I92 PolarHBondContact O-N 3.42Å; I92-K96 VanDerWaalsContact O-CB 3.24Å; I92-K96 WeakPolarHBondContact O-CB 3.33Å; I92-K96 PolarHBondContact O-N 2.98Å
93A95.9Very high88.8Confident47 Ų4792.4 Ų92.439%0.38853%0.528SS..Hα-helixtrans-63.7-42.6177.700000111.8Q89 F90 K96 L97Q89-A93 WeakPolarHBondContact O-CB 3.4Å; Q89-A93 PolarHBondContact O-N 3.2Å; F90-A93 PolarHBondContact O-N 3.03Å; A93-K96 PolarHBondContact O-N 3.36Å; A93-L97 WeakPolarHBondContact O-CB 3.44Å; A93-L97 WeakPolarHBondContact O-CG 3.5Å; A93-L97 PolarHBondContact O-N 3.19Å
94E94.6Very high87Confident75 Ų7596.8 Ų96.835%0.3554%0.544SS..Hα-helixtrans-65.4-46178-164.6-163.2-15200111.5F90 A91 K96 L97 R98F90-E94 VanDerWaalsContact O-CB 3.27Å; F90-E94 WeakPolarHBondContact O-CB 3.38Å; F90-E94 PolarHBondContact O-N 2.92Å; A91-E94 PolarHBondContact O-N 3.45Å; E94-K96 VanDerWaalsContact C-N 3.31Å; E94-K96 PolarHBondContact O-N 3.39Å; E94-L97 PolarHBondContact O-N 3Å; E94-R98 VanDerWaalsContact CD-CZ 3.42Å; E94-R98 WeakPolarHBondContact O-CG 3.45Å; E94-R98 PolarHBondContact O-N 2.91Å; E94-R98 IonicContact OE1-CZ 3.55Å; E94-R98 IonicContact OE1-NH1 2.71Å; E94-R98 PolarHBondContact OE1-NH1 2.94Å; E94-R98 IonicContact OE1-NH2 3.58Å; E94-R98 PolarHBondContact OE1-NH2 2.86Å; E94-R98 IonicContact OE2-CZ 3.86Å; E94-R98 IonicContact OE2-NH1 2.69Å; E94-R98 PolarHBondContact OE2-NH1 3.35Å; E94-R98 IonicContact OE2-NH2 3.36Å
95A92.8Very high85.2Confident56 Ų5696.8 Ų96.846%0.46355%0.551SS.*Hα-helixtrans-61.1-39.8174.100000111.9A91 R98 A99A91-A95 VanDerWaalsContact O-CB 3.25Å; A91-A95 WeakPolarHBondContact O-CB 3.34Å; A91-A95 PolarHBondContact O-N 3.05Å; A95-R98 PolarHBondContact O-N 3.26Å; A95-A99 WeakPolarHBondContact O-CB 3.07Å; A95-A99 PolarHBondContact O-N 3.46Å
96K95.1Very high83.1Confident126 Ų126102.7 Ų102.755%0.54858%0.575SS.*Hα-helixtrans-64.9-45.3175.4-175.1175.7179.7-178.90111.7I92 A93 E94 A99 W100I92-K96 VanDerWaalsContact O-CB 3.24Å; I92-K96 WeakPolarHBondContact O-CB 3.33Å; I92-K96 PolarHBondContact O-N 2.98Å; A93-K96 PolarHBondContact O-N 3.36Å; E94-K96 VanDerWaalsContact C-N 3.31Å; E94-K96 PolarHBondContact O-N 3.39Å; K96-A99 PolarHBondContact O-N 3.09Å; K96-W100 PolarHBondContact O-N 3.36Å; K96-W100 VanDerWaalsContact O-N 3.09Å
97L88.4Confident81Confident126 Ų126107.5 Ų107.566%0.6659%0.592SS**Hα-helixtrans-64.9-39.9176.1-71.7171.3000111.9A93 E94 W100 S101A93-L97 WeakPolarHBondContact O-CB 3.44Å; A93-L97 WeakPolarHBondContact O-CG 3.5Å; A93-L97 PolarHBondContact O-N 3.19Å; E94-L97 PolarHBondContact O-N 3Å; L97-W100 PolarHBondContact O-N 2.86Å; L97-S101 WeakPolarHBondContact O-CB 3.29Å; L97-S101 PolarHBondContact O-N 2.84Å
98R85.3Confident78.9Confident146 Ų146109.7 Ų109.755%0.55160%0.604SS**Hα-helixtrans-60.5-44.7171.7-75.7-167.3-178101.212.1112.1E94 A95 W100 S101 S102E94-R98 VanDerWaalsContact CD-CZ 3.42Å; E94-R98 WeakPolarHBondContact O-CG 3.45Å; E94-R98 PolarHBondContact O-N 2.91Å; E94-R98 IonicContact OE1-CZ 3.55Å; E94-R98 IonicContact OE1-NH1 2.71Å; E94-R98 PolarHBondContact OE1-NH1 2.94Å; E94-R98 IonicContact OE1-NH2 3.58Å; E94-R98 PolarHBondContact OE1-NH2 2.86Å; E94-R98 IonicContact OE2-CZ 3.86Å; E94-R98 IonicContact OE2-NH1 2.69Å; E94-R98 PolarHBondContact OE2-NH1 3.35Å; E94-R98 IonicContact OE2-NH2 3.36Å; A95-R98 PolarHBondContact O-N 3.26Å; R98-W100 PolarHBondContact O-N 3.09Å; R98-S101 PolarHBondContact O-N 3.17Å; R98-S102 WeakPolarHBondContact O-CB 3.25Å; R98-S102 PolarHBondContact O-N 3.04Å
99A83.3Confident76.8Confident70 Ų70110 Ų11058%0.57961%0.61SS**Hα-helixtrans-63-28.9177.600000113.1A95 K96A95-A99 WeakPolarHBondContact O-CB 3.07Å; A95-A99 PolarHBondContact O-N 3.46Å; K96-A99 PolarHBondContact O-N 3.09Å
100W84.3Confident74.4Confident192 Ų192111 Ų11173%0.72762%0.619SS**Hα-helixtrans-83.6-33.9175.8-72.442.6000112K96 L97 R98K96-W100 PolarHBondContact O-N 3.36Å; K96-W100 VanDerWaalsContact O-N 3.09Å; L97-W100 PolarHBondContact O-N 2.86Å; R98-W100 PolarHBondContact O-N 3.09Å
101S65.3Low72.2Confident92 Ų92110.1 Ų110.164%0.64362%0.621SS**Hα-helixtrans-77.2-24.8177-174.60000113.8L97 R98 V103L97-S101 WeakPolarHBondContact O-CB 3.29Å; L97-S101 PolarHBondContact O-N 2.84Å; R98-S101 PolarHBondContact O-N 3.17Å; S101-V103 PolarHBondContact O-N 3.11Å
102S58.9Low70.3Confident100 Ų100112.2 Ų112.270%0.69963%0.632SS**THydrogen-bonded Turntrans-74.3-0.3-175-173.70000114.4R98R98-S102 WeakPolarHBondContact O-CB 3.25Å; R98-S102 PolarHBondContact O-N 3.04Å
103V58.1Low68.1Low112 Ų112118.3 Ų118.368%0.67965%0.651SS**THydrogen-bonded Turntrans-92.3-15.3-176.178.90000113.8S101S101-V103 PolarHBondContact O-N 3.11Å
104D60.4Low66.2Low141 Ų141122.6 Ų122.675%0.75467%0.668SS**SBendtrans-125.434.9-171.1-67.7-42.5000113.1
105G57.5Low64.1Low62 Ų62127 Ų12764%0.63969%0.688SS**  trans-163.957.3-17200000117.5
106D52.9Low62.2Low153 Ų153131.4 Ų131.482%0.81870%0.704SS**  trans-142.966167.6-155.111.5000111.4
107E52.3Low59.6Low178 Ų178134.7 Ų134.783%0.83272%0.719SS**  trans-138.345.8174.659.4-149.914700111.8N109E107-N109 PolarHBondContact O-N 3.2Å
108S54Low57.4Low104 Ų104136.6 Ų136.673%0.72773%0.729SS**  trans-76.2101.5161.156.60000109.9D110S108-D110 PolarHBondContact O-N 2.94Å
109N49.6Very low55.3Low128 Ų128135.5 Ų135.568%0.68474%0.741SS**  trans-7192.2173.5-178.984.4000110.4E107 D111E107-N109 PolarHBondContact O-N 3.2Å; N109-D111 VanDerWaalsContact C-N 3.27Å; N109-D111 VanDerWaalsContact ND2-CG 3.32Å; N109-D111 PolarHBondContact ND2-OD2 3.48Å; N109-D111 PolarHBondContact O-N 2.88Å
110D48.8Very low53.2Low140 Ų140136.3 Ų136.375%0.74975%0.747SS**  trans-78.271.1177.2-173.221.6000111.7S108 S112S108-D110 PolarHBondContact O-N 2.94Å; D110-S112 PolarHBondContact O-N 2.88Å; D110-S112 VanDerWaalsContact O-N 3.1Å
111D49.9Very low51.3Low125 Ų125132.7 Ų132.767%0.66875%0.751SS**  trans-80.466.1165.1-80.3-37.2000109.8N109 Y113N109-D111 VanDerWaalsContact C-N 3.27Å; N109-D111 VanDerWaalsContact ND2-CG 3.32Å; N109-D111 PolarHBondContact ND2-OD2 3.48Å; N109-D111 PolarHBondContact O-N 2.88Å; D111-Y113 VanDerWaalsContact C-N 3.27Å; D111-Y113 PolarHBondContact O-N 3.47Å
112S56.5Low49.8Very low96 Ų96136.5 Ų136.567%0.67176%0.759SS**  trans-66.984.6168171.70000110.2D110 D114D110-S112 PolarHBondContact O-N 2.88Å; D110-S112 VanDerWaalsContact O-N 3.1Å; S112-D114 PolarHBondContact O-N 3.5Å
113Y47.1Very low48.9Very low215 Ų215138 Ų13884%0.84377%0.766SS**  trans-68.7122.4170.9-128.3-99.6000110.4D111D111-Y113 VanDerWaalsContact C-N 3.27Å; D111-Y113 PolarHBondContact O-N 3.47Å
114D54.6Low47.8Very low137 Ų137137.6 Ų137.673%0.73376%0.764SS**  trans-59.5137.6167.5-83.4-45.4000110.6S112S112-D114 PolarHBondContact O-N 3.5Å
115E50.6Low46.7Very low169 Ų169137.3 Ų137.379%0.7977%0.767SS**  trans-149111.7147.2-89.9-60.9116.500109.1F117E115-F117 PolarHBondContact O-N 2.88Å
116D53.3Low45.9Very low148 Ų148142.2 Ų142.279%0.79177%0.774SS**  trans-62.9109.8176.5-79-68000112.8
117F40.9Very low45.2Very low194 Ų194140.6 Ų140.685%0.85177%0.774SS**  trans-153.8106.5152.2-90.3-68.1000113.9E115E115-F117 PolarHBondContact O-N 2.88Å
118L42Very low44.7Very low167 Ų167137.4 Ų137.487%0.87477%0.767SS**  trans-106.6143.5155.1-69.4-177.6000107.5
119P41.9Very low44.2Very low123 Ų123138.9 Ų138.980%0.79976%0.763SS**  -151.217063.240.8-21.2000119
120A38.5Very low44.2Very low87 Ų87138.9 Ų138.972%0.71976%0.762SS**  trans90107.1149.200000120.7
121S44.3Very low43.9Very low116 Ų116136.4 Ų136.481%0.81176%0.756SS**  trans67.188.8140.764.20000121
122E32.9Very low43.9Very low172 Ų172135 Ų13580%0.80476%0.756SS**  trans-138.5138.7133.9-78.3-162.2111.300110T124E122-T124 PolarHBondContact O-N 3.17Å
123P40.1Very low43.5Very low130 Ų130135.2 Ų135.284%0.84474%0.743SS**  trans-81.568.9173.934.6-34.2000110.4T125P123-T125 PolarHBondContact O-N 2.9Å
124T34.8Very low44Very low105 Ų105127.6 Ų127.664%0.64472%0.719SS**  trans-60.4128.6168.9-52.20000109.2E122 Q126E122-T124 PolarHBondContact O-N 3.17Å; T124-Q126 PolarHBondContact O-N 3.35Å
125T38.7Very low44.1Very low134 Ų134125.9 Ų125.982%0.82272%0.716SS**  trans-67.880.6175.649.30000110.8P123 S127P123-T125 PolarHBondContact O-N 2.9Å; T125-S127 PolarHBondContact O-N 3.34Å; T125-S127 VanDerWaalsContact O-N 3.15Å
126Q39.6Very low44.2Very low166 Ų166125.5 Ų125.578%0.77671%0.708SS**  trans-69.7107164.7-68.8-172.24.600108.1T124 T128T124-Q126 PolarHBondContact O-N 3.35Å; Q126-T128 PolarHBondContact O-N 2.94Å
127S38.3Very low44.7Very low118 Ų118120.6 Ų120.683%0.82568%0.682SS**  trans-60.592.9157.1-68.10000107.4T125 E129T125-S127 PolarHBondContact O-N 3.34Å; T125-S127 VanDerWaalsContact O-N 3.15Å; S127-E129 PolarHBondContact O-N 3.35Å
128T42.1Very low45.7Very low112 Ų112115.2 Ų115.269%0.68766%0.658SS**  trans-52126.6-175.1-53.10000110Q126 L130Q126-T128 PolarHBondContact O-N 2.94Å; T128-L130 PolarHBondContact O-N 3.47Å
129E44.2Very low46.6Very low135 Ų135113 Ų11363%0.63165%0.647SS**  trans-62.398.4-160.3-166-176.7-176.500112.6S127 S131 S132S127-E129 PolarHBondContact O-N 3.35Å; E129-S131 PolarHBondContact O-N 3.02Å; E129-S132 PolarHBondContact O-N 3.13Å
130L48.3Very low47.7Very low127 Ų127111.2 Ų111.267%0.66563%0.63SS**THydrogen-bonded Turntrans-67.42.9177.8-138.4110.6000113.1T128 K138T128-L130 PolarHBondContact O-N 3.47Å; L130-K138 WeakPolarHBondContact O-CE 3.38Å; L130-K138 PolarHBondContact O-NZ 2.9Å
131S44.2Very low49Very low89 Ų89111.8 Ų111.862%0.62262%0.62SS**THydrogen-bonded Turntrans-76.1-31173.1-149.90000112.6E129 Y133E129-S131 PolarHBondContact O-N 3.02Å; S131-Y133 VanDerWaalsContact C-N 3.26Å; S131-Y133 PolarHBondContact O-N 2.84Å
132S48.1Very low49.6Very low96 Ų96112.9 Ų112.967%0.67161%0.612SS**SBendtrans-72.7-9.8-171.6-159.50000115.1E129E129-S132 PolarHBondContact O-N 3.13Å
133Y48.4Very low50.7Low100 Ų100107.5 Ų107.539%0.39259%0.594SS.*SBendtrans-93.2133.7-177.3-66.2-82.4000112.5S131 L137 K138S131-Y133 VanDerWaalsContact C-N 3.26Å; S131-Y133 PolarHBondContact O-N 2.84Å; Y133-L137 HydrophobicContact CD1-CD1 4.38Å; Y133-K138 WeakPolarHBondContact O-CE 3.25Å
134P58.7Low51.4Low55 Ų55106.6 Ų106.636%0.35758%0.578SS.*  trans-62.6145.5178.728.2-35.6000110.7Y136 L137P134-Y136 VanDerWaalsContact C-N 3.27Å; P134-Y136 HydrophobicContact CB-CD1 3.92Å; P134-Y136 HydrophobicContact CB-CE1 3.53Å; P134-Y136 HydrophobicContact CG-CD1 4.14Å; P134-Y136 HydrophobicContact CG-CE1 3.42Å; P134-Y136 VanDerWaalsContact CG-CE1 3.42Å; P134-Y136 PolarHBondContact O-N 3.35Å; P134-L137 HydrophobicContact CG-CD1 4.17Å; P134-L137 PolarHBondContact O-N 3Å
135P55.9Low52.1Low100 Ų100106 Ų10665%0.64957%0.57SS**Hα-helixtrans-57.9-33.8-160.517.4-31.1000114.4L137 K138P135-L137 PolarHBondContact O-N 3.35Å; P135-L137 VanDerWaalsContact O-N 3.14Å; P135-K138 WeakPolarHBondContact O-CB 3.46Å; P135-K138 PolarHBondContact O-N 3.37Å
136Y52.9Low52.9Low162 Ų162103.2 Ų103.264%0.63556%0.555SS**Hα-helixtrans-60.7-23.6179.769.3-96.3000114.6P134P134-Y136 VanDerWaalsContact C-N 3.27Å; P134-Y136 HydrophobicContact CB-CD1 3.92Å; P134-Y136 HydrophobicContact CB-CE1 3.53Å; P134-Y136 HydrophobicContact CG-CD1 4.14Å; P134-Y136 HydrophobicContact CG-CE1 3.42Å; P134-Y136 VanDerWaalsContact CG-CE1 3.42Å; P134-Y136 PolarHBondContact O-N 3.35Å
137L63.6Low53.5Low45 Ų45102.1 Ų102.124%0.23655%0.55CS.*Hα-helixtrans-77.6-27.6175.1-88.2162.8000112.4Y133 P134 P135 L140 I141Y133-L137 HydrophobicContact CD1-CD1 4.38Å; P134-L137 HydrophobicContact CG-CD1 4.17Å; P134-L137 PolarHBondContact O-N 3Å; P135-L137 PolarHBondContact O-N 3.35Å; P135-L137 VanDerWaalsContact O-N 3.14Å; L137-L140 PolarHBondContact O-N 2.78Å; L137-I141 WeakPolarHBondContact O-CD1 3.42Å; L137-I141 VanDerWaalsContact O-CG1 3.3Å; L137-I141 WeakPolarHBondContact O-CG1 3.34Å; L137-I141 PolarHBondContact O-N 3.15Å; L137-I141 VanDerWaalsContact O-N 3.17Å
138K62.8Low53.8Low81 Ų81104 Ų10435%0.35255%0.546SS..Hα-helixtrans-66.1-44.8179.9-60.8-176177.3-176.40110.4L130 Y133 P135 L140 I141 H142L130-K138 WeakPolarHBondContact O-CE 3.38Å; L130-K138 PolarHBondContact O-NZ 2.9Å; Y133-K138 WeakPolarHBondContact O-CE 3.25Å; P135-K138 WeakPolarHBondContact O-CB 3.46Å; P135-K138 PolarHBondContact O-N 3.37Å; K138-L140 PolarHBondContact O-N 2.71Å; K138-I141 PolarHBondContact O-N 2.91Å; K138-H142 VanDerWaalsContact O-CB 3.28Å; K138-H142 WeakPolarHBondContact O-CB 3.39Å; K138-H142 PolarHBondContact O-N 3.46Å
139D59.6Low54Low119 Ų119104.5 Ų104.564%0.63654%0.543SS*.Hα-helixtrans-63.7-38.9179.1-64.3-24.9000112.5S143D139-S143 WeakPolarHBondContact O-CB 3.37Å; D139-S143 PolarHBondContact O-N 2.69Å
140L66.8Low54.2Low87 Ų87100.8 Ų100.846%0.45554%0.542SS..Hα-helixtrans-67-43.3178.4-17660000112L137 K138 Q144L137-L140 PolarHBondContact O-N 2.78Å; K138-L140 PolarHBondContact O-N 2.71Å; L140-Q144 PolarHBondContact O-N 3.33Å; L140-Q144 VanDerWaalsContact O-N 3.15Å
141I64.4Low54Low98 Ų98102.3 Ų102.350%0.50355%0.548SS..Hα-helixtrans-66.7-44.2177.3-66.4166.1000110.4L137 K138 Q144 L145L137-I141 WeakPolarHBondContact O-CD1 3.42Å; L137-I141 VanDerWaalsContact O-CG1 3.3Å; L137-I141 WeakPolarHBondContact O-CG1 3.34Å; L137-I141 PolarHBondContact O-N 3.15Å; L137-I141 VanDerWaalsContact O-N 3.17Å; K138-I141 PolarHBondContact O-N 2.91Å; I141-Q144 PolarHBondContact O-N 3.3Å; I141-L145 HydrophobicContact CG2-CD1 3.94Å; I141-L145 WeakPolarHBondContact O-CB 3.34Å; I141-L145 PolarHBondContact O-N 2.85Å
142H56.8Low54.1Low140 Ų140109.1 Ų109.165%0.64856%0.56SS**Hα-helixtrans-65.7-40.8178.9-166.1-101.4000112.2K138 L145 C146K138-H142 VanDerWaalsContact O-CB 3.28Å; K138-H142 WeakPolarHBondContact O-CB 3.39Å; K138-H142 PolarHBondContact O-N 3.46Å; H142-L145 PolarHBondContact O-N 2.81Å; H142-C146 WeakPolarHBondContact O-CB 3.39Å; H142-C146 PolarHBondContact O-N 2.86Å
143S57.1Low53.4Low59 Ų59115.2 Ų115.241%0.41357%0.568SS.*Hα-helixtrans-59.5-46.1174.8175.70000112.4D139 Q147D139-S143 WeakPolarHBondContact O-CB 3.37Å; D139-S143 PolarHBondContact O-N 2.69Å; S143-Q147 WeakPolarHBondContact O-CG 3.34Å; S143-Q147 PolarHBondContact O-N 3.43Å; S143-Q147 PolarHBondContact O-NE2 2.96Å; S143-Q147 PolarHBondContact OG-NE2 2.94Å
144Q54.2Low52.8Low111 Ų111116.3 Ų116.352%0.51959%0.587SS.*Hα-helixtrans-69.6-41.3178.2-72.3-168.22.200112.4L140 I141 C146 Q147 H148L140-Q144 PolarHBondContact O-N 3.33Å; L140-Q144 VanDerWaalsContact O-N 3.15Å; I141-Q144 PolarHBondContact O-N 3.3Å; Q144-C146 PolarHBondContact O-N 3.34Å; Q144-Q147 PolarHBondContact O-N 2.92Å; Q144-H148 WeakPolarHBondContact O-CB 3.4Å; Q144-H148 PolarHBondContact O-N 3.31Å
145L50.3Low51.5Low92 Ų92119 Ų11948%0.48261%0.606SS.*Hα-helixtrans-60.8-42.3175.9-81166.5000112.3I141 H142 Q147 H148 L149I141-L145 HydrophobicContact CG2-CD1 3.94Å; I141-L145 WeakPolarHBondContact O-CB 3.34Å; I141-L145 PolarHBondContact O-N 2.85Å; H142-L145 PolarHBondContact O-N 2.81Å; L145-Q147 VanDerWaalsContact C-N 3.31Å; L145-Q147 PolarHBondContact O-N 3.28Å; L145-H148 PolarHBondContact O-N 3.49Å; L145-L149 WeakPolarHBondContact O-CB 3.45Å; L145-L149 VanDerWaalsContact O-CG 3.28Å; L145-L149 WeakPolarHBondContact O-CG 3.48Å; L145-L149 PolarHBondContact O-N 3.03Å
146C53.8Low50.7Low75 Ų75120.6 Ų120.651%0.50762%0.616SS.*Hα-helixtrans-62-38.3178-169.90000112.4H142 Q144H142-C146 WeakPolarHBondContact O-CB 3.39Å; H142-C146 PolarHBondContact O-N 2.86Å; Q144-C146 PolarHBondContact O-N 3.34Å
147Q52.7Low49.8Very low143 Ų143122.5 Ų122.567%0.66863%0.631SS**Hα-helixtrans-69.2-41.4174-71.6167.683.100112.1S143 Q144 L145 G150S143-Q147 WeakPolarHBondContact O-CG 3.34Å; S143-Q147 PolarHBondContact O-N 3.43Å; S143-Q147 PolarHBondContact O-NE2 2.96Å; S143-Q147 PolarHBondContact OG-NE2 2.94Å; Q144-Q147 PolarHBondContact O-N 2.92Å; L145-Q147 VanDerWaalsContact C-N 3.31Å; L145-Q147 PolarHBondContact O-N 3.28Å; Q147-G150 PolarHBondContact O-N 3.36Å
148H44.7Very low48.4Very low157 Ų157126.2 Ų126.273%0.72766%0.661SS**Hα-helixtrans-77.8-21.8-175.1-140.3-58000114.1Q144 L145Q144-H148 WeakPolarHBondContact O-CB 3.4Å; Q144-H148 PolarHBondContact O-N 3.31Å; L145-H148 PolarHBondContact O-N 3.49Å
149L47.1Very low47.1Very low123 Ų123126.1 Ų126.164%0.64468%0.683SS**THydrogen-bonded Turntrans-89.12.4175.5-67.8170.4000113.6L145 M151L145-L149 WeakPolarHBondContact O-CB 3.45Å; L145-L149 VanDerWaalsContact O-CG 3.28Å; L145-L149 WeakPolarHBondContact O-CG 3.48Å; L145-L149 PolarHBondContact O-N 3.03Å; L149-M151 VanDerWaalsContact C-N 3.3Å; L149-M151 PolarHBondContact O-N 3.48Å
150G47.6Very low45.9Very low58 Ų58124.5 Ų124.560%0.59869%0.694SS**THydrogen-bonded Turntrans68.417.7165.700000116.4Q147 R152Q147-G150 PolarHBondContact O-N 3.36Å; G150-R152 PolarHBondContact O-N 2.84Å
151M45.2Very low44.2Very low159 Ų159123.9 Ų123.978%0.78371%0.709SS**  trans-7328.5-174.6-63.8-60.1-67.400115L149L149-M151 VanDerWaalsContact C-N 3.3Å; L149-M151 PolarHBondContact O-N 3.48Å
152R45.7Very low43.1Very low232 Ų232127.9 Ų127.988%0.87573%0.729SS**  trans-84.4111.2169.8-97.2-81.7-175.4-171.9-1.4109.4G150G150-R152 PolarHBondContact O-N 2.84Å
153R33.2Very low41.9Very low224 Ų224124.8 Ų124.885%0.84574%0.736SS**  trans-51.2128.9168.4175.8-178.6-83.9148.1-8.7110.3
154P35.7Very low41.2Very low122 Ų122131.9 Ų131.979%0.79276%0.762SS**  trans-70.1140.8176.1-18.531.7000112.6
155C31.3Very low40.2Very low113 Ų113130.4 Ų130.476%0.76478%0.777SS**  trans-115.3142.3163.2-67.40000108.5
156P38.5Very low39.6Very low133 Ų133130.3 Ų130.386%0.86480%0.798SS**  trans-80132.3-178.731.2-33.2000112
157E35.3Very low38.5Very low201 Ų201130.5 Ų130.594%0.93981%0.813SS**  trans-79.3145.3168.4-67.5178.3103.500111
158S34.7Very low38.1Very low123 Ų123129.9 Ų129.986%0.8682%0.824SS**  trans-119.3120.3171.5-171.60000110.1
159G33.9Very low37.6Very low79 Ų79133.4 Ų133.481%0.81483%0.831SS**  trans-79.9138.9-179.600000112.9
160G34.2Very low37.5Very low85 Ų85136.5 Ų136.588%0.87684%0.842SS**  trans-88.2163.7-17800000115.3
161G33Very low37.2Very low74 Ų74139.1 Ų139.176%0.76385%0.849SS**  trans-169.286.9176.700000115.4
162I40.8Very low36.7Very low182 Ų182136.7 Ų136.793%0.93385%0.847SS**  trans38.5124.1147.4-48.6177.7000119.8
163G31.2Very low36.4Very low76 Ų76132 Ų13278%0.78485%0.847SS**  trans-179123.1157.100000114
164E42.9Very low36.4Very low207 Ų207127.7 Ų127.797%0.96785%0.846SS**  trans-81.3151.4179.5-63.3171.993.300113.2
165G31.9Very low36.2Very low80 Ų80126.1 Ų126.183%0.82584%0.843SS**  trans161111.216700000113.8
166G39.3Very low36.2Very low90 Ų90127.2 Ų127.293%0.92885%0.85SS**  trans-80.5150.8-177.900000114.5
167G30.4Very low35.7Very low79 Ų79126 Ų12681%0.81485%0.845SS**  trans-179.2119.9173.500000112.3R169G167-R169 PolarHBondContact O-N 3.2Å
168S43.1Very low36.4Very low131 Ų131121.9 Ų121.992%0.91684%0.836SS**  trans-66.7113.1-176.8164.80000113.5
169R35.5Very low36.5Very low230 Ų230123.5 Ų123.587%0.86884%0.835SS**  trans-165.9136.5154.6-146.3167171-176.8-6.3111.3G167G167-R169 PolarHBondContact O-N 3.2Å
170E43.4Very low37.2Very low188 Ų188126 Ų12688%0.87984%0.835SS**  trans-63.1137.3164.9-73176107.500110.1
171P41.7Very low37.8Very low114 Ų114130.1 Ų130.174%0.7484%0.836SS**  -148.6163.7109.837.7-21.7000115.9
172S35.1Very low38.4Very low107 Ų107132.4 Ų132.475%0.74884%0.839SS**  trans39.6132.1149.7-52.60000122.5
173P40.1Very low38.3Very low134 Ų134129.5 Ų129.587%0.8783%0.834SS**  trans-100.2114.9162.834.7-26.1000113
174T32.2Very low39Very low133 Ų133131.2 Ų131.282%0.81684%0.835SS**  trans-112.2115.4163.2-53.10000110.3
175A32.1Very low39Very low89 Ų89129.4 Ų129.474%0.73683%0.83SS**  trans67.6138.3155.600000123
176C30.9Very low39.7Very low136 Ų136132 Ų13292%0.91983%0.834SS**  trans73.9104.7148.8-83.10000122
177S28.7Very low39.9Very low108 Ų108133.4 Ų133.476%0.75583%0.83SS**  trans-130.8138.5142.4-173.90000108.8
178P48.7Very low40.5Very low115 Ų115136.5 Ų136.575%0.74783%0.827SS**  trans-100.6111.4-171.935.3-29.3000113.4
179D37.6Very low40.5Very low156 Ų156134.7 Ų134.783%0.83481%0.808SS**  trans-1569.8169.3-101.2-35.7000115.7
180T48.3Very low41.2Very low132 Ų132131.4 Ų131.481%0.8180%0.802SS**  trans-102.929.4-171.651.60000115.6C182T180-C182 PolarHBondContact O-N 2.98Å
181L47.9Very low41.2Very low171 Ų171130.2 Ų130.290%0.89580%0.796SS**  trans-99.960.3174.2-66.1-177.8000112.9
182C44.1Very low41.5Very low123 Ų123129.6 Ų129.683%0.83178%0.783SS**  trans-14527.5172.7-96.50000114.6T180T180-C182 PolarHBondContact O-N 2.98Å
183S39.7Very low42.3Very low120 Ų120129 Ų12984%0.83978%0.777SS**  trans-130.760.6-177.4-620000113.8
184S45.4Very low42.7Very low113 Ų113129.5 Ų129.579%0.7977%0.771SS**SBendtrans-172.868.9150.6-164.90000113.1
185L42.9Very low43.4Very low168 Ų168128 Ų12888%0.8876%0.758SS**  trans-150.828.9159.9-81.5-169.1000112.1
186C46.4Very low44.2Very low134 Ų134133.5 Ų133.591%0.90576%0.76SS**  trans-11057.4-175.5-66.20000112.9
187S43.2Very low45Very low120 Ų120132.9 Ų132.984%0.83975%0.747SS**  trans-166.778.4153.1-162.20000111
188L43.8Very low45.9Very low145 Ų145132.3 Ų132.376%0.75974%0.735SS**SBendtrans-124.4125.5158.6-91.2168.5000107E190L188-E190 PolarHBondContact O-N 3.44Å
189D42.4Very low45.6Very low93 Ų93135.4 Ų135.450%0.49773%0.732SS.*  trans-59.4123.7-173.8178.355.6000111.3Q191 H192D189-Q191 PolarHBondContact O-N 3.23Å; D189-Q191 WeakPolarHBondContact OD2-CB 3.24Å; D189-H192 PolarHBondContact O-CD2 2.77Å
190E50.3Low46Very low160 Ų160133.2 Ų133.275%0.74873%0.725SS**THydrogen-bonded Turntrans-81.818.8-167.1-148.8171.2153.900112.9L188L188-E190 PolarHBondContact O-N 3.44Å
191Q44.4Very low45.8Very low164 Ų164135.1 Ų135.177%0.76672%0.724SS**THydrogen-bonded Turntrans-107.6-0.7-177-52.2-166.2-11.100114.1D189D189-Q191 PolarHBondContact O-N 3.23Å; D189-Q191 WeakPolarHBondContact OD2-CB 3.24Å
192H46.4Very low45.7Very low100 Ų100137.6 Ų137.646%0.46372%0.722SS.*  trans-64.2127.4178.9-74.6-64.4000112.8D189 L194 L195D189-H192 PolarHBondContact O-CD2 2.77Å; H192-L194 PolarHBondContact O-N 3.46Å; H192-L194 VanDerWaalsContact O-N 3.15Å; H192-L195 HydrophobicContact CB-CD1 4.5Å; H192-L195 PolarHBondContact O-N 3.42Å; H192-L195 VanDerWaalsContact O-N 3.08Å
193P53.5Low45.7Very low94 Ų94134.3 Ų134.361%0.6171%0.709SS**Hα-helixtrans-61.5-28.8-175.321.8-32.2000113.5L195 R196P193-L195 PolarHBondContact O-N 2.93Å; P193-R196 VanDerWaalsContact O-CB 3.31Å; P193-R196 WeakPolarHBondContact O-CB 3.27Å; P193-R196 PolarHBondContact O-N 3.21Å
194L46.8Very low46.2Very low145 Ų145136.6 Ų136.676%0.75971%0.711SS**Hα-helixtrans-62.9-24.8177.3-61.1176.4000113.9H192 L198H192-L194 PolarHBondContact O-N 3.46Å; H192-L194 VanDerWaalsContact O-N 3.15Å; L194-L198 VanDerWaalsContact O-CD1 3.26Å; L194-L198 WeakPolarHBondContact O-CD1 3.33Å
195L48.4Very low46.4Very low103 Ų103136.9 Ų136.954%0.53970%0.7SS.*Hα-helixtrans-85.7-19.9175.7-68.6170.8000112.5H192 P193 L198H192-L195 HydrophobicContact CB-CD1 4.5Å; H192-L195 PolarHBondContact O-N 3.42Å; H192-L195 VanDerWaalsContact O-N 3.08Å; P193-L195 PolarHBondContact O-N 2.93Å; L195-L198 PolarHBondContact O-N 3.17Å
196R49.3Very low46.7Very low203 Ų203133.3 Ų133.377%0.76669%0.694SS**Hα-helixtrans-69.6-37-174.5-161.6173.1-173.5155.11.2112P193 L198 R199P193-R196 VanDerWaalsContact O-CB 3.31Å; P193-R196 WeakPolarHBondContact O-CB 3.27Å; P193-R196 PolarHBondContact O-N 3.21Å; R196-L198 PolarHBondContact O-N 2.77Å; R196-R199 PolarHBondContact O-N 3.28Å
197D46.5Very low46.8Very low124 Ų124135 Ų13566%0.66369%0.689SS**THydrogen-bonded Turntrans-73.6-22.6-179-68.9-20.8000113.4T200D197-T200 PolarHBondContact O-OG1 3.1Å
198L46.9Very low47.2Very low96 Ų96132.9 Ų132.950%0.50367%0.668SS.*THydrogen-bonded Turntrans-80.2-20.6175.7-77.787.3000113.2L194 L195 R196 T200 H201L194-L198 VanDerWaalsContact O-CD1 3.26Å; L194-L198 WeakPolarHBondContact O-CD1 3.33Å; L195-L198 PolarHBondContact O-N 3.17Å; R196-L198 PolarHBondContact O-N 2.77Å; L198-T200 PolarHBondContact O-N 3.47Å; L198-H201 PolarHBondContact O-N 3.2Å
199R43.6Very low47.8Very low179 Ų179129.4 Ų129.468%0.67565%0.651SS**G310 helixtrans-70.8-18.1-176.1-167.1168.6179.8152-0.3113.5R196R196-R199 PolarHBondContact O-N 3.28Å
200T45.7Very low48.4Very low111 Ų111128.4 Ų128.468%0.68166%0.655SS**G310 helixtrans-77.6-24.1179.153.90000113.3D197 L198D197-T200 PolarHBondContact O-OG1 3.1Å; L198-T200 PolarHBondContact O-N 3.47Å
201H44.1Very low48.7Very low172 Ų172123.9 Ų123.980%0.79665%0.645SS**G310 helixtrans-103.650.2177.1-81.3-84.2000112.8L198 G203L198-H201 PolarHBondContact O-N 3.2Å; H201-G203 PolarHBondContact O-N 2.87Å
202R45.9Very low49.5Very low223 Ų223120.7 Ų120.784%0.84263%0.63SS**  trans-72.788.7173.8-178.6175.8-89.4-118-1.4111.1
203G43.8Very low50.5Low54 Ų54120.9 Ų120.956%0.55763%0.634SS**SBendtrans-151.797.9173.700000114H201 H205H201-G203 PolarHBondContact O-N 2.87Å; G203-H205 PolarHBondContact O-N 3.24Å
204N50.8Low50.9Low168 Ų168117.9 Ų117.990%0.89862%0.617SS**SBendtrans50.728.8153.2-65.6-4.3000121.4
205H48.5Very low51.5Low118 Ų118113.4 Ų113.455%0.54660%0.601SS.*  trans-140.869.6171.2-89.9-67.3000115.3G203 Q207 N208 N209G203-H205 PolarHBondContact O-N 3.24Å; H205-Q207 VanDerWaalsContact C-N 3.29Å; H205-Q207 PolarHBondContact O-N 3.29Å; H205-N208 HydrophobicContact CB-CB 4.17Å; H205-N208 VanDerWaalsContact CG-ND2 3.34Å; H205-N208 PolarHBondContact ND1-ND2 3.09Å; H205-N208 PolarHBondContact O-N 2.86Å; H205-N209 PolarHBondContact O-ND2 3.24Å
206A51Low52.2Low93 Ų93114.4 Ų114.477%0.76960%0.601SS**Hα-helixtrans-58.5-37.5174.600000113.4N208 N209A206-N208 PolarHBondContact O-N 3.36Å; A206-N209 PolarHBondContact O-N 3.44Å
207Q47.6Very low53.2Low169 Ų169108 Ų10879%0.7958%0.581SS**Hα-helixtrans-67.1-29.6-178.8-70.9-71.6-7.200114.1H205H205-Q207 VanDerWaalsContact C-N 3.29Å; H205-Q207 PolarHBondContact O-N 3.29Å
208N51.5Low53.9Low76 Ų76106.2 Ų106.241%0.40657%0.571SS.*Hα-helixtrans-81.2-21.5-176.9-62.3-6.4000112.5H205 A206 A210 A211 E212H205-N208 HydrophobicContact CB-CB 4.17Å; H205-N208 VanDerWaalsContact CG-ND2 3.34Å; H205-N208 PolarHBondContact ND1-ND2 3.09Å; H205-N208 PolarHBondContact O-N 2.86Å; A206-N208 PolarHBondContact O-N 3.36Å; N208-A210 PolarHBondContact O-N 3.02Å; N208-A211 PolarHBondContact O-N 3.49Å; N208-E212 WeakPolarHBondContact O-CB 3.39Å; N208-E212 PolarHBondContact O-N 2.88Å
209N55.5Low54.4Low73 Ų73106 Ų10639%0.3958%0.578SS.*Hα-helixtrans-65.9-40.9-174.5-82.5-87.1000112.7H205 A206 L213H205-N209 PolarHBondContact O-ND2 3.24Å; A206-N209 PolarHBondContact O-N 3.44Å; N209-L213 WeakPolarHBondContact O-CB 3.26Å; N209-L213 PolarHBondContact O-N 3.29Å
210A56.4Low55Low71 Ų71101.5 Ų101.559%0.58758%0.579SS**Hα-helixtrans-66.8-40.6176.800000112.2N208 L213 A214N208-A210 PolarHBondContact O-N 3.02Å; A210-L213 PolarHBondContact O-N 3.39Å; A210-A214 WeakPolarHBondContact O-CB 3.22Å; A210-A214 PolarHBondContact O-N 3.46Å
211A55.9Low55.3Low65 Ų65100.9 Ų100.954%0.53757%0.571SS.*Hα-helixtrans-70.1-42.917800000112.4N208 A214 A215N208-A211 PolarHBondContact O-N 3.49Å; A211-A214 PolarHBondContact O-N 2.98Å; A211-A215 VanDerWaalsContact O-CB 3.32Å; A211-A215 WeakPolarHBondContact O-CB 3.36Å; A211-A215 PolarHBondContact O-N 2.99Å
212E61.5Low55.4Low97 Ų97101.5 Ų101.545%0.45357%0.574SS.*Hα-helixtrans-64.2-39.4172.4-87-162.786.600112.4N208 A215 K216N208-E212 WeakPolarHBondContact O-CB 3.39Å; N208-E212 PolarHBondContact O-N 2.88Å; E212-A215 PolarHBondContact O-N 2.73Å; E212-K216 VanDerWaalsContact O-CB 3.31Å; E212-K216 WeakPolarHBondContact O-CB 3.46Å; E212-K216 VanDerWaalsContact O-CG 3.27Å; E212-K216 WeakPolarHBondContact O-CG 3.4Å; E212-K216 PolarHBondContact O-N 3.01Å; E212-K216 WeakPolarHBondContact OE1-CE 3.4Å; E212-K216 IonicContact OE1-NZ 3.59Å; E212-K216 PolarHBondContact OE1-NZ 3.05Å
213L66.8Low55.7Low104 Ų10493 Ų9355%0.54556%0.556SS.*Hα-helixtrans-63.6-47.417717961.5000110.5N209 A210 A215 K216 I217N209-L213 WeakPolarHBondContact O-CB 3.26Å; N209-L213 PolarHBondContact O-N 3.29Å; A210-L213 PolarHBondContact O-N 3.39Å; L213-A215 PolarHBondContact O-N 3.03Å; L213-K216 PolarHBondContact O-N 3.24Å; L213-I217 HydrophobicContact CD1-CD1 3.89Å; L213-I217 HydrophobicContact CD1-CG1 4.26Å; L213-I217 HydrophobicContact CG-CD1 3.84Å; L213-I217 WeakPolarHBondContact O-CB 3.37Å; L213-I217 VanDerWaalsContact O-CG1 3.24Å; L213-I217 WeakPolarHBondContact O-CG1 3.44Å; L213-I217 PolarHBondContact O-N 2.89Å
214A62.9Low56Low31 Ų3192.6 Ų92.626%0.25655%0.552SS.*Hα-helixtrans-59-46.9173.900000111.6A210 A211 K216 I217 L218A210-A214 WeakPolarHBondContact O-CB 3.22Å; A210-A214 PolarHBondContact O-N 3.46Å; A211-A214 PolarHBondContact O-N 2.98Å; A214-K216 PolarHBondContact O-N 3.14Å; A214-I217 PolarHBondContact O-N 3.16Å; A214-L218 WeakPolarHBondContact O-CB 3.31Å; A214-L218 VanDerWaalsContact O-CG 3.22Å; A214-L218 WeakPolarHBondContact O-CG 3.37Å; A214-L218 PolarHBondContact O-N 3.01Å
215A59.1Low56.2Low52 Ų5292.9 Ų92.943%0.4355%0.548SS..Hα-helixtrans-62.2-38.8177.700000112.8A211 E212 L213 S219A211-A215 VanDerWaalsContact O-CB 3.32Å; A211-A215 WeakPolarHBondContact O-CB 3.36Å; A211-A215 PolarHBondContact O-N 2.99Å; E212-A215 PolarHBondContact O-N 2.73Å; L213-A215 PolarHBondContact O-N 3.03Å; A215-S219 VanDerWaalsContact O-CB 3.3Å; A215-S219 WeakPolarHBondContact O-CB 3.48Å; A215-S219 PolarHBondContact O-N 3.26Å; A215-S219 PolarHBondContact O-OG 3.26Å
216K62.7Low56.6Low123 Ų12393.5 Ų93.554%0.53555%0.551SS.*Hα-helixtrans-71.4-39.6177.1-75.4168.6-173.7163.10112.3E212 L213 A214 S219 A220E212-K216 VanDerWaalsContact O-CB 3.31Å; E212-K216 WeakPolarHBondContact O-CB 3.46Å; E212-K216 VanDerWaalsContact O-CG 3.27Å; E212-K216 WeakPolarHBondContact O-CG 3.4Å; E212-K216 PolarHBondContact O-N 3.01Å; E212-K216 WeakPolarHBondContact OE1-CE 3.4Å; E212-K216 IonicContact OE1-NZ 3.59Å; E212-K216 PolarHBondContact OE1-NZ 3.05Å; L213-K216 PolarHBondContact O-N 3.24Å; A214-K216 PolarHBondContact O-N 3.14Å; K216-S219 PolarHBondContact O-N 3.03Å; K216-A220 WeakPolarHBondContact O-CB 3.3Å; K216-A220 PolarHBondContact O-N 3.01Å
217I70.8Confident56.6Low68 Ų6894.2 Ų94.235%0.34954%0.541SS..Hα-helixtrans-61.5-49.4172.3-69.6166.2000110L213 A214 S219 A220 L221L213-I217 HydrophobicContact CD1-CD1 3.89Å; L213-I217 HydrophobicContact CD1-CG1 4.26Å; L213-I217 HydrophobicContact CG-CD1 3.84Å; L213-I217 WeakPolarHBondContact O-CB 3.37Å; L213-I217 VanDerWaalsContact O-CG1 3.24Å; L213-I217 WeakPolarHBondContact O-CG1 3.44Å; L213-I217 PolarHBondContact O-N 2.89Å; A214-I217 PolarHBondContact O-N 3.16Å; I217-S219 VanDerWaalsContact C-N 3.3Å; I217-S219 PolarHBondContact O-N 3.28Å; I217-A220 PolarHBondContact O-N 3.33Å; I217-L221 HydrophobicContact CG2-CD1 3.92Å; I217-L221 VanDerWaalsContact O-CG 3.3Å; I217-L221 WeakPolarHBondContact O-CG 3.48Å; I217-L221 PolarHBondContact O-N 2.79Å; I217-L221 VanDerWaalsContact O-N 3.12Å
218L61.7Low56.8Low87 Ų8791.2 Ų91.246%0.45553%0.53SS..Hα-helixtrans-64-33.2178.4-69.1168.8000112.9A214A214-L218 WeakPolarHBondContact O-CB 3.31Å; A214-L218 VanDerWaalsContact O-CG 3.22Å; A214-L218 WeakPolarHBondContact O-CG 3.37Å; A214-L218 PolarHBondContact O-N 3.01Å
219S57.9Low56.7Low92 Ų9289.7 Ų89.764%0.64353%0.528SS*.Hα-helixtrans-72.2-35.9174.5-59.20000112.4A215 K216 I217 L221A215-S219 VanDerWaalsContact O-CB 3.3Å; A215-S219 WeakPolarHBondContact O-CB 3.48Å; A215-S219 PolarHBondContact O-N 3.26Å; A215-S219 PolarHBondContact O-OG 3.26Å; K216-S219 PolarHBondContact O-N 3.03Å; I217-S219 VanDerWaalsContact C-N 3.3Å; I217-S219 PolarHBondContact O-N 3.28Å; S219-L221 VanDerWaalsContact C-N 3.29Å; S219-L221 PolarHBondContact O-N 2.83Å
220A54.8Low56.5Low85 Ų8593.7 Ų93.770%0.70254%0.538SS*.Hα-helixtrans-71.7-22.4177.200000113.2K216 I217 H222K216-A220 WeakPolarHBondContact O-CB 3.3Å; K216-A220 PolarHBondContact O-N 3.01Å; I217-A220 PolarHBondContact O-N 3.33Å; A220-H222 VanDerWaalsContact C-N 3.27Å; A220-H222 PolarHBondContact O-N 3.28Å
221L52.4Low56.2Low97 Ų9795.3 Ų95.351%0.50854%0.536SS..THydrogen-bonded Turntrans-80.24.8-179.3-74.8167.4000115.1I217 S219I217-L221 HydrophobicContact CG2-CD1 3.92Å; I217-L221 VanDerWaalsContact O-CG 3.3Å; I217-L221 WeakPolarHBondContact O-CG 3.48Å; I217-L221 PolarHBondContact O-N 2.79Å; I217-L221 VanDerWaalsContact O-N 3.12Å; S219-L221 VanDerWaalsContact C-N 3.29Å; S219-L221 PolarHBondContact O-N 2.83Å
222H45.8Very low55.9Low186 Ų18699 Ų9986%0.86154%0.542SS*.SBendtrans61.670.4169.3-148.599.3000115.1A220A220-H222 VanDerWaalsContact C-N 3.27Å; A220-H222 PolarHBondContact O-N 3.28Å
223G52Low55.4Low44 Ų44103.5 Ų103.545%0.45456%0.555SS.*  trans159.635.1174.500000115.7E225 E226G223-E225 PolarHBondContact O-N 3.29Å; G223-E226 PolarHBondContact O-N 3.43Å
224G51.5Low54.4Low46 Ų46104.4 Ų104.447%0.47456%0.564SS.*THydrogen-bonded Turntrans-63.6-10-163.400000117.4
225E55.1Low53.5Low173 Ų173105.9 Ų105.981%0.80858%0.582SS**THydrogen-bonded Turntrans-97.6-30.3-179.359.9-159.713900114G223 A229G223-E225 PolarHBondContact O-N 3.29Å; E225-A229 WeakPolarHBondContact O-CB 3.21Å; E225-A229 PolarHBondContact O-N 3.12Å
226E54.8Low52.7Low131 Ų131111.3 Ų111.361%0.61260%0.598SS**Hα-helixtrans-78.7-38.5-176.1-167.1179.3163.400112.6G223 A229 R230G223-E226 PolarHBondContact O-N 3.43Å; E226-A229 PolarHBondContact O-N 3.16Å; E226-R230 HydrophobicContact CG-CG 4.49Å; E226-R230 WeakPolarHBondContact O-CG 3.47Å; E226-R230 PolarHBondContact O-N 3.28Å
227L52.1Low51.7Low108 Ų108111 Ų11157%0.56561%0.612SS**Hα-helixtrans-70.2-37.4-174.6-150.1153.3000111.8R230 L231L227-R230 PolarHBondContact O-N 3.27Å; L227-L231 PolarHBondContact O-N 3.35Å
228L51.6Low50Low107 Ų107111 Ų11156%0.5663%0.629SS**Hα-helixtrans-65.9-42171.2-76.9170000112.1R230 L231 Q232L228-R230 VanDerWaalsContact C-N 3.28Å; L228-R230 PolarHBondContact O-N 2.82Å; L228-L231 PolarHBondContact O-N 3.11Å; L228-Q232 WeakPolarHBondContact O-CG 3.31Å; L228-Q232 PolarHBondContact O-N 2.89Å
229A50.4Low49.2Very low44 Ų44112.9 Ų112.936%0.36465%0.646SS.*Hα-helixtrans-65.7-29.3176.200000113E225 E226 R233E225-A229 WeakPolarHBondContact O-CB 3.21Å; E225-A229 PolarHBondContact O-N 3.12Å; E226-A229 PolarHBondContact O-N 3.16Å; A229-R233 WeakPolarHBondContact O-CG 3.23Å; A229-R233 PolarHBondContact O-N 2.71Å
230R50.7Low48.3Very low156 Ų156115 Ų11559%0.58966%0.659SS**Hα-helixtrans-74.2-40.2172.1-71.1176.571.3-166.51.9111.9E226 L227 L228 Q232 R233 V234E226-R230 HydrophobicContact CG-CG 4.49Å; E226-R230 WeakPolarHBondContact O-CG 3.47Å; E226-R230 PolarHBondContact O-N 3.28Å; L227-R230 PolarHBondContact O-N 3.27Å; L228-R230 VanDerWaalsContact C-N 3.28Å; L228-R230 PolarHBondContact O-N 2.82Å; R230-Q232 PolarHBondContact O-N 3.47Å; R230-R233 PolarHBondContact O-N 2.84Å; R230-V234 PolarHBondContact O-N 3.23Å
231L49.5Very low47.4Very low106 Ų106114.8 Ų114.856%0.55567%0.665SS**Hα-helixtrans-60.7-44.4175.4-132.981.3000112L227 L228 R233 V234L227-L231 PolarHBondContact O-N 3.35Å; L228-L231 PolarHBondContact O-N 3.11Å; L231-R233 VanDerWaalsContact C-N 3.3Å; L231-R233 PolarHBondContact O-N 2.87Å; L231-V234 PolarHBondContact O-N 2.92Å
232Q50.9Low46.5Very low141 Ų141113.5 Ų113.566%0.65968%0.676SS**Hα-helixtrans-66.1-28.3179.3-71.9179.7-8.600113.7L228 R230 H236L228-Q232 WeakPolarHBondContact O-CG 3.31Å; L228-Q232 PolarHBondContact O-N 2.89Å; R230-Q232 PolarHBondContact O-N 3.47Å; Q232-H236 PolarHBondContact O-ND1 2.93Å
233R50.6Low45.9Very low193 Ų193112 Ų11273%0.72867%0.674SS**Hα-helixtrans-80.6-18.4178.4-77.2-162.9-70164.3-5.2114.6A229 R230 L231 G235A229-R233 WeakPolarHBondContact O-CG 3.23Å; A229-R233 PolarHBondContact O-N 2.71Å; R230-R233 PolarHBondContact O-N 2.84Å; L231-R233 VanDerWaalsContact C-N 3.3Å; L231-R233 PolarHBondContact O-N 2.87Å; R233-G235 VanDerWaalsContact C-N 3.29Å
234V44.6Very low45.1Very low123 Ų123116.3 Ų116.375%0.74570%0.696SS**Hα-helixtrans-74.1-21.7173172.30000111.8R230 L231R230-V234 PolarHBondContact O-N 3.23Å; L231-V234 PolarHBondContact O-N 2.92Å
235G44.2Very low44.2Very low61 Ų61117.2 Ų117.263%0.62971%0.705SS**THydrogen-bonded Turntrans-85.9-0.1-178.100000117.1R233R233-G235 VanDerWaalsContact C-N 3.29Å
236H42.9Very low43.1Very low166 Ų166117.8 Ų117.877%0.76971%0.706SS**  trans-134.440.6-169.4-72.4101.4000114.9Q232 G238Q232-H236 PolarHBondContact O-ND1 2.93Å; H236-G238 PolarHBondContact O-N 3.45Å
237S41.2Very low42.3Very low117 Ų117120.1 Ų120.182%0.81872%0.716SS**  trans-92.682.5166.661.60000111.9
238G34.4Very low41.7Very low68 Ų68119.6 Ų119.670%0.70172%0.721SS**  trans106153.8169.100000115.2H236H236-G238 PolarHBondContact O-N 3.45Å
239P45.9Very low41.2Very low127 Ų127122.8 Ų122.883%0.82574%0.738SS**  cis-110.2160.21.938-28000114.2
240C38.1Very low40.4Very low135 Ų135126.9 Ų126.991%0.91276%0.764SS**  trans-66133163-80.10000110.3
241G36.1Very low39.4Very low81 Ų81123 Ų12384%0.83577%0.772SS**  trans-78.5163.5178.700000114.1
242G34.3Very low38.7Very low71 Ų71122 Ų12273%0.73279%0.788SS**  trans-16576.4178.600000112.2
243D33.3Very low37.7Very low153 Ų153119.1 Ų119.182%0.81880%0.796SS**  trans51.7112148.3-56.2-26.1000123.3
244C35.4Very low37Very low136 Ų136122 Ų12292%0.91981%0.807SS**  68.6148.6129.184.70000121.7
245G31.2Very low36.4Very low65 Ų65119.5 Ų119.567%0.6781%0.806SS**  trans14850.217100000117.1H247G245-H247 PolarHBondContact O-N 2.89Å
246F32.7Very low36Very low185 Ų185122.9 Ų122.981%0.81182%0.82SS**  trans-81.4105.1-178.3-147.7-79.4000112
247H38.5Very low35.7Very low180 Ų180126.4 Ų126.483%0.83383%0.827SS**  trans-133.792.6169.9-59.6-37.7000111.7G245G245-H247 PolarHBondContact O-N 2.89Å
248S38.8Very low35.3Very low96 Ų96126 Ų12667%0.67182%0.824SS**  trans-79.8120.6164-52.80000109.8
249L41.1Very low35.3Very low174 Ų174134.1 Ų134.191%0.91184%0.835SS**  trans-134.4124.4160-78.8179.6000111.3
250S33.1Very low34.6Very low130 Ų130131.9 Ų131.991%0.90984%0.835SS**  trans-71.1144.7171.9154.40000111.2
251G31.2Very low34.4Very low74 Ų74128.8 Ų128.876%0.76383%0.826SS**  trans169.8104.1165.200000113.9
252G33.8Very low34.6Very low87 Ų87133.4 Ų133.490%0.89783%0.826SS**  trans-80.7154.3169.400000112.2
253G30.3Very low34.6Very low80 Ų80137.7 Ų137.783%0.82583%0.832SS**  trans-176.1133.2175.900000113.3
254R36.4Very low35Very low253 Ų253134.5 Ų134.596%0.95582%0.822SS**  trans-81.7128.5178-78.1169147-121.30.7111.5
255G31.5Very low35.5Very low70 Ų70134.2 Ų134.272%0.72282%0.819SS**  trans58.8131.8136.700000121.4
256S35.2Very low35.7Very low133 Ų133136.2 Ų136.293%0.9382%0.821SS**  trans-172.6157.2130.8-850000111.9
257R36.5Very low35.9Very low239 Ų239137.4 Ų137.490%0.90282%0.822SS**  trans-89.7147.1176.4-60.7173.9173.4-139-0.9111
258S33.4Very low36.1Very low108 Ų108134 Ų13476%0.75582%0.818SS**  173.3129.7121.9-81.50000115.3
259Y34.8Very low35.9Very low239 Ų239136.3 Ų136.394%0.93782%0.82SS**  trans24.9133.3140.4-71.2-88.6000123.4
260G31.3Very low35.4Very low81 Ų81132.9 Ų132.984%0.83581%0.81SS**  trans158113.4142.200000117.8
261G33.3Very low35.7Very low70 Ų70137.4 Ų137.472%0.72281%0.809SS**  trans89.3115.8170.500000114.5
262Q39.3Very low36Very low177 Ų177138.5 Ų138.583%0.82781%0.805SS**  57117.154.3-49.4-88.261.600109.8
263D35.3Very low36Very low161 Ų161141.7 Ų141.786%0.86180%0.797SS**  cis-134.2168.341.8-63.5-49.6000116.2
264S42.4Very low36.5Very low87 Ų87144 Ų14461%0.60880%0.795SS**  trans-119.3156.6176.5-1710000109.9C266S264-C266 PolarHBondContact OG-N 3.07Å
265P44.8Very low36.8Very low130 Ų130140.4 Ų140.484%0.84478%0.782SS**  -140.1141.594.135.6-21.4000115
266C34.8Very low37.3Very low107 Ų107145 Ų14572%0.72379%0.789SS**  trans-76.4149.2172.3-51.70000112.2S264S264-C266 PolarHBondContact OG-N 3.07Å
267Y38.2Very low37.5Very low210 Ų210143.6 Ų143.682%0.82478%0.78SS**  trans-119.3101.9157.6-163.6-92.9000108.8M269Y267-M269 HydrophobicContact CD1-CG 4.3Å; Y267-M269 HydrophobicContact CE1-CG 3.69Å; Y267-M269 HydrophobicContact CE1-SD 4.38Å
268S42.1Very low37.8Very low108 Ų108138.4 Ų138.476%0.75578%0.777SS**  trans-106.1121.5174.9-64.80000109.6
269M35Very low38Very low145 Ų145136.8 Ų136.871%0.71478%0.777SS**  trans-92.7125.8162.2-72.6-11863.200108.5Y267Y267-M269 HydrophobicContact CD1-CG 4.3Å; Y267-M269 HydrophobicContact CE1-CG 3.69Å; Y267-M269 HydrophobicContact CE1-SD 4.38Å
270S30.7Very low38.9Very low101 Ų101134.1 Ų134.171%0.70677%0.773SS**  trans-103.5130.2176.1-176.30000109.3
271Y38.3Very low39.6Very low225 Ų225138 Ų13888%0.88278%0.775SS**  trans-130.8128.4153.6-101.9-90.3000107.9
272S38.6Very low40.1Very low97 Ų97141.8 Ų141.868%0.67878%0.779SS**  trans-84.6126.7-171.249.10000112
273E34.4Very low40.2Very low155 Ų155139.6 Ų139.672%0.72477%0.773SS**  trans-75.4139.7155.5-71.3-157.3139.300110.7Y275E273-Y275 WeakPolarHBondContact OE2-CE2 3.4Å
274T41.2Very low40.5Very low127 Ų127138 Ų13878%0.77977%0.769SS**  trans-131.388.5165.4-53.30000108.4
275Y42.3Very low41.1Very low179 Ų179138.9 Ų138.970%0.70277%0.772SS**  trans-75.3133.4168.4-91.8-96.5000110.8E273E273-Y275 WeakPolarHBondContact OE2-CE2 3.4Å
276L40.6Very low40.6Very low165 Ų165138.1 Ų138.186%0.86477%0.769SS**  trans-143.3119.2150.4-78.2-178.1000109.4
277S40.3Very low40.9Very low105 Ų105142.3 Ų142.373%0.73478%0.775SS**  trans-73152.4173-47.50000111.9
278P43.6Very low41.2Very low129 Ų129139.9 Ų139.984%0.83878%0.776SS**  trans-82.1135.1144-927.9000109.4
279G37.4Very low41Very low74 Ų74144.7 Ų144.776%0.76378%0.779SS**  trans-86.3176177.500000113.9
280E52.2Low41Very low183 Ų183146.3 Ų146.386%0.85579%0.785SS**  trans-60.3152.6162.363.3-152.2150.200112.6
281D46.6Very low41Very low162 Ų162144.2 Ų144.287%0.86678%0.779SS**  trans178.3154.4146.2-91-25.5000111
282D44.8Very low40.9Very low150 Ų150139.8 Ų139.880%0.80278%0.776SS**  trans-93.8165.1-157.1-67.4-64.7000119
283D41.2Very low40.6Very low132 Ų132141.1 Ų141.171%0.70678%0.779SS**  trans54.8100.1141.1-73.6-27000124.7
284T41.9Very low40.3Very low128 Ų128138.8 Ų138.879%0.78578%0.779SS**  trans64.8172.2132.768.50000121.3
285P55.2Low39.8Very low104 Ų104140.5 Ų140.568%0.67578%0.779SS**  -131.5-178.7-61.739.5-23.9000114.5
286C33.1Very low39.3Very low115 Ų115139.8 Ų139.878%0.77778%0.782SS**  trans75.1135.8167.2-48.40000116.2
287K42.1Very low39Very low195 Ų195140.3 Ų140.385%0.84878%0.78SS**  -163.1162.953.1-87.2-175.2173.1172.60113.6
288D43.9Very low38.8Very low158 Ų158139.3 Ų139.385%0.84578%0.777SS**  trans-73.1146.6174.9-25.4-91000112.6
289Y36.7Very low38.2Very low210 Ų210142.6 Ų142.682%0.82478%0.782SS**  trans-152.7134.1141.5-164.6-104.9000112
290E36.4Very low37.9Very low179 Ų179142 Ų14284%0.83678%0.776SS**  trans-111.7143.3-178178.3-179.8-174.800109.7
291G30.4Very low37Very low56 Ų56142.5 Ų142.558%0.57778%0.778SS**  trans99.1153.1174.100000114.8
292T37Very low36.3Very low133 Ų133138.1 Ų138.182%0.81677%0.771SS**  cis-143.915416.148.20000114.1
293V30.7Very low35.9Very low124 Ų124138.6 Ų138.675%0.75278%0.779SS**  trans-44.2146.2157.8168.50000113.1
294C29.5Very low35.6Very low107 Ų107135.5 Ų135.572%0.72378%0.779SS**  trans-176.5119.3133.3-92.80000108
295Q30.1Very low35.6Very low163 Ų163140.5 Ų140.576%0.76279%0.785SS**  54.2111.393.9-72.8-172.8-52.600113
296E32.6Very low35.4Very low164 Ų164141 Ų14177%0.76679%0.788SS**  76.2106.657.2-167.9171.2177.600112
297E32.9Very low36.2Very low176 Ų176140.8 Ų140.882%0.82279%0.785SS**  trans76.5145.9165.1-31.6-136.7107.400122.5
298A35.9Very low36.3Very low83 Ų83139 Ų13969%0.68679%0.785SS**  trans94.9109.1135.600000121
299E32.3Very low36Very low198 Ų198142 Ų14293%0.92579%0.786SS**  trans78.8130.3134.5-64.1-176.3169.700122
300G31.3Very low36.2Very low62 Ų62137.3 Ų137.364%0.63978%0.775SS**  trans126.1119.214400000116.3
301Q32.1Very low36.7Very low194 Ų194134.3 Ų134.391%0.90777%0.771SS**  trans30.9117.5160.7-80.574.46.600118.1
302G32.3Very low37.4Very low70 Ų70139 Ų13972%0.72278%0.778SS**  cis105.988.833.200000111.8
303V37Very low37.9Very low159 Ų159143.5 Ų143.596%0.96478%0.78SS**  trans-178.6148.3136.4-910000108.7
304G34.7Very low38.6Very low68 Ų68149 Ų14970%0.70179%0.787SS**  cis156.472.7-8.600000114.8
305Y41.1Very low39.2Very low232 Ų232149.1 Ų149.191%0.9178%0.784SS**  trans-137.6154.5169.4-96-88.8000111.4
306P50.4Low39.9Very low115 Ų115146.5 Ų146.575%0.74778%0.784SS**  trans-83.4166.2-165.4-8.827.6000115
307P51Low40.6Very low110 Ų110145.1 Ų145.171%0.71478%0.782SS**  trans-87.3151-169.336.6-35.6000113.5
308D43.2Very low41.5Very low157 Ų157143 Ų14384%0.8478%0.78SS**  trans167.466.1138.8-87.1-14.1000110.4
309Y37.9Very low42Very low222 Ų222143.5 Ų143.587%0.87179%0.785SS**  trans-147.3101.4156.3-138.2-92.1000110.2P311Y309-P311 WeakPolarHBondContact O-CD 3.25Å
310D41.4Very low42.7Very low111 Ų111139.4 Ų139.459%0.59478%0.778SS**  trans-80.8119178.2-173.1-0.8000110H312D310-H312 PolarHBondContact O-N 3.2Å; D310-H312 WeakPolarHBondContact OD1-CA 3.48Å; D310-H312 VanDerWaalsContact OD1-CB 3.25Å; D310-H312 WeakPolarHBondContact OD1-CB 3.41Å; D310-H312 IonicContact OD1-CD2 3.24Å; D310-H312 PolarHBondContact OD1-CD2 3.08Å; D310-H312 VanDerWaalsContact OD1-CD2 3.24Å; D310-H312 IonicContact OD1-CG 3.33Å; D310-H312 PolarHBondContact OD1-N 2.89Å
311P46.2Very low43.5Very low117 Ų117141.6 Ų141.676%0.7678%0.784SS**  trans-72.4-15.7172.8-14.831.2000112.6Y309 R313Y309-P311 WeakPolarHBondContact O-CD 3.25Å; P311-R313 PolarHBondContact O-N 2.92Å; P311-R313 VanDerWaalsContact O-N 3.16Å
312H45.8Very low44.1Very low155 Ų155135.5 Ų135.572%0.71877%0.773SS**  trans-8195.6177.5-57.2-72.7000110.4D310D310-H312 PolarHBondContact O-N 3.2Å; D310-H312 WeakPolarHBondContact OD1-CA 3.48Å; D310-H312 VanDerWaalsContact OD1-CB 3.25Å; D310-H312 WeakPolarHBondContact OD1-CB 3.41Å; D310-H312 IonicContact OD1-CD2 3.24Å; D310-H312 PolarHBondContact OD1-CD2 3.08Å; D310-H312 VanDerWaalsContact OD1-CD2 3.24Å; D310-H312 IonicContact OD1-CG 3.33Å; D310-H312 PolarHBondContact OD1-N 2.89Å
313R47.6Very low44.6Very low227 Ų227138.5 Ų138.586%0.85778%0.777SS**  173.987128.5-174.5178.7-168.7-149.84.3111.9P311P311-R313 PolarHBondContact O-N 2.92Å; P311-R313 VanDerWaalsContact O-N 3.16Å
314R46.2Very low45Very low240 Ų240136.9 Ų136.991%0.90677%0.767SS**  trans-139.980136-64.5-161.1108.2-121.6-0.9108.9S316R314-S316 PolarHBondContact O-N 2.78Å
315V41.5Very low45.6Very low108 Ų108138.5 Ų138.566%0.65577%0.767SS**  trans-55.9127.2156.5-71.10000107.6
316S44.8Very low45.5Very low108 Ų108134.5 Ų134.576%0.75576%0.761SS**  trans-110.894.8158.348.20000104.7R314 V318R314-S316 PolarHBondContact O-N 2.78Å; S316-V318 PolarHBondContact O-N 3.33Å
317D48.1Very low45.3Very low135 Ų135136 Ų13672%0.72276%0.763SS**  trans-65.699.3-175.9-58.2-61.7000108.9A319D317-A319 PolarHBondContact O-N 2.94Å; D317-A319 VanDerWaalsContact O-N 3.08Å
318V50Low45.4Very low131 Ų131140.1 Ų140.179%0.79477%0.772SS**  trans-71103.4164.7-176.80000105.8S316 S320S316-V318 PolarHBondContact O-N 3.33Å; V318-S320 VanDerWaalsContact C-N 3.25Å; V318-S320 PolarHBondContact O-N 3.19Å
319A48.1Very low45.6Very low95 Ų95141.3 Ų141.379%0.78577%0.773SS**  trans-67.183.8179.100000110.6D317 S321D317-A319 PolarHBondContact O-N 2.94Å; D317-A319 VanDerWaalsContact O-N 3.08Å; A319-S321 VanDerWaalsContact C-N 3.32Å; A319-S321 PolarHBondContact O-N 3.36Å
320S46.7Very low46.2Very low112 Ų112138.8 Ų138.878%0.78377%0.769SS**  trans-60.298.4159.4-77.60000107.9V318 G322V318-S320 VanDerWaalsContact C-N 3.25Å; V318-S320 PolarHBondContact O-N 3.19Å; S320-G322 VanDerWaalsContact C-N 3.3Å; S320-G322 PolarHBondContact O-N 3.44Å
321S47.3Very low46.3Very low108 Ų108143.3 Ų143.376%0.75579%0.787SS**  trans-64.295.1168.3-178.30000108.1A319 V323A319-S321 VanDerWaalsContact C-N 3.32Å; A319-S321 PolarHBondContact O-N 3.36Å; S321-V323 PolarHBondContact O-N 3.16Å
322G45.9Very low46.2Very low66 Ų66145.8 Ų145.868%0.6879%0.788SS**  trans-67.5109.3166.200000108.2S320 V324S320-G322 VanDerWaalsContact C-N 3.3Å; S320-G322 PolarHBondContact O-N 3.44Å; G322-V324 PolarHBondContact O-N 2.83Å
323V41.9Very low46.3Very low133 Ų133146.8 Ų146.881%0.80679%0.793SS**  trans-70.4119.1163.1-73.60000107.7S321 S325S321-V323 PolarHBondContact O-N 3.16Å; V323-S325 PolarHBondContact O-N 3.17Å
324V46.1Very low46.3Very low124 Ų124145.4 Ų145.475%0.75280%0.797SS**  trans-68.9124.4175.7172.10000107.9G322 L326G322-V324 PolarHBondContact O-N 2.83Å; V324-L326 PolarHBondContact O-N 3.44Å
325S46.9Very low46.2Very low102 Ų102141.5 Ų141.571%0.71379%0.793SS**  trans-62.9113.1158-56.80000107V323 D327V323-S325 PolarHBondContact O-N 3.17Å; S325-D327 PolarHBondContact O-N 3.13Å
326L39.6Very low46.6Very low149 Ų149146 Ų14678%0.7881%0.806SS**  trans-75.3116.2157.8-77.4170.2000106.2V324 E328V324-L326 PolarHBondContact O-N 3.44Å; L326-E328 PolarHBondContact O-N 3.24Å; L326-E328 VanDerWaalsContact O-N 3.17Å
327D44.3Very low47Very low147 Ų147149.3 Ų149.379%0.78681%0.81SS**  trans-68.5104.4163.2-69.4-53000107S325 E329S325-D327 PolarHBondContact O-N 3.13Å; D327-E329 PolarHBondContact O-N 3.45Å; D327-E329 VanDerWaalsContact O-N 3.13Å
328E53.8Low47.1Very low195 Ų195154.3 Ų154.391%0.91182%0.819SS**  trans-80.376.2168.1-71-179.517100108.4L326L326-E328 PolarHBondContact O-N 3.24Å; L326-E328 VanDerWaalsContact O-N 3.17Å
329E48Very low47Very low182 Ų182152.6 Ų152.685%0.8582%0.819SS**  trans-129.9137.2171.3-158.3165-128.700108.4D327D327-E329 PolarHBondContact O-N 3.45Å; D327-E329 VanDerWaalsContact O-N 3.13Å
330E51.2Low46.8Very low170 Ų170157.7 Ų157.779%0.79483%0.826SS**  trans73.962.6174.2-149.4171.3-136.300118
331E42.2Very low46.9Very low206 Ų206161.3 Ų161.396%0.96383%0.831SS**  trans-113.969.2142.2-134.4177.6-150.200108.4E333E331-E333 PolarHBondContact O-N 3.29Å; E331-E333 VanDerWaalsContact O-N 3.11Å
332E45Very low47.2Very low168 Ų168161.7 Ų161.779%0.78583%0.83SS**  trans-68103.1174-74.7-167.215700110.4E334E332-E334 PolarHBondContact O-N 3.11Å
333E46.6Very low47Very low177 Ų177165.9 Ų165.983%0.82784%0.837SS**  trans40.555.4137.4-56.5-169.2159.100118E331 L335E331-E333 PolarHBondContact O-N 3.29Å; E331-E333 VanDerWaalsContact O-N 3.11Å; E333-L335 PolarHBondContact O-N 2.83Å
334E47.6Very low47Very low198 Ų198166.2 Ų166.293%0.92584%0.835SS**THydrogen-bonded Turntrans-72.852.6154.8-157.5-177.7-135.600110.7E332E332-E334 PolarHBondContact O-N 3.11Å
335L45.2Very low46.9Very low157 Ų157172.6 Ų172.682%0.82286%0.856SS**THydrogen-bonded Turntrans-138.724.9177.7-77.1-179.8000113.1E333 E337E333-L335 PolarHBondContact O-N 2.83Å; L335-E337 PolarHBondContact O-N 3.04Å
336E49.3Very low46.9Very low202 Ų202176.2 Ų176.294%0.94486%0.863SS**  trans-87.541.5163.3-152.3177.1-149.100112.4
337E53Low47.3Very low179 Ų179177.6 Ų177.684%0.83687%0.868SS**SBendtrans-124.3119.9157.3-165.6-179.1178.500109.2L335L335-E337 PolarHBondContact O-N 3.04Å
338R50.6Low47.4Very low240 Ų240179.3 Ų179.391%0.90687%0.872SS**SBendtrans8669.6170.1-158.3-169.1-166.71576.4118.1
339A47.3Very low47Very low95 Ų95178.4 Ų178.479%0.78587%0.87SS**  -170.798.3120.200000113.2
340E43.8Very low47Very low202 Ų202178.1 Ų178.194%0.94487%0.871SS**  trans-170.996.1136-108.9177-173.800112.9
341E49.6Very low46.7Very low188 Ų188178.7 Ų178.788%0.87988%0.876SS**  trans-116.1160.5145.3-93.5-165.3152.900106.4
342P53.2Low47Very low115 Ų115176.7 Ų176.775%0.74787%0.87SS**  cis-131.6163.4-30.637.7-23.9000111.7
343N41.3Very low47.2Very low155 Ų155177.4 Ų177.483%0.82988%0.877SS**  trans-150.2151.3152.8-146.1-10.2000115.1
344N43.2Very low47.2Very low140 Ų140177.4 Ų177.475%0.74988%0.881SS**  trans-74.2145.5-170.4-54.5-100.5000113.3
345Q42.9Very low47.2Very low258 Ų258175.5 Ų175.5100%1.20688%0.877SS**  -153.20124.9-160.173.482.600110.9

Retrieved 345 of 345 residues in 268.9 ms (Link to these results)