G4VL73_SCHMA Loading...

Putative histone H2B

AlphaFold DB , UniProt , Accession G4VL73, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 82 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
1M49.4Very low51.5Low238 Ų238141.4 Ų141.4100%1.17286%0.859SS**  0119.60-73.4177.6165.600108.4
2P62.2Low51.2Low125 Ų125146.8 Ų146.881%0.81286%0.862SS**PPolyproline II helixtrans-89.7143.7-178.533.6-29.7000111.7
3P67.2Low50.3Low130 Ų130150.6 Ų150.684%0.84486%0.862SS**PPolyproline II helixtrans-81.6139.8176.131.9-30.3000111.6
4K56.2Low50.2Low196 Ų196147.2 Ų147.285%0.85286%0.861SS**PPolyproline II helixtrans-77.3124.9-174.7-158175.1-174.8178.50110.1V6K4-V6 PolarHBondContact O-N 3.28Å
5V54.5Low50.2Low148 Ų148144.8 Ų144.890%0.89786%0.855SS**PPolyproline II helixtrans-60.1126.6175.6-77.50000111.6
6V53.6Low50.1Low125 Ų125148.4 Ų148.476%0.75886%0.857SS**  trans-120.5131.6176.8-75.20000111.8K4K4-V6 PolarHBondContact O-N 3.28Å
7S48.7Very low50.5Low122 Ų122147.2 Ų147.285%0.85385%0.852SS**  trans73.5118.714981.60000119.3
8G49.2Very low50.6Low81 Ų81150 Ų15084%0.83585%0.852SS**  trans-168.172.8168.900000109.7
9K38.1Very low51.1Low204 Ų204149.8 Ų149.889%0.88785%0.848SS**  trans-75.7130.2-162.1-158.8171.1-173.5175.40112.4
10A42.3Very low51.5Low80 Ų80147.8 Ų147.866%0.66184%0.841SS**  trans63106.9141.500000119.5K12A10-K12 PolarHBondContact O-N 3.16Å
11A45.4Very low51.9Low106 Ų106150.8 Ų150.888%0.87684%0.844SS**  trans-41.7111.7154.300000112.7
12K47.4Very low52.4Low206 Ų206145.1 Ų145.190%0.89682%0.818SS**  trans-107.199.1166-89.4-174.1176.4179.50110A10A10-K12 PolarHBondContact O-N 3.16Å
13K39.8Very low52.3Low197 Ų197143.5 Ų143.586%0.85780%0.802SS**  trans27.3109.5145.1-87.4174.4172.5171.90116.6S15K13-S15 PolarHBondContact O-N 2.8Å; K13-S15 VanDerWaalsContact O-N 3.13Å
14A48.4Very low51.9Low103 Ų103145.7 Ų145.785%0.85180%0.801SS**  trans-39.2113.7158.300000111.6K16A14-K16 PolarHBondContact O-N 3.4Å
15S51.1Low51.9Low111 Ų111143.7 Ų143.778%0.77680%0.8SS**  trans-57.2117.1172.4-62.10000109.5K13 V17K13-S15 PolarHBondContact O-N 2.8Å; K13-S15 VanDerWaalsContact O-N 3.13Å; S15-V17 PolarHBondContact O-N 3.42Å
16K48.4Very low52Low203 Ų203145.1 Ų145.188%0.88379%0.794SS**  trans-49.4105168-89.4177.5171.4176.20109.1A14 K18A14-K16 PolarHBondContact O-N 3.4Å; K16-K18 PolarHBondContact O-N 2.57Å
17V57.1Low52.3Low128 Ų128147 Ų14778%0.77679%0.792SS**  trans-62.8105.9165.8-179.60000106.5S15 L19S15-V17 PolarHBondContact O-N 3.42Å; V17-L19 PolarHBondContact O-N 2.69Å; V17-L19 VanDerWaalsContact O-N 3.07Å
18K51.5Low53Low197 Ų197152.8 Ų152.886%0.85780%0.795SS**  trans-65.6106171.9-73.6-179.4177.8177.80107K16K16-K18 PolarHBondContact O-N 2.57Å
19L61.3Low53.7Low146 Ų146160.3 Ų160.376%0.76480%0.799SS**  trans-54.4134166.7-92.980.9000108.3V17 K21V17-L19 PolarHBondContact O-N 2.69Å; V17-L19 VanDerWaalsContact O-N 3.07Å; L19-K21 PolarHBondContact O-N 3.04Å; L19-K21 VanDerWaalsContact O-N 3.17Å
20P59.3Low55.2Low110 Ų110160.4 Ų160.471%0.71479%0.793SS**  trans-60.5124.6174.225.5-30.7000107.7I22P20-I22 VanDerWaalsContact C-N 3.32Å; P20-I22 PolarHBondContact O-N 3.1Å
21K58.3Low56.9Low210 Ų210165.5 Ų165.591%0.91380%0.8SS**  trans-59.8101.1168.8-74.8-178.2176.1179.40106.5L19 D23L19-K21 PolarHBondContact O-N 3.04Å; L19-K21 VanDerWaalsContact O-N 3.17Å; K21-D23 PolarHBondContact O-N 3.14Å
22I60.7Low58.6Low119 Ų119169.7 Ų169.761%0.6180%0.802SS**  trans-58.5110.8172.7-68.1171.1000105.8P20 Q24P20-I22 VanDerWaalsContact C-N 3.32Å; P20-I22 PolarHBondContact O-N 3.1Å; I22-Q24 WeakPolarHBondContact O-CG 3.43Å; I22-Q24 PolarHBondContact O-N 3.35Å
23D60.1Low60.7Low91 Ų91162.1 Ų162.149%0.48778%0.775SS.*  trans-5797.3174.9-170.7-10.2000108.6K21 N25 K26K21-D23 PolarHBondContact O-N 3.14Å; D23-N25 PolarHBondContact O-N 3.32Å; D23-N25 VanDerWaalsContact O-N 3.08Å; D23-N25 WeakPolarHBondContact OD1-CB 3.48Å; D23-N25 PolarHBondContact OD1-N 3Å; D23-K26 PolarHBondContact O-N 3.12Å
24Q59.3Low63.3Low176 Ų176155.9 Ų155.982%0.82275%0.746SS**THydrogen-bonded Turntrans-66.7-7.8-175.7-65.8-164.8-3.800112.1I22I22-Q24 WeakPolarHBondContact O-CG 3.43Å; I22-Q24 PolarHBondContact O-N 3.35Å
25N56.2Low65.4Low155 Ų155151.9 Ų151.983%0.82971%0.714SS**THydrogen-bonded Turntrans-84.4-6.8179.7-74.1-33.9000114.7D23D23-N25 PolarHBondContact O-N 3.32Å; D23-N25 VanDerWaalsContact O-N 3.08Å; D23-N25 WeakPolarHBondContact OD1-CB 3.48Å; D23-N25 PolarHBondContact OD1-N 3Å
26K55.7Low67.5Low177 Ų177150.1 Ų150.177%0.7770%0.695SS**SBendtrans-101.1-15.2-178.9-83.5-179.8178.7173.60116D23 R28D23-K26 PolarHBondContact O-N 3.12Å; K26-R28 PolarHBondContact O-N 2.94Å; K26-R28 VanDerWaalsContact O-N 3.12Å
27K59.8Low69.8Low166 Ų166147.5 Ų147.572%0.72268%0.68SS**  trans-88.480176.1-72.3-176.2179.9179.30109.2R29K27-R29 PolarHBondContact O-N 3.28Å
28R63.6Low71.6Confident242 Ų242142.2 Ų142.291%0.91365%0.648SS**  trans-42115.9162.3-102.8-179.3169.9176.9-1.9107.1K26 R30K26-R28 PolarHBondContact O-N 2.94Å; K26-R28 VanDerWaalsContact O-N 3.12Å; R28-R30 PolarHBondContact O-N 3.37Å
29R65Low73.7Confident240 Ų240138.6 Ų138.691%0.90663%0.629SS**  trans-44.3117.6178.2-80.8-173.8174.5-167.2-0.9107.5K27 K31K27-R29 PolarHBondContact O-N 3.28Å; R29-K31 PolarHBondContact O-N 3.17Å
30R69.1Low75.4Confident205 Ų205137.5 Ų137.577%0.77462%0.618SS**  trans-59.3112.1-178-179.4-179.4174.4-173-3.7106.7R28 E32R28-R30 PolarHBondContact O-N 3.37Å; R30-E32 PolarHBondContact O-N 3.39Å
31K76.8Confident77.3Confident187 Ų187136 Ų13681%0.81361%0.608SS**  trans-66.9121.5170.7-69.6-172.9177.5-174.70107R29 S33R29-K31 PolarHBondContact O-N 3.17Å; K31-S33 PolarHBondContact O-N 2.93Å
32E81Confident79.1Confident194 Ų194127.5 Ų127.591%0.90757%0.572SS**  trans-62.1125.3170.4-66.7-175.615600108.3R30R30-E32 PolarHBondContact O-N 3.39Å
33S92.4Very high80.9Confident48 Ų48125.3 Ų125.334%0.33656%0.556SS.*  trans-157.8146-175.9173.50000110K31 A35 N60K31-S33 PolarHBondContact O-N 2.93Å; S33-A35 PolarHBondContact O-N 2.97Å; S33-A35 VanDerWaalsContact OG-CB 3.23Å; S33-A35 WeakPolarHBondContact OG-CB 3.48Å; S33-A35 PolarHBondContact OG-N 2.97Å; S33-A35 VanDerWaalsContact OG-N 3.11Å; S33-N60 WeakPolarHBondContact CA-OD1 3.44Å; S33-N60 PolarHBondContact OG-OD1 2.84Å
34Y95.2Very high82.7Confident65 Ų65128.3 Ų128.326%0.25557%0.567SS.*THydrogen-bonded Turntrans-74.42173.5-58.8-79.2000113.2I36 Y37 I38 N60 V63 N64Y34-I36 PolarHBondContact O-N 3.07Å; Y34-Y37 HydrophobicContact CD1-CD2 4.17Å; Y34-Y37 PolarHBondContact O-N 3.39Å; Y34-I38 WeakPolarHBondContact O-CG1 3.45Å; Y34-I38 PolarHBondContact O-N 3.17Å; Y34-N60 PolarHBondContact N-OD1 3.34Å; Y34-V63 HydrophobicContact CD1-CG1 3.65Å; Y34-V63 HydrophobicContact CD2-CB 3.81Å; Y34-V63 HydrophobicContact CD2-CG1 3.52Å; Y34-V63 HydrophobicContact CE1-CG1 3.74Å; Y34-V63 HydrophobicContact CE2-CB 4.22Å; Y34-V63 HydrophobicContact CE2-CG1 3.62Å; Y34-V63 HydrophobicContact CG-CB 4.01Å; Y34-V63 HydrophobicContact CG-CG1 3.53Å; Y34-N64 WeakPolarHBondContact CE2-OD1 3.44Å
35A92.8Very high84.5Confident20 Ų20124.3 Ų124.317%0.16555%0.554CS.*Hα-helixtrans-48.7-33.817900000114.9S33 Y39 K56S33-A35 PolarHBondContact O-N 2.97Å; S33-A35 VanDerWaalsContact OG-CB 3.23Å; S33-A35 WeakPolarHBondContact OG-CB 3.48Å; S33-A35 PolarHBondContact OG-N 2.97Å; S33-A35 VanDerWaalsContact OG-N 3.11Å; A35-Y39 PolarHBondContact O-N 2.98Å; A35-K56 HydrophobicContact CB-CD 4.07Å; A35-K56 HydrophobicContact CB-CG 4.37Å; A35-K56 WeakPolarHBondContact O-CE 3.4Å; A35-K56 PolarHBondContact O-NZ 3.23Å
36I93.9Very high86.5Confident74 Ų74121.7 Ų121.738%0.37954%0.537SS..Hα-helixtrans-68.9-45.6178.3-65172.5000110.2Y34 Y39 K40Y34-I36 PolarHBondContact O-N 3.07Å; I36-Y39 PolarHBondContact O-N 3.43Å; I36-K40 HydrophobicContact CG2-CD 4.21Å; I36-K40 HydrophobicContact CG2-CG 4.46Å; I36-K40 WeakPolarHBondContact O-CG 3.23Å; I36-K40 PolarHBondContact O-N 3.41Å
37Y96.3Very high88.5Confident147 Ų147117 Ų11758%0.57653%0.525SS*.Hα-helixtrans-71.3-40.2-177.9-53.2-67.5000111.6Y34 Y39 K40 V41Y34-Y37 HydrophobicContact CD1-CD2 4.17Å; Y34-Y37 PolarHBondContact O-N 3.39Å; Y37-Y39 PolarHBondContact O-N 3.27Å; Y37-K40 PolarHBondContact O-N 2.97Å; Y37-K40 VanDerWaalsContact O-N 3.15Å; Y37-V41 WeakPolarHBondContact O-CG2 3.32Å; Y37-V41 PolarHBondContact O-N 3.42Å
38I96Very high90.3Very high18 Ų18116.7 Ų116.79%0.09253%0.531CS..Hα-helixtrans-53.7-43.3172.7-67.2163.3000110.3Y34 L42 I51 K56 M59 N60Y34-I38 WeakPolarHBondContact O-CG1 3.45Å; Y34-I38 PolarHBondContact O-N 3.17Å; I38-L42 VanDerWaalsContact O-CB 3.23Å; I38-L42 WeakPolarHBondContact O-CB 3.37Å; I38-L42 PolarHBondContact O-N 3Å; I38-I51 HydrophobicContact CG2-CD1 4.3Å; I38-K56 HydrophobicContact CG2-CG 4.31Å; I38-M59 HydrophobicContact CD1-CB 3.62Å; I38-M59 HydrophobicContact CG1-CB 4.14Å; I38-M59 HydrophobicContact CG2-CB 4.41Å; I38-M59 HydrophobicContact CG2-CE 3.36Å; I38-M59 HydrophobicContact CG2-SD 3.9Å; I38-N60 HydrophobicContact CD1-CB 4.28Å
39Y95.9Very high91.9Very high120 Ų120108.7 Ų108.747%0.47151%0.509SS..Hα-helixtrans-70.8-44.9177.3-178.6-98.8000112.8A35 I36 Y37 L42 R43A35-Y39 PolarHBondContact O-N 2.98Å; I36-Y39 PolarHBondContact O-N 3.43Å; Y37-Y39 PolarHBondContact O-N 3.27Å; Y39-L42 PolarHBondContact O-N 3.01Å; Y39-R43 HydrophobicContact CD1-CG 4.32Å; Y39-R43 HydrophobicContact CE1-CG 3.81Å; Y39-R43 HydrophobicContact CE2-CG 4.14Å; Y39-R43 PolarHBondContact O-N 3.15Å
40K97.1Very high93.3Very high123 Ų123100 Ų10054%0.53549%0.494SS..Hα-helixtrans-58.8-50179.8-77.7-176.1173.3-170.10111.8I36 Y37 R43 Q44I36-K40 HydrophobicContact CG2-CD 4.21Å; I36-K40 HydrophobicContact CG2-CG 4.46Å; I36-K40 WeakPolarHBondContact O-CG 3.23Å; I36-K40 PolarHBondContact O-N 3.41Å; Y37-K40 PolarHBondContact O-N 2.97Å; Y37-K40 VanDerWaalsContact O-N 3.15Å; K40-R43 PolarHBondContact O-N 3.26Å; K40-Q44 WeakPolarHBondContact O-CG 3.41Å; K40-Q44 PolarHBondContact O-N 3.31Å; K40-Q44 VanDerWaalsContact O-N 3.14Å
41V97.8Very high94.7Very high80 Ų8092.8 Ų92.849%0.48547%0.47SS..Hα-helixtrans-65.9-42-179.8176.40000110.6Y37 R43 Q44 V45Y37-V41 WeakPolarHBondContact O-CG2 3.32Å; Y37-V41 PolarHBondContact O-N 3.42Å; V41-R43 VanDerWaalsContact C-N 3.32Å; V41-R43 PolarHBondContact O-N 3.24Å; V41-Q44 WeakPolarHBondContact O-CB 3.37Å; V41-Q44 PolarHBondContact O-N 2.91Å; V41-Q44 VanDerWaalsContact O-N 3.1Å; V41-V45 HydrophobicContact CG1-CG2 4.3Å; V41-V45 WeakPolarHBondContact O-CG2 3.48Å; V41-V45 PolarHBondContact O-N 3.27Å
42L97.6Very high95.7Very high31 Ų3187.2 Ų87.216%0.16246%0.455CS..Hα-helixtrans-58.2-43.8176.3179.564.9000112I38 Y39 Q44 V45 H46 I51I38-L42 VanDerWaalsContact O-CB 3.23Å; I38-L42 WeakPolarHBondContact O-CB 3.37Å; I38-L42 PolarHBondContact O-N 3Å; Y39-L42 PolarHBondContact O-N 3.01Å; L42-Q44 VanDerWaalsContact C-N 3.28Å; L42-Q44 PolarHBondContact O-N 3.01Å; L42-V45 PolarHBondContact O-N 2.89Å; L42-H46 HydrophobicContact CD1-CB 4.23Å; L42-H46 CarbonylContact O-C 3.34Å; L42-H46 WeakPolarHBondContact O-CA 3.42Å; L42-H46 PolarHBondContact O-N 3.22Å; L42-I51 HydrophobicContact CD2-CB 3.61Å; L42-I51 HydrophobicContact CD2-CG2 3.53Å
43R96.7Very high96.3Very high73 Ų7383.1 Ų83.128%0.27545%0.448SS..Hα-helixtrans-66.7-29.5177.4-73.8-53.3101165.620.1113.4Y39 K40 V41 P47 T49Y39-R43 HydrophobicContact CD1-CG 4.32Å; Y39-R43 HydrophobicContact CE1-CG 3.81Å; Y39-R43 HydrophobicContact CE2-CG 4.14Å; Y39-R43 PolarHBondContact O-N 3.15Å; K40-R43 PolarHBondContact O-N 3.26Å; V41-R43 VanDerWaalsContact C-N 3.32Å; V41-R43 PolarHBondContact O-N 3.24Å; R43-P47 PolarHBondContact NH1-O 3.28Å; R43-T49 PolarHBondContact NH2-O 3.03Å
44Q97.8Very high96.6Very high154 Ų15488.3 Ų88.372%0.7246%0.464SS*.Hα-helixtrans-72.6-38.2177.2-73.4174.3-34.700112.1K40 V41 L42K40-Q44 WeakPolarHBondContact O-CG 3.41Å; K40-Q44 PolarHBondContact O-N 3.31Å; K40-Q44 VanDerWaalsContact O-N 3.14Å; V41-Q44 WeakPolarHBondContact O-CB 3.37Å; V41-Q44 PolarHBondContact O-N 2.91Å; V41-Q44 VanDerWaalsContact O-N 3.1Å; L42-Q44 VanDerWaalsContact C-N 3.28Å; L42-Q44 PolarHBondContact O-N 3.01Å
45V98.3Very high96.7Very high91 Ų9186.8 Ų86.855%0.55247%0.465SS*.Hα-helixtrans-92.8-37.4-175.3-175.80000112.4V41 L42V41-V45 HydrophobicContact CG1-CG2 4.3Å; V41-V45 WeakPolarHBondContact O-CG2 3.48Å; V41-V45 PolarHBondContact O-N 3.27Å; L42-V45 PolarHBondContact O-N 2.89Å
46H97.6Very high96.8Very high100 Ų10089 Ų8946%0.46347%0.471SS..  trans-13682.3-178.8-59.9-60.3000111.3L42 D48 T49L42-H46 HydrophobicContact CD1-CB 4.23Å; L42-H46 CarbonylContact O-C 3.34Å; L42-H46 WeakPolarHBondContact O-CA 3.42Å; L42-H46 PolarHBondContact O-N 3.22Å; H46-D48 PolarHBondContact O-N 3.23Å; H46-D48 VanDerWaalsContact O-N 3.16Å; H46-T49 PolarHBondContact O-N 3.32Å
47P97.5Very high96.9Very high80 Ų8088.9 Ų88.952%0.51948%0.477SS..THydrogen-bonded Turntrans-56.9-31.2-177.4-25.935.1000114.2R43R43-P47 PolarHBondContact NH1-O 3.28Å
48D97.5Very high96.9Very high158 Ų15885.6 Ų85.685%0.84547%0.468SS*.THydrogen-bonded Turntrans-97.4-5.8-173.4-52.9-47.9000114H46H46-D48 PolarHBondContact O-N 3.23Å; H46-D48 VanDerWaalsContact O-N 3.16Å
49T96.9Very high97Very high75 Ų7588 Ų8846%0.4648%0.48SS..  trans-101.6116.3-173.7-62.10000111.7R43 H46R43-T49 PolarHBondContact NH2-O 3.03Å; H46-T49 PolarHBondContact O-N 3.32Å
50G96.1Very high97Very high58 Ų5883.7 Ų83.760%0.59847%0.465SS*.  trans-72.2169.6174.200000114.5
51I97.2Very high97Very high53 Ų5381 Ų8127%0.27246%0.462SS..  trans-135.6135.5171.1-174.4169.2000112.2I38 L42 A55 M59I38-I51 HydrophobicContact CG2-CD1 4.3Å; L42-I51 HydrophobicContact CD2-CB 3.61Å; L42-I51 HydrophobicContact CD2-CG2 3.53Å; I51-A55 HydrophobicContact CD1-CB 3.85Å; I51-A55 HydrophobicContact CG1-CB 3.65Å; I51-M59 HydrophobicContact CD1-CE 2.84Å; I51-M59 HydrophobicContact CG1-CE 4.32Å
52S97.2Very high97Very high69 Ų6983.5 Ų83.548%0.48347%0.467SS..  trans-70.7155.6176.874.20000112.7K54 A55 K56S52-K54 VanDerWaalsContact C-N 3.28Å; S52-K54 PolarHBondContact O-N 3.4Å; S52-A55 PolarHBondContact O-N 3.26Å; S52-A55 VanDerWaalsContact OG-CB 3.32Å; S52-A55 WeakPolarHBondContact OG-CB 3.43Å; S52-A55 PolarHBondContact OG-N 3.4Å; S52-A55 VanDerWaalsContact OG-N 3.12Å; S52-K56 WeakPolarHBondContact O-CB 3.47Å; S52-K56 PolarHBondContact O-N 3.12Å
53S95.4Very high97Very high108 Ų10884.8 Ų84.876%0.75548%0.476SS*.Hα-helixtrans-59.2-38.7174.955.70000112.4K56 S57S53-K56 PolarHBondContact O-N 2.87Å; S53-S57 PolarHBondContact O-N 2.77Å
54K97Very high96.9Very high157 Ų15784 Ų8468%0.68348%0.476SS*.Hα-helixtrans-61.9-49.8175.7-173.6175.6-179.2179.20111.2S52 K56 S57 I58S52-K54 VanDerWaalsContact C-N 3.28Å; S52-K54 PolarHBondContact O-N 3.4Å; K54-K56 VanDerWaalsContact C-N 3.33Å; K54-K56 PolarHBondContact O-N 2.94Å; K54-S57 WeakPolarHBondContact O-CB 3.42Å; K54-S57 PolarHBondContact O-N 3.11Å; K54-I58 HydrophobicContact CG-CD1 4.17Å; K54-I58 WeakPolarHBondContact O-CG1 3.48Å; K54-I58 PolarHBondContact O-N 3.06Å
55A97.4Very high96.9Very high33 Ų3381 Ų8127%0.27347%0.465SS..Hα-helixtrans-62.7-40177.900000111.8I51 S52 S57 I58 M59I51-A55 HydrophobicContact CD1-CB 3.85Å; I51-A55 HydrophobicContact CG1-CB 3.65Å; S52-A55 PolarHBondContact O-N 3.26Å; S52-A55 VanDerWaalsContact OG-CB 3.32Å; S52-A55 WeakPolarHBondContact OG-CB 3.43Å; S52-A55 PolarHBondContact OG-N 3.4Å; S52-A55 VanDerWaalsContact OG-N 3.12Å; A55-S57 VanDerWaalsContact C-N 3.32Å; A55-S57 PolarHBondContact O-N 3.15Å; A55-I58 PolarHBondContact O-N 3.2Å; A55-M59 PolarHBondContact O-N 3.43Å
56K95.5Very high96.9Very high66 Ų6680.6 Ų80.629%0.28746%0.459SS..Hα-helixtrans-59.8-40.8173.9-163.3-179.9-156.8-175.20112.5A35 I38 S52 S53 K54 N60A35-K56 HydrophobicContact CB-CD 4.07Å; A35-K56 HydrophobicContact CB-CG 4.37Å; A35-K56 WeakPolarHBondContact O-CE 3.4Å; A35-K56 PolarHBondContact O-NZ 3.23Å; I38-K56 HydrophobicContact CG2-CG 4.31Å; S52-K56 WeakPolarHBondContact O-CB 3.47Å; S52-K56 PolarHBondContact O-N 3.12Å; S53-K56 PolarHBondContact O-N 2.87Å; K54-K56 VanDerWaalsContact C-N 3.33Å; K54-K56 PolarHBondContact O-N 2.94Å; K56-N60 WeakPolarHBondContact O-CB 2.92Å; K56-N60 PolarHBondContact O-N 2.74Å
57S95.7Very high96.9Very high73 Ų7381.3 Ų81.351%0.5146%0.462SS..Hα-helixtrans-67.4-41.4176.1-168.50000112.2S53 K54 A55 N60 S61S53-S57 PolarHBondContact O-N 2.77Å; K54-S57 WeakPolarHBondContact O-CB 3.42Å; K54-S57 PolarHBondContact O-N 3.11Å; A55-S57 VanDerWaalsContact C-N 3.32Å; A55-S57 PolarHBondContact O-N 3.15Å; S57-N60 WeakPolarHBondContact O-CB 3.46Å; S57-N60 PolarHBondContact O-N 2.97Å; S57-S61 PolarHBondContact O-N 2.95Å; S57-S61 PolarHBondContact O-OG 3.48Å
58I97.3Very high96.9Very high77 Ų7784.5 Ų84.540%0.39547%0.467SS..Hα-helixtrans-60.7-48.1176.8-68.7166.2000110K54 A55 N60 S61 F62K54-I58 HydrophobicContact CG-CD1 4.17Å; K54-I58 WeakPolarHBondContact O-CG1 3.48Å; K54-I58 PolarHBondContact O-N 3.06Å; A55-I58 PolarHBondContact O-N 3.2Å; I58-N60 VanDerWaalsContact C-N 3.32Å; I58-N60 PolarHBondContact O-N 3.13Å; I58-S61 WeakPolarHBondContact O-CB 3.37Å; I58-S61 PolarHBondContact O-N 3.25Å; I58-F62 HydrophobicContact CG2-CD2 4.25Å; I58-F62 HydrophobicContact CG2-CE1 4.04Å; I58-F62 HydrophobicContact CG2-CE2 3.69Å; I58-F62 HydrophobicContact CG2-CZ 3.58Å; I58-F62 PolarHBondContact O-N 3.44Å
59M97.5Very high96.9Very high70 Ų7085 Ų8535%0.34546%0.457SS..Hα-helixtrans-62.1-38.1176.3-80.9-159.5-88.300113.1I38 I51 A55 S61 F62 V63I38-M59 HydrophobicContact CD1-CB 3.62Å; I38-M59 HydrophobicContact CG1-CB 4.14Å; I38-M59 HydrophobicContact CG2-CB 4.41Å; I38-M59 HydrophobicContact CG2-CE 3.36Å; I38-M59 HydrophobicContact CG2-SD 3.9Å; I51-M59 HydrophobicContact CD1-CE 2.84Å; I51-M59 HydrophobicContact CG1-CE 4.32Å; A55-M59 PolarHBondContact O-N 3.43Å; M59-S61 VanDerWaalsContact C-N 3.27Å; M59-S61 PolarHBondContact O-N 3.06Å; M59-F62 PolarHBondContact O-N 3.16Å; M59-V63 WeakPolarHBondContact O-CG2 3.19Å; M59-V63 PolarHBondContact O-N 2.85Å
60N95.9Very high97Very high28 Ų2886.5 Ų86.515%0.1546%0.461CS..Hα-helixtrans-60-39.9173.6-178.185.7000111.5S33 Y34 I38 K56 S57 I58 N64S33-N60 WeakPolarHBondContact CA-OD1 3.44Å; S33-N60 PolarHBondContact OG-OD1 2.84Å; Y34-N60 PolarHBondContact N-OD1 3.34Å; I38-N60 HydrophobicContact CD1-CB 4.28Å; K56-N60 WeakPolarHBondContact O-CB 2.92Å; K56-N60 PolarHBondContact O-N 2.74Å; S57-N60 WeakPolarHBondContact O-CB 3.46Å; S57-N60 PolarHBondContact O-N 2.97Å; I58-N60 VanDerWaalsContact C-N 3.32Å; I58-N60 PolarHBondContact O-N 3.13Å; N60-N64 PolarHBondContact ND2-ND2 3.44Å; N60-N64 PolarHBondContact O-N 3.37Å; N60-N64 VanDerWaalsContact O-N 3.15Å; N60-N64 PolarHBondContact O-ND2 3.24Å
61S96.7Very high97.1Very high67 Ų6785.9 Ų85.947%0.46945%0.451SS..Hα-helixtrans-66.8-39.5174.9-61.40000112.5S57 I58 M59 N64 D65S57-S61 PolarHBondContact O-N 2.95Å; S57-S61 PolarHBondContact O-OG 3.48Å; I58-S61 WeakPolarHBondContact O-CB 3.37Å; I58-S61 PolarHBondContact O-N 3.25Å; M59-S61 VanDerWaalsContact C-N 3.27Å; M59-S61 PolarHBondContact O-N 3.06Å; S61-N64 PolarHBondContact O-N 3.45Å; S61-D65 PolarHBondContact O-N 3.46Å
62F97.6Very high97.1Very high133 Ų13385.7 Ų85.758%0.58346%0.457SS*.Hα-helixtrans-60.8-45.1175.2-68.2-17.4000112.5I58 M59 N64 D65 I66I58-F62 HydrophobicContact CG2-CD2 4.25Å; I58-F62 HydrophobicContact CG2-CE1 4.04Å; I58-F62 HydrophobicContact CG2-CE2 3.69Å; I58-F62 HydrophobicContact CG2-CZ 3.58Å; I58-F62 PolarHBondContact O-N 3.44Å; M59-F62 PolarHBondContact O-N 3.16Å; F62-N64 VanDerWaalsContact C-N 3.29Å; F62-N64 PolarHBondContact O-N 2.96Å; F62-D65 PolarHBondContact O-N 3.31Å; F62-I66 WeakPolarHBondContact O-CG1 3.31Å; F62-I66 PolarHBondContact O-N 2.9Å; F62-I66 VanDerWaalsContact O-N 3.12Å
63V97.2Very high97.1Very high58 Ų5886.4 Ų86.435%0.35245%0.453SS..Hα-helixtrans-61.6-40.9176.2179.30000110.8Y34 M59 F67Y34-V63 HydrophobicContact CD1-CG1 3.65Å; Y34-V63 HydrophobicContact CD2-CB 3.81Å; Y34-V63 HydrophobicContact CD2-CG1 3.52Å; Y34-V63 HydrophobicContact CE1-CG1 3.74Å; Y34-V63 HydrophobicContact CE2-CB 4.22Å; Y34-V63 HydrophobicContact CE2-CG1 3.62Å; Y34-V63 HydrophobicContact CG-CB 4.01Å; Y34-V63 HydrophobicContact CG-CG1 3.53Å; M59-V63 WeakPolarHBondContact O-CG2 3.19Å; M59-V63 PolarHBondContact O-N 2.85Å; V63-F67 WeakPolarHBondContact O-CB 3.23Å; V63-F67 PolarHBondContact O-N 2.94Å
64N96.6Very high97.2Very high55 Ų5583.8 Ų83.829%0.29444%0.438SS..Hα-helixtrans-65.3-39.3177.3-80.3-63.1000113.2Y34 N60 S61 F62 F67 K68Y34-N64 WeakPolarHBondContact CE2-OD1 3.44Å; N60-N64 PolarHBondContact ND2-ND2 3.44Å; N60-N64 PolarHBondContact O-N 3.37Å; N60-N64 VanDerWaalsContact O-N 3.15Å; N60-N64 PolarHBondContact O-ND2 3.24Å; S61-N64 PolarHBondContact O-N 3.45Å; F62-N64 VanDerWaalsContact C-N 3.29Å; F62-N64 PolarHBondContact O-N 2.96Å; N64-F67 PolarHBondContact O-N 3.1Å; N64-K68 VanDerWaalsContact O-CG 3.31Å; N64-K68 WeakPolarHBondContact O-CG 3.33Å; N64-K68 PolarHBondContact O-N 3.02Å
65D97.3Very high97.2Very high91 Ų9178.9 Ų78.949%0.48742%0.423SS..Hα-helixtrans-62.5-50.2177.6-177.555.3000111.2S61 F62 F67 K68 R69S61-D65 PolarHBondContact O-N 3.46Å; F62-D65 PolarHBondContact O-N 3.31Å; D65-F67 VanDerWaalsContact C-N 3.35Å; D65-F67 PolarHBondContact O-N 3.29Å; D65-K68 PolarHBondContact O-N 2.97Å; D65-R69 WeakPolarHBondContact O-CG 3.49Å; D65-R69 PolarHBondContact O-N 3.12Å; D65-R69 VanDerWaalsContact O-N 3.13Å
66I97.8Very high97.2Very high83 Ų8383.9 Ų83.943%0.42644%0.435SS..Hα-helixtrans-62.9-42.4176.6-60.7-56.7000111.2F62 K68 R69 I70F62-I66 WeakPolarHBondContact O-CG1 3.31Å; F62-I66 PolarHBondContact O-N 2.9Å; F62-I66 VanDerWaalsContact O-N 3.12Å; I66-K68 VanDerWaalsContact C-N 3.31Å; I66-K68 PolarHBondContact O-N 2.94Å; I66-R69 PolarHBondContact O-N 3.36Å; I66-R69 VanDerWaalsContact O-N 3.16Å; I66-I70 HydrophobicContact CG2-CD1 3.79Å; I66-I70 HydrophobicContact CG2-CG1 4.34Å; I66-I70 WeakPolarHBondContact O-CG1 3.5Å; I66-I70 PolarHBondContact O-N 3Å
67F97.7Very high97.2Very high116 Ų11685.7 Ų85.751%0.50945%0.447SS..Hα-helixtrans-58.7-42.4177-177.6-93000111.9V63 N64 D65 R69 I70 A71V63-F67 WeakPolarHBondContact O-CB 3.23Å; V63-F67 PolarHBondContact O-N 2.94Å; N64-F67 PolarHBondContact O-N 3.1Å; D65-F67 VanDerWaalsContact C-N 3.35Å; D65-F67 PolarHBondContact O-N 3.29Å; F67-R69 PolarHBondContact O-N 2.95Å; F67-I70 PolarHBondContact O-N 2.97Å; F67-A71 WeakPolarHBondContact O-CB 3.36Å; F67-A71 PolarHBondContact O-N 2.69Å
68K97.2Very high97.3Very high147 Ų14785.8 Ų85.864%0.63945%0.448SS*.Hα-helixtrans-62.4-41.3176-76174.4-179.1-177.10112.2N64 D65 I66 A71 A72N64-K68 VanDerWaalsContact O-CG 3.31Å; N64-K68 WeakPolarHBondContact O-CG 3.33Å; N64-K68 PolarHBondContact O-N 3.02Å; D65-K68 PolarHBondContact O-N 2.97Å; I66-K68 VanDerWaalsContact C-N 3.31Å; I66-K68 PolarHBondContact O-N 2.94Å; K68-A71 PolarHBondContact O-N 3.1Å; K68-A72 WeakPolarHBondContact O-CB 3.36Å; K68-A72 PolarHBondContact O-N 3.32Å
69R98Very high97.1Very high167 Ų16787.6 Ų87.663%0.6346%0.455SS*.Hα-helixtrans-63.5-44.2177-65.9175.872.3-168.71.8111.3D65 I66 F67 A72 E73D65-R69 WeakPolarHBondContact O-CG 3.49Å; D65-R69 PolarHBondContact O-N 3.12Å; D65-R69 VanDerWaalsContact O-N 3.13Å; I66-R69 PolarHBondContact O-N 3.36Å; I66-R69 VanDerWaalsContact O-N 3.16Å; F67-R69 PolarHBondContact O-N 2.95Å; R69-A72 PolarHBondContact O-N 3.48Å; R69-E73 PolarHBondContact O-N 3.39Å
70I98.2Very high97Very high107 Ų10792.9 Ų92.955%0.54947%0.472SS..Hα-helixtrans-63.7-45.8176.2-65.8169.3000110.9I66 F67 A72 E73 A74I66-I70 HydrophobicContact CG2-CD1 3.79Å; I66-I70 HydrophobicContact CG2-CG1 4.34Å; I66-I70 WeakPolarHBondContact O-CG1 3.5Å; I66-I70 PolarHBondContact O-N 3Å; F67-I70 PolarHBondContact O-N 2.97Å; I70-A72 VanDerWaalsContact C-N 3.34Å; I70-A72 PolarHBondContact O-N 2.96Å; I70-E73 PolarHBondContact O-N 3.38Å; I70-A74 WeakPolarHBondContact O-CB 3.31Å; I70-A74 PolarHBondContact O-N 3.35Å
71A98Very high96.6Very high46 Ų4698.2 Ų98.238%0.3850%0.5SS..Hα-helixtrans-62.9-39.5179.300000112.3F67 K68 S75F67-A71 WeakPolarHBondContact O-CB 3.36Å; F67-A71 PolarHBondContact O-N 2.69Å; K68-A71 PolarHBondContact O-N 3.1Å; A71-S75 WeakPolarHBondContact O-CB 3.5Å; A71-S75 PolarHBondContact O-N 3.4Å
72A97.6Very high95.4Very high48 Ų48106.3 Ų106.340%0.39753%0.527SS..Hα-helixtrans-63.6-42.7174.800000111.8K68 R69 I70 S75 R76K68-A72 WeakPolarHBondContact O-CB 3.36Å; K68-A72 PolarHBondContact O-N 3.32Å; R69-A72 PolarHBondContact O-N 3.48Å; I70-A72 VanDerWaalsContact C-N 3.34Å; I70-A72 PolarHBondContact O-N 2.96Å; A72-S75 WeakPolarHBondContact O-CB 3.4Å; A72-S75 PolarHBondContact O-N 3.09Å; A72-R76 WeakPolarHBondContact O-CG 3.48Å; A72-R76 PolarHBondContact O-N 3.38Å
73E97.7Very high95.3Very high85 Ų85105 Ų10540%0.39752%0.524SS..Hα-helixtrans-69.3-42.8178.4-16457.9-152.800112R69 I70 S75 R76 L77R69-E73 PolarHBondContact O-N 3.39Å; I70-E73 PolarHBondContact O-N 3.38Å; E73-S75 PolarHBondContact O-N 3.17Å; E73-R76 WeakPolarHBondContact O-CB 3.4Å; E73-R76 PolarHBondContact O-N 3.1Å; E73-R76 VanDerWaalsContact O-N 3.1Å; E73-R76 IonicContact OE2-CZ 3.93Å; E73-R76 IonicContact OE2-NH1 2.9Å; E73-R76 PolarHBondContact OE2-NH1 3.32Å; E73-L77 WeakPolarHBondContact O-CG 3.44Å; E73-L77 PolarHBondContact O-N 3.22Å
74A98Very high95.2Very high53 Ų53107.4 Ų107.444%0.43853%0.533SS..Hα-helixtrans-58.4-38.8173.200000111.7I70 L77 S78I70-A74 WeakPolarHBondContact O-CB 3.31Å; I70-A74 PolarHBondContact O-N 3.35Å; A74-L77 PolarHBondContact O-N 2.86Å; A74-S78 PolarHBondContact O-N 3.23Å
75S96.8Very high95.1Very high54 Ų54110.3 Ų110.338%0.37855%0.547SS..Hα-helixtrans-62.7-47.9173.1-173.20000111.3A71 A72 E73 L77 S78 H79A71-S75 WeakPolarHBondContact O-CB 3.5Å; A71-S75 PolarHBondContact O-N 3.4Å; A72-S75 WeakPolarHBondContact O-CB 3.4Å; A72-S75 PolarHBondContact O-N 3.09Å; E73-S75 PolarHBondContact O-N 3.17Å; S75-L77 VanDerWaalsContact C-N 3.33Å; S75-L77 PolarHBondContact O-N 2.99Å; S75-S78 PolarHBondContact O-N 3.17Å; S75-S78 PolarHBondContact O-OG 3.07Å; S75-H79 PolarHBondContact O-N 3.02Å; S75-H79 VanDerWaalsContact O-N 3.1Å; S75-H79 PolarHBondContact O-ND1 2.92Å; S75-H79 PolarHBondContact OG-CE1 3.21Å
76R96.3Very high95Very high138 Ų138111.5 Ų111.552%0.52155%0.55SS.*Hα-helixtrans-57.5-45.9176.6-70.7175.4-176152.6-5.4112.1A72 E73 S78 H79 Y80A72-R76 WeakPolarHBondContact O-CG 3.48Å; A72-R76 PolarHBondContact O-N 3.38Å; E73-R76 WeakPolarHBondContact O-CB 3.4Å; E73-R76 PolarHBondContact O-N 3.1Å; E73-R76 VanDerWaalsContact O-N 3.1Å; E73-R76 IonicContact OE2-CZ 3.93Å; E73-R76 IonicContact OE2-NH1 2.9Å; E73-R76 PolarHBondContact OE2-NH1 3.32Å; R76-S78 VanDerWaalsContact C-N 3.33Å; R76-S78 PolarHBondContact O-N 2.9Å; R76-H79 WeakPolarHBondContact O-CB 3.48Å; R76-H79 PolarHBondContact O-N 3.19Å; R76-H79 VanDerWaalsContact O-N 3.1Å; R76-Y80 HydrophobicContact CB-CE2 4.24Å; R76-Y80 VanDerWaalsContact O-CD2 3.31Å; R76-Y80 WeakPolarHBondContact O-CD2 3.42Å; R76-Y80 PolarHBondContact O-N 3.08Å; R76-Y80 VanDerWaalsContact O-N 3.09Å
77L97Very high94.8Very high103 Ų103113.3 Ų113.354%0.53956%0.558SS.*Hα-helixtrans-58.9-42.1176.9-68.8173000112.2E73 A74 S75 H79 Y80 N81E73-L77 WeakPolarHBondContact O-CG 3.44Å; E73-L77 PolarHBondContact O-N 3.22Å; A74-L77 PolarHBondContact O-N 2.86Å; S75-L77 VanDerWaalsContact C-N 3.33Å; S75-L77 PolarHBondContact O-N 2.99Å; L77-H79 VanDerWaalsContact C-N 3.27Å; L77-H79 PolarHBondContact O-N 2.85Å; L77-Y80 PolarHBondContact O-N 3.13Å; L77-N81 PolarHBondContact O-N 3.45Å
78S96.3Very high94.6Very high76 Ų76113.1 Ų113.153%0.53156%0.561SS.*Hα-helixtrans-66.7-29.3177.5800000112.8A74 S75 R76A74-S78 PolarHBondContact O-N 3.23Å; S75-S78 PolarHBondContact O-N 3.17Å; S75-S78 PolarHBondContact O-OG 3.07Å; R76-S78 VanDerWaalsContact C-N 3.33Å; R76-S78 PolarHBondContact O-N 2.9Å
79H94.5Very high94.4Very high115 Ų115110.6 Ų110.653%0.53256%0.556SS.*Hα-helixtrans-73.7-32.4174.7-71.587.5000112.5S75 R76 L77S75-H79 PolarHBondContact O-N 3.02Å; S75-H79 VanDerWaalsContact O-N 3.1Å; S75-H79 PolarHBondContact O-ND1 2.92Å; S75-H79 PolarHBondContact OG-CE1 3.21Å; R76-H79 WeakPolarHBondContact O-CB 3.48Å; R76-H79 PolarHBondContact O-N 3.19Å; R76-H79 VanDerWaalsContact O-N 3.1Å; L77-H79 VanDerWaalsContact C-N 3.27Å; L77-H79 PolarHBondContact O-N 2.85Å
80Y95Very high94.1Very high180 Ų180106.3 Ų106.371%0.70655%0.55SS*.Hα-helixtrans-71.4-30.1175.5-63.5-40.6000112.8R76 L77 K82R76-Y80 HydrophobicContact CB-CE2 4.24Å; R76-Y80 VanDerWaalsContact O-CD2 3.31Å; R76-Y80 WeakPolarHBondContact O-CD2 3.42Å; R76-Y80 PolarHBondContact O-N 3.08Å; R76-Y80 VanDerWaalsContact O-N 3.09Å; L77-Y80 PolarHBondContact O-N 3.13Å; Y80-K82 PolarHBondContact O-N 3.19Å
81N88.1Confident93.8Very high140 Ų140106.3 Ų106.375%0.74955%0.55SS*.THydrogen-bonded Turntrans-8939-179-16576.2000113.4L77L77-N81 PolarHBondContact O-N 3.45Å
82K70.2Confident93.4Very high237 Ų237111.7 Ų111.7100%1.0357%0.565SS**  trans-77.50163.3-74.3-175.7179.7179.70110.1Y80Y80-K82 PolarHBondContact O-N 3.19Å

Retrieved 82 of 82 residues in 16 ms (Link to these results)