A0A060XKK0_ONCMY Loading...

STARD3 N-terminal like

AlphaFold DB , UniProt , Accession A0A060XKK0, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene stard3nl, Length 225 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
1M37.7Very low36.4Very low224 Ų224143.3 Ų143.3100%1.10384%0.844SS**  088.10-78.3165143.800106
2E34.7Very low36.5Very low179 Ų179149.7 Ų149.784%0.83684%0.843SS**  54.7127.484.2-71.9168.2104.400110.3
3S36.5Very low37.1Very low106 Ų106144.6 Ų144.674%0.74183%0.832SS**  cis174.6149.51.536.50000104
4R37Very low37.2Very low244 Ų244143.8 Ų143.892%0.92183%0.831SS**  165.2123.9121.4-131.4165.6179.3164.2-1.3112.6
5S37.5Very low37.7Very low121 Ų121146.6 Ų146.685%0.84684%0.84SS**  trans-84.8161.7167.7-46.90000112
6G33.3Very low37.8Very low80 Ų80151.9 Ų151.983%0.82584%0.842SS**  trans103.4131.6163.200000113.2
7S32.3Very low38.3Very low114 Ų114146.2 Ų146.280%0.79783%0.826SS**  cis-153.9144.738.448.90000113
8S44.3Very low38.9Very low118 Ų118146.3 Ų146.383%0.82582%0.822SS**  trans-79.1128.7158.3172.70000108.7
9V39.2Very low39.5Very low126 Ų126145.6 Ų145.676%0.76482%0.817SS**  trans-144.3114.5156.5-169.20000109.7
10D33.5Very low40.2Very low132 Ų132142.6 Ų142.671%0.70680%0.802SS**  trans-25.8126.6161.5-85.6-48.9000115.2R12D10-R12 PolarHBondContact O-N 3.12Å; D10-R12 VanDerWaalsContact O-N 3.11Å
11S34.8Very low40.9Very low132 Ų132140.9 Ų140.992%0.92380%0.795SS**  trans-83.276154.5-68.20000108.9
12R36.9Very low42Very low220 Ų220134.2 Ų134.283%0.8377%0.768SS**  trans-67.8133.3164.4-127.4178.5-179.1162.40.2108.8D10D10-R12 PolarHBondContact O-N 3.12Å; D10-R12 VanDerWaalsContact O-N 3.11Å
13A44.6Very low43.1Very low84 Ų84130.7 Ų130.769%0.69476%0.755SS**  trans57.2102.5143.400000118.2
14T38Very low44.1Very low133 Ų133130.3 Ų130.382%0.81674%0.744SS**  trans-143.562.6139.621.30000109.5R16T14-R16 PolarHBondContact O-N 3.18Å
15L44.8Very low45.2Very low186 Ų186121.2 Ų121.297%0.97472%0.721SS**  trans-68.972.2151-165.392000106.8G17L15-G17 PolarHBondContact O-N 3.06Å; L15-G17 VanDerWaalsContact O-N 3.15Å
16R39.9Very low46.2Very low231 Ų231122.8 Ų122.887%0.87271%0.708SS**  trans-83.893.5-175.4-166.5175.2-167.6170.62.9108.9T14T14-R16 PolarHBondContact O-N 3.18Å
17G45.6Very low47.6Very low55 Ų55123.1 Ų123.157%0.56769%0.69SS**  trans60.573.414000000116.3L15 N19L15-G17 PolarHBondContact O-N 3.06Å; L15-G17 VanDerWaalsContact O-N 3.15Å; G17-N19 PolarHBondContact O-N 2.88Å
18I50.3Low48.9Very low149 Ų149123.4 Ų123.476%0.76468%0.679SS**  trans-65123.8149.1-59.4172.7000105.3T20I18-T20 HydrophobicContact CB-CG2 4.25Å; I18-T20 HydrophobicContact CG2-CG2 3.89Å; I18-T20 PolarHBondContact O-N 3.08Å; I18-T20 PolarHBondContact O-OG1 3.4Å
19N49.4Very low49.7Very low133 Ų133121 Ų12171%0.71166%0.662SS**  trans-63.469.3175.5-67.9-37.3000110.8G17 P22G17-N19 PolarHBondContact O-N 2.88Å; N19-P22 HydrophobicContact CB-CG 4.28Å; N19-P22 WeakPolarHBondContact O-CD 3.4Å
20T54Low50.5Low84 Ų84119.9 Ų119.952%0.51565%0.645SS.*Hα-helixtrans-79.8-22.417945.60000112.1I18 L23 L24I18-T20 HydrophobicContact CB-CG2 4.25Å; I18-T20 HydrophobicContact CG2-CG2 3.89Å; I18-T20 PolarHBondContact O-N 3.08Å; I18-T20 PolarHBondContact O-OG1 3.4Å; T20-L23 PolarHBondContact O-N 2.97Å; T20-L24 WeakPolarHBondContact O-CB 3.25Å; T20-L24 PolarHBondContact O-N 2.8Å
21T55.3Low51.6Low108 Ų108117.6 Ų117.666%0.66363%0.63SS**Hα-helixtrans-61-47.3-179.726.80000115.2A25T21-A25 VanDerWaalsContact O-CB 3.29Å; T21-A25 WeakPolarHBondContact O-CB 3.25Å; T21-A25 PolarHBondContact O-N 2.52Å
22P60Low52.6Low83 Ų83113.8 Ų113.854%0.53961%0.607SS.*Hα-helixtrans-71.4-31.5178.526.4-33.9000112.6N19 R26N19-P22 HydrophobicContact CB-CG 4.28Å; N19-P22 WeakPolarHBondContact O-CD 3.4Å; P22-R26 WeakPolarHBondContact O-CB 3.2Å; P22-R26 PolarHBondContact O-N 2.95Å; P22-R26 VanDerWaalsContact O-N 3.09Å
23L57.4Low53.4Low106 Ų106106.9 Ų106.956%0.55559%0.592SS**Hα-helixtrans-74.3-42.6178.9-143.8-166.3000110.8T20 R26 I27T20-L23 PolarHBondContact O-N 2.97Å; L23-R26 WeakPolarHBondContact O-CB 3.34Å; L23-R26 PolarHBondContact O-N 3.22Å; L23-I27 HydrophobicContact CD2-CD1 3.6Å; L23-I27 HydrophobicContact CD2-CG1 3.82Å; L23-I27 VanDerWaalsContact O-CG1 3.31Å; L23-I27 WeakPolarHBondContact O-CG1 2.95Å; L23-I27 PolarHBondContact O-N 3.13Å
24L58.3Low53.8Low97 Ų97106 Ų10651%0.50857%0.573SS.*Hα-helixtrans-67.2-44.4178.1-154.6169.8000110.5T20 R26 I27 E28T20-L24 WeakPolarHBondContact O-CB 3.25Å; T20-L24 PolarHBondContact O-N 2.8Å; L24-R26 VanDerWaalsContact C-N 3.27Å; L24-R26 PolarHBondContact O-N 3.36Å; L24-I27 CarbonylContact O-C 3.53Å; L24-I27 PolarHBondContact O-N 3.05Å; L24-I27 VanDerWaalsContact O-N 3.15Å; L24-E28 HydrophobicContact CD2-CG 4.4Å; L24-E28 WeakPolarHBondContact O-CB 2.91Å; L24-E28 PolarHBondContact O-N 3.42Å
25A59Low54.6Low54 Ų54105.5 Ų105.545%0.44656%0.56SS.*Hα-helixtrans-62-35.3174.300000112.7T21 S29T21-A25 VanDerWaalsContact O-CB 3.29Å; T21-A25 WeakPolarHBondContact O-CB 3.25Å; T21-A25 PolarHBondContact O-N 2.52Å; A25-S29 WeakPolarHBondContact O-CB 3.49Å; A25-S29 PolarHBondContact O-N 2.72Å; A25-S29 PolarHBondContact O-OG 2.98Å
26R59.4Low55.2Low154 Ų154103.7 Ų103.758%0.58154%0.544SS*.Hα-helixtrans-66.3-46.4172.7-172.5168.3-172.4142.85.3111.1P22 L23 L24 S29 Y30P22-R26 WeakPolarHBondContact O-CB 3.2Å; P22-R26 PolarHBondContact O-N 2.95Å; P22-R26 VanDerWaalsContact O-N 3.09Å; L23-R26 WeakPolarHBondContact O-CB 3.34Å; L23-R26 PolarHBondContact O-N 3.22Å; L24-R26 VanDerWaalsContact C-N 3.27Å; L24-R26 PolarHBondContact O-N 3.36Å; R26-S29 WeakPolarHBondContact CA-OG 3.49Å; R26-S29 PolarHBondContact O-N 2.88Å; R26-S29 PolarHBondContact O-OG 3.19Å; R26-Y30 HydrophobicContact CG-CD2 3.77Å; R26-Y30 HydrophobicContact CG-CE2 3.42Å; R26-Y30 VanDerWaalsContact CG-CE2 3.42Å; R26-Y30 PolarHBondContact NH2-OH 2.63Å; R26-Y30 WeakPolarHBondContact O-CD2 3.14Å; R26-Y30 PolarHBondContact O-N 3.35Å
27I62.4Low56Low86 Ų8694.7 Ų94.744%0.44152%0.516SS..Hα-helixtrans-61-45.4174.1-69.6168.7000110.9L23 L24 S29 Y30 E31L23-I27 HydrophobicContact CD2-CD1 3.6Å; L23-I27 HydrophobicContact CD2-CG1 3.82Å; L23-I27 VanDerWaalsContact O-CG1 3.31Å; L23-I27 WeakPolarHBondContact O-CG1 2.95Å; L23-I27 PolarHBondContact O-N 3.13Å; L24-I27 CarbonylContact O-C 3.53Å; L24-I27 PolarHBondContact O-N 3.05Å; L24-I27 VanDerWaalsContact O-N 3.15Å; I27-S29 VanDerWaalsContact C-N 3.35Å; I27-S29 PolarHBondContact O-N 2.71Å; I27-Y30 PolarHBondContact O-N 2.63Å; I27-E31 VanDerWaalsContact O-CB 3.3Å; I27-E31 WeakPolarHBondContact O-CB 3.26Å; I27-E31 PolarHBondContact O-N 2.94Å
28E60.8Low56.8Low121 Ų12195.7 Ų95.757%0.56551%0.508SS*.Hα-helixtrans-63.4-39.8179.8-122.9-179.6167.800111.7L24 E31 A32L24-E28 HydrophobicContact CD2-CG 4.4Å; L24-E28 WeakPolarHBondContact O-CB 2.91Å; L24-E28 PolarHBondContact O-N 3.42Å; E28-E31 PolarHBondContact O-N 3.34Å; E28-A32 WeakPolarHBondContact O-CB 3.15Å; E28-A32 PolarHBondContact O-N 3.41Å
29S59.7Low57.3Low68 Ų6890.8 Ų90.848%0.47649%0.487SS..Hα-helixtrans-69.5-36.3174.558.50000112.8A25 R26 I27 S33A25-S29 WeakPolarHBondContact O-CB 3.49Å; A25-S29 PolarHBondContact O-N 2.72Å; A25-S29 PolarHBondContact O-OG 2.98Å; R26-S29 WeakPolarHBondContact CA-OG 3.49Å; R26-S29 PolarHBondContact O-N 2.88Å; R26-S29 PolarHBondContact O-OG 3.19Å; I27-S29 VanDerWaalsContact C-N 3.35Å; I27-S29 PolarHBondContact O-N 2.71Å; S29-S33 WeakPolarHBondContact O-CB 3.39Å; S29-S33 PolarHBondContact O-N 3.11Å
30Y56.4Low58.2Low102 Ų10288.9 Ų88.940%0.448%0.477SS..Hα-helixtrans-66.4-43.6171.2-80-66.4000111.4R26 I27 S33 E34R26-Y30 HydrophobicContact CG-CD2 3.77Å; R26-Y30 HydrophobicContact CG-CE2 3.42Å; R26-Y30 VanDerWaalsContact CG-CE2 3.42Å; R26-Y30 PolarHBondContact NH2-OH 2.63Å; R26-Y30 WeakPolarHBondContact O-CD2 3.14Å; R26-Y30 PolarHBondContact O-N 3.35Å; I27-Y30 PolarHBondContact O-N 2.63Å; Y30-S33 CarbonylContact O-C 3.57Å; Y30-S33 PolarHBondContact O-N 2.86Å; Y30-E34 VanDerWaalsContact O-CB 3.32Å; Y30-E34 WeakPolarHBondContact O-CB 3.19Å; Y30-E34 PolarHBondContact O-N 3.43Å
31E57.5Low59Low83 Ų8385.8 Ų85.839%0.38846%0.458SS..Hα-helixtrans-68.8-36.9-179.4-152.2-168.9153.400111.5I27 E28 K35I27-E31 VanDerWaalsContact O-CB 3.3Å; I27-E31 WeakPolarHBondContact O-CB 3.26Å; I27-E31 PolarHBondContact O-N 2.94Å; E28-E31 PolarHBondContact O-N 3.34Å; E31-K35 VanDerWaalsContact CD-NZ 3.33Å; E31-K35 VanDerWaalsContact O-CB 3.29Å; E31-K35 WeakPolarHBondContact O-CB 3.44Å; E31-K35 WeakPolarHBondContact O-CD 3.42Å; E31-K35 WeakPolarHBondContact O-CG 3.3Å; E31-K35 PolarHBondContact O-N 3Å; E31-K35 WeakPolarHBondContact OE1-CE 3.25Å; E31-K35 IonicContact OE1-NZ 3.88Å; E31-K35 PolarHBondContact OE1-NZ 3.19Å
32A54.6Low59.9Low53 Ų5384.5 Ų84.544%0.43844%0.44SS..Hα-helixtrans-71.1-34.7173.600000112.4E28 K36E28-A32 WeakPolarHBondContact O-CB 3.15Å; E28-A32 PolarHBondContact O-N 3.41Å; A32-K36 WeakPolarHBondContact O-CG 3.45Å; A32-K36 PolarHBondContact O-N 2.95Å
33S53.7Low60.7Low74 Ų7488.5 Ų88.552%0.51745%0.445SS..Hα-helixtrans-71.8-40173.5-172.90000111.6S29 Y30 K36 C37S29-S33 WeakPolarHBondContact O-CB 3.39Å; S29-S33 PolarHBondContact O-N 3.11Å; Y30-S33 CarbonylContact O-C 3.57Å; Y30-S33 PolarHBondContact O-N 2.86Å; S33-K36 PolarHBondContact O-N 3.24Å; S33-C37 WeakPolarHBondContact O-CB 3.32Å; S33-C37 PolarHBondContact O-N 2.93Å
34E53.1Low61.8Low65 Ų6587.5 Ų87.530%0.30444%0.443SS..Hα-helixtrans-61.3-51.6173.7-107.7-179.8125.300110.6Y30 K36 C37 I38Y30-E34 VanDerWaalsContact O-CB 3.32Å; Y30-E34 WeakPolarHBondContact O-CB 3.19Å; Y30-E34 PolarHBondContact O-N 3.43Å; E34-K36 PolarHBondContact O-N 3.24Å; E34-C37 PolarHBondContact O-N 3.39Å; E34-I38 WeakPolarHBondContact O-CB 3.23Å; E34-I38 WeakPolarHBondContact O-CG2 3.28Å; E34-I38 PolarHBondContact O-N 3.05Å
35K55.9Low62.7Low124 Ų12484.1 Ų84.154%0.53942%0.424SS..Hα-helixtrans-58.3-33.9179.1-75.6167.7-174.6164.80112E31 S39E31-K35 VanDerWaalsContact CD-NZ 3.33Å; E31-K35 VanDerWaalsContact O-CB 3.29Å; E31-K35 WeakPolarHBondContact O-CB 3.44Å; E31-K35 WeakPolarHBondContact O-CD 3.42Å; E31-K35 WeakPolarHBondContact O-CG 3.3Å; E31-K35 PolarHBondContact O-N 3Å; E31-K35 WeakPolarHBondContact OE1-CE 3.25Å; E31-K35 IonicContact OE1-NZ 3.88Å; E31-K35 PolarHBondContact OE1-NZ 3.19Å; K35-S39 VanDerWaalsContact O-CB 3.24Å; K35-S39 WeakPolarHBondContact O-CB 3.2Å; K35-S39 PolarHBondContact O-OG 3.36Å
36K57.1Low63.5Low148 Ų14884.2 Ų84.264%0.64342%0.421SS*.Hα-helixtrans-75.7-51174.8-78.3179.9176.4-179.40111.9A32 S33 E34 S39 D40A32-K36 WeakPolarHBondContact O-CG 3.45Å; A32-K36 PolarHBondContact O-N 2.95Å; S33-K36 PolarHBondContact O-N 3.24Å; E34-K36 PolarHBondContact O-N 3.24Å; K36-S39 PolarHBondContact O-N 3.3Å; K36-S39 PolarHBondContact O-OG 3.41Å; K36-D40 PolarHBondContact O-N 3.15Å; K36-D40 VanDerWaalsContact O-N 3.14Å
37C56.2Low64.7Low42 Ų4282.2 Ų82.228%0.28442%0.422SS..Hα-helixtrans-62.1-46.9-176.3-164.40000112.4S33 E34 S39 D40 V41 Q168S33-C37 WeakPolarHBondContact O-CB 3.32Å; S33-C37 PolarHBondContact O-N 2.93Å; E34-C37 PolarHBondContact O-N 3.39Å; C37-S39 VanDerWaalsContact C-N 3.26Å; C37-S39 PolarHBondContact O-N 2.91Å; C37-D40 PolarHBondContact O-N 3.3Å; C37-V41 WeakPolarHBondContact O-CG2 3.26Å; C37-V41 PolarHBondContact O-N 3.33Å; C37-Q168 PolarHBondContact SG-NE2 3.35Å
38I61.9Low65.7Low76 Ų7680.3 Ų80.339%0.3941%0.41SS..Hα-helixtrans-64.9-31.9178.2-158.6164000112E34 R42E34-I38 WeakPolarHBondContact O-CB 3.23Å; E34-I38 WeakPolarHBondContact O-CG2 3.28Å; E34-I38 PolarHBondContact O-N 3.05Å; I38-R42 VanDerWaalsContact O-CD 3.3Å; I38-R42 WeakPolarHBondContact O-CD 3.02Å; I38-R42 WeakPolarHBondContact O-CG 3.3Å; I38-R42 PolarHBondContact O-N 2.78Å
39S62.2Low66.7Low46 Ų4674.6 Ų74.632%0.32238%0.383SS..Hα-helixtrans-75.1-32.3-179.5780000113K35 K36 C37 R43K35-S39 VanDerWaalsContact O-CB 3.24Å; K35-S39 WeakPolarHBondContact O-CB 3.2Å; K35-S39 PolarHBondContact O-OG 3.36Å; K36-S39 PolarHBondContact O-N 3.3Å; K36-S39 PolarHBondContact O-OG 3.41Å; C37-S39 VanDerWaalsContact C-N 3.26Å; C37-S39 PolarHBondContact O-N 2.91Å; S39-R43 WeakPolarHBondContact O-CB 3.13Å; S39-R43 PolarHBondContact O-N 3.23Å; S39-R43 VanDerWaalsContact O-N 3.09Å
40D68.1Low68Low93 Ų9373.6 Ų73.650%0.49738%0.375SS..Hα-helixtrans-75-43.3-177.9-77.2-21.1000111.5K36 C37 R42 R43 T44K36-D40 PolarHBondContact O-N 3.15Å; K36-D40 VanDerWaalsContact O-N 3.14Å; C37-D40 PolarHBondContact O-N 3.3Å; D40-R42 PolarHBondContact O-N 3.25Å; D40-R43 PolarHBondContact O-N 2.78Å; D40-T44 PolarHBondContact O-N 3.34Å; D40-T44 PolarHBondContact O-OG1 2.74Å; D40-T44 VanDerWaalsContact O-OG1 3.11Å
41V70.7Confident69.6Low19 Ų1973.4 Ų73.412%0.11538%0.376CS..Hα-helixtrans-58.9-48.1177.3177.60000111.2C37 R43 T44 F45 V165 Q168C37-V41 WeakPolarHBondContact O-CG2 3.26Å; C37-V41 PolarHBondContact O-N 3.33Å; V41-R43 VanDerWaalsContact C-N 3.34Å; V41-R43 PolarHBondContact O-N 2.98Å; V41-T44 PolarHBondContact O-N 3.36Å; V41-F45 WeakPolarHBondContact O-CB 3.15Å; V41-F45 PolarHBondContact O-N 3.23Å; V41-V165 HydrophobicContact CG1-CB 4.19Å; V41-V165 HydrophobicContact CG1-CG1 4.14Å; V41-V165 HydrophobicContact CG1-CG2 3.73Å; V41-Q168 HydrophobicContact CG2-CG 4.15Å
42R73.8Confident71.1Confident80 Ų8069.5 Ų69.530%0.30236%0.358SS..Hα-helixtrans-67.5-34.7-179.9-65.6175.6131.2-143-14.7112.4I38 D40 C46 Y105 E169I38-R42 VanDerWaalsContact O-CD 3.3Å; I38-R42 WeakPolarHBondContact O-CD 3.02Å; I38-R42 WeakPolarHBondContact O-CG 3.3Å; I38-R42 PolarHBondContact O-N 2.78Å; D40-R42 PolarHBondContact O-N 3.25Å; R42-C46 WeakPolarHBondContact O-CB 3.23Å; R42-C46 PolarHBondContact O-N 2.75Å; R42-Y105 HydrophobicContact CB-CE2 4.33Å; R42-Y105 WeakPolarHBondContact CD-OH 3.47Å; R42-Y105 HydrophobicContact CG-CE2 3.97Å; R42-Y105 VanDerWaalsContact CZ-CE2 3.47Å; R42-Y105 PolarHBondContact NE-OH 3.35Å; R42-Y105 PolarHBondContact NH1-OH 3.2Å; R42-Y105 VanDerWaalsContact NH2-CE2 3.34Å; R42-Y105 PolarHBondContact NH2-OH 3.11Å; R42-E169 IonicContact NE-OE1 3.89Å
43R77.4Confident72.8Confident168 Ų16868.7 Ų68.763%0.63435%0.346SS*.Hα-helixtrans-68-45175.9-174-173.4-59.2-1261.1111.1S39 D40 V41 F45 C46 L47S39-R43 WeakPolarHBondContact O-CB 3.13Å; S39-R43 PolarHBondContact O-N 3.23Å; S39-R43 VanDerWaalsContact O-N 3.09Å; D40-R43 PolarHBondContact O-N 2.78Å; V41-R43 VanDerWaalsContact C-N 3.34Å; V41-R43 PolarHBondContact O-N 2.98Å; R43-F45 VanDerWaalsContact C-N 3.34Å; R43-C46 PolarHBondContact O-N 3.02Å; R43-L47 WeakPolarHBondContact O-CB 3.24Å; R43-L47 PolarHBondContact O-N 2.87Å
44T78.8Confident74.6Confident85 Ų8570.5 Ų70.552%0.52135%0.35SS..Hα-helixtrans-64.5-40.2175.8-58.10000111.3D40 V41 L47 F48D40-T44 PolarHBondContact O-N 3.34Å; D40-T44 PolarHBondContact O-OG1 2.74Å; D40-T44 VanDerWaalsContact O-OG1 3.11Å; V41-T44 PolarHBondContact O-N 3.36Å; T44-L47 PolarHBondContact O-N 2.96Å; T44-F48 WeakPolarHBondContact O-CB 3.35Å; T44-F48 PolarHBondContact O-N 3.24Å
45F78.1Confident76.4Confident25 Ų2570.6 Ų70.611%0.1135%0.349CS..Hα-helixtrans-59.5-54.2174.6170.8-111.3000112.1V41 R43 L47 F48 V49 L101 Y105 L161 V165V41-F45 WeakPolarHBondContact O-CB 3.15Å; V41-F45 PolarHBondContact O-N 3.23Å; R43-F45 VanDerWaalsContact C-N 3.34Å; F45-L47 VanDerWaalsContact C-N 3.27Å; F45-L47 PolarHBondContact O-N 2.95Å; F45-F48 PolarHBondContact O-N 3.42Å; F45-F48 VanDerWaalsContact O-N 3.12Å; F45-V49 HydrophobicContact CD2-CG2 3.97Å; F45-V49 HydrophobicContact CE1-CG2 4.33Å; F45-V49 HydrophobicContact CE2-CG2 3.39Å; F45-V49 HydrophobicContact CZ-CG2 3.64Å; F45-V49 WeakPolarHBondContact O-CG2 3.25Å; F45-V49 PolarHBondContact O-N 3.37Å; F45-L101 HydrophobicContact CZ-CB 4.25Å; F45-Y105 HydrophobicContact CD1-CD2 4.38Å; F45-Y105 HydrophobicContact CE1-CD2 4.25Å; F45-L161 HydrophobicContact CD2-CD2 3.62Å; F45-L161 HydrophobicContact CD2-CG 4.11Å; F45-L161 HydrophobicContact CE2-CD1 3.96Å; F45-L161 HydrophobicContact CE2-CD2 3.09Å; F45-L161 HydrophobicContact CE2-CG 3.57Å; F45-L161 HydrophobicContact CZ-CD2 3.71Å; F45-L161 HydrophobicContact CZ-CG 4.48Å; F45-V165 HydrophobicContact CB-CG2 4.34Å
46C76.7Confident78Confident56 Ų5664.7 Ų64.738%0.37832%0.323SS..Hα-helixtrans-60.7-39179.1-174.10000111.6R42 R43 F48 V49 T50R42-C46 WeakPolarHBondContact O-CB 3.23Å; R42-C46 PolarHBondContact O-N 2.75Å; R43-C46 PolarHBondContact O-N 3.02Å; C46-F48 VanDerWaalsContact C-N 3.33Å; C46-F48 PolarHBondContact O-N 3.49Å; C46-V49 PolarHBondContact O-N 3.37Å; C46-T50 WeakPolarHBondContact O-CB 3.37Å; C46-T50 WeakPolarHBondContact O-CG2 3.41Å; C46-T50 PolarHBondContact O-N 2.83Å; C46-T50 PolarHBondContact O-OG1 3.35Å
47L83.1Confident79.5Confident113 Ų11359 Ų5959%0.59230%0.301SS*.Hα-helixtrans-62-40.6176-172.5146.2000111.8R43 T44 F45 T50 F51R43-L47 WeakPolarHBondContact O-CB 3.24Å; R43-L47 PolarHBondContact O-N 2.87Å; T44-L47 PolarHBondContact O-N 2.96Å; F45-L47 VanDerWaalsContact C-N 3.27Å; F45-L47 PolarHBondContact O-N 2.95Å; L47-T50 WeakPolarHBondContact CA-OG1 3.07Å; L47-T50 PolarHBondContact O-OG1 2.99Å; L47-F51 WeakPolarHBondContact O-CB 3.46Å; L47-F51 PolarHBondContact O-N 2.99Å
48F83.3Confident81.2Confident45 Ų4561.4 Ų61.420%0.19731%0.31CS..Hα-helixtrans-71.3-42.3179.6-164-98.9000112.3T44 F45 C46 F51 D52 I156 E157 L160T44-F48 WeakPolarHBondContact O-CB 3.35Å; T44-F48 PolarHBondContact O-N 3.24Å; F45-F48 PolarHBondContact O-N 3.42Å; F45-F48 VanDerWaalsContact O-N 3.12Å; C46-F48 VanDerWaalsContact C-N 3.33Å; C46-F48 PolarHBondContact O-N 3.49Å; F48-F51 PolarHBondContact O-N 3.05Å; F48-D52 PolarHBondContact O-N 3.43Å; F48-I156 HydrophobicContact CE1-CB 4.42Å; F48-I156 HydrophobicContact CE1-CG2 3.88Å; F48-I156 HydrophobicContact CE2-CG2 4.23Å; F48-I156 HydrophobicContact CZ-CB 4.13Å; F48-I156 HydrophobicContact CZ-CG2 3.36Å; F48-E157 HydrophobicContact CD1-CB 4.42Å; F48-E157 HydrophobicContact CD1-CG 3.58Å; F48-E157 HydrophobicContact CE1-CB 4.12Å; F48-E157 HydrophobicContact CE1-CG 3.36Å; F48-L160 HydrophobicContact CD1-CD1 3.53Å; F48-L160 HydrophobicContact CD2-CD1 3.68Å; F48-L160 HydrophobicContact CE1-CD1 3.48Å; F48-L160 VanDerWaalsContact CE1-CD1 3.48Å; F48-L160 HydrophobicContact CE2-CD1 3.63Å; F48-L160 HydrophobicContact CG-CD1 3.65Å; F48-L160 HydrophobicContact CZ-CD1 3.56Å
49V83.2Confident82.4Confident1 Ų158.5 Ų58.51%0.00630%0.296CS..Hα-helixtrans-66.1-38.5177.1169.60000112.3F45 C46 L53 F98 L101F45-V49 HydrophobicContact CD2-CG2 3.97Å; F45-V49 HydrophobicContact CE1-CG2 4.33Å; F45-V49 HydrophobicContact CE2-CG2 3.39Å; F45-V49 HydrophobicContact CZ-CG2 3.64Å; F45-V49 WeakPolarHBondContact O-CG2 3.25Å; F45-V49 PolarHBondContact O-N 3.37Å; C46-V49 PolarHBondContact O-N 3.37Å; V49-L53 PolarHBondContact O-N 2.97Å; V49-F98 HydrophobicContact CG1-CD2 3.45Å; V49-F98 VanDerWaalsContact CG1-CD2 3.45Å; V49-F98 HydrophobicContact CG1-CE2 3.89Å; V49-F98 HydrophobicContact CG1-CG 4.41Å; V49-L101 HydrophobicContact CG1-CB 4.2Å; V49-L101 HydrophobicContact CG1-CD1 4.05Å; V49-L101 HydrophobicContact CG2-CB 4.47Å; V49-L101 HydrophobicContact CG2-CD1 3.73Å
50T87.4Confident83.5Confident48 Ų4857.5 Ų57.529%0.29429%0.285SS..Hα-helixtrans-71-39.5173.349.40000111.8C46 L47 D52 L53 L54 F98C46-T50 WeakPolarHBondContact O-CB 3.37Å; C46-T50 WeakPolarHBondContact O-CG2 3.41Å; C46-T50 PolarHBondContact O-N 2.83Å; C46-T50 PolarHBondContact O-OG1 3.35Å; L47-T50 WeakPolarHBondContact CA-OG1 3.07Å; L47-T50 PolarHBondContact O-OG1 2.99Å; T50-D52 PolarHBondContact O-N 3.45Å; T50-L53 PolarHBondContact O-N 2.58Å; T50-L54 VanDerWaalsContact O-CG 3.31Å; T50-L54 WeakPolarHBondContact O-CG 3.25Å; T50-L54 PolarHBondContact O-N 3.37Å; T50-F98 HydrophobicContact CG2-CE2 3.66Å; T50-F98 HydrophobicContact CG2-CZ 4.27Å
51F88.6Confident84.3Confident97 Ų9756.8 Ų56.843%0.42528%0.28SS..Hα-helixtrans-60.1-43.1176.5172-101.3000112.3L47 F48 L54 F55L47-F51 WeakPolarHBondContact O-CB 3.46Å; L47-F51 PolarHBondContact O-N 2.99Å; F48-F51 PolarHBondContact O-N 3.05Å; F51-L54 PolarHBondContact O-N 3.46Å; F51-F55 HydrophobicContact CZ-CD2 4.21Å; F51-F55 WeakPolarHBondContact O-CB 3.4Å; F51-F55 PolarHBondContact O-N 2.97Å
52D89.3Confident85Confident1 Ų158.7 Ų58.71%0.00529%0.289CS..Hα-helixtrans-58.8-51.9175.5170.179.6000112.7F48 T50 L54 F55 I56 R97 L153 E157F48-D52 PolarHBondContact O-N 3.43Å; T50-D52 PolarHBondContact O-N 3.45Å; D52-L54 PolarHBondContact O-N 3.34Å; D52-F55 PolarHBondContact O-N 3.29Å; D52-I56 WeakPolarHBondContact O-CG1 3.28Å; D52-I56 PolarHBondContact O-N 3.33Å; D52-R97 IonicContact OD1-CZ 2.94Å; D52-R97 IonicContact OD1-NH1 2.77Å; D52-R97 IonicContact OD1-NH2 3.25Å; D52-R97 PolarHBondContact OD1-NH2 3.02Å; D52-R97 IonicContact OD2-CZ 3.17Å; D52-R97 VanDerWaalsContact OD2-CZ 3.25Å; D52-R97 IonicContact OD2-NE 2.68Å; D52-R97 IonicContact OD2-NH1 3.58Å; D52-R97 IonicContact OD2-NH2 3.62Å; D52-R97 PolarHBondContact OD2-NH2 3.3Å; D52-L153 WeakPolarHBondContact OD1-CB 3.31Å; D52-L153 VanDerWaalsContact OD1-CD1 3.26Å; D52-L153 WeakPolarHBondContact OD1-CD1 2.92Å; D52-E157 WeakPolarHBondContact CB-OE1 3.28Å
53L89.9Confident85.4Confident36 Ų3655.1 Ų55.119%0.18828%0.276CS..Hα-helixtrans-55.8-45.4179.1179.7120.1000110.3V49 T50 F55 T57 V95 F98V49-L53 PolarHBondContact O-N 2.97Å; T50-L53 PolarHBondContact O-N 2.58Å; L53-F55 VanDerWaalsContact C-N 3.35Å; L53-F55 PolarHBondContact O-N 2.82Å; L53-T57 VanDerWaalsContact O-CB 3.27Å; L53-T57 WeakPolarHBondContact O-CB 3.39Å; L53-T57 PolarHBondContact O-N 3.4Å; L53-T57 PolarHBondContact O-OG1 3.36Å; L53-V95 HydrophobicContact CD1-CB 4.34Å; L53-V95 HydrophobicContact CD1-CG2 3.94Å; L53-F98 HydrophobicContact CB-CD2 4.38Å; L53-F98 HydrophobicContact CD1-CB 3.58Å; L53-F98 HydrophobicContact CD1-CD1 4.32Å; L53-F98 HydrophobicContact CD1-CD2 4.43Å; L53-F98 HydrophobicContact CD1-CG 3.87Å
54L91.1Very high85.5Confident113 Ų11347.2 Ų47.259%0.59225%0.246SC*.Hα-helixtrans-62.5-41.3176.6-69.7177.1000112.1T50 F51 D52 T57 L58T50-L54 VanDerWaalsContact O-CG 3.31Å; T50-L54 WeakPolarHBondContact O-CG 3.25Å; T50-L54 PolarHBondContact O-N 3.37Å; F51-L54 PolarHBondContact O-N 3.46Å; D52-L54 PolarHBondContact O-N 3.34Å; L54-T57 PolarHBondContact O-N 3.33Å; L54-L58 VanDerWaalsContact O-CB 3.27Å; L54-L58 WeakPolarHBondContact O-CB 3.03Å; L54-L58 PolarHBondContact O-N 3.43Å
55F90.8Very high85.7Confident67 Ų6748 Ų4829%0.29425%0.247SC..Hα-helixtrans-68.9-43.4-178.7-166-107.3000112.5F51 D52 L53 T57 L58 L59 I149 L153F51-F55 HydrophobicContact CZ-CD2 4.21Å; F51-F55 WeakPolarHBondContact O-CB 3.4Å; F51-F55 PolarHBondContact O-N 2.97Å; D52-F55 PolarHBondContact O-N 3.29Å; L53-F55 VanDerWaalsContact C-N 3.35Å; L53-F55 PolarHBondContact O-N 2.82Å; F55-T57 VanDerWaalsContact C-N 3.35Å; F55-L58 PolarHBondContact O-N 2.83Å; F55-L59 HydrophobicContact CD1-CD1 3.72Å; F55-L59 HydrophobicContact CD1-CG 4.43Å; F55-L59 HydrophobicContact CE1-CD1 3.56Å; F55-L59 HydrophobicContact CE1-CG 4.33Å; F55-L59 HydrophobicContact CZ-CD1 4.21Å; F55-L59 WeakPolarHBondContact O-CG 3.4Å; F55-L59 PolarHBondContact O-N 2.8Å; F55-I149 HydrophobicContact CD1-CG2 3.79Å; F55-I149 HydrophobicContact CE1-CD1 4.13Å; F55-I149 HydrophobicContact CE1-CG2 3.45Å; F55-I149 VanDerWaalsContact CE1-CG2 3.45Å; F55-L153 HydrophobicContact CB-CD1 4.38Å; F55-L153 HydrophobicContact CD1-CD1 3.51Å; F55-L153 HydrophobicContact CE1-CD1 4.21Å; F55-L153 HydrophobicContact CG-CD1 4.33Å
56I89.9Confident85.7Confident0 Ų050.8 Ų50.80%027%0.266CS..Hα-helixtrans-64.4-42174.4-61.4-57.9000110.8D52 L58 L59 W60 I90 A94 I149 L153D52-I56 WeakPolarHBondContact O-CG1 3.28Å; D52-I56 PolarHBondContact O-N 3.33Å; I56-L58 VanDerWaalsContact C-N 3.33Å; I56-L58 PolarHBondContact O-N 3.08Å; I56-L59 PolarHBondContact O-N 2.84Å; I56-W60 WeakPolarHBondContact O-CB 3.43Å; I56-W60 PolarHBondContact O-N 2.89Å; I56-I90 HydrophobicContact CG2-CG2 4.24Å; I56-A94 HydrophobicContact CB-CB 3.94Å; I56-A94 HydrophobicContact CG1-CB 4.19Å; I56-A94 HydrophobicContact CG2-CB 3.74Å; I56-I149 HydrophobicContact CD1-CG2 4.28Å; I56-L153 HydrophobicContact CD1-CD1 4.01Å; I56-L153 HydrophobicContact CG1-CD1 4.44Å
57T89.6Confident85.4Confident28 Ų2850.6 Ų50.617%0.17226%0.262CS..Hα-helixtrans-60.8-43.7174.9-54.50000111.2L53 L54 F55 W60 I61 F91L53-T57 VanDerWaalsContact O-CB 3.27Å; L53-T57 WeakPolarHBondContact O-CB 3.39Å; L53-T57 PolarHBondContact O-N 3.4Å; L53-T57 PolarHBondContact O-OG1 3.36Å; L54-T57 PolarHBondContact O-N 3.33Å; F55-T57 VanDerWaalsContact C-N 3.35Å; T57-W60 PolarHBondContact O-N 2.97Å; T57-I61 HydrophobicContact CG2-CD1 3.89Å; T57-I61 VanDerWaalsContact O-CG1 3.28Å; T57-I61 WeakPolarHBondContact O-CG1 3.38Å; T57-I61 PolarHBondContact O-N 3.32Å; T57-F91 HydrophobicContact CG2-CD2 4.35Å; T57-F91 HydrophobicContact CG2-CE2 3.87Å; T57-F91 VanDerWaalsContact OG1-CE2 3.3Å; T57-F91 WeakPolarHBondContact OG1-CE2 3.42Å
58L90.6Very high84.6Confident92 Ų9248.7 Ų48.748%0.48227%0.269SS..Hα-helixtrans-63-47.5178.6-177.669.9000111.3L54 F55 I56 W60 I61 I62L54-L58 VanDerWaalsContact O-CB 3.27Å; L54-L58 WeakPolarHBondContact O-CB 3.03Å; L54-L58 PolarHBondContact O-N 3.43Å; F55-L58 PolarHBondContact O-N 2.83Å; I56-L58 VanDerWaalsContact C-N 3.33Å; I56-L58 PolarHBondContact O-N 3.08Å; L58-W60 VanDerWaalsContact C-N 3.29Å; L58-W60 PolarHBondContact O-N 3.42Å; L58-I61 PolarHBondContact O-N 3.43Å; L58-I62 HydrophobicContact CD1-CD1 4.25Å; L58-I62 HydrophobicContact CD2-CD1 4.43Å; L58-I62 HydrophobicContact CG-CD1 3.85Å; L58-I62 VanDerWaalsContact O-CG1 3.26Å; L58-I62 WeakPolarHBondContact O-CG1 3.48Å; L58-I62 PolarHBondContact O-N 3.29Å
59L87.9Confident83.9Confident16 Ų1647.8 Ų47.88%0.08427%0.272CS..Hα-helixtrans-61.7-39.2177.6-74.9171.5000112.1F55 I56 I62 E63 L146 I149F55-L59 HydrophobicContact CD1-CD1 3.72Å; F55-L59 HydrophobicContact CD1-CG 4.43Å; F55-L59 HydrophobicContact CE1-CD1 3.56Å; F55-L59 HydrophobicContact CE1-CG 4.33Å; F55-L59 HydrophobicContact CZ-CD1 4.21Å; F55-L59 WeakPolarHBondContact O-CG 3.4Å; F55-L59 PolarHBondContact O-N 2.8Å; I56-L59 PolarHBondContact O-N 2.84Å; L59-I62 PolarHBondContact O-N 3.45Å; L59-E63 WeakPolarHBondContact O-CB 3.5Å; L59-E63 PolarHBondContact O-N 3.35Å; L59-L146 HydrophobicContact CB-CD1 4.19Å; L59-L146 HydrophobicContact CB-CG 4.32Å; L59-I149 HydrophobicContact CD1-CB 4.07Å; L59-I149 HydrophobicContact CD1-CD1 3.66Å; L59-I149 HydrophobicContact CD1-CG1 4.46Å; L59-I149 HydrophobicContact CD1-CG2 3.62Å; L59-I149 HydrophobicContact CD2-CD1 4.45Å
60W86.1Confident83.3Confident24 Ų2451.4 Ų51.49%0.09129%0.291CS..Hα-helixtrans-62.5-46.6174.6178.755.8000112I56 T57 L58 I62 E63 L64 L74 E77 F88 F91 L146I56-W60 WeakPolarHBondContact O-CB 3.43Å; I56-W60 PolarHBondContact O-N 2.89Å; T57-W60 PolarHBondContact O-N 2.97Å; L58-W60 VanDerWaalsContact C-N 3.29Å; L58-W60 PolarHBondContact O-N 3.42Å; W60-I62 VanDerWaalsContact C-N 3.34Å; W60-I62 PolarHBondContact O-N 3.04Å; W60-E63 PolarHBondContact O-N 2.96Å; W60-L64 HydrophobicContact CD2-CD1 4.13Å; W60-L64 HydrophobicContact CH2-CD1 4.31Å; W60-L64 HydrophobicContact CZ2-CD1 3.87Å; W60-L64 WeakPolarHBondContact O-CG 3.3Å; W60-L64 PolarHBondContact O-N 3.16Å; W60-L74 HydrophobicContact CH2-CD2 3.99Å; W60-L74 HydrophobicContact CZ2-CD2 4.26Å; W60-E77 PolarHBondContact NE1-OE1 2.94Å; W60-F88 HydrophobicContact CZ2-CD2 4.31Å; W60-F91 HydrophobicContact CD2-CB 4.1Å; W60-F91 HydrophobicContact CD2-CG 4.26Å; W60-F91 HydrophobicContact CE3-CB 4.3Å; W60-F91 HydrophobicContact CE3-CD1 4.41Å; W60-F91 AromaticContact CE3-CD2 3.97Å; W60-F91 HydrophobicContact CE3-CD2 3.97Å; W60-F91 HydrophobicContact CE3-CE2 4.44Å; W60-F91 AromaticContact CE3-CG 3.95Å; W60-F91 HydrophobicContact CE3-CG 3.95Å; W60-F91 HydrophobicContact CG-CB 4.26Å; W60-F91 HydrophobicContact CH2-CD1 4.5Å; W60-F91 HydrophobicContact CZ3-CD1 4.24Å; W60-F91 HydrophobicContact CZ3-CD2 4.39Å; W60-F91 HydrophobicContact CZ3-CE1 4.39Å; W60-F91 HydrophobicContact CZ3-CG 4.23Å; W60-L146 HydrophobicContact CB-CD1 4.11Å
61I84.8Confident82.3Confident78 Ų7857 Ų5740%0.431%0.313SS..Hα-helixtrans-63.8-38.3176.6-67.4168.3000111.9T57 L58 L64 N65T57-I61 HydrophobicContact CG2-CD1 3.89Å; T57-I61 VanDerWaalsContact O-CG1 3.28Å; T57-I61 WeakPolarHBondContact O-CG1 3.38Å; T57-I61 PolarHBondContact O-N 3.32Å; L58-I61 PolarHBondContact O-N 3.43Å; I61-L64 WeakPolarHBondContact O-CB 3.47Å; I61-L64 PolarHBondContact O-N 2.81Å; I61-N65 WeakPolarHBondContact O-CB 3.48Å; I61-N65 PolarHBondContact O-N 3.07Å
62I85.6Confident81.2Confident60 Ų6056.9 Ų56.931%0.30832%0.321SS..Hα-helixtrans-66.3-41.3177.3-69.2166.5000110.9L58 L59 W60 N65 V66 F142L58-I62 HydrophobicContact CD1-CD1 4.25Å; L58-I62 HydrophobicContact CD2-CD1 4.43Å; L58-I62 HydrophobicContact CG-CD1 3.85Å; L58-I62 VanDerWaalsContact O-CG1 3.26Å; L58-I62 WeakPolarHBondContact O-CG1 3.48Å; L58-I62 PolarHBondContact O-N 3.29Å; L59-I62 PolarHBondContact O-N 3.45Å; W60-I62 VanDerWaalsContact C-N 3.34Å; W60-I62 PolarHBondContact O-N 3.04Å; I62-N65 PolarHBondContact O-N 3.19Å; I62-N65 VanDerWaalsContact O-N 3.16Å; I62-V66 HydrophobicContact CG2-CG2 4.21Å; I62-V66 WeakPolarHBondContact O-CG2 3.35Å; I62-V66 PolarHBondContact O-N 3.02Å; I62-F142 HydrophobicContact CG2-CE1 4Å; I62-F142 HydrophobicContact CG2-CZ 4.46Å
63E80.5Confident80.1Confident5 Ų560.2 Ų60.22%0.02333%0.333CS..Hα-helixtrans-60.7-45.8175.4-171.6-77.5148.400111L59 W60 N65 V66 N67 F87 L146L59-E63 WeakPolarHBondContact O-CB 3.5Å; L59-E63 PolarHBondContact O-N 3.35Å; W60-E63 PolarHBondContact O-N 2.96Å; E63-N65 VanDerWaalsContact C-N 3.26Å; E63-N65 PolarHBondContact O-N 3.42Å; E63-V66 PolarHBondContact O-N 3.29Å; E63-N67 WeakPolarHBondContact O-CB 3.29Å; E63-N67 PolarHBondContact O-N 3.12Å; E63-N67 PolarHBondContact OE1-ND2 2.96Å; E63-F87 HydrophobicContact CG-CD2 3.96Å; E63-F87 HydrophobicContact CG-CE2 3.69Å; E63-F87 HydrophobicContact CG-CZ 4.2Å; E63-F87 WeakPolarHBondContact OE1-CE2 3.29Å; E63-F87 VanDerWaalsContact OE2-CD2 3.23Å; E63-F87 WeakPolarHBondContact OE2-CD2 3.42Å; E63-L146 HydrophobicContact CB-CD1 4.28Å
64L79.1Confident79.1Confident2 Ų261.3 Ų61.31%0.0134%0.339CS..Hα-helixtrans-58-38.7173.6-71173.7000112.3W60 I61 R73 L74 E77W60-L64 HydrophobicContact CD2-CD1 4.13Å; W60-L64 HydrophobicContact CH2-CD1 4.31Å; W60-L64 HydrophobicContact CZ2-CD1 3.87Å; W60-L64 WeakPolarHBondContact O-CG 3.3Å; W60-L64 PolarHBondContact O-N 3.16Å; I61-L64 WeakPolarHBondContact O-CB 3.47Å; I61-L64 PolarHBondContact O-N 2.81Å; L64-R73 HydrophobicContact CD2-CB 3.68Å; L64-L74 HydrophobicContact CD1-CG 4.22Å; L64-E77 WeakPolarHBondContact CD2-OE2 3.25Å
65N82.9Confident77.9Confident100 Ų10060.6 Ų60.654%0.53534%0.336SS..Hα-helixtrans-71.7-46.4-178.9-173.9-99000112.7I61 I62 E63 N67 G68I61-N65 WeakPolarHBondContact O-CB 3.48Å; I61-N65 PolarHBondContact O-N 3.07Å; I62-N65 PolarHBondContact O-N 3.19Å; I62-N65 VanDerWaalsContact O-N 3.16Å; E63-N65 VanDerWaalsContact C-N 3.26Å; E63-N65 PolarHBondContact O-N 3.42Å; N65-N67 PolarHBondContact O-N 2.87Å; N65-G68 PolarHBondContact O-N 3.42Å
66V78.3Confident76.7Confident85 Ų8564.6 Ų64.652%0.51535%0.353SS..Hα-helixtrans-64-29.6-178.9168.60000111.6I62 E63 G68I62-V66 HydrophobicContact CG2-CG2 4.21Å; I62-V66 WeakPolarHBondContact O-CG2 3.35Å; I62-V66 PolarHBondContact O-N 3.02Å; E63-V66 PolarHBondContact O-N 3.29Å; V66-G68 VanDerWaalsContact C-N 3.31Å; V66-G68 PolarHBondContact O-N 2.97Å
67N70.5Confident75.6Confident52 Ų5265 Ų6528%0.27836%0.355SS..THydrogen-bonded Turntrans-8814.7-174.4-91.15.5000115.6E63 N65 R73E63-N67 WeakPolarHBondContact O-CB 3.29Å; E63-N67 PolarHBondContact O-N 3.12Å; E63-N67 PolarHBondContact OE1-ND2 2.96Å; N65-N67 PolarHBondContact O-N 2.87Å; N67-R73 VanDerWaalsContact CB-CZ 3.49Å; N67-R73 VanDerWaalsContact ND2-CZ 3.31Å; N67-R73 PolarHBondContact ND2-NH1 2.93Å; N67-R73 PolarHBondContact ND2-NH2 3.21Å
68G66.3Low74.6Confident72 Ų7267 Ų6774%0.74237%0.367SS*.THydrogen-bonded Turntrans102.812.9161.100000117.2N65 V66N65-G68 PolarHBondContact O-N 3.42Å; V66-G68 VanDerWaalsContact C-N 3.31Å; V66-G68 PolarHBondContact O-N 2.97Å
69G68.4Low73.1Confident26 Ų2668.8 Ų68.827%0.26838%0.377SS..  trans149.6123.817000000113.9R73G69-R73 PolarHBondContact O-N 2.91Å
70I72.3Confident71.8Confident78 Ų7875.3 Ų75.340%0.441%0.406SS..Hα-helixtrans-65.3-45.3-172-54.2162.6000111.2L74I70-L74 HydrophobicContact CG2-CD1 3.61Å; I70-L74 VanDerWaalsContact O-CB 3.23Å; I70-L74 WeakPolarHBondContact O-CB 3.48Å; I70-L74 PolarHBondContact O-N 3.31Å
71E65.6Low70.6Confident164 Ų16479.2 Ų79.277%0.76642%0.422SS*.Hα-helixtrans-64.4-51.6-177.6-96-175.6138.200113.6R73 L74 D75E71-R73 VanDerWaalsContact C-N 3.29Å; E71-R73 PolarHBondContact O-N 3.43Å; E71-L74 PolarHBondContact O-N 3.47Å; E71-D75 PolarHBondContact O-N 2.81Å
72T65.1Low69.6Low95 Ų9579.7 Ų79.758%0.58343%0.425SS*.Hα-helixtrans-72.3-25.7-172.859.90000112.8K76T72-K76 PolarHBondContact O-N 3Å
73R67.1Low68.4Low71 Ų7180.3 Ų80.327%0.26842%0.424SS..Hα-helixtrans-80.5-42.3170-75.9-134.2-178.1-151.28.9112.2L64 N67 G69 E71 D75 K76 E77L64-R73 HydrophobicContact CD2-CB 3.68Å; N67-R73 VanDerWaalsContact CB-CZ 3.49Å; N67-R73 VanDerWaalsContact ND2-CZ 3.31Å; N67-R73 PolarHBondContact ND2-NH1 2.93Å; N67-R73 PolarHBondContact ND2-NH2 3.21Å; G69-R73 PolarHBondContact O-N 2.91Å; E71-R73 VanDerWaalsContact C-N 3.29Å; E71-R73 PolarHBondContact O-N 3.43Å; R73-D75 VanDerWaalsContact C-N 3.28Å; R73-D75 PolarHBondContact O-N 3.46Å; R73-K76 CarbonylContact O-C 3.57Å; R73-K76 PolarHBondContact O-N 3.31Å; R73-E77 WeakPolarHBondContact O-CA 3.26Å; R73-E77 WeakPolarHBondContact O-CB 3.48Å; R73-E77 PolarHBondContact O-N 2.83Å
74L68.2Low67.3Low59 Ų5984 Ų8431%0.30944%0.441SS..Hα-helixtrans-55.3-45.2172.8-99.9156.3000111.7W60 L64 I70 E71 K76 E77 V78W60-L74 HydrophobicContact CH2-CD2 3.99Å; W60-L74 HydrophobicContact CZ2-CD2 4.26Å; L64-L74 HydrophobicContact CD1-CG 4.22Å; I70-L74 HydrophobicContact CG2-CD1 3.61Å; I70-L74 VanDerWaalsContact O-CB 3.23Å; I70-L74 WeakPolarHBondContact O-CB 3.48Å; I70-L74 PolarHBondContact O-N 3.31Å; E71-L74 PolarHBondContact O-N 3.47Å; L74-K76 VanDerWaalsContact C-N 3.32Å; L74-K76 PolarHBondContact O-N 2.76Å; L74-E77 PolarHBondContact O-N 3.36Å; L74-V78 HydrophobicContact CD2-CG2 3.65Å; L74-V78 WeakPolarHBondContact O-CA 3.22Å; L74-V78 VanDerWaalsContact O-CB 3.25Å; L74-V78 WeakPolarHBondContact O-CB 3.33Å; L74-V78 PolarHBondContact O-N 2.99Å
75D67Low66.4Low98 Ų9886 Ų8652%0.52446%0.458SS..Iπ-helixtrans-61.6-40.8175.9-94.7-27.9000111.8E71 R73 L79 H80E71-D75 PolarHBondContact O-N 2.81Å; R73-D75 VanDerWaalsContact C-N 3.28Å; R73-D75 PolarHBondContact O-N 3.46Å; D75-L79 CarbonylContact O-C 3.58Å; D75-L79 VanDerWaalsContact O-CA 3.25Å; D75-L79 WeakPolarHBondContact O-CA 3.35Å; D75-L79 WeakPolarHBondContact O-CB 3.31Å; D75-L79 PolarHBondContact O-N 3.04Å; D75-H80 PolarHBondContact O-N 3.42Å; D75-H80 VanDerWaalsContact O-N 3.08Å
76K64.6Low65.8Low151 Ų15181.4 Ų81.466%0.65743%0.434SS*.Iπ-helixtrans-71.5-33.9175.9-80.2178.4178.3169.20113.4T72 R73 L74 H80T72-K76 PolarHBondContact O-N 3Å; R73-K76 CarbonylContact O-C 3.57Å; R73-K76 PolarHBondContact O-N 3.31Å; L74-K76 VanDerWaalsContact C-N 3.32Å; L74-K76 PolarHBondContact O-N 2.76Å; K76-H80 CarbonylContact O-C 3.6Å; K76-H80 WeakPolarHBondContact O-CA 3.31Å; K76-H80 PolarHBondContact O-N 3.44Å
77E67.7Low65.6Low10 Ų1077.5 Ų77.55%0.04741%0.409CS..Iπ-helixtrans-90.7-30.8-167.7-160.6165.9157.600112.3W60 L64 R73 L74 S86 F87 F88W60-E77 PolarHBondContact NE1-OE1 2.94Å; L64-E77 WeakPolarHBondContact CD2-OE2 3.25Å; R73-E77 WeakPolarHBondContact O-CA 3.26Å; R73-E77 WeakPolarHBondContact O-CB 3.48Å; R73-E77 PolarHBondContact O-N 2.83Å; L74-E77 PolarHBondContact O-N 3.36Å; E77-S86 WeakPolarHBondContact CG-OG 3.1Å; E77-S86 PolarHBondContact O-OG 3.17Å; E77-S86 VanDerWaalsContact O-OG 3.13Å; E77-F87 VanDerWaalsContact OE1-CA 3.3Å; E77-F87 WeakPolarHBondContact OE1-CA 3.49Å; E77-F87 VanDerWaalsContact OE1-CB 3.26Å; E77-F87 WeakPolarHBondContact OE1-CB 3.49Å; E77-F87 PolarHBondContact OE1-N 3.38Å; E77-F88 HydrophobicContact CG-CB 4.34Å; E77-F88 PolarHBondContact OE1-N 3.38Å
78V68Low66Low69 Ų6977.3 Ų77.342%0.41841%0.406SS..Iπ-helixtrans-101.5-42.3176.6177.90000111.9L74 F88L74-V78 HydrophobicContact CD2-CG2 3.65Å; L74-V78 WeakPolarHBondContact O-CA 3.22Å; L74-V78 VanDerWaalsContact O-CB 3.25Å; L74-V78 WeakPolarHBondContact O-CB 3.33Å; L74-V78 PolarHBondContact O-N 2.99Å; V78-F88 HydrophobicContact CG2-CD2 3.96Å; V78-F88 HydrophobicContact CG2-CE2 4.21Å
79L59.2Low66.9Low130 Ų13074.2 Ų74.268%0.68137%0.373SS*.Iπ-helixtrans-88.8-37.6-176.2-145.989.1000112.9D75D75-L79 CarbonylContact O-C 3.58Å; D75-L79 VanDerWaalsContact O-CA 3.25Å; D75-L79 WeakPolarHBondContact O-CA 3.35Å; D75-L79 WeakPolarHBondContact O-CB 3.31Å; D75-L79 PolarHBondContact O-N 3.04Å
80H60.1Low67.7Low153 Ų15373 Ų7371%0.70836%0.36SS*.SBendtrans-107.748.4176.2-103.679.1000111.9D75 K76 D82D75-H80 PolarHBondContact O-N 3.42Å; D75-H80 VanDerWaalsContact O-N 3.08Å; K76-H80 CarbonylContact O-C 3.6Å; K76-H80 WeakPolarHBondContact O-CA 3.31Å; K76-H80 PolarHBondContact O-N 3.44Å; H80-D82 PolarHBondContact O-N 3.41Å; H80-D82 VanDerWaalsContact O-N 3.12Å
81Y62.3Low68.4Low105 Ų10571.4 Ų71.441%0.41235%0.35SS..  trans-49.2116.5-173.2176.1-96.7000113.3Y83 F88 D89Y81-Y83 WeakPolarHBondContact OH-CD2 3.38Å; Y81-F88 HydrophobicContact CD2-CD1 4.09Å; Y81-F88 AromaticContact CE2-CD1 3.99Å; Y81-F88 HydrophobicContact CE2-CD1 3.99Å; Y81-D89 WeakPolarHBondContact CE2-OD1 3.16Å; Y81-D89 VanDerWaalsContact CZ-OD1 3.25Å; Y81-D89 PolarHBondContact OH-OD1 3.49Å; Y81-D89 PolarHBondContact OH-OD2 3.25Å
82D62Low69.4Low88 Ų8867.6 Ų67.647%0.47134%0.335SS..  trans-118113.5171.2-168.4-21.3000109.5H80 H84 A85 S86H80-D82 PolarHBondContact O-N 3.41Å; H80-D82 VanDerWaalsContact O-N 3.12Å; D82-H84 PolarHBondContact O-N 3.17Å; D82-H84 PolarHBondContact OD1-N 2.81Å; D82-A85 PolarHBondContact O-N 2.99Å; D82-S86 WeakPolarHBondContact O-CB 3.24Å; D82-S86 PolarHBondContact O-N 3.16Å
83Y60.6Low70.5Confident74 Ų7463.7 Ų63.729%0.2931%0.31SS..THydrogen-bonded Turntrans-55.3-26.3-177.2-173.8-95.3000113.2Y81 D89 F126 K130 L133Y81-Y83 WeakPolarHBondContact OH-CD2 3.38Å; Y83-D89 WeakPolarHBondContact CD2-OD2 3.27Å; Y83-F126 HydrophobicContact CE2-CE2 4.33Å; Y83-F126 HydrophobicContact CE2-CZ 4.32Å; Y83-K130 PolarHBondContact O-NZ 3.3Å; Y83-L133 HydrophobicContact CE1-CD1 4.29Å
84H57.7Low71.6Confident83 Ų8360.4 Ų60.438%0.38430%0.298SS..THydrogen-bonded Turntrans-91.7-16.4-175.9-69-79.2000115D82 L133 S134 K135D82-H84 PolarHBondContact O-N 3.17Å; D82-H84 PolarHBondContact OD1-N 2.81Å; H84-L133 PolarHBondContact ND1-O 3.03Å; H84-S134 WeakPolarHBondContact O-CA 2.87Å; H84-K135 PolarHBondContact O-N 3.37Å
85A60.5Low72.5Confident43 Ų4360.2 Ų60.236%0.35530%0.299SS..THydrogen-bonded Turntrans-125-10.9-172.200000114.1D82 L136D82-A85 PolarHBondContact O-N 2.99Å; A85-L136 VanDerWaalsContact O-CD2 3.26Å; A85-L136 WeakPolarHBondContact O-CD2 3.46Å
86S69.8Low73.6Confident4 Ų460.6 Ų60.63%0.02830%0.301CS..  trans-94.7131-177.9177.10000112.6E77 D82 F88 K130E77-S86 WeakPolarHBondContact CG-OG 3.1Å; E77-S86 PolarHBondContact O-OG 3.17Å; E77-S86 VanDerWaalsContact O-OG 3.13Å; D82-S86 WeakPolarHBondContact O-CB 3.24Å; D82-S86 PolarHBondContact O-N 3.16Å; S86-F88 VanDerWaalsContact C-N 3.27Å; S86-F88 WeakPolarHBondContact OG-CB 3.33Å; S86-F88 PolarHBondContact OG-N 2.8Å; S86-K130 PolarHBondContact O-NZ 2.92Å
87F74.3Confident74.6Confident2 Ų254 Ų541%0.00927%0.272CS..SBendtrans-82-5.8170.5-63.6-77.4000112.6E63 E77 D89 I90 F91 L136 L146E63-F87 HydrophobicContact CG-CD2 3.96Å; E63-F87 HydrophobicContact CG-CE2 3.69Å; E63-F87 HydrophobicContact CG-CZ 4.2Å; E63-F87 WeakPolarHBondContact OE1-CE2 3.29Å; E63-F87 VanDerWaalsContact OE2-CD2 3.23Å; E63-F87 WeakPolarHBondContact OE2-CD2 3.42Å; E77-F87 VanDerWaalsContact OE1-CA 3.3Å; E77-F87 WeakPolarHBondContact OE1-CA 3.49Å; E77-F87 VanDerWaalsContact OE1-CB 3.26Å; E77-F87 WeakPolarHBondContact OE1-CB 3.49Å; E77-F87 PolarHBondContact OE1-N 3.38Å; F87-D89 PolarHBondContact O-N 2.98Å; F87-D89 VanDerWaalsContact O-N 3.15Å; F87-I90 HydrophobicContact CD1-CD1 4.19Å; F87-I90 PolarHBondContact O-N 2.9Å; F87-F91 PolarHBondContact O-N 3.49Å; F87-L136 HydrophobicContact CD1-CD1 3.98Å; F87-L136 HydrophobicContact CD2-CD1 4.46Å; F87-L136 HydrophobicContact CD2-CD2 4.21Å; F87-L136 HydrophobicContact CE1-CB 4.3Å; F87-L136 HydrophobicContact CE1-CD1 3.77Å; F87-L136 HydrophobicContact CE1-CD2 4.12Å; F87-L136 HydrophobicContact CE1-CG 4.27Å; F87-L136 HydrophobicContact CE2-CD1 4.23Å; F87-L136 HydrophobicContact CE2-CD2 3.39Å; F87-L136 HydrophobicContact CE2-CG 4.34Å; F87-L136 HydrophobicContact CG-CD1 4.34Å; F87-L136 HydrophobicContact CZ-CB 4.11Å; F87-L136 HydrophobicContact CZ-CD1 3.9Å; F87-L136 HydrophobicContact CZ-CD2 3.36Å; F87-L136 HydrophobicContact CZ-CG 3.97Å; F87-L146 HydrophobicContact CB-CD2 4.45Å; F87-L146 HydrophobicContact CD1-CB 4.47Å; F87-L146 HydrophobicContact CD1-CD1 4.34Å; F87-L146 HydrophobicContact CD1-CD2 3.96Å; F87-L146 HydrophobicContact CG-CD1 4.49Å
88F79.7Confident75.6Confident49 Ų4956.3 Ų56.322%0.21528%0.282CS..Hα-helixtrans-52.6-36175.7-178.2-110.4000112.6W60 E77 V78 Y81 S86 I90 F91 L92W60-F88 HydrophobicContact CZ2-CD2 4.31Å; E77-F88 HydrophobicContact CG-CB 4.34Å; E77-F88 PolarHBondContact OE1-N 3.38Å; V78-F88 HydrophobicContact CG2-CD2 3.96Å; V78-F88 HydrophobicContact CG2-CE2 4.21Å; Y81-F88 HydrophobicContact CD2-CD1 4.09Å; Y81-F88 AromaticContact CE2-CD1 3.99Å; Y81-F88 HydrophobicContact CE2-CD1 3.99Å; S86-F88 VanDerWaalsContact C-N 3.27Å; S86-F88 WeakPolarHBondContact OG-CB 3.33Å; S86-F88 PolarHBondContact OG-N 2.8Å; F88-I90 VanDerWaalsContact C-N 3.28Å; F88-I90 PolarHBondContact O-N 3.43Å; F88-F91 HydrophobicContact CD2-CD1 4.26Å; F88-F91 HydrophobicContact CE2-CD1 4.18Å; F88-F91 PolarHBondContact O-N 2.82Å; F88-L92 HydrophobicContact CE1-CB 4.43Å; F88-L92 HydrophobicContact CE1-CD2 4.18Å; F88-L92 VanDerWaalsContact O-CB 3.28Å; F88-L92 WeakPolarHBondContact O-CB 3.27Å; F88-L92 PolarHBondContact O-N 3.45Å
89D84.4Confident76.5Confident6 Ų655.5 Ų55.53%0.03228%0.282CS..Hα-helixtrans-63.2-33.4178.4-71.6-25.2000113.6Y81 Y83 F87 L93 F126 K130Y81-D89 WeakPolarHBondContact CE2-OD1 3.16Å; Y81-D89 VanDerWaalsContact CZ-OD1 3.25Å; Y81-D89 PolarHBondContact OH-OD1 3.49Å; Y81-D89 PolarHBondContact OH-OD2 3.25Å; Y83-D89 WeakPolarHBondContact CD2-OD2 3.27Å; F87-D89 PolarHBondContact O-N 2.98Å; F87-D89 VanDerWaalsContact O-N 3.15Å; D89-L93 WeakPolarHBondContact O-CB 3.37Å; D89-L93 PolarHBondContact O-N 3.22Å; D89-F126 HydrophobicContact CB-CE1 4.22Å; D89-F126 HydrophobicContact CB-CZ 4.18Å; D89-K130 HydrophobicContact CB-CD 4.14Å; D89-K130 IonicContact OD2-NZ 3.67Å; D89-K130 PolarHBondContact OD2-NZ 3.34Å
90I85.8Confident77.7Confident1 Ų150.4 Ų50.41%0.00526%0.259CS..Hα-helixtrans-75.8-39-179.6-60170.8000109.6I56 F87 F88 L93 A94 L127 K130 L146 P147 S150I56-I90 HydrophobicContact CG2-CG2 4.24Å; F87-I90 HydrophobicContact CD1-CD1 4.19Å; F87-I90 PolarHBondContact O-N 2.9Å; F88-I90 VanDerWaalsContact C-N 3.28Å; F88-I90 PolarHBondContact O-N 3.43Å; I90-L93 PolarHBondContact O-N 3.41Å; I90-A94 PolarHBondContact O-N 2.84Å; I90-L127 HydrophobicContact CG1-CD2 4.42Å; I90-L127 HydrophobicContact CG2-CD2 4.44Å; I90-K130 HydrophobicContact CG1-CG 4.48Å; I90-L146 HydrophobicContact CB-CD2 3.72Å; I90-L146 HydrophobicContact CD1-CD2 3.55Å; I90-L146 HydrophobicContact CG1-CD2 4.23Å; I90-L146 HydrophobicContact CG2-CD2 3.54Å; I90-P147 HydrophobicContact CD1-CB 4.09Å; I90-P147 HydrophobicContact CD1-CG 3.8Å; I90-S150 WeakPolarHBondContact CG2-OG 3.49Å
91F86.6Confident78.8Confident44 Ų4443.5 Ų43.519%0.19323%0.227CC..Hα-helixtrans-62.7-48.4170.8169.5-103.1000111.6T57 W60 F87 F88 L93 A94 V95T57-F91 HydrophobicContact CG2-CD2 4.35Å; T57-F91 HydrophobicContact CG2-CE2 3.87Å; T57-F91 VanDerWaalsContact OG1-CE2 3.3Å; T57-F91 WeakPolarHBondContact OG1-CE2 3.42Å; W60-F91 HydrophobicContact CD2-CB 4.1Å; W60-F91 HydrophobicContact CD2-CG 4.26Å; W60-F91 HydrophobicContact CE3-CB 4.3Å; W60-F91 HydrophobicContact CE3-CD1 4.41Å; W60-F91 AromaticContact CE3-CD2 3.97Å; W60-F91 HydrophobicContact CE3-CD2 3.97Å; W60-F91 HydrophobicContact CE3-CE2 4.44Å; W60-F91 AromaticContact CE3-CG 3.95Å; W60-F91 HydrophobicContact CE3-CG 3.95Å; W60-F91 HydrophobicContact CG-CB 4.26Å; W60-F91 HydrophobicContact CH2-CD1 4.5Å; W60-F91 HydrophobicContact CZ3-CD1 4.24Å; W60-F91 HydrophobicContact CZ3-CD2 4.39Å; W60-F91 HydrophobicContact CZ3-CE1 4.39Å; W60-F91 HydrophobicContact CZ3-CG 4.23Å; F87-F91 PolarHBondContact O-N 3.49Å; F88-F91 HydrophobicContact CD2-CD1 4.26Å; F88-F91 HydrophobicContact CE2-CD1 4.18Å; F88-F91 PolarHBondContact O-N 2.82Å; F91-L93 VanDerWaalsContact C-N 3.27Å; F91-L93 PolarHBondContact O-N 2.85Å; F91-A94 WeakPolarHBondContact O-CB 3.23Å; F91-A94 PolarHBondContact O-N 3.46Å; F91-A94 VanDerWaalsContact O-N 3.08Å; F91-V95 HydrophobicContact CE1-CG2 4.08Å; F91-V95 HydrophobicContact CE2-CG2 4.07Å; F91-V95 HydrophobicContact CZ-CG2 3.81Å; F91-V95 WeakPolarHBondContact O-CG2 3.27Å; F91-V95 PolarHBondContact O-N 3.47Å
92L87.5Confident79.8Confident85 Ų8541.3 Ų41.345%0.44522%0.222SC..Hα-helixtrans-60.1-39.5176.9-176.166.4000111.2F88 V95 L96F88-L92 HydrophobicContact CE1-CB 4.43Å; F88-L92 HydrophobicContact CE1-CD2 4.18Å; F88-L92 VanDerWaalsContact O-CB 3.28Å; F88-L92 WeakPolarHBondContact O-CB 3.27Å; F88-L92 PolarHBondContact O-N 3.45Å; L92-V95 PolarHBondContact O-N 3.31Å; L92-L96 WeakPolarHBondContact O-CB 3.28Å; L92-L96 PolarHBondContact O-N 3.45Å
93L88.1Confident80.7Confident13 Ų1342.1 Ų42.17%0.06823%0.226CC..Hα-helixtrans-63.8-40.3174.6-17075.9000111.8D89 I90 F91 L96 R97 T123 F126 L127D89-L93 WeakPolarHBondContact O-CB 3.37Å; D89-L93 PolarHBondContact O-N 3.22Å; I90-L93 PolarHBondContact O-N 3.41Å; F91-L93 VanDerWaalsContact C-N 3.27Å; F91-L93 PolarHBondContact O-N 2.85Å; L93-L96 HydrophobicContact CD1-CD2 4.42Å; L93-L96 PolarHBondContact O-N 3.48Å; L93-R97 VanDerWaalsContact O-CB 3.26Å; L93-R97 WeakPolarHBondContact O-CB 3.35Å; L93-R97 PolarHBondContact O-N 3.42Å; L93-T123 HydrophobicContact CD1-CG2 3.92Å; L93-T123 HydrophobicContact CG-CG2 4.36Å; L93-F126 HydrophobicContact CB-CE1 4.46Å; L93-F126 HydrophobicContact CD1-CB 4.36Å; L93-F126 HydrophobicContact CD1-CD1 3.62Å; L93-F126 HydrophobicContact CD1-CE1 4.15Å; L93-F126 HydrophobicContact CD1-CG 4.13Å; L93-F126 HydrophobicContact CD2-CD1 3.77Å; L93-F126 HydrophobicContact CD2-CE1 4.39Å; L93-F126 HydrophobicContact CG-CD1 4.18Å; L93-L127 HydrophobicContact CD2-CD1 4.12Å; L93-L127 HydrophobicContact CD2-CD2 3.46Å; L93-L127 VanDerWaalsContact CD2-CD2 3.46Å; L93-L127 HydrophobicContact CD2-CG 3.44Å; L93-L127 VanDerWaalsContact CD2-CG 3.44Å
94A88.5Confident81.4Confident1 Ų139.2 Ų39.21%0.00822%0.217CC..Hα-helixtrans-63.5-41.1174.900000111.7I56 I90 F91 R97 F98I56-A94 HydrophobicContact CB-CB 3.94Å; I56-A94 HydrophobicContact CG1-CB 4.19Å; I56-A94 HydrophobicContact CG2-CB 3.74Å; I90-A94 PolarHBondContact O-N 2.84Å; F91-A94 WeakPolarHBondContact O-CB 3.23Å; F91-A94 PolarHBondContact O-N 3.46Å; F91-A94 VanDerWaalsContact O-N 3.08Å; A94-R97 PolarHBondContact O-N 2.9Å; A94-F98 WeakPolarHBondContact O-CB 3.38Å; A94-F98 PolarHBondContact O-N 3.35Å
95V88.9Confident82.2Confident56 Ų5638.6 Ų38.634%0.33921%0.212SC..Hα-helixtrans-63-45.2173.2176.40000111.4L53 F91 L92 R97 F98 A99L53-V95 HydrophobicContact CD1-CB 4.34Å; L53-V95 HydrophobicContact CD1-CG2 3.94Å; F91-V95 HydrophobicContact CE1-CG2 4.08Å; F91-V95 HydrophobicContact CE2-CG2 4.07Å; F91-V95 HydrophobicContact CZ-CG2 3.81Å; F91-V95 WeakPolarHBondContact O-CG2 3.27Å; F91-V95 PolarHBondContact O-N 3.47Å; L92-V95 PolarHBondContact O-N 3.31Å; V95-R97 VanDerWaalsContact C-N 3.31Å; V95-R97 PolarHBondContact O-N 3.37Å; V95-F98 PolarHBondContact O-N 2.62Å; V95-A99 WeakPolarHBondContact O-CB 3.47Å; V95-A99 PolarHBondContact O-N 2.94Å
96L88.6Confident82.7Confident106 Ų10640 Ų4056%0.55522%0.224SC*.Hα-helixtrans-61.1-42.4176.7-178.771.2000110.9L92 L93 A99 A100L92-L96 WeakPolarHBondContact O-CB 3.28Å; L92-L96 PolarHBondContact O-N 3.45Å; L93-L96 HydrophobicContact CD1-CD2 4.42Å; L93-L96 PolarHBondContact O-N 3.48Å; L96-A99 PolarHBondContact O-N 3.26Å; L96-A100 VanDerWaalsContact O-CB 3.28Å; L96-A100 WeakPolarHBondContact O-CB 3.22Å; L96-A100 PolarHBondContact O-N 2.94Å
97R87Confident82.7Confident11 Ų1144.9 Ų44.94%0.04225%0.253CS..Hα-helixtrans-64.3-48.1178.1-166.2174.689.7-16216.1110.9D52 L93 A94 V95 A99 A100 L101 T123 S150 A154 E157D52-R97 IonicContact OD1-CZ 2.94Å; D52-R97 IonicContact OD1-NH1 2.77Å; D52-R97 IonicContact OD1-NH2 3.25Å; D52-R97 PolarHBondContact OD1-NH2 3.02Å; D52-R97 IonicContact OD2-CZ 3.17Å; D52-R97 VanDerWaalsContact OD2-CZ 3.25Å; D52-R97 IonicContact OD2-NE 2.68Å; D52-R97 IonicContact OD2-NH1 3.58Å; D52-R97 IonicContact OD2-NH2 3.62Å; D52-R97 PolarHBondContact OD2-NH2 3.3Å; L93-R97 VanDerWaalsContact O-CB 3.26Å; L93-R97 WeakPolarHBondContact O-CB 3.35Å; L93-R97 PolarHBondContact O-N 3.42Å; A94-R97 PolarHBondContact O-N 2.9Å; V95-R97 VanDerWaalsContact C-N 3.31Å; V95-R97 PolarHBondContact O-N 3.37Å; R97-A99 VanDerWaalsContact C-N 3.33Å; R97-A99 PolarHBondContact O-N 3.4Å; R97-A100 PolarHBondContact O-N 2.94Å; R97-L101 HydrophobicContact CG-CD1 4.15Å; R97-L101 WeakPolarHBondContact O-CB 3.42Å; R97-L101 VanDerWaalsContact O-CG 3.27Å; R97-L101 WeakPolarHBondContact O-CG 3.26Å; R97-L101 PolarHBondContact O-N 2.77Å; R97-T123 HydrophobicContact CB-CG2 4.47Å; R97-S150 PolarHBondContact NH1-O 3.21Å; R97-A154 VanDerWaalsContact NH1-CB 3.33Å; R97-E157 IonicContact CZ-OE1 2.63Å; R97-E157 IonicContact CZ-OE2 3.73Å; R97-E157 IonicContact NE-OE1 2.84Å; R97-E157 IonicContact NE-OE2 2.68Å; R97-E157 PolarHBondContact NE-OE2 3.33Å; R97-E157 IonicContact NH2-OE1 2.69Å; R97-E157 PolarHBondContact NH2-OE1 3.1Å; R97-E157 IonicContact NH2-OE2 3.79Å; R97-E157 PolarHBondContact NH2-OE2 2.84Å
98F88.6Confident82.2Confident60 Ų6046.9 Ų46.926%0.26327%0.267SS..Hα-helixtrans-53.5-50.6172.7176.5-97.5000111.3V49 T50 L53 A94 V95 A100 L101 I102V49-F98 HydrophobicContact CG1-CD2 3.45Å; V49-F98 VanDerWaalsContact CG1-CD2 3.45Å; V49-F98 HydrophobicContact CG1-CE2 3.89Å; V49-F98 HydrophobicContact CG1-CG 4.41Å; T50-F98 HydrophobicContact CG2-CE2 3.66Å; T50-F98 HydrophobicContact CG2-CZ 4.27Å; L53-F98 HydrophobicContact CB-CD2 4.38Å; L53-F98 HydrophobicContact CD1-CB 3.58Å; L53-F98 HydrophobicContact CD1-CD1 4.32Å; L53-F98 HydrophobicContact CD1-CD2 4.43Å; L53-F98 HydrophobicContact CD1-CG 3.87Å; A94-F98 WeakPolarHBondContact O-CB 3.38Å; A94-F98 PolarHBondContact O-N 3.35Å; V95-F98 PolarHBondContact O-N 2.62Å; F98-A100 PolarHBondContact O-N 2.69Å; F98-L101 PolarHBondContact O-N 2.84Å; F98-I102 HydrophobicContact CD1-CG1 4.44Å; F98-I102 HydrophobicContact CD2-CG1 4.46Å; F98-I102 HydrophobicContact CE1-CG1 4.07Å; F98-I102 HydrophobicContact CE2-CD1 4.29Å; F98-I102 HydrophobicContact CE2-CG1 4.04Å; F98-I102 HydrophobicContact CZ-CD1 4.27Å; F98-I102 HydrophobicContact CZ-CG1 3.84Å; F98-I102 VanDerWaalsContact O-CG1 3.27Å; F98-I102 WeakPolarHBondContact O-CG1 3.42Å; F98-I102 PolarHBondContact O-N 3.48Å
99A87.3Confident81.3Confident51 Ų5151.4 Ų51.442%0.42129%0.286SS..Hα-helixtrans-62.5-43.1178.800000112.3V95 L96 R97 L101 I102 L103V95-A99 WeakPolarHBondContact O-CB 3.47Å; V95-A99 PolarHBondContact O-N 2.94Å; L96-A99 PolarHBondContact O-N 3.26Å; R97-A99 VanDerWaalsContact C-N 3.33Å; R97-A99 PolarHBondContact O-N 3.4Å; A99-L101 PolarHBondContact O-N 2.68Å; A99-I102 PolarHBondContact O-N 2.94Å; A99-L103 WeakPolarHBondContact O-CB 3.36Å; A99-L103 PolarHBondContact O-N 2.84Å
100A84.1Confident79.8Confident24 Ų2452.5 Ų52.520%0.19829%0.292CS..Hα-helixtrans-64-39.3178.500000112.1L96 R97 F98 L103 A104 T119L96-A100 VanDerWaalsContact O-CB 3.28Å; L96-A100 WeakPolarHBondContact O-CB 3.22Å; L96-A100 PolarHBondContact O-N 2.94Å; R97-A100 PolarHBondContact O-N 2.94Å; F98-A100 PolarHBondContact O-N 2.69Å; A100-L103 PolarHBondContact O-N 2.94Å; A100-A104 VanDerWaalsContact O-CB 3.23Å; A100-A104 WeakPolarHBondContact O-CB 2.93Å; A100-A104 PolarHBondContact O-N 3.24Å; A100-T119 HydrophobicContact CB-CG2 4.21Å
101L83.6Confident78.5Confident8 Ų861.8 Ų61.84%0.04233%0.327CS..Hα-helixtrans-69.9-42.5177.7-71.8176.4000112.1F45 V49 R97 F98 A99 L103 A104 Y105 E157 L161F45-L101 HydrophobicContact CZ-CB 4.25Å; V49-L101 HydrophobicContact CG1-CB 4.2Å; V49-L101 HydrophobicContact CG1-CD1 4.05Å; V49-L101 HydrophobicContact CG2-CB 4.47Å; V49-L101 HydrophobicContact CG2-CD1 3.73Å; R97-L101 HydrophobicContact CG-CD1 4.15Å; R97-L101 WeakPolarHBondContact O-CB 3.42Å; R97-L101 VanDerWaalsContact O-CG 3.27Å; R97-L101 WeakPolarHBondContact O-CG 3.26Å; R97-L101 PolarHBondContact O-N 2.77Å; F98-L101 PolarHBondContact O-N 2.84Å; A99-L101 PolarHBondContact O-N 2.68Å; L101-L103 VanDerWaalsContact C-N 3.33Å; L101-A104 PolarHBondContact O-N 2.95Å; L101-Y105 VanDerWaalsContact O-CB 3.28Å; L101-Y105 WeakPolarHBondContact O-CB 3.4Å; L101-Y105 PolarHBondContact O-N 2.8Å; L101-E157 WeakPolarHBondContact CD1-OE2 3.26Å; L101-L161 HydrophobicContact CD2-CD1 3.53Å
102I82.3Confident77.5Confident58 Ų5864.9 Ų64.930%0.29734%0.342SS..Hα-helixtrans-65.7-38.1173.5-63.6-62.3000110.9F98 A99 Y105 A106F98-I102 HydrophobicContact CD1-CG1 4.44Å; F98-I102 HydrophobicContact CD2-CG1 4.46Å; F98-I102 HydrophobicContact CE1-CG1 4.07Å; F98-I102 HydrophobicContact CE2-CD1 4.29Å; F98-I102 HydrophobicContact CE2-CG1 4.04Å; F98-I102 HydrophobicContact CZ-CD1 4.27Å; F98-I102 HydrophobicContact CZ-CG1 3.84Å; F98-I102 VanDerWaalsContact O-CG1 3.27Å; F98-I102 WeakPolarHBondContact O-CG1 3.42Å; F98-I102 PolarHBondContact O-N 3.48Å; A99-I102 PolarHBondContact O-N 2.94Å; I102-Y105 WeakPolarHBondContact O-CB 3.08Å; I102-Y105 PolarHBondContact O-N 3.4Å; I102-A106 VanDerWaalsContact O-CB 3.29Å; I102-A106 WeakPolarHBondContact O-CB 3.42Å; I102-A106 PolarHBondContact O-N 3.1Å
103L81.6Confident76.6Confident106 Ų10667.2 Ų67.256%0.55535%0.345SS*.Hα-helixtrans-68.9-43.6177.1-172.570.4000111.7A99 A100 L101 Y105 A106 V107A99-L103 WeakPolarHBondContact O-CB 3.36Å; A99-L103 PolarHBondContact O-N 2.84Å; A100-L103 PolarHBondContact O-N 2.94Å; L101-L103 VanDerWaalsContact C-N 3.33Å; L103-Y105 PolarHBondContact O-N 3.36Å; L103-A106 PolarHBondContact O-N 3.48Å; L103-V107 HydrophobicContact CD1-CB 4.35Å; L103-V107 HydrophobicContact CD1-CG2 3.51Å; L103-V107 HydrophobicContact CG-CG2 4.23Å; L103-V107 WeakPolarHBondContact O-CB 3.49Å; L103-V107 PolarHBondContact O-N 3.29Å
104A75.5Confident75.8Confident13 Ų1375 Ų7511%0.10737%0.374CS..Hα-helixtrans-59.6-39.1173.900000110.9A100 L101 C108 I116A100-A104 VanDerWaalsContact O-CB 3.23Å; A100-A104 WeakPolarHBondContact O-CB 2.93Å; A100-A104 PolarHBondContact O-N 3.24Å; L101-A104 PolarHBondContact O-N 2.95Å; A104-C108 WeakPolarHBondContact O-CA 3.43Å; A104-C108 VanDerWaalsContact O-CB 3.27Å; A104-C108 WeakPolarHBondContact O-CB 3.26Å; A104-C108 PolarHBondContact O-N 3.02Å; A104-I116 HydrophobicContact CB-CG1 4.31Å
105Y72.9Confident75.1Confident70 Ų7076.5 Ų76.528%0.27539%0.386SS..Hα-helixtrans-66.6-46.2174.3176.1-96.4000113.1R42 F45 L101 I102 L103 L110R42-Y105 HydrophobicContact CB-CE2 4.33Å; R42-Y105 WeakPolarHBondContact CD-OH 3.47Å; R42-Y105 HydrophobicContact CG-CE2 3.97Å; R42-Y105 VanDerWaalsContact CZ-CE2 3.47Å; R42-Y105 PolarHBondContact NE-OH 3.35Å; R42-Y105 PolarHBondContact NH1-OH 3.2Å; R42-Y105 VanDerWaalsContact NH2-CE2 3.34Å; R42-Y105 PolarHBondContact NH2-OH 3.11Å; F45-Y105 HydrophobicContact CD1-CD2 4.38Å; F45-Y105 HydrophobicContact CE1-CD2 4.25Å; L101-Y105 VanDerWaalsContact O-CB 3.28Å; L101-Y105 WeakPolarHBondContact O-CB 3.4Å; L101-Y105 PolarHBondContact O-N 2.8Å; I102-Y105 WeakPolarHBondContact O-CB 3.08Å; I102-Y105 PolarHBondContact O-N 3.4Å; L103-Y105 PolarHBondContact O-N 3.36Å; Y105-L110 HydrophobicContact CD2-CD1 4.31Å
106A72.5Confident74.5Confident73 Ų7374.5 Ų74.560%0.60337%0.373SS*.Hα-helixtrans-77.7-41.1-174.600000113.7I102 L103I102-A106 VanDerWaalsContact O-CB 3.29Å; I102-A106 WeakPolarHBondContact O-CB 3.42Å; I102-A106 PolarHBondContact O-N 3.1Å; L103-A106 PolarHBondContact O-N 3.48Å
107V69.5Low74.1Confident105 Ų10571.3 Ų71.364%0.63636%0.362SS*.Hα-helixtrans-100.6-40.7-170.6178.40000112L103L103-V107 HydrophobicContact CD1-CB 4.35Å; L103-V107 HydrophobicContact CD1-CG2 3.51Å; L103-V107 HydrophobicContact CG-CG2 4.23Å; L103-V107 WeakPolarHBondContact O-CB 3.49Å; L103-V107 PolarHBondContact O-N 3.29Å
108C63.3Low73.8Confident45 Ų4574.7 Ų74.730%0.30438%0.38SS..SBendtrans-88.3-5.8-173.4-60.40000113.5A104 L110 R111A104-C108 WeakPolarHBondContact O-CA 3.43Å; A104-C108 VanDerWaalsContact O-CB 3.27Å; A104-C108 WeakPolarHBondContact O-CB 3.26Å; A104-C108 PolarHBondContact O-N 3.02Å; C108-L110 PolarHBondContact O-N 3.31Å; C108-R111 PolarHBondContact O-N 2.84Å
109K60.7Low73.5Confident144 Ų14474 Ų7463%0.62638%0.381SS*.THydrogen-bonded Turntrans37.645.4179.4-154.7-161.7179-1600111.8R111K109-R111 PolarHBondContact O-N 3.46Å
110L53.9Low73.3Confident28 Ų2872.5 Ų72.515%0.14737%0.366CS..THydrogen-bonded Turntrans49.86.6-176.9-65.9110.4000117.7Y105 C108 H112 I116 V165 L166 E169Y105-L110 HydrophobicContact CD2-CD1 4.31Å; C108-L110 PolarHBondContact O-N 3.31Å; L110-H112 VanDerWaalsContact C-N 3.25Å; L110-H112 PolarHBondContact O-N 3.32Å; L110-I116 HydrophobicContact CD2-CD1 4.46Å; L110-V165 HydrophobicContact CD2-CG1 4.02Å; L110-L166 HydrophobicContact CD2-CD2 4.25Å; L110-E169 WeakPolarHBondContact CD1-OE2 3.27Å; L110-E169 WeakPolarHBondContact CG-OE2 3.27Å
111R56.9Low73.3Confident197 Ų19773.9 Ų73.974%0.74338%0.378SS*.  trans-72.4-17.3-171.7-165.3160.163.8102.41.6113.9C108 K109C108-R111 PolarHBondContact O-N 2.84Å; K109-R111 PolarHBondContact O-N 3.46Å
112H65.6Low73.4Confident109 Ų10977.7 Ų77.751%0.50540%0.401SS..  trans-123.189.7175.9-65.1-56.5000110.3L110 W114 A115L110-H112 VanDerWaalsContact C-N 3.25Å; L110-H112 PolarHBondContact O-N 3.32Å; H112-W114 PolarHBondContact O-N 3.18Å; H112-W114 VanDerWaalsContact O-N 3.1Å; H112-A115 HydrophobicContact CB-CB 4.5Å; H112-A115 WeakPolarHBondContact O-CB 3.31Å; H112-A115 PolarHBondContact O-N 2.84Å
113W68.8Low73.6Confident133 Ų13375.4 Ų75.450%0.50439%0.39SS..Hα-helixtrans-47-36.6171.8-177.858000113.2A115 I116 A117 D162W113-A115 VanDerWaalsContact C-N 3.3Å; W113-A115 PolarHBondContact O-N 3.26Å; W113-I116 PolarHBondContact O-N 2.94Å; W113-A117 PolarHBondContact O-N 2.9Å; W113-D162 VanDerWaalsContact CE2-OD1 3.23Å; W113-D162 VanDerWaalsContact CZ2-OD1 3.27Å; W113-D162 WeakPolarHBondContact CZ2-OD1 3.32Å; W113-D162 PolarHBondContact NE1-OD1 3.45Å
114W72.5Confident73.7Confident178 Ų17871.2 Ų71.267%0.67437%0.37SS*.Hα-helixtrans-64-28-179.5-118.465.3000114.5H112 A117 I118H112-W114 PolarHBondContact O-N 3.18Å; H112-W114 VanDerWaalsContact O-N 3.1Å; W114-A117 PolarHBondContact O-N 2.86Å; W114-I118 HydrophobicContact CD2-CD1 4.45Å; W114-I118 HydrophobicContact CE3-CD1 3.4Å; W114-I118 VanDerWaalsContact CE3-CD1 3.4Å; W114-I118 HydrophobicContact CE3-CG1 3.85Å; W114-I118 HydrophobicContact CZ3-CD1 3.78Å; W114-I118 HydrophobicContact CZ3-CG1 4.06Å; W114-I118 WeakPolarHBondContact O-CD1 3.45Å; W114-I118 VanDerWaalsContact O-CG1 3.25Å; W114-I118 WeakPolarHBondContact O-CG1 3.29Å; W114-I118 PolarHBondContact O-N 2.96Å
115A73.8Confident74.4Confident32 Ų3273.4 Ų73.426%0.26439%0.388SS..Hα-helixtrans-66.3-41.3-18000000111.4H112 W113 I118 T119H112-A115 HydrophobicContact CB-CB 4.5Å; H112-A115 WeakPolarHBondContact O-CB 3.31Å; H112-A115 PolarHBondContact O-N 2.84Å; W113-A115 VanDerWaalsContact C-N 3.3Å; W113-A115 PolarHBondContact O-N 3.26Å; A115-I118 PolarHBondContact O-N 3.38Å; A115-T119 WeakPolarHBondContact O-CG2 3.33Å; A115-T119 PolarHBondContact O-N 3.28Å; A115-T119 PolarHBondContact O-OG1 2.99Å; A115-T119 VanDerWaalsContact O-OG1 3.12Å
116I75.3Confident75Confident14 Ų1473.1 Ų73.17%0.07239%0.388CS..Hα-helixtrans-64.8-48.3177.4-60.2165.7000109.1A104 L110 W113 I118 T119 T120 L161A104-I116 HydrophobicContact CB-CG1 4.31Å; L110-I116 HydrophobicContact CD2-CD1 4.46Å; W113-I116 PolarHBondContact O-N 2.94Å; I116-I118 VanDerWaalsContact C-N 3.34Å; I116-I118 PolarHBondContact O-N 2.9Å; I116-T119 WeakPolarHBondContact CA-OG1 3.31Å; I116-T119 PolarHBondContact O-N 3.35Å; I116-T119 PolarHBondContact O-OG1 2.98Å; I116-T120 PolarHBondContact O-N 3.01Å; I116-T120 PolarHBondContact O-OG1 2.76Å; I116-L161 HydrophobicContact CG2-CD1 3.91Å
117A80.2Confident75.6Confident38 Ų3869.7 Ų69.731%0.31436%0.36SS..Hα-helixtrans-57.8-42.6177.400000112.6W113 W114 T120 A121W113-A117 PolarHBondContact O-N 2.9Å; W114-A117 PolarHBondContact O-N 2.86Å; A117-T120 PolarHBondContact O-N 2.93Å; A117-A121 VanDerWaalsContact O-CB 3.22Å; A117-A121 WeakPolarHBondContact O-CB 3.36Å; A117-A121 PolarHBondContact O-N 2.96Å
118I81.4Confident76.4Confident83 Ų8368.8 Ų68.843%0.42635%0.35SS..Hα-helixtrans-64.7-44.8177-69.8162.2000111.2W114 A115 I116 T120 A121 T122W114-I118 HydrophobicContact CD2-CD1 4.45Å; W114-I118 HydrophobicContact CE3-CD1 3.4Å; W114-I118 VanDerWaalsContact CE3-CD1 3.4Å; W114-I118 HydrophobicContact CE3-CG1 3.85Å; W114-I118 HydrophobicContact CZ3-CD1 3.78Å; W114-I118 HydrophobicContact CZ3-CG1 4.06Å; W114-I118 WeakPolarHBondContact O-CD1 3.45Å; W114-I118 VanDerWaalsContact O-CG1 3.25Å; W114-I118 WeakPolarHBondContact O-CG1 3.29Å; W114-I118 PolarHBondContact O-N 2.96Å; A115-I118 PolarHBondContact O-N 3.38Å; I116-I118 VanDerWaalsContact C-N 3.34Å; I116-I118 PolarHBondContact O-N 2.9Å; I118-T120 VanDerWaalsContact C-N 3.33Å; I118-T120 PolarHBondContact O-N 3.44Å; I118-A121 PolarHBondContact O-N 3.05Å; I118-T122 WeakPolarHBondContact O-CB 2.83Å; I118-T122 PolarHBondContact O-N 3.35Å; I118-T122 PolarHBondContact O-OG1 3.38Å
119T81.6Confident77.3Confident46 Ų4668.5 Ų68.528%0.28235%0.351SS..Hα-helixtrans-64.9-38.2179.749.50000111.8A100 A115 I116 T123A100-T119 HydrophobicContact CB-CG2 4.21Å; A115-T119 WeakPolarHBondContact O-CG2 3.33Å; A115-T119 PolarHBondContact O-N 3.28Å; A115-T119 PolarHBondContact O-OG1 2.99Å; A115-T119 VanDerWaalsContact O-OG1 3.12Å; I116-T119 WeakPolarHBondContact CA-OG1 3.31Å; I116-T119 PolarHBondContact O-N 3.35Å; I116-T119 PolarHBondContact O-OG1 2.98Å; T119-T123 WeakPolarHBondContact O-CB 3.27Å; T119-T123 VanDerWaalsContact O-CG2 3.29Å; T119-T123 WeakPolarHBondContact O-CG2 3.28Å; T119-T123 PolarHBondContact O-N 3.4Å; T119-T123 PolarHBondContact O-OG1 3.48Å
120T82.4Confident78.4Confident18 Ų1861.8 Ų61.811%0.1132%0.322CS..Hα-helixtrans-67.8-44.8172.3-58.50000111.9I116 A117 I118 T122 T123 S124 T158I116-T120 PolarHBondContact O-N 3.01Å; I116-T120 PolarHBondContact O-OG1 2.76Å; A117-T120 PolarHBondContact O-N 2.93Å; I118-T120 VanDerWaalsContact C-N 3.33Å; I118-T120 PolarHBondContact O-N 3.44Å; T120-T122 VanDerWaalsContact C-N 3.27Å; T120-T122 PolarHBondContact O-N 2.86Å; T120-T123 WeakPolarHBondContact CA-OG1 3.43Å; T120-T123 PolarHBondContact O-N 3.47Å; T120-T123 PolarHBondContact O-OG1 2.82Å; T120-S124 VanDerWaalsContact O-CB 3.31Å; T120-S124 WeakPolarHBondContact O-CB 3.27Å; T120-S124 PolarHBondContact O-N 2.83Å; T120-S124 PolarHBondContact O-OG 2.66Å; T120-T158 HydrophobicContact CG2-CG2 3.88Å; T120-T158 WeakPolarHBondContact CG2-OG1 3.14Å; T120-T158 PolarHBondContact OG1-OG1 3.1Å
121A85.5Confident79.7Confident54 Ų5462.8 Ų62.845%0.44633%0.329SS..Hα-helixtrans-60.7-40.6178.800000111.1A117 I118 S124 A125A117-A121 VanDerWaalsContact O-CB 3.22Å; A117-A121 WeakPolarHBondContact O-CB 3.36Å; A117-A121 PolarHBondContact O-N 2.96Å; I118-A121 PolarHBondContact O-N 3.05Å; A121-S124 WeakPolarHBondContact CA-OG 3.42Å; A121-S124 PolarHBondContact O-OG 3.37Å; A121-A125 VanDerWaalsContact O-CB 3.24Å; A121-A125 WeakPolarHBondContact O-CB 3.32Å; A121-A125 PolarHBondContact O-N 2.85Å
122T85.7Confident80.8Confident87 Ų8759.5 Ų59.553%0.53433%0.325SS..Hα-helixtrans-66-47.3177.1-54.20000111.4I118 T120 A125 F126I118-T122 WeakPolarHBondContact O-CB 2.83Å; I118-T122 PolarHBondContact O-N 3.35Å; I118-T122 PolarHBondContact O-OG1 3.38Å; T120-T122 VanDerWaalsContact C-N 3.27Å; T120-T122 PolarHBondContact O-N 2.86Å; T122-A125 PolarHBondContact O-N 3.34Å; T122-F126 WeakPolarHBondContact O-CB 3.39Å; T122-F126 PolarHBondContact O-N 2.83Å
123T85.1Confident81Confident10 Ų1058.4 Ų58.46%0.06132%0.322CS..Hα-helixtrans-67.5-38.6-18049.70000112.2L93 R97 T119 T120 F126 L127L93-T123 HydrophobicContact CD1-CG2 3.92Å; L93-T123 HydrophobicContact CG-CG2 4.36Å; R97-T123 HydrophobicContact CB-CG2 4.47Å; T119-T123 WeakPolarHBondContact O-CB 3.27Å; T119-T123 VanDerWaalsContact O-CG2 3.29Å; T119-T123 WeakPolarHBondContact O-CG2 3.28Å; T119-T123 PolarHBondContact O-N 3.4Å; T119-T123 PolarHBondContact O-OG1 3.48Å; T120-T123 WeakPolarHBondContact CA-OG1 3.43Å; T120-T123 PolarHBondContact O-N 3.47Å; T120-T123 PolarHBondContact O-OG1 2.82Å; T123-F126 PolarHBondContact O-N 2.98Å; T123-L127 PolarHBondContact O-N 3.49Å
124S85.5Confident81Confident19 Ų1952.6 Ų52.613%0.13330%0.302CS..Hα-helixtrans-67.6-43175.3560000112.8T120 A121 F126 L127 I128T120-S124 VanDerWaalsContact O-CB 3.31Å; T120-S124 WeakPolarHBondContact O-CB 3.27Å; T120-S124 PolarHBondContact O-N 2.83Å; T120-S124 PolarHBondContact O-OG 2.66Å; A121-S124 WeakPolarHBondContact CA-OG 3.42Å; A121-S124 PolarHBondContact O-OG 3.37Å; S124-F126 VanDerWaalsContact C-N 3.3Å; S124-F126 PolarHBondContact O-N 3.21Å; S124-L127 PolarHBondContact O-N 3.03Å; S124-I128 VanDerWaalsContact O-CG1 3.31Å; S124-I128 WeakPolarHBondContact O-CG1 3.35Å; S124-I128 PolarHBondContact O-N 3.34Å
125A88.4Confident80.7Confident58 Ų5852.4 Ų52.448%0.47931%0.306SS..Hα-helixtrans-60.4-41.417400000111.7A121 T122 I128 A129A121-A125 VanDerWaalsContact O-CB 3.24Å; A121-A125 WeakPolarHBondContact O-CB 3.32Å; A121-A125 PolarHBondContact O-N 2.85Å; T122-A125 PolarHBondContact O-N 3.34Å; A125-I128 PolarHBondContact O-N 3.27Å; A125-A129 WeakPolarHBondContact O-CB 3.18Å; A125-A129 PolarHBondContact O-N 2.83Å
126F86.5Confident79.9Confident64 Ų6451.1 Ų51.128%0.28130%0.295SS..Hα-helixtrans-62.1-44.8174.7-177.5-91.2000112Y83 D89 L93 T122 T123 S124 I128 A129 K130Y83-F126 HydrophobicContact CE2-CE2 4.33Å; Y83-F126 HydrophobicContact CE2-CZ 4.32Å; D89-F126 HydrophobicContact CB-CE1 4.22Å; D89-F126 HydrophobicContact CB-CZ 4.18Å; L93-F126 HydrophobicContact CB-CE1 4.46Å; L93-F126 HydrophobicContact CD1-CB 4.36Å; L93-F126 HydrophobicContact CD1-CD1 3.62Å; L93-F126 HydrophobicContact CD1-CE1 4.15Å; L93-F126 HydrophobicContact CD1-CG 4.13Å; L93-F126 HydrophobicContact CD2-CD1 3.77Å; L93-F126 HydrophobicContact CD2-CE1 4.39Å; L93-F126 HydrophobicContact CG-CD1 4.18Å; T122-F126 WeakPolarHBondContact O-CB 3.39Å; T122-F126 PolarHBondContact O-N 2.83Å; T123-F126 PolarHBondContact O-N 2.98Å; S124-F126 VanDerWaalsContact C-N 3.3Å; S124-F126 PolarHBondContact O-N 3.21Å; F126-I128 PolarHBondContact O-N 3.44Å; F126-A129 PolarHBondContact O-N 2.95Å; F126-K130 VanDerWaalsContact O-CB 3.25Å; F126-K130 WeakPolarHBondContact O-CB 3.37Å; F126-K130 PolarHBondContact O-N 2.91Å
127L85.3Confident79.1Confident2 Ų253.8 Ų53.81%0.0131%0.309CS..Hα-helixtrans-60.5-43.2175.6-76.9177.1000112.3I90 L93 T123 S124 K130 V131 F151I90-L127 HydrophobicContact CG1-CD2 4.42Å; I90-L127 HydrophobicContact CG2-CD2 4.44Å; L93-L127 HydrophobicContact CD2-CD1 4.12Å; L93-L127 HydrophobicContact CD2-CD2 3.46Å; L93-L127 VanDerWaalsContact CD2-CD2 3.46Å; L93-L127 HydrophobicContact CD2-CG 3.44Å; L93-L127 VanDerWaalsContact CD2-CG 3.44Å; T123-L127 PolarHBondContact O-N 3.49Å; S124-L127 PolarHBondContact O-N 3.03Å; L127-K130 PolarHBondContact O-N 3.34Å; L127-V131 WeakPolarHBondContact O-CB 3.42Å; L127-V131 VanDerWaalsContact O-CG2 3.25Å; L127-V131 WeakPolarHBondContact O-CG2 3.41Å; L127-V131 PolarHBondContact O-N 2.72Å; L127-F151 HydrophobicContact CD1-CB 4.18Å; L127-F151 HydrophobicContact CD1-CD2 4.49Å
128I85.2Confident78.1Confident85 Ų8557.3 Ų57.344%0.43633%0.331SS..Hα-helixtrans-62.8-47.7178.4-67.4164.9000110.3S124 A125 F126 K130 V131 I132 F151S124-I128 VanDerWaalsContact O-CG1 3.31Å; S124-I128 WeakPolarHBondContact O-CG1 3.35Å; S124-I128 PolarHBondContact O-N 3.34Å; A125-I128 PolarHBondContact O-N 3.27Å; F126-I128 PolarHBondContact O-N 3.44Å; I128-K130 VanDerWaalsContact C-N 3.32Å; I128-K130 PolarHBondContact O-N 3.41Å; I128-V131 PolarHBondContact O-N 3.12Å; I128-I132 HydrophobicContact CG2-CD1 3.77Å; I128-I132 VanDerWaalsContact O-CG1 3.3Å; I128-I132 WeakPolarHBondContact O-CG1 3.34Å; I128-I132 PolarHBondContact O-N 2.97Å; I128-F151 HydrophobicContact CD1-CE2 4.45Å; I128-F151 HydrophobicContact CG1-CE2 4.39Å
129A84.1Confident77.2Confident40 Ų4057.4 Ų57.433%0.33133%0.33SS..Hα-helixtrans-59.9-44.3177.200000111.4A125 F126 I132 L133A125-A129 WeakPolarHBondContact O-CB 3.18Å; A125-A129 PolarHBondContact O-N 2.83Å; F126-A129 PolarHBondContact O-N 2.95Å; A129-I132 PolarHBondContact O-N 3.02Å; A129-L133 VanDerWaalsContact O-CB 3.32Å; A129-L133 WeakPolarHBondContact O-CB 3.2Å; A129-L133 VanDerWaalsContact O-CG 3.25Å; A129-L133 WeakPolarHBondContact O-CG 3.38Å; A129-L133 PolarHBondContact O-N 2.91Å
130K82.8Confident76.5Confident3 Ų357 Ų571%0.01333%0.334CS..Hα-helixtrans-61.4-46.4176.7-176.477.2179.2177.30111.4Y83 S86 D89 I90 F126 L127 I128 I132 L133 S134Y83-K130 PolarHBondContact O-NZ 3.3Å; S86-K130 PolarHBondContact O-NZ 2.92Å; D89-K130 HydrophobicContact CB-CD 4.14Å; D89-K130 IonicContact OD2-NZ 3.67Å; D89-K130 PolarHBondContact OD2-NZ 3.34Å; I90-K130 HydrophobicContact CG1-CG 4.48Å; F126-K130 VanDerWaalsContact O-CB 3.25Å; F126-K130 WeakPolarHBondContact O-CB 3.37Å; F126-K130 PolarHBondContact O-N 2.91Å; L127-K130 PolarHBondContact O-N 3.34Å; I128-K130 VanDerWaalsContact C-N 3.32Å; I128-K130 PolarHBondContact O-N 3.41Å; K130-I132 VanDerWaalsContact C-N 3.32Å; K130-I132 PolarHBondContact O-N 3.46Å; K130-L133 PolarHBondContact O-N 3.47Å; K130-S134 WeakPolarHBondContact O-CB 3.35Å; K130-S134 PolarHBondContact O-N 3.49Å; K130-S134 PolarHBondContact O-OG 3.31Å
131V81.5Confident76Confident49 Ų4960 Ų6030%0.29736%0.361SS..Hα-helixtrans-59.8-42.3178.6165.70000111.4L127 I128 L137 P147L127-V131 WeakPolarHBondContact O-CB 3.42Å; L127-V131 VanDerWaalsContact O-CG2 3.25Å; L127-V131 WeakPolarHBondContact O-CG2 3.41Å; L127-V131 PolarHBondContact O-N 2.72Å; I128-V131 PolarHBondContact O-N 3.12Å; V131-L137 WeakPolarHBondContact O-CD1 3.27Å; V131-P147 HydrophobicContact CG2-CB 3.55Å; V131-P147 HydrophobicContact CG2-CG 4.5Å
132I79.4Confident75.3Confident128 Ų12861.6 Ų61.666%0.65636%0.359SS*.Hα-helixtrans-72.2-36.9-178.8-64.4166.3000111.7I128 A129 K130I128-I132 HydrophobicContact CG2-CD1 3.77Å; I128-I132 VanDerWaalsContact O-CG1 3.3Å; I128-I132 WeakPolarHBondContact O-CG1 3.34Å; I128-I132 PolarHBondContact O-N 2.97Å; A129-I132 PolarHBondContact O-N 3.02Å; K130-I132 VanDerWaalsContact C-N 3.32Å; K130-I132 PolarHBondContact O-N 3.46Å
133L70.8Confident74.8Confident85 Ų8557.7 Ų57.745%0.44534%0.336SS..Hα-helixtrans-87.6-18.1-174.8-68.7172.3000114.2Y83 H84 A129 K130Y83-L133 HydrophobicContact CE1-CD1 4.29Å; H84-L133 PolarHBondContact ND1-O 3.03Å; A129-L133 VanDerWaalsContact O-CB 3.32Å; A129-L133 WeakPolarHBondContact O-CB 3.2Å; A129-L133 VanDerWaalsContact O-CG 3.25Å; A129-L133 WeakPolarHBondContact O-CG 3.38Å; A129-L133 PolarHBondContact O-N 2.91Å; K130-L133 PolarHBondContact O-N 3.47Å
134S69.1Low74.6Confident12 Ų1261.2 Ų61.28%0.08435%0.348CS..  trans-82122.5-174.1-61.90000111.4H84 K130 L136H84-S134 WeakPolarHBondContact O-CA 2.87Å; K130-S134 WeakPolarHBondContact O-CB 3.35Å; K130-S134 PolarHBondContact O-N 3.49Å; K130-S134 PolarHBondContact O-OG 3.31Å; S134-L136 PolarHBondContact O-N 3.5Å; S134-L136 VanDerWaalsContact O-N 3.11Å
135K64.6Low74.5Confident174 Ų17463.6 Ų63.676%0.75736%0.359SS*.G310 helixtrans-68.5-3.5169.2-71.5-167.2177.3178.40112.9H84 L137 S138H84-K135 PolarHBondContact O-N 3.37Å; K135-L137 PolarHBondContact O-N 3.3Å; K135-S138 PolarHBondContact O-N 2.9Å
136L58.2Low74.3Confident4 Ų461 Ų612%0.02134%0.337CS..G310 helixtrans-57.1-23.9173.7-74.4164.5000113.6A85 F87 S134 S138 Q139A85-L136 VanDerWaalsContact O-CD2 3.26Å; A85-L136 WeakPolarHBondContact O-CD2 3.46Å; F87-L136 HydrophobicContact CD1-CD1 3.98Å; F87-L136 HydrophobicContact CD2-CD1 4.46Å; F87-L136 HydrophobicContact CD2-CD2 4.21Å; F87-L136 HydrophobicContact CE1-CB 4.3Å; F87-L136 HydrophobicContact CE1-CD1 3.77Å; F87-L136 HydrophobicContact CE1-CD2 4.12Å; F87-L136 HydrophobicContact CE1-CG 4.27Å; F87-L136 HydrophobicContact CE2-CD1 4.23Å; F87-L136 HydrophobicContact CE2-CD2 3.39Å; F87-L136 HydrophobicContact CE2-CG 4.34Å; F87-L136 HydrophobicContact CG-CD1 4.34Å; F87-L136 HydrophobicContact CZ-CB 4.11Å; F87-L136 HydrophobicContact CZ-CD1 3.9Å; F87-L136 HydrophobicContact CZ-CD2 3.36Å; F87-L136 HydrophobicContact CZ-CG 3.97Å; S134-L136 PolarHBondContact O-N 3.5Å; S134-L136 VanDerWaalsContact O-N 3.11Å; L136-S138 PolarHBondContact O-N 3.43Å; L136-Q139 PolarHBondContact O-N 3.38Å
137L57Low74.1Confident70 Ų7058.5 Ų58.537%0.36633%0.328SS..G310 helixtrans-64.6-1.7169.6-60.6180000113.6V131 K135 Y144V131-L137 WeakPolarHBondContact O-CD1 3.27Å; K135-L137 PolarHBondContact O-N 3.3Å; L137-Y144 VanDerWaalsContact C-CE1 3.46Å; L137-Y144 VanDerWaalsContact CA-CE1 3.41Å; L137-Y144 HydrophobicContact CB-CD1 4.23Å; L137-Y144 HydrophobicContact CB-CE1 3.79Å; L137-Y144 HydrophobicContact CD2-CD1 3.42Å; L137-Y144 VanDerWaalsContact CD2-CD1 3.42Å; L137-Y144 HydrophobicContact CD2-CE1 3.91Å; L137-Y144 HydrophobicContact CD2-CG 4.47Å; L137-Y144 HydrophobicContact CG-CD1 4.41Å; L137-Y144 HydrophobicContact CG-CE1 4.46Å; L137-Y144 WeakPolarHBondContact O-CE1 3.48Å; L137-Y144 PolarHBondContact O-OH 2.91Å
138S60.3Low74.2Confident112 Ų11262.9 Ų62.978%0.78335%0.35SS*.G310 helixtrans-107.9-2.8169.8-83.30000113.3K135 L136K135-S138 PolarHBondContact O-N 2.9Å; L136-S138 PolarHBondContact O-N 3.43Å
139Q62.6Low74.3Confident85 Ų8560.4 Ų60.440%0.39734%0.337SS..SBendtrans-99.221.5-166.3-149170.9-70.400114.8L136L136-Q139 PolarHBondContact O-N 3.38Å
140G67.5Low74.4Confident37 Ų3758.5 Ų58.538%0.38132%0.321SS..  trans104.5168.8173.800000114.6F142 G143 Y144G140-F142 VanDerWaalsContact C-N 3.29Å; G140-F142 PolarHBondContact O-N 3.09Å; G140-F142 VanDerWaalsContact O-N 3.16Å; G140-G143 PolarHBondContact O-N 2.81Å; G140-Y144 VanDerWaalsContact C-CE2 3.48Å; G140-Y144 VanDerWaalsContact O-CD2 3.29Å; G140-Y144 WeakPolarHBondContact O-CD2 3.38Å; G140-Y144 WeakPolarHBondContact O-CE2 3.4Å
141A70.3Confident74.6Confident82 Ų8261.8 Ų61.868%0.67834%0.336SS*.Hα-helixtrans-58.4-31.9-166.900000115G143 Y144A141-G143 VanDerWaalsContact C-N 3.33Å; A141-Y144 WeakPolarHBondContact O-CD2 3.47Å
142F72.3Confident75Confident88 Ų8863.4 Ų63.439%0.38634%0.342SS..Hα-helixtrans-74-23.3177.8-94.5-88.1000113.4I62 G140 Y144 L145 L146I62-F142 HydrophobicContact CG2-CE1 4Å; I62-F142 HydrophobicContact CG2-CZ 4.46Å; G140-F142 VanDerWaalsContact C-N 3.29Å; G140-F142 PolarHBondContact O-N 3.09Å; G140-F142 VanDerWaalsContact O-N 3.16Å; F142-Y144 VanDerWaalsContact C-N 3.31Å; F142-Y144 PolarHBondContact O-N 3.46Å; F142-L145 HydrophobicContact CD1-CD2 4.04Å; F142-L145 HydrophobicContact CE1-CD2 3.91Å; F142-L145 PolarHBondContact O-N 3.25Å; F142-L146 PolarHBondContact O-N 2.95Å
143G75.3Confident75.3Confident5 Ų558.1 Ų58.15%0.05232%0.315CS..Hα-helixtrans-70.2-25.7179.700000114G140 A141 P147G140-G143 PolarHBondContact O-N 2.81Å; A141-G143 VanDerWaalsContact C-N 3.33Å; G143-P147 WeakPolarHBondContact O-CD 3.12Å; G143-P147 WeakPolarHBondContact O-CG 3.4Å
144Y79Confident75.9Confident84 Ų8454.1 Ų54.133%0.32929%0.294SS..Hα-helixtrans-82.5-33.3172.1-40.8-85.8000111.9L137 G140 A141 F142 L146 P147 I148L137-Y144 VanDerWaalsContact C-CE1 3.46Å; L137-Y144 VanDerWaalsContact CA-CE1 3.41Å; L137-Y144 HydrophobicContact CB-CD1 4.23Å; L137-Y144 HydrophobicContact CB-CE1 3.79Å; L137-Y144 HydrophobicContact CD2-CD1 3.42Å; L137-Y144 VanDerWaalsContact CD2-CD1 3.42Å; L137-Y144 HydrophobicContact CD2-CE1 3.91Å; L137-Y144 HydrophobicContact CD2-CG 4.47Å; L137-Y144 HydrophobicContact CG-CD1 4.41Å; L137-Y144 HydrophobicContact CG-CE1 4.46Å; L137-Y144 WeakPolarHBondContact O-CE1 3.48Å; L137-Y144 PolarHBondContact O-OH 2.91Å; G140-Y144 VanDerWaalsContact C-CE2 3.48Å; G140-Y144 VanDerWaalsContact O-CD2 3.29Å; G140-Y144 WeakPolarHBondContact O-CD2 3.38Å; G140-Y144 WeakPolarHBondContact O-CE2 3.4Å; A141-Y144 WeakPolarHBondContact O-CD2 3.47Å; F142-Y144 VanDerWaalsContact C-N 3.31Å; F142-Y144 PolarHBondContact O-N 3.46Å; Y144-L146 VanDerWaalsContact C-N 3.35Å; Y144-L146 PolarHBondContact O-N 3.04Å; Y144-P147 WeakPolarHBondContact O-CD 3.19Å; Y144-I148 WeakPolarHBondContact O-CB 3.49Å; Y144-I148 VanDerWaalsContact O-CD1 3.24Å; Y144-I148 WeakPolarHBondContact O-CD1 3.46Å; Y144-I148 WeakPolarHBondContact O-CG1 3.27Å; Y144-I148 PolarHBondContact O-N 2.94Å; Y144-I148 VanDerWaalsContact O-N 3.17Å
145L84.2Confident76.6Confident68 Ų6860.7 Ų60.736%0.35632%0.317SS..Hα-helixtrans-64.5-42.1-172.3-170.464.1000111.3F142 I148 I149F142-L145 HydrophobicContact CD1-CD2 4.04Å; F142-L145 HydrophobicContact CE1-CD2 3.91Å; F142-L145 PolarHBondContact O-N 3.25Å; L145-I148 PolarHBondContact O-N 3.3Å; L145-I149 HydrophobicContact CD1-CD1 3.65Å; L145-I149 HydrophobicContact CD1-CG1 4.03Å; L145-I149 HydrophobicContact CD2-CD1 4.3Å; L145-I149 HydrophobicContact CG-CD1 3.63Å; L145-I149 HydrophobicContact CG-CG1 4.26Å; L145-I149 VanDerWaalsContact O-CB 3.27Å; L145-I149 WeakPolarHBondContact O-CB 3.36Å; L145-I149 VanDerWaalsContact O-CG1 3.26Å; L145-I149 WeakPolarHBondContact O-CG1 3.35Å; L145-I149 PolarHBondContact O-N 3.34Å
146L83.9Confident77.5Confident4 Ų455.6 Ų55.62%0.02130%0.298CS..Hα-helixtrans-65.7-48.9-175.6-164.4153.9000112.9L59 W60 E63 F87 I90 F142 Y144 S150L59-L146 HydrophobicContact CB-CD1 4.19Å; L59-L146 HydrophobicContact CB-CG 4.32Å; W60-L146 HydrophobicContact CB-CD1 4.11Å; E63-L146 HydrophobicContact CB-CD1 4.28Å; F87-L146 HydrophobicContact CB-CD2 4.45Å; F87-L146 HydrophobicContact CD1-CB 4.47Å; F87-L146 HydrophobicContact CD1-CD1 4.34Å; F87-L146 HydrophobicContact CD1-CD2 3.96Å; F87-L146 HydrophobicContact CG-CD1 4.49Å; I90-L146 HydrophobicContact CB-CD2 3.72Å; I90-L146 HydrophobicContact CD1-CD2 3.55Å; I90-L146 HydrophobicContact CG1-CD2 4.23Å; I90-L146 HydrophobicContact CG2-CD2 3.54Å; F142-L146 PolarHBondContact O-N 2.95Å; Y144-L146 VanDerWaalsContact C-N 3.35Å; Y144-L146 PolarHBondContact O-N 3.04Å; L146-S150 VanDerWaalsContact O-CB 3.31Å; L146-S150 WeakPolarHBondContact O-CB 3.3Å; L146-S150 PolarHBondContact O-N 3.39Å
147P82.9Confident78.5Confident12 Ų1255.6 Ų55.68%0.07830%0.298CS..Hα-helixtrans-64.5-41.1172.6-1623.9000114.1I90 V131 G143 Y144 S150 F151I90-P147 HydrophobicContact CD1-CB 4.09Å; I90-P147 HydrophobicContact CD1-CG 3.8Å; V131-P147 HydrophobicContact CG2-CB 3.55Å; V131-P147 HydrophobicContact CG2-CG 4.5Å; G143-P147 WeakPolarHBondContact O-CD 3.12Å; G143-P147 WeakPolarHBondContact O-CG 3.4Å; Y144-P147 WeakPolarHBondContact O-CD 3.19Å; P147-S150 PolarHBondContact O-N 3.45Å; P147-F151 WeakPolarHBondContact O-CB 3.49Å; P147-F151 PolarHBondContact O-N 3.01Å
148I86.3Confident79.5Confident94 Ų9453.8 Ų53.848%0.48229%0.289SS..Hα-helixtrans-64.4-47.4-178.4-69.5167.8000110.4Y144 L145 F151 I152Y144-I148 WeakPolarHBondContact O-CB 3.49Å; Y144-I148 VanDerWaalsContact O-CD1 3.24Å; Y144-I148 WeakPolarHBondContact O-CD1 3.46Å; Y144-I148 WeakPolarHBondContact O-CG1 3.27Å; Y144-I148 PolarHBondContact O-N 2.94Å; Y144-I148 VanDerWaalsContact O-N 3.17Å; L145-I148 PolarHBondContact O-N 3.3Å; I148-F151 PolarHBondContact O-N 3.46Å; I148-I152 HydrophobicContact CG2-CD1 3.8Å; I148-I152 VanDerWaalsContact O-CG1 3.32Å; I148-I152 WeakPolarHBondContact O-CG1 3.18Å; I148-I152 PolarHBondContact O-N 3.37Å
149I87.9Confident80.4Confident32 Ų3255.6 Ų55.616%0.16428%0.279CS..Hα-helixtrans-63.6-44177-72.8-178.7000110.8F55 I56 L59 L145 F151 I152 L153F55-I149 HydrophobicContact CD1-CG2 3.79Å; F55-I149 HydrophobicContact CE1-CD1 4.13Å; F55-I149 HydrophobicContact CE1-CG2 3.45Å; F55-I149 VanDerWaalsContact CE1-CG2 3.45Å; I56-I149 HydrophobicContact CD1-CG2 4.28Å; L59-I149 HydrophobicContact CD1-CB 4.07Å; L59-I149 HydrophobicContact CD1-CD1 3.66Å; L59-I149 HydrophobicContact CD1-CG1 4.46Å; L59-I149 HydrophobicContact CD1-CG2 3.62Å; L59-I149 HydrophobicContact CD2-CD1 4.45Å; L145-I149 HydrophobicContact CD1-CD1 3.65Å; L145-I149 HydrophobicContact CD1-CG1 4.03Å; L145-I149 HydrophobicContact CD2-CD1 4.3Å; L145-I149 HydrophobicContact CG-CD1 3.63Å; L145-I149 HydrophobicContact CG-CG1 4.26Å; L145-I149 VanDerWaalsContact O-CB 3.27Å; L145-I149 WeakPolarHBondContact O-CB 3.36Å; L145-I149 VanDerWaalsContact O-CG1 3.26Å; L145-I149 WeakPolarHBondContact O-CG1 3.35Å; L145-I149 PolarHBondContact O-N 3.34Å; I149-F151 PolarHBondContact O-N 3.03Å; I149-I152 PolarHBondContact O-N 3.36Å; I149-L153 HydrophobicContact CG2-CD1 3.74Å; I149-L153 HydrophobicContact CG2-CG 4.14Å; I149-L153 WeakPolarHBondContact O-CB 3.22Å; I149-L153 WeakPolarHBondContact O-CG 3.07Å; I149-L153 PolarHBondContact O-N 2.98Å
150S87.6Confident80.9Confident0 Ų053.7 Ų53.70%027%0.271CS..Hα-helixtrans-56.7-40.7177.2-175.30000112.2I90 R97 L146 P147 A154I90-S150 WeakPolarHBondContact CG2-OG 3.49Å; R97-S150 PolarHBondContact NH1-O 3.21Å; L146-S150 VanDerWaalsContact O-CB 3.31Å; L146-S150 WeakPolarHBondContact O-CB 3.3Å; L146-S150 PolarHBondContact O-N 3.39Å; P147-S150 PolarHBondContact O-N 3.45Å; S150-A154 WeakPolarHBondContact O-CB 3.17Å; S150-A154 PolarHBondContact O-N 2.91Å
151F86.8Confident81.1Confident73 Ų7352.1 Ų52.132%0.3225%0.254SS..Hα-helixtrans-66.9-47175.4-179.8-100.1000112.4L127 I128 P147 I148 I149 L153 A154 W155L127-F151 HydrophobicContact CD1-CB 4.18Å; L127-F151 HydrophobicContact CD1-CD2 4.49Å; I128-F151 HydrophobicContact CD1-CE2 4.45Å; I128-F151 HydrophobicContact CG1-CE2 4.39Å; P147-F151 WeakPolarHBondContact O-CB 3.49Å; P147-F151 PolarHBondContact O-N 3.01Å; I148-F151 PolarHBondContact O-N 3.46Å; I149-F151 PolarHBondContact O-N 3.03Å; F151-L153 VanDerWaalsContact C-N 3.34Å; F151-L153 PolarHBondContact O-N 3.13Å; F151-A154 WeakPolarHBondContact O-CB 3.35Å; F151-A154 PolarHBondContact O-N 2.87Å; F151-W155 AromaticContact CE1-CD1 3.69Å; F151-W155 AromaticContact CE1-NE1 3.76Å; F151-W155 AromaticContact CE2-CD1 3.65Å; F151-W155 AromaticContact CE2-NE1 3.3Å; F151-W155 VanDerWaalsContact CE2-NE1 3.3Å; F151-W155 AromaticContact CZ-CD1 3.47Å; F151-W155 VanDerWaalsContact CZ-CD1 3.47Å; F151-W155 AromaticContact CZ-NE1 3.08Å; F151-W155 PolarHBondContact O-N 3.14Å; F151-W155 VanDerWaalsContact O-N 3.11Å
152I88.6Confident81.2Confident82 Ų8250.8 Ų50.842%0.42124%0.235SC..Hα-helixtrans-60.6-45.5178.5-69.2168.5000110.4I148 I149 A154 W155 I156I148-I152 HydrophobicContact CG2-CD1 3.8Å; I148-I152 VanDerWaalsContact O-CG1 3.32Å; I148-I152 WeakPolarHBondContact O-CG1 3.18Å; I148-I152 PolarHBondContact O-N 3.37Å; I149-I152 PolarHBondContact O-N 3.36Å; I152-A154 PolarHBondContact O-N 3.22Å; I152-W155 PolarHBondContact O-N 3.32Å; I152-I156 HydrophobicContact CG2-CD1 3.6Å; I152-I156 HydrophobicContact CG2-CG1 4.2Å; I152-I156 VanDerWaalsContact O-CG1 3.31Å; I152-I156 WeakPolarHBondContact O-CG1 3.18Å; I152-I156 PolarHBondContact O-N 3.11Å
153L86.3Confident80.7Confident17 Ų1752.7 Ų52.79%0.08924%0.244CC..Hα-helixtrans-65.9-37.4179-69.3176.1000112.4D52 F55 I56 I149 F151 W155 I156 E157D52-L153 WeakPolarHBondContact OD1-CB 3.31Å; D52-L153 VanDerWaalsContact OD1-CD1 3.26Å; D52-L153 WeakPolarHBondContact OD1-CD1 2.92Å; F55-L153 HydrophobicContact CB-CD1 4.38Å; F55-L153 HydrophobicContact CD1-CD1 3.51Å; F55-L153 HydrophobicContact CE1-CD1 4.21Å; F55-L153 HydrophobicContact CG-CD1 4.33Å; I56-L153 HydrophobicContact CD1-CD1 4.01Å; I56-L153 HydrophobicContact CG1-CD1 4.44Å; I149-L153 HydrophobicContact CG2-CD1 3.74Å; I149-L153 HydrophobicContact CG2-CG 4.14Å; I149-L153 WeakPolarHBondContact O-CB 3.22Å; I149-L153 WeakPolarHBondContact O-CG 3.07Å; I149-L153 PolarHBondContact O-N 2.98Å; F151-L153 VanDerWaalsContact C-N 3.34Å; F151-L153 PolarHBondContact O-N 3.13Å; L153-W155 VanDerWaalsContact C-N 3.26Å; L153-W155 PolarHBondContact O-N 2.78Å; L153-I156 PolarHBondContact O-N 2.84Å; L153-E157 WeakPolarHBondContact O-CB 3.35Å; L153-E157 WeakPolarHBondContact O-CG 3.44Å; L153-E157 PolarHBondContact O-N 3.2Å
154A83.8Confident80.1Confident1 Ų158.6 Ų58.61%0.00827%0.268CS..Hα-helixtrans-58.2-41173.100000112R97 S150 F151 I152 T158R97-A154 VanDerWaalsContact NH1-CB 3.33Å; S150-A154 WeakPolarHBondContact O-CB 3.17Å; S150-A154 PolarHBondContact O-N 2.91Å; F151-A154 WeakPolarHBondContact O-CB 3.35Å; F151-A154 PolarHBondContact O-N 2.87Å; I152-A154 PolarHBondContact O-N 3.22Å; A154-T158 WeakPolarHBondContact O-CB 3.34Å; A154-T158 PolarHBondContact O-N 3.2Å; A154-T158 VanDerWaalsContact O-N 3.1Å; A154-T158 PolarHBondContact O-OG1 3.46Å
155W83.1Confident79.1Confident150 Ų15055.1 Ų55.157%0.56826%0.256SS*.Hα-helixtrans-71.9-41.6177.1-88.987.5000112.6F151 I152 L153 T158 W159F151-W155 AromaticContact CE1-CD1 3.69Å; F151-W155 AromaticContact CE1-NE1 3.76Å; F151-W155 AromaticContact CE2-CD1 3.65Å; F151-W155 AromaticContact CE2-NE1 3.3Å; F151-W155 VanDerWaalsContact CE2-NE1 3.3Å; F151-W155 AromaticContact CZ-CD1 3.47Å; F151-W155 VanDerWaalsContact CZ-CD1 3.47Å; F151-W155 AromaticContact CZ-NE1 3.08Å; F151-W155 PolarHBondContact O-N 3.14Å; F151-W155 VanDerWaalsContact O-N 3.11Å; I152-W155 PolarHBondContact O-N 3.32Å; L153-W155 VanDerWaalsContact C-N 3.26Å; L153-W155 PolarHBondContact O-N 2.78Å; W155-T158 PolarHBondContact O-N 3.38Å; W155-W159 WeakPolarHBondContact O-CB 3.32Å; W155-W159 PolarHBondContact O-N 3.48Å
156I83.4Confident77.8Confident68 Ų6853.1 Ų53.135%0.34925%0.245SC..Hα-helixtrans-65.1-42.4176.6-63.8169.4000110.4F48 I152 L153 T158 W159 L160F48-I156 HydrophobicContact CE1-CB 4.42Å; F48-I156 HydrophobicContact CE1-CG2 3.88Å; F48-I156 HydrophobicContact CE2-CG2 4.23Å; F48-I156 HydrophobicContact CZ-CB 4.13Å; F48-I156 HydrophobicContact CZ-CG2 3.36Å; I152-I156 HydrophobicContact CG2-CD1 3.6Å; I152-I156 HydrophobicContact CG2-CG1 4.2Å; I152-I156 VanDerWaalsContact O-CG1 3.31Å; I152-I156 WeakPolarHBondContact O-CG1 3.18Å; I152-I156 PolarHBondContact O-N 3.11Å; L153-I156 PolarHBondContact O-N 2.84Å; I156-T158 VanDerWaalsContact C-N 3.35Å; I156-T158 PolarHBondContact O-N 3.26Å; I156-W159 PolarHBondContact O-N 3.22Å; I156-L160 HydrophobicContact CG2-CD1 3.85Å; I156-L160 HydrophobicContact CG2-CG 4.21Å; I156-L160 WeakPolarHBondContact O-CB 3.48Å; I156-L160 VanDerWaalsContact O-CG 3.27Å; I156-L160 WeakPolarHBondContact O-CG 3.41Å; I156-L160 PolarHBondContact O-N 3.21Å
157E79.4Confident76.4Confident4 Ų455.8 Ų55.82%0.01926%0.263CS..Hα-helixtrans-58.4-47.6174.8-82.7-170.5-174.600112.1F48 D52 R97 L101 L153 W159 L160 L161F48-E157 HydrophobicContact CD1-CB 4.42Å; F48-E157 HydrophobicContact CD1-CG 3.58Å; F48-E157 HydrophobicContact CE1-CB 4.12Å; F48-E157 HydrophobicContact CE1-CG 3.36Å; D52-E157 WeakPolarHBondContact CB-OE1 3.28Å; R97-E157 IonicContact CZ-OE1 2.63Å; R97-E157 IonicContact CZ-OE2 3.73Å; R97-E157 IonicContact NE-OE1 2.84Å; R97-E157 IonicContact NE-OE2 2.68Å; R97-E157 PolarHBondContact NE-OE2 3.33Å; R97-E157 IonicContact NH2-OE1 2.69Å; R97-E157 PolarHBondContact NH2-OE1 3.1Å; R97-E157 IonicContact NH2-OE2 3.79Å; R97-E157 PolarHBondContact NH2-OE2 2.84Å; L101-E157 WeakPolarHBondContact CD1-OE2 3.26Å; L153-E157 WeakPolarHBondContact O-CB 3.35Å; L153-E157 WeakPolarHBondContact O-CG 3.44Å; L153-E157 PolarHBondContact O-N 3.2Å; E157-W159 VanDerWaalsContact C-N 3.34Å; E157-L160 PolarHBondContact O-N 2.86Å; E157-L161 WeakPolarHBondContact O-CB 3.14Å; E157-L161 WeakPolarHBondContact O-CG 3.13Å; E157-L161 PolarHBondContact O-N 3.25Å
158T77.8Confident75.1Confident31 Ų3158.4 Ų58.419%0.1927%0.274CS..Hα-helixtrans-66-41.4-179.9-58.70000110.7T120 A154 W155 I156 L161 D162T120-T158 HydrophobicContact CG2-CG2 3.88Å; T120-T158 WeakPolarHBondContact CG2-OG1 3.14Å; T120-T158 PolarHBondContact OG1-OG1 3.1Å; A154-T158 WeakPolarHBondContact O-CB 3.34Å; A154-T158 PolarHBondContact O-N 3.2Å; A154-T158 VanDerWaalsContact O-N 3.1Å; A154-T158 PolarHBondContact O-OG1 3.46Å; W155-T158 PolarHBondContact O-N 3.38Å; I156-T158 VanDerWaalsContact C-N 3.35Å; I156-T158 PolarHBondContact O-N 3.26Å; T158-L161 WeakPolarHBondContact O-CB 3.29Å; T158-L161 PolarHBondContact O-N 2.93Å; T158-D162 WeakPolarHBondContact O-CB 3.23Å; T158-D162 PolarHBondContact O-N 2.9Å
159W79.3Confident73.9Confident150 Ų15055.2 Ų55.257%0.56826%0.257SS*.Hα-helixtrans-63.8-41.3176.5-171.285.5000111.8W155 I156 E157 D162 F163W155-W159 WeakPolarHBondContact O-CB 3.32Å; W155-W159 PolarHBondContact O-N 3.48Å; I156-W159 PolarHBondContact O-N 3.22Å; E157-W159 VanDerWaalsContact C-N 3.34Å; W159-D162 PolarHBondContact O-N 3.33Å; W159-F163 AromaticContact CD1-CD2 3.26Å; W159-F163 AromaticContact CD1-CE2 3.29Å; W159-F163 AromaticContact CD2-CD2 3.95Å; W159-F163 HydrophobicContact CD2-CD2 3.95Å; W159-F163 AromaticContact CE2-CD2 3.56Å; W159-F163 AromaticContact CG-CD2 3.76Å; W159-F163 HydrophobicContact CG-CD2 3.76Å; W159-F163 HydrophobicContact CG-CE2 4.21Å; W159-F163 HydrophobicContact CZ2-CD2 4.29Å; W159-F163 HydrophobicContact CZ2-CG 4.43Å; W159-F163 AromaticContact NE1-CD2 3.11Å; W159-F163 AromaticContact NE1-CE2 3.15Å; W159-F163 WeakPolarHBondContact O-CB 2.88Å; W159-F163 PolarHBondContact O-N 3.19Å
160L73.7Confident72.4Confident45 Ų4555.8 Ų55.824%0.23627%0.267CS..Hα-helixtrans-67.4-38.4175.8-74.9174.1000112.5F48 I156 E157 K164F48-L160 HydrophobicContact CD1-CD1 3.53Å; F48-L160 HydrophobicContact CD2-CD1 3.68Å; F48-L160 HydrophobicContact CE1-CD1 3.48Å; F48-L160 VanDerWaalsContact CE1-CD1 3.48Å; F48-L160 HydrophobicContact CE2-CD1 3.63Å; F48-L160 HydrophobicContact CG-CD1 3.65Å; F48-L160 HydrophobicContact CZ-CD1 3.56Å; I156-L160 HydrophobicContact CG2-CD1 3.85Å; I156-L160 HydrophobicContact CG2-CG 4.21Å; I156-L160 WeakPolarHBondContact O-CB 3.48Å; I156-L160 VanDerWaalsContact O-CG 3.27Å; I156-L160 WeakPolarHBondContact O-CG 3.41Å; I156-L160 PolarHBondContact O-N 3.21Å; E157-L160 PolarHBondContact O-N 2.86Å; L160-K164 HydrophobicContact CD2-CD 4.28Å; L160-K164 VanDerWaalsContact O-CB 3.27Å; L160-K164 WeakPolarHBondContact O-CB 3.43Å; L160-K164 PolarHBondContact O-N 2.68Å
161L72.4Confident70.9Confident4 Ų460.3 Ų60.32%0.02129%0.291CS..Iπ-helixtrans-59.2-51.5170.7-84.8162.3000110.8F45 L101 I116 E157 T158 V165 L166F45-L161 HydrophobicContact CD2-CD2 3.62Å; F45-L161 HydrophobicContact CD2-CG 4.11Å; F45-L161 HydrophobicContact CE2-CD1 3.96Å; F45-L161 HydrophobicContact CE2-CD2 3.09Å; F45-L161 HydrophobicContact CE2-CG 3.57Å; F45-L161 HydrophobicContact CZ-CD2 3.71Å; F45-L161 HydrophobicContact CZ-CG 4.48Å; L101-L161 HydrophobicContact CD2-CD1 3.53Å; I116-L161 HydrophobicContact CG2-CD1 3.91Å; E157-L161 WeakPolarHBondContact O-CB 3.14Å; E157-L161 WeakPolarHBondContact O-CG 3.13Å; E157-L161 PolarHBondContact O-N 3.25Å; T158-L161 WeakPolarHBondContact O-CB 3.29Å; T158-L161 PolarHBondContact O-N 2.93Å; L161-V165 PolarHBondContact O-N 2.77Å; L161-L166 WeakPolarHBondContact O-CD1 3.12Å; L161-L166 PolarHBondContact O-N 3.47Å
162D71.3Confident69.5Low54 Ų5458.4 Ų58.429%0.28928%0.284SS..Iπ-helixtrans-71.7-47.1-170.4-157.940.8000113.4W113 T158 W159 P167W113-D162 VanDerWaalsContact CE2-OD1 3.23Å; W113-D162 VanDerWaalsContact CZ2-OD1 3.27Å; W113-D162 WeakPolarHBondContact CZ2-OD1 3.32Å; W113-D162 PolarHBondContact NE1-OD1 3.45Å; T158-D162 WeakPolarHBondContact O-CB 3.23Å; T158-D162 PolarHBondContact O-N 2.9Å; W159-D162 PolarHBondContact O-N 3.33Å; D162-P167 WeakPolarHBondContact O-CD 3.32Å
163F62Low68.1Low128 Ų12859.4 Ų59.456%0.56129%0.287SS*.Iπ-helixtrans-90.6-18.1-174-76.1-78.4000114.9W159W159-F163 AromaticContact CD1-CD2 3.26Å; W159-F163 AromaticContact CD1-CE2 3.29Å; W159-F163 AromaticContact CD2-CD2 3.95Å; W159-F163 HydrophobicContact CD2-CD2 3.95Å; W159-F163 AromaticContact CE2-CD2 3.56Å; W159-F163 AromaticContact CG-CD2 3.76Å; W159-F163 HydrophobicContact CG-CD2 3.76Å; W159-F163 HydrophobicContact CG-CE2 4.21Å; W159-F163 HydrophobicContact CZ2-CD2 4.29Å; W159-F163 HydrophobicContact CZ2-CG 4.43Å; W159-F163 AromaticContact NE1-CD2 3.11Å; W159-F163 AromaticContact NE1-CE2 3.15Å; W159-F163 WeakPolarHBondContact O-CB 2.88Å; W159-F163 PolarHBondContact O-N 3.19Å
164K61.9Low66.8Low129 Ų12963.5 Ų63.556%0.56131%0.309SS*.Iπ-helixtrans-121.7-27.9-168.1-152.5174.1171.971.70114.5L160L160-K164 HydrophobicContact CD2-CD 4.28Å; L160-K164 VanDerWaalsContact O-CB 3.27Å; L160-K164 WeakPolarHBondContact O-CB 3.43Å; L160-K164 PolarHBondContact O-N 2.68Å
165V59.6Low65.7Low11 Ų1170.7 Ų70.77%0.06734%0.336CS..Iπ-helixtrans-103-42.3-176.1172.20000111.9V41 F45 L110 L161 E169V41-V165 HydrophobicContact CG1-CB 4.19Å; V41-V165 HydrophobicContact CG1-CG1 4.14Å; V41-V165 HydrophobicContact CG1-CG2 3.73Å; F45-V165 HydrophobicContact CB-CG2 4.34Å; L110-V165 HydrophobicContact CD2-CG1 4.02Å; L161-V165 PolarHBondContact O-N 2.77Å; V165-E169 HydrophobicContact CG1-CG 4.48Å; V165-E169 WeakPolarHBondContact O-CG 3.24Å; V165-E169 PolarHBondContact O-N 2.74Å
166L56.6Low64.5Low27 Ų2768.2 Ų68.214%0.14133%0.329CS..Hα-helixtrans-70.8-41.3-176-78.2147000115.3L110 L161 Q168 A170L110-L166 HydrophobicContact CD2-CD2 4.25Å; L161-L166 WeakPolarHBondContact O-CD1 3.12Å; L161-L166 PolarHBondContact O-N 3.47Å; L166-Q168 VanDerWaalsContact C-N 3.32Å; L166-A170 WeakPolarHBondContact O-CB 3.5Å; L166-A170 PolarHBondContact O-N 3.2Å
167P54.2Low63.4Low59 Ų5970 Ų7038%0.38334%0.339SS..Hα-helixtrans-66.6-38.8175.2-16.729.4000111D162 A170 D171D162-P167 WeakPolarHBondContact O-CD 3.32Å; P167-A170 PolarHBondContact O-N 3.43Å; P167-D171 WeakPolarHBondContact O-CB 3.48Å; P167-D171 PolarHBondContact O-N 2.95Å
168Q55.6Low62.5Low68 Ų6873.7 Ų73.732%0.31837%0.365SS..Hα-helixtrans-70.4-40.3-176.3-168.1164.4-8.100112C37 V41 L166 D172C37-Q168 PolarHBondContact SG-NE2 3.35Å; V41-Q168 HydrophobicContact CG2-CG 4.15Å; L166-Q168 VanDerWaalsContact C-N 3.32Å; Q168-D172 WeakPolarHBondContact O-CB 3.46Å; Q168-D172 VanDerWaalsContact O-CG 3.22Å; Q168-D172 PolarHBondContact O-N 2.83Å; Q168-D172 VanDerWaalsContact O-N 3.13Å
169E60.2Low61.6Low27 Ų2776.4 Ų76.413%0.12638%0.377CS..Hα-helixtrans-73.5-37.6174.1-69.1-166.417600112.9R42 L110 V165 D172 E173R42-E169 IonicContact NE-OE1 3.89Å; L110-E169 WeakPolarHBondContact CD1-OE2 3.27Å; L110-E169 WeakPolarHBondContact CG-OE2 3.27Å; V165-E169 HydrophobicContact CG1-CG 4.48Å; V165-E169 WeakPolarHBondContact O-CG 3.24Å; V165-E169 PolarHBondContact O-N 2.74Å; E169-D172 PolarHBondContact O-N 3.25Å; E169-E173 WeakPolarHBondContact O-CG 3.2Å; E169-E173 PolarHBondContact O-N 3.33Å
170A57.1Low60.6Low44 Ų4474.8 Ų74.836%0.36438%0.378SS..Hα-helixtrans-69.8-35.1177.300000112.6L166 P167 N174L166-A170 WeakPolarHBondContact O-CB 3.5Å; L166-A170 PolarHBondContact O-N 3.2Å; P167-A170 PolarHBondContact O-N 3.43Å; A170-N174 WeakPolarHBondContact O-CB 3.3Å; A170-N174 VanDerWaalsContact O-CG 3.3Å; A170-N174 PolarHBondContact O-N 3.3Å; A170-N174 PolarHBondContact O-ND2 3.09Å
171D55.8Low59.7Low94 Ų9477.2 Ų77.250%0.50339%0.391SS..Hα-helixtrans-71.5-36.1175.2-74.6-21.2000111.7P167 R175P167-D171 WeakPolarHBondContact O-CB 3.48Å; P167-D171 PolarHBondContact O-N 2.95Å; D171-R175 VanDerWaalsContact O-CB 3.23Å; D171-R175 WeakPolarHBondContact O-CB 3.42Å; D171-R175 PolarHBondContact O-N 2.95Å
172D57.7Low58.8Low34 Ų3480.1 Ų80.118%0.18242%0.415CS..Hα-helixtrans-68.1-43.5175.4-77.5-12.6000111.2Q168 E169 R175 F176Q168-D172 WeakPolarHBondContact O-CB 3.46Å; Q168-D172 VanDerWaalsContact O-CG 3.22Å; Q168-D172 PolarHBondContact O-N 2.83Å; Q168-D172 VanDerWaalsContact O-N 3.13Å; E169-D172 PolarHBondContact O-N 3.25Å; D172-R175 PolarHBondContact O-N 3Å; D172-F176 WeakPolarHBondContact O-CB 3.46Å; D172-F176 PolarHBondContact O-N 3.15Å
173E58.8Low57.9Low102 Ų10282.1 Ų82.148%0.47743%0.431SS..Hα-helixtrans-63.7-43.6174.7-73.1-169.315900112.4E169 R175 F176 L177E169-E173 WeakPolarHBondContact O-CG 3.2Å; E169-E173 PolarHBondContact O-N 3.33Å; E173-R175 VanDerWaalsContact C-N 3.32Å; E173-R175 PolarHBondContact O-N 2.75Å; E173-F176 PolarHBondContact O-N 2.83Å; E173-L177 WeakPolarHBondContact O-CB 3.44Å; E173-L177 WeakPolarHBondContact O-CG 3.28Å; E173-L177 PolarHBondContact O-N 2.85Å
174N59.9Low57.1Low103 Ų10383.7 Ų83.755%0.55144%0.44SS*.Hα-helixtrans-65.5-35.1177.3-79.5-38.8000112.4A170 S178A170-N174 WeakPolarHBondContact O-CB 3.3Å; A170-N174 VanDerWaalsContact O-CG 3.3Å; A170-N174 PolarHBondContact O-N 3.3Å; A170-N174 PolarHBondContact O-ND2 3.09Å; N174-S178 VanDerWaalsContact O-CB 3.28Å; N174-S178 WeakPolarHBondContact O-CB 3.41Å; N174-S178 PolarHBondContact O-N 3.48Å
175R59.8Low56.3Low153 Ų15387.1 Ų87.158%0.57745%0.45SS*.Hα-helixtrans-71.9-40.9176.9-162.9-175.4-59.7-143.51.6111.4D171 D172 E173 S178 I179D171-R175 VanDerWaalsContact O-CB 3.23Å; D171-R175 WeakPolarHBondContact O-CB 3.42Å; D171-R175 PolarHBondContact O-N 2.95Å; D172-R175 PolarHBondContact O-N 3Å; E173-R175 VanDerWaalsContact C-N 3.32Å; E173-R175 PolarHBondContact O-N 2.75Å; R175-S178 PolarHBondContact O-N 3.03Å; R175-I179 HydrophobicContact CG-CD1 4.04Å; R175-I179 WeakPolarHBondContact O-CB 3.16Å; R175-I179 WeakPolarHBondContact O-CD1 3.22Å; R175-I179 WeakPolarHBondContact O-CG1 3.31Å; R175-I179 PolarHBondContact O-N 2.77Å
176F58.7Low55.4Low98 Ų9892.1 Ų92.143%0.4348%0.48SS..Hα-helixtrans-62-45.8174.5-175.4-102.4000111.6D172 E173 I179 M180D172-F176 WeakPolarHBondContact O-CB 3.46Å; D172-F176 PolarHBondContact O-N 3.15Å; E173-F176 PolarHBondContact O-N 2.83Å; F176-I179 PolarHBondContact O-N 3.41Å; F176-M180 HydrophobicContact CD1-CG 4.42Å; F176-M180 HydrophobicContact CD1-SD 3.79Å; F176-M180 HydrophobicContact CE1-CG 4.11Å; F176-M180 HydrophobicContact CE1-SD 3.07Å; F176-M180 WeakPolarHBondContact CE1-SD 3.37Å; F176-M180 HydrophobicContact CE2-SD 4.28Å; F176-M180 HydrophobicContact CZ-CG 4.15Å; F176-M180 HydrophobicContact CZ-SD 3.36Å; F176-M180 WeakPolarHBondContact CZ-SD 3.16Å; F176-M180 WeakPolarHBondContact O-CB 3.19Å; F176-M180 PolarHBondContact O-N 2.71Å
177L60.2Low54.6Low106 Ų10696.3 Ų96.356%0.55551%0.509SS*.Hα-helixtrans-63.1-42.7174.1-70.5174.2000111.8E173 I179 M180 D181E173-L177 WeakPolarHBondContact O-CB 3.44Å; E173-L177 WeakPolarHBondContact O-CG 3.28Å; E173-L177 PolarHBondContact O-N 2.85Å; L177-I179 VanDerWaalsContact C-N 3.28Å; L177-I179 PolarHBondContact O-N 2.94Å; L177-M180 CarbonylContact O-C 3.04Å; L177-M180 PolarHBondContact O-N 3.41Å; L177-D181 WeakPolarHBondContact O-CB 3Å; L177-D181 PolarHBondContact O-N 2.93Å
178S59.9Low54.1Low81 Ų81101.8 Ų101.857%0.56653%0.527SS*.Hα-helixtrans-63.1-31.5175.6179.20000113.3N174 R175 A182N174-S178 VanDerWaalsContact O-CB 3.28Å; N174-S178 WeakPolarHBondContact O-CB 3.41Å; N174-S178 PolarHBondContact O-N 3.48Å; R175-S178 PolarHBondContact O-N 3.03Å; S178-A182 WeakPolarHBondContact O-CB 3.4Å; S178-A182 PolarHBondContact O-N 3.43Å
179I59.5Low53.7Low87 Ų87104.7 Ų104.745%0.44655%0.55SS..Hα-helixtrans-80.5-35.7177.4-67.8165.5000110.8R175 F176 L177 A182 P183R175-I179 HydrophobicContact CG-CD1 4.04Å; R175-I179 WeakPolarHBondContact O-CB 3.16Å; R175-I179 WeakPolarHBondContact O-CD1 3.22Å; R175-I179 WeakPolarHBondContact O-CG1 3.31Å; R175-I179 PolarHBondContact O-N 2.77Å; F176-I179 PolarHBondContact O-N 3.41Å; L177-I179 VanDerWaalsContact C-N 3.28Å; L177-I179 PolarHBondContact O-N 2.94Å; I179-A182 WeakPolarHBondContact O-CB 3.49Å; I179-A182 PolarHBondContact O-N 2.86Å; I179-P183 WeakPolarHBondContact O-CD 3.43Å
180M57.6Low52.8Low117 Ų117110.5 Ų110.558%0.57658%0.577SS**Hα-helixtrans-75-20.9173.2-79.3-170.773.400114.2F176 L177 P183F176-M180 HydrophobicContact CD1-CG 4.42Å; F176-M180 HydrophobicContact CD1-SD 3.79Å; F176-M180 HydrophobicContact CE1-CG 4.11Å; F176-M180 HydrophobicContact CE1-SD 3.07Å; F176-M180 WeakPolarHBondContact CE1-SD 3.37Å; F176-M180 HydrophobicContact CE2-SD 4.28Å; F176-M180 HydrophobicContact CZ-CG 4.15Å; F176-M180 HydrophobicContact CZ-SD 3.36Å; F176-M180 WeakPolarHBondContact CZ-SD 3.16Å; F176-M180 WeakPolarHBondContact O-CB 3.19Å; F176-M180 PolarHBondContact O-N 2.71Å; L177-M180 CarbonylContact O-C 3.04Å; L177-M180 PolarHBondContact O-N 3.41Å; M180-P183 WeakPolarHBondContact O-CD 3.46Å; M180-P183 WeakPolarHBondContact O-CG 3.17Å
181D54.7Low52.1Low96 Ų96114.5 Ų114.551%0.51360%0.599SS.*SBendtrans-91.6-13.6174-155.743.6000111.8L177L177-D181 WeakPolarHBondContact O-CB 3Å; L177-D181 PolarHBondContact O-N 2.93Å
182A54.4Low51.1Low64 Ų64113.3 Ų113.353%0.52961%0.609SS.*THydrogen-bonded Turntrans-69.2-18.8170.800000117.3S178 I179 E184S178-A182 WeakPolarHBondContact O-CB 3.4Å; S178-A182 PolarHBondContact O-N 3.43Å; I179-A182 WeakPolarHBondContact O-CB 3.49Å; I179-A182 PolarHBondContact O-N 2.86Å; A182-E184 VanDerWaalsContact C-N 3.29Å; A182-E184 PolarHBondContact O-N 3.03Å
183P52.4Low50.2Low97 Ų97117.7 Ų117.763%0.6364%0.639SS**THydrogen-bonded Turntrans-78.3-8175.931.6-28.7000113.5I179 M180I179-P183 WeakPolarHBondContact O-CD 3.43Å; M180-P183 WeakPolarHBondContact O-CD 3.46Å; M180-P183 WeakPolarHBondContact O-CG 3.17Å
184E44.5Very low49.9Very low161 Ų161121.4 Ų121.475%0.75266%0.661SS**THydrogen-bonded Turntrans-103-17.2176.2-70.4-164.8160.200114.4A182 T186A182-E184 VanDerWaalsContact C-N 3.29Å; A182-E184 PolarHBondContact O-N 3.03Å; E184-T186 PolarHBondContact O-N 2.88Å; E184-T186 VanDerWaalsContact O-N 3.1Å
185R44.2Very low49.2Very low201 Ų201122.1 Ų122.176%0.75867%0.674SS**  trans-89.165.6172.1-68.2-87.516677.25.1109.7P187R185-P187 VanDerWaalsContact O-CD 3.28Å; R185-P187 WeakPolarHBondContact O-CD 3.29Å; R185-P187 VanDerWaalsContact O-N 3.13Å
186T41.3Very low48.6Very low115 Ų115122.9 Ų122.971%0.70669%0.69SS**  trans-43.9119.4153.134.50000108E184 F188E184-T186 PolarHBondContact O-N 2.88Å; E184-T186 VanDerWaalsContact O-N 3.1Å; T186-F188 PolarHBondContact O-N 3.15Å
187P41.1Very low48.3Very low116 Ų116121 Ų12175%0.75370%0.699SS**  trans-55.7116.9162-18.230.8000105.6R185 V189R185-P187 VanDerWaalsContact O-CD 3.28Å; R185-P187 WeakPolarHBondContact O-CD 3.29Å; R185-P187 VanDerWaalsContact O-N 3.13Å; P187-V189 VanDerWaalsContact C-N 3.27Å; P187-V189 PolarHBondContact O-N 3.38Å
188F41.9Very low48Very low173 Ų173124.3 Ų124.376%0.75971%0.711SS**  trans-61.291.7179.8-174.3-98.5000108.2T186 Q190T186-F188 PolarHBondContact O-N 3.15Å; F188-Q190 VanDerWaalsContact C-N 3.35Å; F188-Q190 HydrophobicContact CD1-CG 3.84Å; F188-Q190 HydrophobicContact CE1-CG 3.69Å; F188-Q190 PolarHBondContact O-N 3.36Å
189V47.6Very low47.2Very low130 Ų130130.3 Ų130.379%0.78873%0.728SS**  trans-7098.8168.4176.90000105.7P187P187-V189 VanDerWaalsContact C-N 3.27Å; P187-V189 PolarHBondContact O-N 3.38Å
190Q41.9Very low47.1Very low149 Ų149136.4 Ų136.470%0.69675%0.746SS**  trans-53.8135.9167.8-82.9178.5-8.500110F188F188-Q190 VanDerWaalsContact C-N 3.35Å; F188-Q190 HydrophobicContact CD1-CG 3.84Å; F188-Q190 HydrophobicContact CE1-CG 3.69Å; F188-Q190 PolarHBondContact O-N 3.36Å
191P42.9Very low47.1Very low127 Ų127136 Ų13683%0.82576%0.755SS**  trans-85.5115.6170.127.8-22.3000111.5
192G33.7Very low46.6Very low69 Ų69136.7 Ų136.771%0.71177%0.765SS**  trans101.4154.4154.400000117.2
193P38.4Very low46.3Very low127 Ų127139.6 Ų139.683%0.82578%0.778SS**  cis-119.9164.113.434.6-17.8000115S195P193-S195 PolarHBondContact O-N 3.11Å
194L52.8Low46Very low180 Ų180143.4 Ų143.494%0.94279%0.787SS**  trans-48.7124.6168.8-63165.6000111.1
195S44.9Very low46Very low118 Ų118141.3 Ų141.383%0.82579%0.79SS**  trans-134.1104162.8-168.60000108.6P193P193-S195 PolarHBondContact O-N 3.11Å
196D48.2Very low46.1Very low168 Ų168137.4 Ų137.490%0.89879%0.789SS**  trans-51.7138.8160.5-76.4-46000109.9
197G51.3Low46.2Very low60 Ų60136.3 Ų136.362%0.61979%0.792SS**  trans156.394.2166.600000115.4
198Q53.9Low46.1Very low175 Ų175137.6 Ų137.682%0.81879%0.792SS**  trans41.897.7142.4-114.285.7-28.800118.2
199F44.2Very low46.2Very low207 Ų207133.8 Ų133.891%0.90879%0.787SS**  trans-113.8106.3148.7-106.2-90.4000109
200Y56.1Low46.3Very low215 Ų215134.8 Ų134.884%0.84379%0.788SS**  trans-111.2119.5164.1-121.4-86.6000107
201S58.8Low46.6Very low107 Ų107137 Ų13775%0.74880%0.798SS**  trans-142.5144.1151.9-81.90000109.2
202P44.8Very low46.8Very low112 Ų112139.5 Ų139.573%0.72780%0.799SS**  trans-95.3175.7-146.7-1.924.7000113.8
203P47.9Very low47.2Very low124 Ų124143.3 Ų143.381%0.80580%0.802SS**  trans-78164.5-173.734.2-34.1000113.7
204E46Very low47.6Very low177 Ų177144.5 Ų144.583%0.82780%0.801SS**  trans-23.1145.4-179.9-74.517683.400119.7
205S44.8Very low47.2Very low117 Ų117144.7 Ų144.782%0.81880%0.797SS**  trans-130.5110.2151.31640000109.1
206V45.4Very low46.9Very low120 Ų120145.1 Ų145.173%0.72779%0.79SS**  trans-96.7159.2160.1-73.50000108.7
207A43.8Very low46.8Very low92 Ų92145.7 Ų145.776%0.7678%0.784SS**  trans84.5132.6-175.300000113.8
208D39.3Very low46Very low142 Ų142150.6 Ų150.676%0.75979%0.791SS**  cis-167.4118.238.8-158.821.2000108.2
209S43.4Very low45.6Very low93 Ų93149.4 Ų149.465%0.6579%0.79SS**  60.3106.8106.3-40.60000117.4
210D49.5Very low45.7Very low152 Ų152143.8 Ų143.881%0.81377%0.774SS**  trans28.6121.7132.5-44.6-25.3000121.7
211E48.5Very low45.2Very low196 Ų196141 Ų14192%0.91677%0.769SS**  trans-142.8122.7146.1-62.6-8314800109.2
212E46.3Very low44.5Very low179 Ų179144.4 Ų144.484%0.83677%0.77SS**  trans-52.3157.5176-68.5166.310500114.3
213L43.1Very low44.2Very low148 Ų148143 Ų14378%0.77577%0.768SS**  175.8122.4116.2-96.3160.1000114.9
214L47Very low44.1Very low152 Ų152144.9 Ų144.980%0.79677%0.771SS**  trans101.182.6146.1-56.6171.4000119.5
215E43.4Very low43.9Very low185 Ų185148 Ų14886%0.86479%0.791SS**  -12.9150122.7-87.7176.891.900119.2
216D40Very low43.9Very low126 Ų126149.6 Ų149.667%0.67479%0.789SS**  trans97.698.7142.2-153.445.3000119.4
217K44.5Very low43.8Very low180 Ų180151.1 Ų151.178%0.78379%0.792SS**  168.7108.1110.6-94.9-169.2168.9-178.10110.9
218H35.7Very low43.8Very low164 Ų164154.4 Ų154.476%0.75979%0.794SS**  91.5103.587.9-140.375000113.1
219D45.7Very low44.1Very low149 Ų149155.1 Ų155.180%0.79780%0.796SS**  trans-100.6134.5148.7-158.25.4000104.5
220P45.9Very low44.1Very low90 Ų90159 Ų15958%0.58481%0.805SS**  -158.215980.539.2-16.8000117.5
221E45.8Very low43.8Very low157 Ų157159.5 Ų159.573%0.73481%0.805SS**  trans53.2132.1139.6-128.7-165.2132.800123.3
222K42.9Very low43.4Very low177 Ų177156.9 Ų156.977%0.7780%0.797SS**  trans104.3139.3145.6-62.2-162.7179.1-173.50121.3
223A39.7Very low43.2Very low83 Ų83155.2 Ų155.269%0.68679%0.794SS**  trans96.3107.3140.500000118.1
224L45.4Very low43.2Very low164 Ų164155.8 Ų155.886%0.85980%0.796SS**  40.6111.8125.5-74.7151.1000116.7
225I42.7Very low42.9Very low242 Ų242156.1 Ų156.1100%1.24180%0.795SS**  -163.9098-82.5147.1000107.9

Retrieved 225 of 225 residues in 1012.9 ms (Link to these results)