A0A077ZJV2_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077ZJV2, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 215 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
1M31Very low37.6Very low229 Ų229147.2 Ų147.2100%1.12869%0.691SS**  0900-158.9170.6-165.900105.9L3M1-L3 PolarHBondContact O-N 3.19Å
2F31.8Very low37.5Very low216 Ų216141.6 Ų141.695%0.94768%0.679SS**  trans-79.3103.4177.7-79.4-89.9000106.5N4F2-N4 PolarHBondContact O-N 3.23Å
3L32.3Very low37.4Very low136 Ų136138.4 Ų138.471%0.71269%0.69SS**  trans-62.8107171.3-79.3157.9000107.1M1 F5M1-L3 PolarHBondContact O-N 3.19Å; L3-F5 HydrophobicContact CB-CD2 3.86Å; L3-F5 HydrophobicContact CB-CE2 3.71Å; L3-F5 HydrophobicContact CD1-CE2 4.21Å; L3-F5 PolarHBondContact O-N 2.79Å
4N31.4Very low37.5Very low133 Ų133134.4 Ų134.471%0.71170%0.702SS**  trans-76.580.8-179.8-147-12000107.3F2 R6F2-N4 PolarHBondContact O-N 3.23Å; N4-R6 PolarHBondContact O-N 3.07Å
5F38.8Very low37.5Very low117 Ų117129.7 Ų129.751%0.51369%0.685SS.*G310 helixtrans-6611.1177.5-88-83.4000113.7L3 C7 Y8 W31L3-F5 HydrophobicContact CB-CD2 3.86Å; L3-F5 HydrophobicContact CB-CE2 3.71Å; L3-F5 HydrophobicContact CD1-CE2 4.21Å; L3-F5 PolarHBondContact O-N 2.79Å; F5-C7 PolarHBondContact O-N 2.77Å; F5-C7 VanDerWaalsContact O-N 3.11Å; F5-Y8 PolarHBondContact O-N 3.49Å; F5-W31 HydrophobicContact CD2-CZ3 4.44Å; F5-W31 HydrophobicContact CE2-CH2 4.38Å; F5-W31 HydrophobicContact CE2-CZ3 4.04Å; F5-W31 HydrophobicContact CZ-CZ3 4.43Å
6R43.6Very low37.6Very low209 Ų209129.8 Ų129.879%0.78969%0.692SS**G310 helixtrans-65.9-16.1-170.1-142.1169.1-179.1158-2.7113.7N4N4-R6 PolarHBondContact O-N 3.07Å
7C39.5Very low37.9Very low124 Ų124136.2 Ų136.284%0.83870%0.704SS**G310 helixtrans-103.18.2-178.9-60.70000114.9F5 R9F5-C7 PolarHBondContact O-N 2.77Å; F5-C7 VanDerWaalsContact O-N 3.11Å; C7-R9 PolarHBondContact O-N 2.85Å; C7-R9 VanDerWaalsContact O-N 3.08Å
8Y38.4Very low38.2Very low108 Ų108133.4 Ų133.442%0.42469%0.691SS.*  trans-82.692.5178.1-155.8-102.9000111F5 P10F5-Y8 PolarHBondContact O-N 3.49Å; Y8-P10 HydrophobicContact CD1-CB 4.3Å; Y8-P10 HydrophobicContact CD1-CG 4.01Å; Y8-P10 HydrophobicContact CE1-CB 3.76Å; Y8-P10 HydrophobicContact CE1-CG 3.88Å; Y8-P10 VanDerWaalsContact O-CD 3.25Å; Y8-P10 WeakPolarHBondContact O-CD 3.4Å
9R41.9Very low38.8Very low164 Ų164134.4 Ų134.462%0.61969%0.689SS**  trans-102.491.6165.6-165.6-177.4-158.4-175.58.3108.4C7 H11C7-R9 PolarHBondContact O-N 2.85Å; C7-R9 VanDerWaalsContact O-N 3.08Å; R9-H11 PolarHBondContact O-N 2.8Å
10P43.8Very low39.2Very low40 Ų40131.6 Ų131.626%0.2668%0.68SS.*  trans-67.6111.917326.4-27.9000107.3Y8 C12Y8-P10 HydrophobicContact CD1-CB 4.3Å; Y8-P10 HydrophobicContact CD1-CG 4.01Å; Y8-P10 HydrophobicContact CE1-CB 3.76Å; Y8-P10 HydrophobicContact CE1-CG 3.88Å; Y8-P10 VanDerWaalsContact O-CD 3.25Å; Y8-P10 WeakPolarHBondContact O-CD 3.4Å; P10-C12 PolarHBondContact O-N 3.22Å
11H41Very low39.7Very low143 Ų143132.4 Ų132.466%0.66268%0.675SS**  trans-70.979.6166.8-124.581.6000106.6R9 A13 P81R9-H11 PolarHBondContact O-N 2.8Å; H11-A13 PolarHBondContact O-N 3.21Å; H11-P81 VanDerWaalsContact O-CG 3.24Å; H11-P81 WeakPolarHBondContact O-CG 3.23Å
12C36.9Very low40.7Very low80 Ų80124.4 Ų124.454%0.54164%0.639SS.*  trans-63.796.5-177-62.80000110P10 G14P10-C12 PolarHBondContact O-N 3.22Å; C12-G14 PolarHBondContact O-N 3.33Å
13A35.3Very low41.8Very low100 Ų100116.4 Ų116.483%0.82661%0.608SS**THydrogen-bonded Turntrans-64.1111.3163.800000108H11H11-A13 PolarHBondContact O-N 3.21Å
14G39.8Very low42.9Very low83 Ų83111.3 Ų111.386%0.85658%0.583SS**THydrogen-bonded Turntrans113.7-16.7166.900000117.4C12C12-G14 PolarHBondContact O-N 3.33Å
15S37.6Very low44.2Very low64 Ų64108.5 Ų108.545%0.44857%0.574SS.*SBendtrans-100.1110.1168.3-160.70000109.2R17 D18S15-R17 PolarHBondContact O-N 3.01Å; S15-D18 PolarHBondContact OG-OD2 3.46Å
16T38.2Very low45.4Very low131 Ų131106.7 Ų106.780%0.80458%0.575SS**THydrogen-bonded Turntrans-51.6101.3-179.149.80000111.5D18T16-D18 VanDerWaalsContact C-N 3.35Å; T16-D18 PolarHBondContact O-N 3.17Å; T16-D18 VanDerWaalsContact O-N 3.13Å
17R42.5Very low46.5Very low238 Ų238101.7 Ų101.790%0.89856%0.556SS**THydrogen-bonded Turntrans50.446.6157.4-155.5179.8-171.7175.73.6114.3S15 K19S15-R17 PolarHBondContact O-N 3.01Å; R17-K19 PolarHBondContact O-N 3.39Å; R17-K19 VanDerWaalsContact O-N 3.08Å
18D43.3Very low47.5Very low86 Ų8698.9 Ų98.946%0.4653%0.53SS..  trans-67.3110.8168.9-77.4-51.2000108.7S15 T16 T22S15-D18 PolarHBondContact OG-OD2 3.46Å; T16-D18 VanDerWaalsContact C-N 3.35Å; T16-D18 PolarHBondContact O-N 3.17Å; T16-D18 VanDerWaalsContact O-N 3.13Å; D18-T22 HydrophobicContact CB-CG2 4.47Å
19K49.3Very low48.9Very low153 Ų153104.4 Ų104.467%0.66555%0.55SS*.  trans-51.3146.8179.3-75.6178.5169.4850109.3R17 R21 T22R17-K19 PolarHBondContact O-N 3.39Å; R17-K19 VanDerWaalsContact O-N 3.08Å; K19-R21 PolarHBondContact O-N 3.19Å; K19-T22 WeakPolarHBondContact O-CB 3.34Å; K19-T22 PolarHBondContact O-N 2.85Å; K19-T22 PolarHBondContact O-OG1 3.33Å
20P48.1Very low50Low78 Ų78103.1 Ų103.151%0.50656%0.555SS.*Hα-helixtrans-47.3-31.8177.9-28.233000114.2T22 V23 S24 L41P20-T22 VanDerWaalsContact C-N 3.26Å; P20-T22 PolarHBondContact O-N 2.94Å; P20-V23 PolarHBondContact O-N 3.41Å; P20-S24 PolarHBondContact O-N 3.3Å; P20-L41 HydrophobicContact CB-CD1 4.18Å; P20-L41 HydrophobicContact CG-CD1 4.41Å
21R49.8Very low51.2Low148 Ų148107.6 Ų107.656%0.55857%0.566SS**Hα-helixtrans-55.1-34.6173.1-74.1-174.3175.7-109.1-5.9114K19 S24 S25 E39K19-R21 PolarHBondContact O-N 3.19Å; R21-S24 PolarHBondContact O-OG 3.26Å; R21-S25 VanDerWaalsContact O-CB 3.31Å; R21-S25 WeakPolarHBondContact O-CB 3.33Å; R21-S25 PolarHBondContact O-N 3.06Å; R21-S25 PolarHBondContact O-OG 3.16Å; R21-E39 IonicContact NH2-OE1 3.3Å; R21-E39 PolarHBondContact NH2-OE1 3.19Å
22T52.2Low52.4Low62 Ų62109.2 Ų109.238%0.3857%0.567SS.*Hα-helixtrans-72.5-42.9-179.1-48.90000111.1D18 K19 P20 S25 C26D18-T22 HydrophobicContact CB-CG2 4.47Å; K19-T22 WeakPolarHBondContact O-CB 3.34Å; K19-T22 PolarHBondContact O-N 2.85Å; K19-T22 PolarHBondContact O-OG1 3.33Å; P20-T22 VanDerWaalsContact C-N 3.26Å; P20-T22 PolarHBondContact O-N 2.94Å; T22-S25 PolarHBondContact O-N 3.38Å; T22-C26 PolarHBondContact O-N 3.36Å; T22-C26 PolarHBondContact O-SG 2.87Å
23V54Low53.7Low48 Ų48113.3 Ų113.329%0.29158%0.583SS.*Hα-helixtrans-64.7-50.2177.2177.50000109.6P20 S25 C26 W27P20-V23 PolarHBondContact O-N 3.41Å; V23-S25 PolarHBondContact O-N 2.9Å; V23-C26 WeakPolarHBondContact O-CB 3.38Å; V23-C26 PolarHBondContact O-N 2.79Å; V23-W27 PolarHBondContact O-N 2.78Å; V23-W27 VanDerWaalsContact O-N 3.11Å
24S56.1Low54.7Low28 Ų28112.3 Ų112.320%0.19658%0.575CS.*Hα-helixtrans-58.3-37.417877.60000112P20 R21 C26 W27 K28P20-S24 PolarHBondContact O-N 3.3Å; R21-S24 PolarHBondContact O-OG 3.26Å; S24-C26 PolarHBondContact O-N 3.3Å; S24-W27 PolarHBondContact O-N 3.41Å; S24-K28 VanDerWaalsContact O-CB 3.32Å; S24-K28 WeakPolarHBondContact O-CB 3.37Å; S24-K28 PolarHBondContact O-N 3.22Å
25S58.8Low55.2Low75 Ų75109.9 Ų109.952%0.52454%0.543SS..Hα-helixtrans-63.6-40.3175.9-63.60000112.9R21 T22 V23 K28 R29R21-S25 VanDerWaalsContact O-CB 3.31Å; R21-S25 WeakPolarHBondContact O-CB 3.33Å; R21-S25 PolarHBondContact O-N 3.06Å; R21-S25 PolarHBondContact O-OG 3.16Å; T22-S25 PolarHBondContact O-N 3.38Å; V23-S25 PolarHBondContact O-N 2.9Å; S25-K28 PolarHBondContact O-N 3.35Å; S25-R29 PolarHBondContact O-N 2.93Å
26C63.4Low56.1Low79 Ų79110.7 Ų110.753%0.53455%0.549SS..Hα-helixtrans-62.1-44.8175.7-68.30000111.2T22 V23 S24 R29T22-C26 PolarHBondContact O-N 3.36Å; T22-C26 PolarHBondContact O-SG 2.87Å; V23-C26 WeakPolarHBondContact O-CB 3.38Å; V23-C26 PolarHBondContact O-N 2.79Å; S24-C26 PolarHBondContact O-N 3.3Å; C26-R29 PolarHBondContact O-N 3.44Å
27W67Low57Low103 Ų103110.2 Ų110.239%0.3954%0.538SS..Hα-helixtrans-70.8-35.1178.8-73.195.9000112.9V23 S24 R29 L30 W31 V35V23-W27 PolarHBondContact O-N 2.78Å; V23-W27 VanDerWaalsContact O-N 3.11Å; S24-W27 PolarHBondContact O-N 3.41Å; W27-R29 PolarHBondContact O-N 2.73Å; W27-L30 PolarHBondContact O-N 3.12Å; W27-W31 HydrophobicContact CE3-CE3 4.44Å; W27-W31 HydrophobicContact CZ3-CE3 4.48Å; W27-W31 HydrophobicContact CZ3-CZ3 4.3Å; W27-W31 PolarHBondContact O-N 3.2Å; W27-V35 HydrophobicContact CB-CG1 4.17Å; W27-V35 HydrophobicContact CB-CG2 3.8Å
28K60.4Low57.5Low66 Ų66101.8 Ų101.829%0.28752%0.515SS..Hα-helixtrans-62-25.6177.1-155.8177.3-168.8-171.60112.6S24 S25 R32 V35 E37S24-K28 VanDerWaalsContact O-CB 3.32Å; S24-K28 WeakPolarHBondContact O-CB 3.37Å; S24-K28 PolarHBondContact O-N 3.22Å; S25-K28 PolarHBondContact O-N 3.35Å; K28-R32 HydrophobicContact CG-CG 4.38Å; K28-R32 VanDerWaalsContact O-CA 3.28Å; K28-R32 WeakPolarHBondContact O-CA 3.39Å; K28-R32 PolarHBondContact O-N 3.05Å; K28-V35 HydrophobicContact CB-CG1 4.39Å; K28-E37 IonicContact NZ-OE1 3.43Å; K28-E37 PolarHBondContact NZ-OE1 3.11Å
29R67.1Low58Low223 Ų223103.1 Ų103.184%0.84252%0.518SS*.Hα-helixtrans-71.8-30.7173.6-159.3170.9103175.63.9112.6S25 C26 W27S25-R29 PolarHBondContact O-N 2.93Å; C26-R29 PolarHBondContact O-N 3.44Å; W27-R29 PolarHBondContact O-N 2.73Å
30L65.5Low58.4Low137 Ų137103.1 Ų103.172%0.71753%0.525SS*.Hα-helixtrans-88.5-41.9178.8-80.3144.1000112W27W27-L30 PolarHBondContact O-N 3.12Å
31W69.5Low58.7Low134 Ų134104.9 Ų104.951%0.50853%0.53SS..  trans-135.575.5-177.6-72.3-22000112.1F5 W27 D33 A34 V35F5-W31 HydrophobicContact CD2-CZ3 4.44Å; F5-W31 HydrophobicContact CE2-CH2 4.38Å; F5-W31 HydrophobicContact CE2-CZ3 4.04Å; F5-W31 HydrophobicContact CZ-CZ3 4.43Å; W27-W31 HydrophobicContact CE3-CE3 4.44Å; W27-W31 HydrophobicContact CZ3-CE3 4.48Å; W27-W31 HydrophobicContact CZ3-CZ3 4.3Å; W27-W31 PolarHBondContact O-N 3.2Å; W31-D33 PolarHBondContact O-N 3.37Å; W31-A34 HydrophobicContact CB-CB 4.17Å; W31-A34 PolarHBondContact O-N 3.13Å; W31-V35 HydrophobicContact CB-CG2 4.18Å; W31-V35 WeakPolarHBondContact O-CG2 3.36Å; W31-V35 PolarHBondContact O-N 3.4Å
32R66Low59.3Low178 Ų17899.1 Ų99.167%0.67252%0.517SS*.THydrogen-bonded Turntrans-57.2-34.3-176-155.6-175.7-57.9-93.1-2.1113.8K28K28-R32 HydrophobicContact CG-CG 4.38Å; K28-R32 VanDerWaalsContact O-CA 3.28Å; K28-R32 WeakPolarHBondContact O-CA 3.39Å; K28-R32 PolarHBondContact O-N 3.05Å
33D65Low60.4Low165 Ų16598.7 Ų98.788%0.88252%0.519SS*.THydrogen-bonded Turntrans-89-22.5-173.9-57.8-24000113.6W31W31-D33 PolarHBondContact O-N 3.37Å
34A54.3Low61.5Low80 Ų80100.2 Ų100.266%0.66153%0.525SS*.THydrogen-bonded Turntrans-94.6-23.1-177.400000113.1W31W31-A34 HydrophobicContact CB-CB 4.17Å; W31-A34 PolarHBondContact O-N 3.13Å
35V51.1Low62.6Low31 Ų31103.8 Ų103.819%0.18854%0.542CS..  trans-99.8100-174.3-1780000108.9W27 K28 W31W27-V35 HydrophobicContact CB-CG1 4.17Å; W27-V35 HydrophobicContact CB-CG2 3.8Å; K28-V35 HydrophobicContact CB-CG1 4.39Å; W31-V35 HydrophobicContact CB-CG2 4.18Å; W31-V35 WeakPolarHBondContact O-CG2 3.36Å; W31-V35 PolarHBondContact O-N 3.4Å
36S57.3Low63.9Low81 Ų81106.2 Ų106.257%0.56655%0.545SS*.  trans-70.7154.3172.969.10000111C38S36-C38 VanDerWaalsContact C-N 3.35Å; S36-C38 PolarHBondContact O-N 2.97Å
37E57.1Low64.9Low122 Ų122108.2 Ų108.257%0.5755%0.546SS*.  trans-66.997.8166-63.4-176.3-178.500107.5K28 E39K28-E37 IonicContact NZ-OE1 3.43Å; K28-E37 PolarHBondContact NZ-OE1 3.11Å; E37-E39 HydrophobicContact CB-CG 4.12Å; E37-E39 PolarHBondContact O-N 2.88Å
38C51.8Low65.9Low61 Ų61103.6 Ų103.641%0.41253%0.529SS..  trans-71.686.1169.2-65.50000107.4S36 L41S36-C38 VanDerWaalsContact C-N 3.35Å; S36-C38 PolarHBondContact O-N 2.97Å; C38-L41 HydrophobicContact CB-CD2 4.22Å; C38-L41 HydrophobicContact CB-CG 4.42Å
39E55Low67.2Low114 Ų114104.6 Ų104.653%0.53354%0.536SS..  trans-74.4-33.1177.8-62.2-153.3110.700111.4R21 E37R21-E39 IonicContact NH2-OE1 3.3Å; R21-E39 PolarHBondContact NH2-OE1 3.19Å; E37-E39 HydrophobicContact CB-CG 4.12Å; E37-E39 PolarHBondContact O-N 2.88Å
40D56.2Low68.3Low152 Ų15295.2 Ų95.281%0.81351%0.509SS*.  trans-131.995.6179.8-63.1-43.6000109.3G42D40-G42 PolarHBondContact O-N 3.11Å
41L56Low69.4Low116 Ų11691.8 Ų91.861%0.60749%0.494SS*.  trans-74.5109.5152.8-64175.2000104.1P20 C38P20-L41 HydrophobicContact CB-CD1 4.18Å; P20-L41 HydrophobicContact CG-CD1 4.41Å; C38-L41 HydrophobicContact CB-CD2 4.22Å; C38-L41 HydrophobicContact CB-CG 4.42Å
42G61.3Low70.5Confident27 Ų2785.6 Ų85.628%0.27847%0.471SS..  trans-52167.3175.600000111.5D40 I44D40-G42 PolarHBondContact O-N 3.11Å; G42-I44 PolarHBondContact O-N 3.46Å
43A75Confident71.8Confident52 Ų5280.9 Ų80.943%0.4346%0.459SS..  trans-56.8138.2172.600000108.6D45 E46 E47A43-D45 PolarHBondContact O-N 3.17Å; A43-D45 VanDerWaalsContact O-N 3.09Å; A43-E46 HydrophobicContact CB-CG 4.15Å; A43-E46 PolarHBondContact N-OE2 3Å; A43-E46 WeakPolarHBondContact O-CB 3.29Å; A43-E46 PolarHBondContact O-N 2.72Å; A43-E47 PolarHBondContact O-N 2.79Å
44I76.9Confident73.1Confident81 Ų8177.7 Ų77.742%0.41544%0.441SS..Hα-helixtrans-53.5-37.8-177.6-61167.9000110.2G42 E46 E47 I48G42-I44 PolarHBondContact O-N 3.46Å; I44-E46 VanDerWaalsContact C-N 3.3Å; I44-E46 PolarHBondContact O-N 3.39Å; I44-E47 PolarHBondContact O-N 2.8Å; I44-I48 HydrophobicContact CG2-CD1 3.82Å; I44-I48 HydrophobicContact CG2-CG1 4.23Å; I44-I48 WeakPolarHBondContact O-CG1 3.2Å; I44-I48 PolarHBondContact O-N 3.43Å
45D80.7Confident74.9Confident102 Ų10274 Ų7455%0.54541%0.411SS..Hα-helixtrans-61.2-35.2177.9-57.6-39.7000112.8A43 M49A43-D45 PolarHBondContact O-N 3.17Å; A43-D45 VanDerWaalsContact O-N 3.09Å; D45-M49 WeakPolarHBondContact O-CB 3.35Å; D45-M49 PolarHBondContact O-N 2.91Å
46E84.7Confident76.8Confident127 Ų12777.7 Ų77.759%0.59342%0.424SS*.Hα-helixtrans-68.3-39.3176.5-68.2172.8169.200111.5A43 I44 G50A43-E46 HydrophobicContact CB-CG 4.15Å; A43-E46 PolarHBondContact N-OE2 3Å; A43-E46 WeakPolarHBondContact O-CB 3.29Å; A43-E46 PolarHBondContact O-N 2.72Å; I44-E46 VanDerWaalsContact C-N 3.3Å; I44-E46 PolarHBondContact O-N 3.39Å; E46-G50 PolarHBondContact O-N 3.29Å
47E84.4Confident78.5Confident120 Ų12081.6 Ų81.656%0.56143%0.433SS*.Hα-helixtrans-72.4-38.9178.8-67.5-68.1158.100112.2A43 I44 M49 G50 T51A43-E47 PolarHBondContact O-N 2.79Å; I44-E47 PolarHBondContact O-N 2.8Å; E47-M49 VanDerWaalsContact C-N 3.34Å; E47-G50 PolarHBondContact O-N 3.16Å; E47-T51 WeakPolarHBondContact O-CB 3.39Å; E47-T51 PolarHBondContact O-N 2.77Å; E47-T51 PolarHBondContact O-OG1 2.59Å
48I88.2Confident80.2Confident6 Ų682 Ų823%0.03144%0.439CS..Hα-helixtrans-58.6-50.5172.7-70173.6000109I44 G50 T51 V52 E68 I71 R72 I75I44-I48 HydrophobicContact CG2-CD1 3.82Å; I44-I48 HydrophobicContact CG2-CG1 4.23Å; I44-I48 WeakPolarHBondContact O-CG1 3.2Å; I44-I48 PolarHBondContact O-N 3.43Å; I48-G50 PolarHBondContact O-N 2.67Å; I48-T51 WeakPolarHBondContact O-CB 3.21Å; I48-T51 PolarHBondContact O-N 2.66Å; I48-V52 WeakPolarHBondContact O-CG2 3.2Å; I48-V52 PolarHBondContact O-N 2.66Å; I48-E68 HydrophobicContact CG2-CB 3.83Å; I48-E68 HydrophobicContact CG2-CG 4.07Å; I48-I71 HydrophobicContact CB-CG2 4.49Å; I48-I71 HydrophobicContact CG1-CG2 4.05Å; I48-I71 HydrophobicContact CG2-CB 4.2Å; I48-I71 HydrophobicContact CG2-CD1 4.43Å; I48-I71 HydrophobicContact CG2-CG2 4.25Å; I48-R72 HydrophobicContact CD1-CB 4.46Å; I48-I75 HydrophobicContact CD1-CD1 3.9Å; I48-I75 HydrophobicContact CG1-CD1 3.78Å
49M88.5Confident81.8Confident87 Ų8780.2 Ų80.243%0.42943%0.431SS..Hα-helixtrans-63-41.2179.1-166.7-170.8-44.800112.3D45 E47 T51 V52 N53D45-M49 WeakPolarHBondContact O-CB 3.35Å; D45-M49 PolarHBondContact O-N 2.91Å; E47-M49 VanDerWaalsContact C-N 3.34Å; M49-T51 VanDerWaalsContact C-N 3.29Å; M49-T51 PolarHBondContact O-N 3.45Å; M49-V52 PolarHBondContact O-N 3.12Å; M49-N53 VanDerWaalsContact O-CG 3.28Å; M49-N53 PolarHBondContact O-N 2.67Å; M49-N53 PolarHBondContact O-ND2 3.39Å
50G89.7Confident83.4Confident27 Ų2777 Ų7728%0.27843%0.428SS..Hα-helixtrans-58.1-42174.400000112.3E46 E47 I48 N53 I54E46-G50 PolarHBondContact O-N 3.29Å; E47-G50 PolarHBondContact O-N 3.16Å; I48-G50 PolarHBondContact O-N 2.67Å; G50-N53 PolarHBondContact O-N 2.86Å; G50-I54 WeakPolarHBondContact O-CD1 3.23Å; G50-I54 VanDerWaalsContact O-CG1 3.25Å; G50-I54 WeakPolarHBondContact O-CG1 3.46Å; G50-I54 PolarHBondContact O-N 3.33Å
51T89.7Confident85Confident64 Ų6479 Ų7939%0.39343%0.433SS..Hα-helixtrans-65.7-44.4178-570000111.9E47 I48 M49 N53 I54 A55 I71E47-T51 WeakPolarHBondContact O-CB 3.39Å; E47-T51 PolarHBondContact O-N 2.77Å; E47-T51 PolarHBondContact O-OG1 2.59Å; I48-T51 WeakPolarHBondContact O-CB 3.21Å; I48-T51 PolarHBondContact O-N 2.66Å; M49-T51 VanDerWaalsContact C-N 3.29Å; M49-T51 PolarHBondContact O-N 3.45Å; T51-N53 VanDerWaalsContact C-N 3.32Å; T51-N53 PolarHBondContact O-N 2.61Å; T51-I54 PolarHBondContact O-N 2.65Å; T51-A55 PolarHBondContact O-N 3.38Å; T51-I71 HydrophobicContact CG2-CD1 3.69Å; T51-I71 HydrophobicContact CG2-CG1 4.32Å
52V91.2Very high86.6Confident5 Ų575.8 Ų75.83%0.0343%0.428CS..Hα-helixtrans-57.8-46.2173.7173.90000110.9I48 M49 A55 K56 E68 I71I48-V52 WeakPolarHBondContact O-CG2 3.2Å; I48-V52 PolarHBondContact O-N 2.66Å; M49-V52 PolarHBondContact O-N 3.12Å; V52-A55 PolarHBondContact O-N 2.64Å; V52-K56 HydrophobicContact CG1-CD 3.96Å; V52-K56 WeakPolarHBondContact O-CG 3.41Å; V52-K56 PolarHBondContact O-N 2.7Å; V52-E68 HydrophobicContact CG2-CB 4.48Å; V52-E68 HydrophobicContact CG2-CG 3.92Å; V52-I71 HydrophobicContact CB-CD1 4.46Å; V52-I71 HydrophobicContact CG2-CD1 3.41Å; V52-I71 VanDerWaalsContact CG2-CD1 3.41Å
53N93Very high87.9Confident79 Ų7979.8 Ų79.842%0.42244%0.437SS..Hα-helixtrans-63.7-45.1-178.8-71.6-24.2000111.7M49 G50 T51 A55 K56 E57M49-N53 VanDerWaalsContact O-CG 3.28Å; M49-N53 PolarHBondContact O-N 2.67Å; M49-N53 PolarHBondContact O-ND2 3.39Å; G50-N53 PolarHBondContact O-N 2.86Å; T51-N53 VanDerWaalsContact C-N 3.32Å; T51-N53 PolarHBondContact O-N 2.61Å; N53-A55 VanDerWaalsContact C-N 3.29Å; N53-A55 PolarHBondContact O-N 2.73Å; N53-K56 PolarHBondContact O-N 3.33Å; N53-E57 WeakPolarHBondContact O-CG 3.07Å; N53-E57 PolarHBondContact O-N 3.28Å
54I92.7Very high88.7Confident97 Ų9780 Ų8050%0.49744%0.436SS..Hα-helixtrans-59.1-43.1176.8-70164000110.7G50 T51 E57 L58G50-I54 WeakPolarHBondContact O-CD1 3.23Å; G50-I54 VanDerWaalsContact O-CG1 3.25Å; G50-I54 WeakPolarHBondContact O-CG1 3.46Å; G50-I54 PolarHBondContact O-N 3.33Å; T51-I54 PolarHBondContact O-N 2.65Å; I54-E57 PolarHBondContact O-N 2.67Å; I54-L58 HydrophobicContact CG2-CD1 3.95Å; I54-L58 HydrophobicContact CG2-CG 4.31Å; I54-L58 WeakPolarHBondContact O-CB 3.3Å; I54-L58 VanDerWaalsContact O-CG 3.27Å; I54-L58 WeakPolarHBondContact O-CG 3.24Å; I54-L58 PolarHBondContact O-N 3.48Å
55A91.8Very high89.4Confident4 Ų482 Ų823%0.03345%0.447CS..Hα-helixtrans-66.4-39.4178.800000113.1T51 V52 N53 E57 L58 G59 F63 M66T51-A55 PolarHBondContact O-N 3.38Å; V52-A55 PolarHBondContact O-N 2.64Å; N53-A55 VanDerWaalsContact C-N 3.29Å; N53-A55 PolarHBondContact O-N 2.73Å; A55-E57 VanDerWaalsContact C-N 3.3Å; A55-E57 PolarHBondContact O-N 2.81Å; A55-L58 PolarHBondContact O-N 3.44Å; A55-G59 PolarHBondContact O-N 2.75Å; A55-F63 HydrophobicContact CB-CB 4.22Å; A55-F63 HydrophobicContact CB-CD1 4.14Å; A55-M66 HydrophobicContact CB-CE 2.93Å
56K92.4Very high89.9Confident107 Ų10778.8 Ų78.847%0.46543%0.43SS..Hα-helixtrans-63.3-37.8173.7-73.3176179172.40112.1V52 N53 G59V52-K56 HydrophobicContact CG1-CD 3.96Å; V52-K56 WeakPolarHBondContact O-CG 3.41Å; V52-K56 PolarHBondContact O-N 2.7Å; N53-K56 PolarHBondContact O-N 3.33Å; K56-G59 PolarHBondContact O-N 2.71Å
57E93.1Very high90.3Very high164 Ų16476.8 Ų76.877%0.76642%0.422SS*.Hα-helixtrans-68.4-41.3175-74.5178.9-179.900112.9N53 I54 A55 G59N53-E57 WeakPolarHBondContact O-CG 3.07Å; N53-E57 PolarHBondContact O-N 3.28Å; I54-E57 PolarHBondContact O-N 2.67Å; A55-E57 VanDerWaalsContact C-N 3.3Å; A55-E57 PolarHBondContact O-N 2.81Å; E57-G59 PolarHBondContact O-N 2.74Å
58L91.2Very high90.6Very high129 Ų12975 Ų7568%0.67541%0.414SS*.Hα-helixtrans-63.1-36.7174.8-72.4172.7000111.1I54 A55I54-L58 HydrophobicContact CG2-CD1 3.95Å; I54-L58 HydrophobicContact CG2-CG 4.31Å; I54-L58 WeakPolarHBondContact O-CB 3.3Å; I54-L58 VanDerWaalsContact O-CG 3.27Å; I54-L58 WeakPolarHBondContact O-CG 3.24Å; I54-L58 PolarHBondContact O-N 3.48Å; A55-L58 PolarHBondContact O-N 3.44Å
59G86.5Confident90.7Very high25 Ų2579 Ų7926%0.25844%0.436SS..  trans64.3178-179.400000113.3A55 K56 E57 S64A55-G59 PolarHBondContact O-N 2.75Å; K56-G59 PolarHBondContact O-N 2.71Å; E57-G59 PolarHBondContact O-N 2.74Å; G59-S64 WeakPolarHBondContact CA-OG 3.24Å
60G88.5Confident90.8Very high45 Ų4577.7 Ų77.746%0.46443%0.43SS..SBendtrans106.2160.6-177.500000112.6G62 F63 S64G60-G62 PolarHBondContact O-N 2.85Å; G60-F63 PolarHBondContact O-N 3.39Å; G60-F63 VanDerWaalsContact O-N 3.1Å; G60-S64 PolarHBondContact N-OG 2.79Å; G60-S64 PolarHBondContact O-N 3.18Å; G60-S64 VanDerWaalsContact O-N 3.07Å
61E89.8Confident90.7Very high195 Ų19577.3 Ų77.391%0.91142%0.422SS*.THydrogen-bonded Turntrans-57.4126.4-178.7-171.3173.2-173.500110.4F63E61-F63 VanDerWaalsContact C-N 3.3Å; E61-F63 PolarHBondContact O-N 3.28Å
62G88.7Confident90.6Very high49 Ų4978.1 Ų78.151%0.50542%0.417SS..THydrogen-bonded Turntrans86.1-29.6-176.100000115.3G60G60-G62 PolarHBondContact O-N 2.85Å
63F89.9Confident90.3Very high110 Ų11084 Ų8448%0.48245%0.445SS..THydrogen-bonded Turntrans-84.3-40.1175.9-69.6-64.5000112.6A55 G60 E61 D65 M66A55-F63 HydrophobicContact CB-CB 4.22Å; A55-F63 HydrophobicContact CB-CD1 4.14Å; G60-F63 PolarHBondContact O-N 3.39Å; G60-F63 VanDerWaalsContact O-N 3.1Å; E61-F63 VanDerWaalsContact C-N 3.3Å; E61-F63 PolarHBondContact O-N 3.28Å; F63-D65 PolarHBondContact O-N 3.44Å; F63-M66 HydrophobicContact CD1-CE 4.22Å; F63-M66 PolarHBondContact O-N 3.26Å
64S90.9Very high89.8Confident58 Ų5886.4 Ų86.441%0.40645%0.453SS..THydrogen-bonded Turntrans-66.9-27.9177.8-66.40000113.1G59 G60G59-S64 WeakPolarHBondContact CA-OG 3.24Å; G60-S64 PolarHBondContact N-OG 2.79Å; G60-S64 PolarHBondContact O-N 3.18Å; G60-S64 VanDerWaalsContact O-N 3.07Å
65D91.2Very high89.2Confident121 Ų12185.8 Ų85.865%0.64745%0.45SS*.THydrogen-bonded Turntrans-90.3-5.8-178.1-55.6-48000113F63 I67F63-D65 PolarHBondContact O-N 3.44Å; D65-I67 PolarHBondContact O-N 2.92Å
66M92.8Very high88.6Confident36 Ų3692.7 Ų92.718%0.17748%0.481CS..  trans-65.6131.9-175.9-175.1158.645.100111.5A55 F63 D70 I71A55-M66 HydrophobicContact CB-CE 2.93Å; F63-M66 HydrophobicContact CD1-CE 4.22Å; F63-M66 PolarHBondContact O-N 3.26Å; M66-D70 WeakPolarHBondContact CA-OD2 3.42Å; M66-D70 HydrophobicContact CG-CB 4.34Å; M66-I71 HydrophobicContact CG-CD1 4.35Å; M66-I71 HydrophobicContact CG-CG1 4.42Å; M66-I71 HydrophobicContact SD-CD1 4.17Å; M66-I71 HydrophobicContact SD-CG1 3.99Å
67I92.4Very high87.8Confident85 Ų8593.4 Ų93.444%0.43649%0.49SS..  trans-115.2165.1178.958.8170.2000111.3D65 D69 D70D65-I67 PolarHBondContact O-N 2.92Å; I67-D69 HydrophobicContact CD1-CB 4.05Å; I67-D69 HydrophobicContact CG1-CB 4.34Å; I67-D69 PolarHBondContact O-N 2.93Å; I67-D70 WeakPolarHBondContact CG1-OD2 3.36Å; I67-D70 PolarHBondContact N-OD2 3.12Å; I67-D70 PolarHBondContact O-N 3.14Å
68E90.2Very high86.4Confident81 Ų8190 Ų9038%0.37948%0.484SS..Hα-helixtrans-59.2-34.3-179.9-65.3177.6-162.100112.2I48 V52 D70 I71 R72I48-E68 HydrophobicContact CG2-CB 3.83Å; I48-E68 HydrophobicContact CG2-CG 4.07Å; V52-E68 HydrophobicContact CG2-CB 4.48Å; V52-E68 HydrophobicContact CG2-CG 3.92Å; E68-D70 PolarHBondContact O-N 3.16Å; E68-I71 PolarHBondContact O-N 3.19Å; E68-R72 WeakPolarHBondContact O-CB 3.36Å; E68-R72 PolarHBondContact O-N 2.76Å; E68-R72 IonicContact OE2-NH2 3.85Å
69D90.8Very high85.2Confident92 Ų9286.7 Ų86.749%0.49248%0.481SS..Hα-helixtrans-66.8-34.4-179.2-71.6-16.7000112.1I67 I71 R72 E73I67-D69 HydrophobicContact CD1-CB 4.05Å; I67-D69 HydrophobicContact CG1-CB 4.34Å; I67-D69 PolarHBondContact O-N 2.93Å; D69-I71 VanDerWaalsContact C-N 3.29Å; D69-I71 PolarHBondContact O-N 3.45Å; D69-R72 PolarHBondContact O-N 3.23Å; D69-R72 IonicContact OD1-CZ 2.68Å; D69-R72 IonicContact OD1-NH1 2.7Å; D69-R72 PolarHBondContact OD1-NH1 3.25Å; D69-E73 VanDerWaalsContact O-CB 3.31Å; D69-E73 WeakPolarHBondContact O-CB 3.47Å; D69-E73 PolarHBondContact O-N 2.93Å
70D89.9Confident84.4Confident58 Ų5894.3 Ų94.331%0.3151%0.51SS..Hα-helixtrans-61.2-41.3176.2-56.7-31.2000111M66 I67 E68 H74M66-D70 WeakPolarHBondContact CA-OD2 3.42Å; M66-D70 HydrophobicContact CG-CB 4.34Å; I67-D70 WeakPolarHBondContact CG1-OD2 3.36Å; I67-D70 PolarHBondContact N-OD2 3.12Å; I67-D70 PolarHBondContact O-N 3.14Å; E68-D70 PolarHBondContact O-N 3.16Å; D70-H74 PolarHBondContact O-CD2 3.34Å; D70-H74 PolarHBondContact O-N 3.39Å; D70-H74 VanDerWaalsContact O-N 3.11Å
71I87.9Confident83.2Confident20 Ų2094.6 Ų94.610%0.10350%0.503CS..Hα-helixtrans-74.8-38.9179.3-62.3157.4000110.2I48 T51 V52 M66 E68 D69 H74 I75I48-I71 HydrophobicContact CB-CG2 4.49Å; I48-I71 HydrophobicContact CG1-CG2 4.05Å; I48-I71 HydrophobicContact CG2-CB 4.2Å; I48-I71 HydrophobicContact CG2-CD1 4.43Å; I48-I71 HydrophobicContact CG2-CG2 4.25Å; T51-I71 HydrophobicContact CG2-CD1 3.69Å; T51-I71 HydrophobicContact CG2-CG1 4.32Å; V52-I71 HydrophobicContact CB-CD1 4.46Å; V52-I71 HydrophobicContact CG2-CD1 3.41Å; V52-I71 VanDerWaalsContact CG2-CD1 3.41Å; M66-I71 HydrophobicContact CG-CD1 4.35Å; M66-I71 HydrophobicContact CG-CG1 4.42Å; M66-I71 HydrophobicContact SD-CD1 4.17Å; M66-I71 HydrophobicContact SD-CG1 3.99Å; E68-I71 PolarHBondContact O-N 3.19Å; D69-I71 VanDerWaalsContact C-N 3.29Å; D69-I71 PolarHBondContact O-N 3.45Å; I71-H74 PolarHBondContact O-N 3.16Å; I71-I75 HydrophobicContact CG2-CD1 3.86Å; I71-I75 HydrophobicContact CG2-CG1 4.41Å; I71-I75 VanDerWaalsContact O-CG1 3.26Å; I71-I75 WeakPolarHBondContact O-CG1 3.26Å; I71-I75 PolarHBondContact O-N 3.1Å
72R87.1Confident82.1Confident80 Ų8090.8 Ų90.830%0.30248%0.484SS..Hα-helixtrans-63.6-45.4177.2-169.7177.8-62.2127.36.7110.9I48 E68 D69 H74 I75 E76I48-R72 HydrophobicContact CD1-CB 4.46Å; E68-R72 WeakPolarHBondContact O-CB 3.36Å; E68-R72 PolarHBondContact O-N 2.76Å; E68-R72 IonicContact OE2-NH2 3.85Å; D69-R72 PolarHBondContact O-N 3.23Å; D69-R72 IonicContact OD1-CZ 2.68Å; D69-R72 IonicContact OD1-NH1 2.7Å; D69-R72 PolarHBondContact OD1-NH1 3.25Å; R72-H74 VanDerWaalsContact C-N 3.31Å; R72-H74 PolarHBondContact O-N 2.91Å; R72-I75 PolarHBondContact O-N 3.11Å; R72-I75 VanDerWaalsContact O-N 3.16Å; R72-E76 WeakPolarHBondContact O-CG 3.5Å; R72-E76 PolarHBondContact O-N 3.43Å
73E86.4Confident81.5Confident130 Ų13091.4 Ų91.461%0.60748%0.478SS*.Hα-helixtrans-56.2-47173.2-177.4176.4-17600110.3D69 I75 E76 D77D69-E73 VanDerWaalsContact O-CB 3.31Å; D69-E73 WeakPolarHBondContact O-CB 3.47Å; D69-E73 PolarHBondContact O-N 2.93Å; E73-I75 VanDerWaalsContact C-N 3.34Å; E73-I75 PolarHBondContact O-N 3.28Å; E73-E76 PolarHBondContact O-N 3.31Å; E73-D77 WeakPolarHBondContact O-CB 2.85Å; E73-D77 PolarHBondContact O-N 3.37Å
74H81.5Confident80.8Confident128 Ų12891.6 Ų91.659%0.59348%0.484SS*.Hα-helixtrans-64.8-32.9177.2-78.8-41.7000114.7D70 I71 R72 C78D70-H74 PolarHBondContact O-CD2 3.34Å; D70-H74 PolarHBondContact O-N 3.39Å; D70-H74 VanDerWaalsContact O-N 3.11Å; I71-H74 PolarHBondContact O-N 3.16Å; R72-H74 VanDerWaalsContact C-N 3.31Å; R72-H74 PolarHBondContact O-N 2.91Å; H74-C78 PolarHBondContact O-N 2.8Å; H74-C78 PolarHBondContact O-SG 3.07Å
75I80.9Confident80.3Confident85 Ų8594.4 Ų94.444%0.43649%0.49SS..Hα-helixtrans-70.9-38.3175.1-69.7165000110.7I48 I71 R72 E73 C78I48-I75 HydrophobicContact CD1-CD1 3.9Å; I48-I75 HydrophobicContact CG1-CD1 3.78Å; I71-I75 HydrophobicContact CG2-CD1 3.86Å; I71-I75 HydrophobicContact CG2-CG1 4.41Å; I71-I75 VanDerWaalsContact O-CG1 3.26Å; I71-I75 WeakPolarHBondContact O-CG1 3.26Å; I71-I75 PolarHBondContact O-N 3.1Å; R72-I75 PolarHBondContact O-N 3.11Å; R72-I75 VanDerWaalsContact O-N 3.16Å; E73-I75 VanDerWaalsContact C-N 3.34Å; E73-I75 PolarHBondContact O-N 3.28Å; I75-C78 WeakPolarHBondContact O-CB 2.89Å
76E77.5Confident79.7Confident149 Ų14992.9 Ų92.970%0.69648%0.479SS*.Hα-helixtrans-77.2-33.4179.3-69.9177.5-171.500112.3R72 E73 C78R72-E76 WeakPolarHBondContact O-CG 3.5Å; R72-E76 PolarHBondContact O-N 3.43Å; E73-E76 PolarHBondContact O-N 3.31Å; E76-C78 PolarHBondContact O-N 3.32Å
77D76Confident78.9Confident121 Ų12194.8 Ų94.865%0.64749%0.49SS*.SBendtrans-80.1-1.4173.8-170.853.1000113E73 G79E73-D77 WeakPolarHBondContact O-CB 2.85Å; E73-D77 PolarHBondContact O-N 3.37Å; D77-G79 PolarHBondContact O-N 3.37Å
78C64.4Low78.2Confident94 Ų9496.5 Ų96.564%0.63550%0.496SS*.SBendtrans-60.198.3160-73.70000106.2H74 I75 E76H74-C78 PolarHBondContact O-N 2.8Å; H74-C78 PolarHBondContact O-SG 3.07Å; I75-C78 WeakPolarHBondContact O-CB 2.89Å; E76-C78 PolarHBondContact O-N 3.32Å
79G66.7Low77.6Confident59 Ų5997.8 Ų97.861%0.60850%0.502SS*.  trans-55.2-176.6-171.200000113.5D77D77-G79 PolarHBondContact O-N 3.37Å
80E69.2Low76.9Confident185 Ų18598.1 Ų98.186%0.86450%0.504SS*.SBendtrans-50.6134.6-175.5-73.2-160.5170.500111.7F82E80-F82 PolarHBondContact O-N 3.4Å
81P63.6Low76.2Confident51 Ų5198.7 Ų98.733%0.33151%0.511SS..PPolyproline II helixtrans-55.6139.9178.226.2-35.8000108.6H11 T83H11-P81 VanDerWaalsContact O-CG 3.24Å; H11-P81 WeakPolarHBondContact O-CG 3.23Å; P81-T83 PolarHBondContact O-N 2.95Å; P81-T83 VanDerWaalsContact O-N 3.14Å
82F66.6Low75.7Confident115 Ų115100.4 Ų100.450%0.50452%0.52SS..PPolyproline II helixtrans-47.2126.6175.2-73.7-76.1000110.3E80 E86E80-F82 PolarHBondContact O-N 3.4Å; F82-E86 HydrophobicContact CB-CB 4.39Å; F82-E86 HydrophobicContact CD1-CB 3.87Å
83T76.5Confident75.2Confident61 Ų61101.8 Ų101.837%0.37453%0.53SS..PPolyproline II helixtrans-59.4155.4169.559.50000109.5P81 E85 E86 L87P81-T83 PolarHBondContact O-N 2.95Å; P81-T83 VanDerWaalsContact O-N 3.14Å; T83-E85 PolarHBondContact O-N 3.44Å; T83-E86 PolarHBondContact N-OE2 3.24Å; T83-E86 PolarHBondContact O-N 3.23Å; T83-E86 VanDerWaalsContact O-N 3.16Å; T83-E86 VanDerWaalsContact OG1-CD 3.23Å; T83-E86 WeakPolarHBondContact OG1-CG 3.34Å; T83-E86 PolarHBondContact OG1-N 3.48Å; T83-E86 PolarHBondContact OG1-OE2 3.03Å; T83-L87 PolarHBondContact O-N 3.08Å
84N74.8Confident74.3Confident115 Ų115100.9 Ų100.962%0.61553%0.529SS*.Hα-helixtrans-59.2-33.417952.4-63.6000111.4E88N84-E88 WeakPolarHBondContact O-CB 3.33Å; N84-E88 PolarHBondContact O-N 3.01Å
85E80.3Confident73.8Confident116 Ų116102.5 Ų102.554%0.54253%0.53SS..Hα-helixtrans-64.4-48.1174.4-65.272.5-155.100111.7T83 L87 E88 E89T83-E85 PolarHBondContact O-N 3.44Å; E85-L87 VanDerWaalsContact C-N 3.32Å; E85-L87 PolarHBondContact O-N 3.49Å; E85-E88 PolarHBondContact O-N 3.23Å; E85-E89 VanDerWaalsContact O-CB 3.29Å; E85-E89 WeakPolarHBondContact O-CB 3.45Å; E85-E89 PolarHBondContact O-N 2.85Å
86E77.8Confident73Confident89 Ų89100.5 Ų100.542%0.41653%0.526SS..Hα-helixtrans-65.3-36.2177.7-70.5165.3138.700112F82 T83 E89 L90F82-E86 HydrophobicContact CB-CB 4.39Å; F82-E86 HydrophobicContact CD1-CB 3.87Å; T83-E86 PolarHBondContact N-OE2 3.24Å; T83-E86 PolarHBondContact O-N 3.23Å; T83-E86 VanDerWaalsContact O-N 3.16Å; T83-E86 VanDerWaalsContact OG1-CD 3.23Å; T83-E86 WeakPolarHBondContact OG1-CG 3.34Å; T83-E86 PolarHBondContact OG1-N 3.48Å; T83-E86 PolarHBondContact OG1-OE2 3.03Å; E86-E89 PolarHBondContact O-N 3.36Å; E86-L90 WeakPolarHBondContact O-CB 2.94Å; E86-L90 PolarHBondContact O-N 2.99Å
87L76.7Confident72Confident76 Ų7695.8 Ų95.840%0.39851%0.512SS..Hα-helixtrans-68.2-41.2176-174.366.6000111.4T83 E85 L90 C91T83-L87 PolarHBondContact O-N 3.08Å; E85-L87 VanDerWaalsContact C-N 3.32Å; E85-L87 PolarHBondContact O-N 3.49Å; L87-L90 PolarHBondContact O-N 2.97Å; L87-C91 WeakPolarHBondContact O-CB 3.42Å; L87-C91 PolarHBondContact O-N 3.38Å; L87-C91 PolarHBondContact O-SG 3.44Å
88E77Confident70.8Confident122 Ų12293.2 Ų93.257%0.5750%0.501SS*.Hα-helixtrans-66.7-40.4174.6-163.6-173.6165.700110.6N84 E85 C91 N92N84-E88 WeakPolarHBondContact O-CB 3.33Å; N84-E88 PolarHBondContact O-N 3.01Å; E85-E88 PolarHBondContact O-N 3.23Å; E88-C91 CarbonylContact O-C 3.57Å; E88-C91 PolarHBondContact O-N 3.31Å; E88-N92 WeakPolarHBondContact O-CB 2.94Å; E88-N92 PolarHBondContact O-N 2.89Å; E88-N92 PolarHBondContact O-ND2 2.87Å
89E78.9Confident70.2Confident108 Ų10892.4 Ų92.451%0.50549%0.493SS..Hα-helixtrans-61.4-42.9173.3-178.8170.7-16500111.1E85 E86 N92 H93E85-E89 VanDerWaalsContact O-CB 3.29Å; E85-E89 WeakPolarHBondContact O-CB 3.45Å; E85-E89 PolarHBondContact O-N 2.85Å; E86-E89 PolarHBondContact O-N 3.36Å; E89-N92 CarbonylContact O-C 3.53Å; E89-N92 PolarHBondContact O-N 2.57Å; E89-H93 WeakPolarHBondContact CG-CE1 3.34Å; E89-H93 WeakPolarHBondContact CG-ND1 3.19Å; E89-H93 VanDerWaalsContact O-CB 3.31Å; E89-H93 WeakPolarHBondContact O-CB 3.31Å; E89-H93 VanDerWaalsContact O-CG 3.3Å; E89-H93 PolarHBondContact O-N 3.39Å; E89-H93 PolarHBondContact O-ND1 2.67Å; E89-H93 IonicContact OE1-CE1 3.26Å; E89-H93 PolarHBondContact OE1-CE1 3.31Å; E89-H93 VanDerWaalsContact OE1-CE1 3.26Å
90L74.8Confident69.6Low99 Ų9991.3 Ų91.352%0.51848%0.475SS..Hα-helixtrans-64.7-42.6174.1-172.472.2000111.5E86 L87 N92 H93 L94E86-L90 WeakPolarHBondContact O-CB 2.94Å; E86-L90 PolarHBondContact O-N 2.99Å; L87-L90 PolarHBondContact O-N 2.97Å; L90-N92 VanDerWaalsContact C-N 3.3Å; L90-N92 PolarHBondContact O-N 3.33Å; L90-H93 CarbonylContact O-C 3.6Å; L90-H93 PolarHBondContact O-N 2.64Å; L90-L94 VanDerWaalsContact O-CB 3.29Å; L90-L94 WeakPolarHBondContact O-CB 3.36Å; L90-L94 PolarHBondContact O-N 2.88Å
91C76.4Confident68.4Low70 Ų7085.9 Ų85.947%0.47346%0.455SS..Hα-helixtrans-63.8-38174.4-74.70000111.6L87 E88 L94 R95L87-C91 WeakPolarHBondContact O-CB 3.42Å; L87-C91 PolarHBondContact O-N 3.38Å; L87-C91 PolarHBondContact O-SG 3.44Å; E88-C91 CarbonylContact O-C 3.57Å; E88-C91 PolarHBondContact O-N 3.31Å; C91-L94 PolarHBondContact O-N 2.89Å; C91-R95 WeakPolarHBondContact O-CB 3.24Å; C91-R95 PolarHBondContact O-N 2.62Å
92N77.2Confident67.6Low55 Ų5588.9 Ų88.929%0.29447%0.467SS..Hα-helixtrans-71.6-37.4176.4-77.9-32.4000111.1E88 E89 L90 R95 A96E88-N92 WeakPolarHBondContact O-CB 2.94Å; E88-N92 PolarHBondContact O-N 2.89Å; E88-N92 PolarHBondContact O-ND2 2.87Å; E89-N92 CarbonylContact O-C 3.53Å; E89-N92 PolarHBondContact O-N 2.57Å; L90-N92 VanDerWaalsContact C-N 3.3Å; L90-N92 PolarHBondContact O-N 3.33Å; N92-R95 PolarHBondContact OD1-NH2 2.82Å; N92-A96 WeakPolarHBondContact O-CA 3.31Å; N92-A96 WeakPolarHBondContact O-CB 3.42Å; N92-A96 PolarHBondContact O-N 2.87Å
93H75.3Confident66.7Low109 Ų10991.4 Ų91.451%0.50547%0.474SS..Hα-helixtrans-68.4-37.9171.7-78.3130.6000111.3E89 L90 A96 A97E89-H93 WeakPolarHBondContact CG-CE1 3.34Å; E89-H93 WeakPolarHBondContact CG-ND1 3.19Å; E89-H93 VanDerWaalsContact O-CB 3.31Å; E89-H93 WeakPolarHBondContact O-CB 3.31Å; E89-H93 VanDerWaalsContact O-CG 3.3Å; E89-H93 PolarHBondContact O-N 3.39Å; E89-H93 PolarHBondContact O-ND1 2.67Å; E89-H93 IonicContact OE1-CE1 3.26Å; E89-H93 PolarHBondContact OE1-CE1 3.31Å; E89-H93 VanDerWaalsContact OE1-CE1 3.26Å; L90-H93 CarbonylContact O-C 3.6Å; L90-H93 PolarHBondContact O-N 2.64Å; H93-A96 CarbonylContact O-C 3.55Å; H93-A97 WeakPolarHBondContact O-CA 3.35Å; H93-A97 WeakPolarHBondContact O-CB 3.48Å; H93-A97 PolarHBondContact O-N 3.18Å
94L68.9Low65Low111 Ų11193.2 Ų93.258%0.58148%0.476SS*.Hα-helixtrans-71.4-40175.4-176.462.9000110.9L90 C91 A97 T98L90-L94 VanDerWaalsContact O-CB 3.29Å; L90-L94 WeakPolarHBondContact O-CB 3.36Å; L90-L94 PolarHBondContact O-N 2.88Å; C91-L94 PolarHBondContact O-N 2.89Å; L94-A97 CarbonylContact O-C 3.46Å; L94-A97 PolarHBondContact O-N 3.08Å; L94-T98 WeakPolarHBondContact O-CA 3.43Å; L94-T98 WeakPolarHBondContact O-CB 3.35Å; L94-T98 PolarHBondContact O-N 3.46Å; L94-T98 PolarHBondContact O-OG1 2.93Å
95R70.2Confident63.5Low162 Ų16293.6 Ų93.661%0.61148%0.477SS*.Hα-helixtrans-68.8-40.2173.1178.4173.162.6150.5-3110.7C91 N92 A97 T98 T99C91-R95 WeakPolarHBondContact O-CB 3.24Å; C91-R95 PolarHBondContact O-N 2.62Å; N92-R95 PolarHBondContact OD1-NH2 2.82Å; R95-A97 VanDerWaalsContact C-N 3.29Å; R95-T98 PolarHBondContact O-N 2.89Å; R95-T99 HydrophobicContact CG-CG2 4.3Å; R95-T99 WeakPolarHBondContact O-CA 3.36Å; R95-T99 VanDerWaalsContact O-CB 3.24Å; R95-T99 WeakPolarHBondContact O-CB 3.43Å; R95-T99 WeakPolarHBondContact O-CG2 3.41Å; R95-T99 PolarHBondContact O-N 2.66Å; R95-T99 PolarHBondContact O-OG1 3.42Å
96A63.7Low62Low43 Ų4393.5 Ų93.536%0.35549%0.485SS..Hα-helixtrans-67.3-34.8173.200000109.7N92 H93 T99 T100N92-A96 WeakPolarHBondContact O-CA 3.31Å; N92-A96 WeakPolarHBondContact O-CB 3.42Å; N92-A96 PolarHBondContact O-N 2.87Å; H93-A96 CarbonylContact O-C 3.55Å; A96-T99 VanDerWaalsContact CA-OG1 3.23Å; A96-T99 WeakPolarHBondContact CA-OG1 2.86Å; A96-T99 PolarHBondContact O-OG1 3.27Å; A96-T99 VanDerWaalsContact O-OG1 3.12Å; A96-T100 WeakPolarHBondContact O-CA 3.23Å; A96-T100 WeakPolarHBondContact O-CB 3.45Å; A96-T100 PolarHBondContact O-N 2.68Å; A96-T100 PolarHBondContact O-OG1 3.1Å
97A57.6Low60Low50 Ų5091 Ų9141%0.41348%0.482SS..Hα-helixtrans-79.6-25.5176.800000111.8H93 L94 R95 T100 T101H93-A97 WeakPolarHBondContact O-CA 3.35Å; H93-A97 WeakPolarHBondContact O-CB 3.48Å; H93-A97 PolarHBondContact O-N 3.18Å; L94-A97 CarbonylContact O-C 3.46Å; L94-A97 PolarHBondContact O-N 3.08Å; R95-A97 VanDerWaalsContact C-N 3.29Å; A97-T100 CarbonylContact O-C 3.36Å; A97-T100 VanDerWaalsContact O-CA 3.26Å; A97-T100 WeakPolarHBondContact O-CA 3.34Å; A97-T101 PolarHBondContact O-N 2.88Å; A97-T101 PolarHBondContact O-OG1 3.04Å
98T50.3Low58.4Low67 Ų6789.5 Ų89.541%0.41148%0.481SS..Hα-helixtrans-86.3-35.4174.3-55.90000110.8L94 R95 T101 L102L94-T98 WeakPolarHBondContact O-CA 3.43Å; L94-T98 WeakPolarHBondContact O-CB 3.35Å; L94-T98 PolarHBondContact O-N 3.46Å; L94-T98 PolarHBondContact O-OG1 2.93Å; R95-T98 PolarHBondContact O-N 2.89Å; T98-T101 WeakPolarHBondContact CA-OG1 3.22Å; T98-T101 CarbonylContact O-C 3.51Å; T98-T101 PolarHBondContact O-N 2.96Å; T98-L102 WeakPolarHBondContact O-CA 3.21Å; T98-L102 WeakPolarHBondContact O-CB 3.33Å; T98-L102 PolarHBondContact O-N 3.19Å
99T52.1Low56.9Low77 Ų7790.3 Ų90.347%0.47249%0.485SS..Hα-helixtrans-68.7-55167.851.80000107.2R95 A96 T101 L102 W103R95-T99 HydrophobicContact CG-CG2 4.3Å; R95-T99 WeakPolarHBondContact O-CA 3.36Å; R95-T99 VanDerWaalsContact O-CB 3.24Å; R95-T99 WeakPolarHBondContact O-CB 3.43Å; R95-T99 WeakPolarHBondContact O-CG2 3.41Å; R95-T99 PolarHBondContact O-N 2.66Å; R95-T99 PolarHBondContact O-OG1 3.42Å; A96-T99 VanDerWaalsContact CA-OG1 3.23Å; A96-T99 WeakPolarHBondContact CA-OG1 2.86Å; A96-T99 PolarHBondContact O-OG1 3.27Å; A96-T99 VanDerWaalsContact O-OG1 3.12Å; T99-T101 PolarHBondContact O-N 3.35Å; T99-L102 CarbonylContact O-C 3.17Å; T99-L102 VanDerWaalsContact O-CA 3.3Å; T99-L102 WeakPolarHBondContact O-CA 3.22Å; T99-L102 WeakPolarHBondContact O-CB 3.46Å; T99-L102 PolarHBondContact O-N 2.92Å; T99-W103 PolarHBondContact O-N 3.25Å; T99-W103 PolarHBondContact O-NE1 3.16Å
100T52.9Low55.7Low37 Ų3788.2 Ų88.223%0.22748%0.479CS..Hα-helixtrans7.1-80.5132.1-6.30000118.2A96 A97 W103 K104A96-T100 WeakPolarHBondContact O-CA 3.23Å; A96-T100 WeakPolarHBondContact O-CB 3.45Å; A96-T100 PolarHBondContact O-N 2.68Å; A96-T100 PolarHBondContact O-OG1 3.1Å; A97-T100 CarbonylContact O-C 3.36Å; A97-T100 VanDerWaalsContact O-CA 3.26Å; A97-T100 WeakPolarHBondContact O-CA 3.34Å; T100-W103 HydrophobicContact CG2-CZ2 3.9Å; T100-W103 PolarHBondContact O-NE1 3.14Å; T100-W103 WeakPolarHBondContact OG1-CZ2 2.85Å; T100-W103 PolarHBondContact OG1-NE1 3.38Å; T100-K104 HydrophobicContact CG2-CD 3.6Å; T100-K104 HydrophobicContact CG2-CG 3.97Å; T100-K104 WeakPolarHBondContact O-CB 3.18Å; T100-K104 WeakPolarHBondContact O-CG 3.41Å; T100-K104 PolarHBondContact O-N 3.01Å
101T45.5Very low54.7Low70 Ų7085.4 Ų85.443%0.42947%0.465SS..Hα-helixtrans-79.5-25.2175.2170000110.7A97 T98 T99 K104 I105A97-T101 PolarHBondContact O-N 2.88Å; A97-T101 PolarHBondContact O-OG1 3.04Å; T98-T101 WeakPolarHBondContact CA-OG1 3.22Å; T98-T101 CarbonylContact O-C 3.51Å; T98-T101 PolarHBondContact O-N 2.96Å; T99-T101 PolarHBondContact O-N 3.35Å; T101-K104 CarbonylContact O-C 3.46Å; T101-K104 PolarHBondContact O-N 3.49Å; T101-I105 HydrophobicContact CG2-CD1 4.05Å; T101-I105 HydrophobicContact CG2-CG1 4.17Å; T101-I105 VanDerWaalsContact O-CA 3.23Å; T101-I105 WeakPolarHBondContact O-CA 3.19Å; T101-I105 WeakPolarHBondContact O-CB 3.46Å; T101-I105 WeakPolarHBondContact O-CD1 3.3Å; T101-I105 WeakPolarHBondContact O-CG1 3.13Å; T101-I105 PolarHBondContact O-N 3.45Å
102L46.4Very low54.2Low114 Ų11484.2 Ų84.260%0.59746%0.458SS*.Hα-helixtrans-70.4-48.8177-128.397.3000111.2T98 T99 T106T98-L102 WeakPolarHBondContact O-CA 3.21Å; T98-L102 WeakPolarHBondContact O-CB 3.33Å; T98-L102 PolarHBondContact O-N 3.19Å; T99-L102 CarbonylContact O-C 3.17Å; T99-L102 VanDerWaalsContact O-CA 3.3Å; T99-L102 WeakPolarHBondContact O-CA 3.22Å; T99-L102 WeakPolarHBondContact O-CB 3.46Å; T99-L102 PolarHBondContact O-N 2.92Å; L102-T106 VanDerWaalsContact O-CB 3.22Å; L102-T106 WeakPolarHBondContact O-CB 3.38Å; L102-T106 PolarHBondContact O-N 2.9Å; L102-T106 PolarHBondContact O-OG1 3.03Å
103W48.2Very low53.9Low169 Ų16987.4 Ų87.464%0.6447%0.474SS*.Hα-helixtrans-72.7-21171.470.4-25.9000113.6T99 T100 G107T99-W103 PolarHBondContact O-N 3.25Å; T99-W103 PolarHBondContact O-NE1 3.16Å; T100-W103 HydrophobicContact CG2-CZ2 3.9Å; T100-W103 PolarHBondContact O-NE1 3.14Å; T100-W103 WeakPolarHBondContact OG1-CZ2 2.85Å; T100-W103 PolarHBondContact OG1-NE1 3.38Å; W103-G107 VanDerWaalsContact O-CA 3.23Å; W103-G107 WeakPolarHBondContact O-CA 3.49Å; W103-G107 PolarHBondContact O-N 3.32Å
104K39.3Very low53.5Low98 Ų9890.3 Ų90.343%0.42648%0.481SS..Hα-helixtrans-92.8-20169.7-69.7-174.4178.7177.50115.5T100 T101 T106 G107 Q109T100-K104 HydrophobicContact CG2-CD 3.6Å; T100-K104 HydrophobicContact CG2-CG 3.97Å; T100-K104 WeakPolarHBondContact O-CB 3.18Å; T100-K104 WeakPolarHBondContact O-CG 3.41Å; T100-K104 PolarHBondContact O-N 3.01Å; T101-K104 CarbonylContact O-C 3.46Å; T101-K104 PolarHBondContact O-N 3.49Å; K104-T106 VanDerWaalsContact C-N 3.33Å; K104-G107 WeakPolarHBondContact CA-O 3.29Å; K104-G107 CarbonylContact O-C 3.43Å; K104-G107 PolarHBondContact O-N 3.06Å; K104-G107 VanDerWaalsContact O-O 3.05Å; K104-Q109 PolarHBondContact O-N 2.89Å; K104-Q109 VanDerWaalsContact O-N 3.11Å
105I44.9Very low54.1Low124 Ų12485.8 Ų85.864%0.63646%0.46SS*.Hα-helixtrans-75.1-34.6165.9-70.2161.9000107.3T101 G107T101-I105 HydrophobicContact CG2-CD1 4.05Å; T101-I105 HydrophobicContact CG2-CG1 4.17Å; T101-I105 VanDerWaalsContact O-CA 3.23Å; T101-I105 WeakPolarHBondContact O-CA 3.19Å; T101-I105 WeakPolarHBondContact O-CB 3.46Å; T101-I105 WeakPolarHBondContact O-CD1 3.3Å; T101-I105 WeakPolarHBondContact O-CG1 3.13Å; T101-I105 PolarHBondContact O-N 3.45Å; I105-G107 VanDerWaalsContact C-N 3.33Å
106T48.1Very low54.5Low114 Ų11480.3 Ų80.370%0.69944%0.442SS*.THydrogen-bonded Turntrans-80.7-15.7169.1-44.70000112.3L102 K104L102-T106 VanDerWaalsContact O-CB 3.22Å; L102-T106 WeakPolarHBondContact O-CB 3.38Å; L102-T106 PolarHBondContact O-N 2.9Å; L102-T106 PolarHBondContact O-OG1 3.03Å; K104-T106 VanDerWaalsContact C-N 3.33Å
107G35.9Very low55.4Low35 Ų3585 Ų8536%0.36146%0.457SS..THydrogen-bonded Turntrans-136.986.5-172.900000112.8W103 K104 I105 Q109W103-G107 VanDerWaalsContact O-CA 3.23Å; W103-G107 WeakPolarHBondContact O-CA 3.49Å; W103-G107 PolarHBondContact O-N 3.32Å; K104-G107 WeakPolarHBondContact CA-O 3.29Å; K104-G107 CarbonylContact O-C 3.43Å; K104-G107 PolarHBondContact O-N 3.06Å; K104-G107 VanDerWaalsContact O-O 3.05Å; I105-G107 VanDerWaalsContact C-N 3.33Å; G107-Q109 PolarHBondContact O-N 2.88Å
108A42.7Very low56.8Low46 Ų4688.9 Ų88.938%0.3846%0.464SS..THydrogen-bonded Turntrans61.727153.900000118.8T110 V167 L171A108-T110 PolarHBondContact O-N 3.09Å; A108-T110 VanDerWaalsContact O-N 3.11Å; A108-V167 HydrophobicContact CB-CG1 4.02Å; A108-L171 HydrophobicContact CB-CD2 3.82Å
109Q46.3Very low58.4Low138 Ų13886.8 Ų86.865%0.64545%0.451SS*.  trans-79.287.5147.8-151.174.854.200106.4K104 G107 L111K104-Q109 PolarHBondContact O-N 2.89Å; K104-Q109 VanDerWaalsContact O-N 3.11Å; G107-Q109 PolarHBondContact O-N 2.88Å; Q109-L111 PolarHBondContact O-N 3.24Å
110T53.5Low60.1Low64 Ų6485.6 Ų85.639%0.39345%0.449SS..  trans-32.4117.1156.642.30000106.3A108 S112A108-T110 PolarHBondContact O-N 3.09Å; A108-T110 VanDerWaalsContact O-N 3.11Å; T110-S112 VanDerWaalsContact C-N 3.31Å; T110-S112 WeakPolarHBondContact O-CA 3.26Å; T110-S112 PolarHBondContact O-N 3.3Å
111L53.2Low62Low40 Ų4086 Ų8621%0.20945%0.453CS..  trans-38.1112.2162.2-89.7165.2000104Q109 D113 A115 L116 L119 L160 L161 A164Q109-L111 PolarHBondContact O-N 3.24Å; L111-D113 PolarHBondContact O-N 3.11Å; L111-A115 HydrophobicContact CB-CB 4.47Å; L111-A115 HydrophobicContact CD2-CB 4Å; L111-L116 HydrophobicContact CB-CD1 4.39Å; L111-L116 HydrophobicContact CB-CD2 3.68Å; L111-L116 HydrophobicContact CB-CG 3.64Å; L111-L116 HydrophobicContact CD1-CD2 3.67Å; L111-L116 HydrophobicContact CG-CD2 4.34Å; L111-L116 WeakPolarHBondContact O-CD1 3.15Å; L111-L116 WeakPolarHBondContact O-CG 3.4Å; L111-L119 HydrophobicContact CD1-CD1 3.96Å; L111-L119 HydrophobicContact CD2-CD1 4.4Å; L111-L160 HydrophobicContact CD1-CG 4.43Å; L111-L161 HydrophobicContact CD1-CD2 4.04Å; L111-A164 HydrophobicContact CD1-CB 3.66Å; L111-A164 HydrophobicContact CG-CB 4.22Å
112S66.2Low64.1Low46 Ų4685.5 Ų85.532%0.32245%0.45SS..  trans-46.9139.7-172.8470000107.7T110 W114 A115 L116T110-S112 VanDerWaalsContact C-N 3.31Å; T110-S112 WeakPolarHBondContact O-CA 3.26Å; T110-S112 PolarHBondContact O-N 3.3Å; S112-W114 CarbonylContact O-C 3.56Å; S112-W114 PolarHBondContact O-N 2.93Å; S112-W114 PolarHBondContact OG-NE1 3.13Å; S112-A115 WeakPolarHBondContact O-CA 3.47Å; S112-A115 WeakPolarHBondContact O-CB 3.47Å; S112-A115 PolarHBondContact O-N 3.02Å; S112-A115 WeakPolarHBondContact OG-CB 3.33Å; S112-L116 PolarHBondContact O-N 2.91Å; S112-L116 VanDerWaalsContact O-N 3.16Å
113D70.6Confident66.3Low121 Ų12182.2 Ų82.265%0.64743%0.431SS*.Hα-helixtrans-47.4-34.7-173.8-70.7-17.9000112.4L111 L116 Q117L111-D113 PolarHBondContact O-N 3.11Å; D113-L116 PolarHBondContact O-N 3.29Å; D113-Q117 WeakPolarHBondContact O-CB 3.39Å; D113-Q117 VanDerWaalsContact O-CG 3.24Å; D113-Q117 WeakPolarHBondContact O-CG 3.42Å; D113-Q117 PolarHBondContact O-N 2.73Å
114W68Low68.5Low170 Ų17083 Ų8364%0.64443%0.434SS*.Hα-helixtrans-59.7-44.6172.985.8-101.6000113.4S112 Q117 K118S112-W114 CarbonylContact O-C 3.56Å; S112-W114 PolarHBondContact O-N 2.93Å; S112-W114 PolarHBondContact OG-NE1 3.13Å; W114-Q117 WeakPolarHBondContact O-CB 3.41Å; W114-Q117 PolarHBondContact O-N 2.87Å; W114-K118 HydrophobicContact CE3-CG 3.73Å; W114-K118 HydrophobicContact CZ3-CG 3.91Å; W114-K118 VanDerWaalsContact O-CG 3.3Å; W114-K118 WeakPolarHBondContact O-CG 3.41Å; W114-K118 PolarHBondContact O-N 3.31Å
115A79.8Confident71.3Confident16 Ų1684.3 Ų84.313%0.13244%0.441CS..Hα-helixtrans-66.2-40.8177.100000112L111 S112 Q117 K118 L119L111-A115 HydrophobicContact CB-CB 4.47Å; L111-A115 HydrophobicContact CD2-CB 4Å; S112-A115 WeakPolarHBondContact O-CA 3.47Å; S112-A115 WeakPolarHBondContact O-CB 3.47Å; S112-A115 PolarHBondContact O-N 3.02Å; S112-A115 WeakPolarHBondContact OG-CB 3.33Å; A115-Q117 VanDerWaalsContact C-N 3.34Å; A115-K118 PolarHBondContact O-N 3.04Å; A115-L119 WeakPolarHBondContact O-CB 3.48Å; A115-L119 WeakPolarHBondContact O-CG 3.25Å; A115-L119 PolarHBondContact O-N 2.87Å
116L79.5Confident73.7Confident48 Ų4879 Ų7925%0.25142%0.415SS..Hα-helixtrans-60.8-44.5172.5-72.9174.6000111.2L111 S112 D113 L119 A120 L161L111-L116 HydrophobicContact CB-CD1 4.39Å; L111-L116 HydrophobicContact CB-CD2 3.68Å; L111-L116 HydrophobicContact CB-CG 3.64Å; L111-L116 HydrophobicContact CD1-CD2 3.67Å; L111-L116 HydrophobicContact CG-CD2 4.34Å; L111-L116 WeakPolarHBondContact O-CD1 3.15Å; L111-L116 WeakPolarHBondContact O-CG 3.4Å; S112-L116 PolarHBondContact O-N 2.91Å; S112-L116 VanDerWaalsContact O-N 3.16Å; D113-L116 PolarHBondContact O-N 3.29Å; L116-L119 PolarHBondContact O-N 3.45Å; L116-A120 WeakPolarHBondContact O-CB 3.45Å; L116-A120 PolarHBondContact O-N 3.44Å; L116-L161 HydrophobicContact CD2-CD2 3.46Å; L116-L161 VanDerWaalsContact CD2-CD2 3.46Å
117Q82.4Confident76Confident140 Ų14077.9 Ų77.965%0.65440%0.402SS*.Hα-helixtrans-62.3-42.7176-74.4176.6600112D113 W114 A115 A120 S121D113-Q117 WeakPolarHBondContact O-CB 3.39Å; D113-Q117 VanDerWaalsContact O-CG 3.24Å; D113-Q117 WeakPolarHBondContact O-CG 3.42Å; D113-Q117 PolarHBondContact O-N 2.73Å; W114-Q117 WeakPolarHBondContact O-CB 3.41Å; W114-Q117 PolarHBondContact O-N 2.87Å; A115-Q117 VanDerWaalsContact C-N 3.34Å; Q117-A120 PolarHBondContact O-N 3.04Å; Q117-S121 WeakPolarHBondContact O-CB 3.49Å; Q117-S121 PolarHBondContact O-N 3.37Å
118K86.4Confident78.9Confident132 Ų13280 Ų8057%0.57441%0.407SS*.Hα-helixtrans-64.5-44.6176.5-68.4-56.1-179.5-177.50111.6W114 A115 S121 T122W114-K118 HydrophobicContact CE3-CG 3.73Å; W114-K118 HydrophobicContact CZ3-CG 3.91Å; W114-K118 VanDerWaalsContact O-CG 3.3Å; W114-K118 WeakPolarHBondContact O-CG 3.41Å; W114-K118 PolarHBondContact O-N 3.31Å; A115-K118 PolarHBondContact O-N 3.04Å; K118-S121 WeakPolarHBondContact O-CB 3.49Å; K118-S121 PolarHBondContact O-N 3.18Å; K118-T122 PolarHBondContact O-N 2.85Å; K118-T122 PolarHBondContact O-OG1 3.28Å; K118-T122 VanDerWaalsContact O-OG1 3.09Å
119L85.7Confident81.5Confident24 Ų2481.9 Ų81.913%0.12641%0.411CS..Hα-helixtrans-60.8-48175.3-74.6171000111.3L111 A115 L116 S121 T122 F123 L157 L161L111-L119 HydrophobicContact CD1-CD1 3.96Å; L111-L119 HydrophobicContact CD2-CD1 4.4Å; A115-L119 WeakPolarHBondContact O-CB 3.48Å; A115-L119 WeakPolarHBondContact O-CG 3.25Å; A115-L119 PolarHBondContact O-N 2.87Å; L116-L119 PolarHBondContact O-N 3.45Å; L119-S121 VanDerWaalsContact C-N 3.27Å; L119-S121 PolarHBondContact O-N 3.39Å; L119-T122 WeakPolarHBondContact O-CA 3.46Å; L119-T122 WeakPolarHBondContact O-CB 3.33Å; L119-T122 PolarHBondContact O-N 2.97Å; L119-F123 WeakPolarHBondContact O-CD2 3.39Å; L119-F123 PolarHBondContact O-N 3.33Å; L119-L157 HydrophobicContact CD2-CB 4.46Å; L119-L157 HydrophobicContact CD2-CD1 4.37Å; L119-L157 HydrophobicContact CD2-CD2 4.18Å; L119-L161 HydrophobicContact CB-CD1 4.27Å; L119-L161 HydrophobicContact CB-CD2 4.06Å; L119-L161 HydrophobicContact CB-CG 4.44Å; L119-L161 HydrophobicContact CD1-CD2 3.6Å; L119-L161 HydrophobicContact CD1-CG 4.04Å; L119-L161 HydrophobicContact CG-CD2 4.48Å
120A86.7Confident83.9Confident52 Ų5277 Ų7743%0.4339%0.388SS..Hα-helixtrans-58.4-39.6176.300000112.3L116 Q117 F123 R124L116-A120 WeakPolarHBondContact O-CB 3.45Å; L116-A120 PolarHBondContact O-N 3.44Å; Q117-A120 PolarHBondContact O-N 3.04Å; A120-F123 PolarHBondContact O-N 3.44Å; A120-R124 WeakPolarHBondContact O-CB 3.27Å; A120-R124 PolarHBondContact O-N 3.4Å
121S92.2Very high86Confident44 Ų4478.3 Ų78.331%0.30839%0.392SS..Hα-helixtrans-61.7-45.7172.2178.90000111.6Q117 K118 L119 F123 R124 Q125Q117-S121 WeakPolarHBondContact O-CB 3.49Å; Q117-S121 PolarHBondContact O-N 3.37Å; K118-S121 WeakPolarHBondContact O-CB 3.49Å; K118-S121 PolarHBondContact O-N 3.18Å; L119-S121 VanDerWaalsContact C-N 3.27Å; L119-S121 PolarHBondContact O-N 3.39Å; S121-F123 PolarHBondContact O-N 3.44Å; S121-R124 WeakPolarHBondContact O-CB 3.48Å; S121-R124 PolarHBondContact O-N 2.96Å; S121-Q125 WeakPolarHBondContact O-CG 3.46Å; S121-Q125 PolarHBondContact O-N 2.94Å; S121-Q125 PolarHBondContact OG-NE2 3.34Å
122T90.4Very high88.1Confident60 Ų6080.2 Ų80.237%0.36840%0.402SS..Hα-helixtrans-60.4-44.6177.2-60.50000111.8K118 L119 R124 Q125 S126K118-T122 PolarHBondContact O-N 2.85Å; K118-T122 PolarHBondContact O-OG1 3.28Å; K118-T122 VanDerWaalsContact O-OG1 3.09Å; L119-T122 WeakPolarHBondContact O-CA 3.46Å; L119-T122 WeakPolarHBondContact O-CB 3.33Å; L119-T122 PolarHBondContact O-N 2.97Å; T122-R124 VanDerWaalsContact C-N 3.34Å; T122-R124 PolarHBondContact O-N 3.09Å; T122-Q125 PolarHBondContact O-N 3.21Å; T122-S126 WeakPolarHBondContact O-CB 3.47Å; T122-S126 PolarHBondContact O-N 2.91Å
123F92.9Very high89.5Confident45 Ų4579.7 Ų79.720%0.19740%0.395CS..Hα-helixtrans-62-41.6175.7-79.8-73.7000112.1L119 A120 S121 S126 Q127 L154 L157 Q158 L161L119-F123 WeakPolarHBondContact O-CD2 3.39Å; L119-F123 PolarHBondContact O-N 3.33Å; A120-F123 PolarHBondContact O-N 3.44Å; S121-F123 PolarHBondContact O-N 3.44Å; F123-S126 PolarHBondContact O-N 3.37Å; F123-Q127 PolarHBondContact O-N 2.86Å; F123-L154 HydrophobicContact CE1-CB 4.12Å; F123-L157 HydrophobicContact CE2-CB 4.3Å; F123-L157 HydrophobicContact CZ-CB 3.92Å; F123-Q158 HydrophobicContact CE1-CB 4.2Å; F123-Q158 HydrophobicContact CZ-CB 3.95Å; F123-L161 HydrophobicContact CD2-CD1 3.79Å; F123-L161 HydrophobicContact CE2-CD1 3.35Å; F123-L161 HydrophobicContact CE2-CG 4.42Å; F123-L161 HydrophobicContact CZ-CD1 4.24Å
124R94.5Very high90.6Very high186 Ų18677.5 Ų77.570%0.70239%0.394SS*.Hα-helixtrans-61.1-48.1175.4-170.1-171.7-58-174.91.4111.5A120 S121 T122 Q127 V128A120-R124 WeakPolarHBondContact O-CB 3.27Å; A120-R124 PolarHBondContact O-N 3.4Å; S121-R124 WeakPolarHBondContact O-CB 3.48Å; S121-R124 PolarHBondContact O-N 2.96Å; T122-R124 VanDerWaalsContact C-N 3.34Å; T122-R124 PolarHBondContact O-N 3.09Å; R124-Q127 PolarHBondContact O-N 2.99Å; R124-V128 WeakPolarHBondContact O-CG2 3.39Å; R124-V128 PolarHBondContact O-N 3.37Å
125Q97.2Very high91.9Very high126 Ų12673 Ų7359%0.58939%0.393SS*.Hα-helixtrans-64.3-41.6179.2-71.1176.732.900111.9S121 T122 Q127 V128 L129S121-Q125 WeakPolarHBondContact O-CG 3.46Å; S121-Q125 PolarHBondContact O-N 2.94Å; S121-Q125 PolarHBondContact OG-NE2 3.34Å; T122-Q125 PolarHBondContact O-N 3.21Å; Q125-Q127 VanDerWaalsContact C-N 3.3Å; Q125-Q127 PolarHBondContact O-N 2.97Å; Q125-V128 WeakPolarHBondContact O-CB 3.49Å; Q125-V128 PolarHBondContact O-N 3.36Å; Q125-L129 PolarHBondContact O-N 3.04Å
126S95Very high92.6Very high13 Ų1381 Ų819%0.09142%0.421CS..Hα-helixtrans-59.4-41.91731740000111.7T122 F123 V128 L129 K130 I150 L154T122-S126 WeakPolarHBondContact O-CB 3.47Å; T122-S126 PolarHBondContact O-N 2.91Å; F123-S126 PolarHBondContact O-N 3.37Å; S126-V128 VanDerWaalsContact C-N 3.34Å; S126-V128 PolarHBondContact O-N 2.7Å; S126-L129 PolarHBondContact O-N 3.14Å; S126-K130 WeakPolarHBondContact O-CG 3.38Å; S126-K130 PolarHBondContact O-N 3.22Å; S126-I150 VanDerWaalsContact OG-CG2 3.29Å; S126-I150 WeakPolarHBondContact OG-CG2 3.25Å; S126-L154 VanDerWaalsContact CB-CD1 3.45Å; S126-L154 WeakPolarHBondContact OG-CD1 3.46Å
127Q96.8Very high93.3Very high89 Ų8980.2 Ų80.242%0.41642%0.417SS..Hα-helixtrans-63.3-41.8176.9-170.458.943.900111.9F123 R124 Q125 K130 N131F123-Q127 PolarHBondContact O-N 2.86Å; R124-Q127 PolarHBondContact O-N 2.99Å; Q125-Q127 VanDerWaalsContact C-N 3.3Å; Q125-Q127 PolarHBondContact O-N 2.97Å; Q127-K130 PolarHBondContact O-N 3.31Å; Q127-N131 PolarHBondContact NE2-OD1 3.45Å; Q127-N131 PolarHBondContact O-N 3.06Å; Q127-N131 PolarHBondContact O-OD1 2.95Å
128V97.7Very high94Very high79 Ų7979.4 Ų79.448%0.47942%0.424SS..Hα-helixtrans-59-50172.91730000110.3R124 Q125 S126 K130 N131 L132R124-V128 WeakPolarHBondContact O-CG2 3.39Å; R124-V128 PolarHBondContact O-N 3.37Å; Q125-V128 WeakPolarHBondContact O-CB 3.49Å; Q125-V128 PolarHBondContact O-N 3.36Å; S126-V128 VanDerWaalsContact C-N 3.34Å; S126-V128 PolarHBondContact O-N 2.7Å; V128-K130 VanDerWaalsContact C-N 3.33Å; V128-K130 PolarHBondContact O-N 2.95Å; V128-N131 WeakPolarHBondContact O-CB 3.34Å; V128-N131 PolarHBondContact O-N 3.49Å; V128-N131 VanDerWaalsContact O-N 3.1Å; V128-L132 HydrophobicContact CG1-CD1 4.02Å; V128-L132 HydrophobicContact CG1-CG 4.26Å; V128-L132 WeakPolarHBondContact O-CG 3.37Å; V128-L132 PolarHBondContact O-N 3.46Å
129L97.3Very high94.5Very high86 Ų8675.1 Ų75.145%0.4541%0.411SS..Hα-helixtrans-56.6-45.3178.3177.261.6000112.1Q125 S126 N131 L132 I133 I150Q125-L129 PolarHBondContact O-N 3.04Å; S126-L129 PolarHBondContact O-N 3.14Å; L129-N131 VanDerWaalsContact C-N 3.31Å; L129-N131 PolarHBondContact O-N 3.05Å; L129-L132 PolarHBondContact O-N 3.48Å; L129-I133 HydrophobicContact CD1-CD1 4Å; L129-I133 HydrophobicContact CD1-CG1 4.22Å; L129-I133 HydrophobicContact CG-CD1 3.89Å; L129-I133 WeakPolarHBondContact O-CG1 3.47Å; L129-I133 PolarHBondContact O-N 3.02Å; L129-I150 HydrophobicContact CD2-CD1 4.13Å; L129-I150 HydrophobicContact CG-CD1 4.45Å
130K96.9Very high94.9Very high36 Ų3679.2 Ų79.216%0.15744%0.437CS..Hα-helixtrans-60.5-41.3177.3-71.5-177.4-61.81780112S126 Q127 V128 I133 A134 T147 I150S126-K130 WeakPolarHBondContact O-CG 3.38Å; S126-K130 PolarHBondContact O-N 3.22Å; Q127-K130 PolarHBondContact O-N 3.31Å; V128-K130 VanDerWaalsContact C-N 3.33Å; V128-K130 PolarHBondContact O-N 2.95Å; K130-I133 PolarHBondContact O-N 2.81Å; K130-A134 WeakPolarHBondContact O-CB 3.39Å; K130-A134 PolarHBondContact O-N 3.27Å; K130-T147 HydrophobicContact CB-CG2 3.81Å; K130-T147 HydrophobicContact CG-CG2 3.93Å; K130-I150 HydrophobicContact CD-CG2 4.26Å; K130-I150 HydrophobicContact CG-CD1 4.36Å; K130-I150 HydrophobicContact CG-CG2 4.22Å
131N96.8Very high95.4Very high92 Ų9283.7 Ų83.749%0.49245%0.449SS..Hα-helixtrans-66.1-40.4176.8-64.7-6.8000111.6Q127 V128 L129 A134 A135Q127-N131 PolarHBondContact NE2-OD1 3.45Å; Q127-N131 PolarHBondContact O-N 3.06Å; Q127-N131 PolarHBondContact O-OD1 2.95Å; V128-N131 WeakPolarHBondContact O-CB 3.34Å; V128-N131 PolarHBondContact O-N 3.49Å; V128-N131 VanDerWaalsContact O-N 3.1Å; L129-N131 VanDerWaalsContact C-N 3.31Å; L129-N131 PolarHBondContact O-N 3.05Å; N131-A134 PolarHBondContact O-N 3.24Å; N131-A135 WeakPolarHBondContact O-CB 3.32Å; N131-A135 PolarHBondContact O-N 3.45Å
132L97.6Very high95.6Very high80 Ų8087.9 Ų87.942%0.41946%0.458SS..Hα-helixtrans-65.6-42.2177.3-64.8177.2000111.7V128 L129 A134 A135 Y136V128-L132 HydrophobicContact CG1-CD1 4.02Å; V128-L132 HydrophobicContact CG1-CG 4.26Å; V128-L132 WeakPolarHBondContact O-CG 3.37Å; V128-L132 PolarHBondContact O-N 3.46Å; L129-L132 PolarHBondContact O-N 3.48Å; L132-A134 VanDerWaalsContact C-N 3.33Å; L132-A134 PolarHBondContact O-N 3.14Å; L132-A135 PolarHBondContact O-N 2.85Å; L132-Y136 HydrophobicContact CB-CD2 4.18Å; L132-Y136 HydrophobicContact CB-CE2 4.35Å; L132-Y136 HydrophobicContact CD2-CE2 3.87Å; L132-Y136 WeakPolarHBondContact O-CB 3.33Å; L132-Y136 VanDerWaalsContact O-CD2 3.25Å; L132-Y136 WeakPolarHBondContact O-CD2 3.38Å; L132-Y136 PolarHBondContact O-N 3.32Å
133I96.2Very high95.9Very high35 Ų3585.2 Ų85.218%0.17944%0.442CS..Hα-helixtrans-60-46174.8-68.8165000110.1L129 K130 A135 Y136 D137 V146 T147 I150L129-I133 HydrophobicContact CD1-CD1 4Å; L129-I133 HydrophobicContact CD1-CG1 4.22Å; L129-I133 HydrophobicContact CG-CD1 3.89Å; L129-I133 WeakPolarHBondContact O-CG1 3.47Å; L129-I133 PolarHBondContact O-N 3.02Å; K130-I133 PolarHBondContact O-N 2.81Å; I133-A135 VanDerWaalsContact C-N 3.26Å; I133-A135 PolarHBondContact O-N 3.18Å; I133-Y136 PolarHBondContact O-N 2.96Å; I133-D137 HydrophobicContact CG2-CB 4.45Å; I133-D137 WeakPolarHBondContact O-CB 3.44Å; I133-D137 PolarHBondContact O-N 3.4Å; I133-V146 HydrophobicContact CD1-CG1 3.87Å; I133-T147 HydrophobicContact CB-CG2 4.26Å; I133-T147 HydrophobicContact CG2-CG2 4.13Å; I133-I150 HydrophobicContact CD1-CD1 3.78Å
134A92.3Very high96.1Very high75 Ų7586.2 Ų86.262%0.6245%0.449SS*.Hα-helixtrans-64.4-30.2178.500000113.3K130 N131 L132K130-A134 WeakPolarHBondContact O-CB 3.39Å; K130-A134 PolarHBondContact O-N 3.27Å; N131-A134 PolarHBondContact O-N 3.24Å; L132-A134 VanDerWaalsContact C-N 3.33Å; L132-A134 PolarHBondContact O-N 3.14Å
135A94.7Very high96.2Very high76 Ų7683.2 Ų83.263%0.62844%0.444SS*.Hα-helixtrans-81.9-35.7179.300000113.3N131 L132 I133N131-A135 WeakPolarHBondContact O-CB 3.32Å; N131-A135 PolarHBondContact O-N 3.45Å; L132-A135 PolarHBondContact O-N 2.85Å; I133-A135 VanDerWaalsContact C-N 3.26Å; I133-A135 PolarHBondContact O-N 3.18Å
136Y95.6Very high96.1Very high182 Ų18280.4 Ų80.471%0.71444%0.435SS*.Hα-helixtrans-102.6-20.5-172.7-65.8-54.7000114.8L132 I133 P138L132-Y136 HydrophobicContact CB-CD2 4.18Å; L132-Y136 HydrophobicContact CB-CE2 4.35Å; L132-Y136 HydrophobicContact CD2-CE2 3.87Å; L132-Y136 WeakPolarHBondContact O-CB 3.33Å; L132-Y136 VanDerWaalsContact O-CD2 3.25Å; L132-Y136 WeakPolarHBondContact O-CD2 3.38Å; L132-Y136 PolarHBondContact O-N 3.32Å; I133-Y136 PolarHBondContact O-N 2.96Å; Y136-P138 WeakPolarHBondContact O-CD 3.44Å
137D94Very high96.2Very high32 Ų3280.9 Ų80.917%0.17144%0.438CS..  trans-73.6116.8177.7-167-22.1000110.2I133 S139 R142 G143I133-D137 HydrophobicContact CG2-CB 4.45Å; I133-D137 WeakPolarHBondContact O-CB 3.44Å; I133-D137 PolarHBondContact O-N 3.4Å; D137-S139 VanDerWaalsContact CG-O 3.32Å; D137-S139 PolarHBondContact O-N 3.31Å; D137-S139 PolarHBondContact OD1-N 3.11Å; D137-R142 IonicContact OD1-CZ 2.64Å; D137-R142 VanDerWaalsContact OD1-CZ 3.3Å; D137-R142 IonicContact OD1-NE 2.94Å; D137-R142 PolarHBondContact OD1-NE 2.83Å; D137-R142 IonicContact OD1-NH2 3.26Å; D137-R142 PolarHBondContact OD1-NH2 3.45Å; D137-R142 IonicContact OD2-CZ 3.77Å; D137-R142 IonicContact OD2-NE 3.89Å; D137-R142 PolarHBondContact OD2-NE 3.34Å; D137-R142 IonicContact OD2-NH2 3.76Å; D137-G143 PolarHBondContact OD2-N 3.06Å
138P96.1Very high96.2Very high124 Ų12485 Ų8581%0.80545%0.45SS*.SBendtrans-62.3-23176.6-21.734.5000113.2Y136Y136-P138 WeakPolarHBondContact O-CD 3.44Å
139S97.4Very high96.1Very high41 Ų4182.9 Ų82.929%0.28744%0.444SS..  trans-99.6108.2176.4177.60000110.2D137 E141 R142 G143D137-S139 VanDerWaalsContact CG-O 3.32Å; D137-S139 PolarHBondContact O-N 3.31Å; D137-S139 PolarHBondContact OD1-N 3.11Å; S139-E141 VanDerWaalsContact C-N 3.29Å; S139-E141 PolarHBondContact O-N 3.06Å; S139-R142 PolarHBondContact O-N 3.22Å; S139-R142 PolarHBondContact OG-N 3.3Å; S139-G143 PolarHBondContact O-N 3.48Å
140V95.6Very high96Very high110 Ų11080.5 Ų80.567%0.66743%0.431SS*.Hα-helixtrans-58.4-42.3175.1177.50000111.3G143 I144V140-G143 PolarHBondContact O-N 3.04Å; V140-I144 HydrophobicContact CG1-CD1 3.6Å; V140-I144 HydrophobicContact CG1-CG1 4.25Å; V140-I144 WeakPolarHBondContact O-CB 3.22Å; V140-I144 WeakPolarHBondContact O-CG1 3.01Å; V140-I144 PolarHBondContact O-N 3.29Å
141E96.4Very high96Very high147 Ų14782.2 Ų82.269%0.68744%0.444SS*.Hα-helixtrans-60.8-48.5179.9-177.4175.8-168.100111.9S139 I144 M145S139-E141 VanDerWaalsContact C-N 3.29Å; S139-E141 PolarHBondContact O-N 3.06Å; E141-I144 PolarHBondContact O-N 2.77Å; E141-M145 WeakPolarHBondContact O-CB 3.38Å; E141-M145 PolarHBondContact O-N 3.08Å
142R96.3Very high96Very high132 Ų13281 Ų8150%0.49845%0.447SS..Hα-helixtrans-64.8-46.2178-177.7177.258.2-140.82.5111.5D137 S139 I144 M145 V146D137-R142 IonicContact OD1-CZ 2.64Å; D137-R142 VanDerWaalsContact OD1-CZ 3.3Å; D137-R142 IonicContact OD1-NE 2.94Å; D137-R142 PolarHBondContact OD1-NE 2.83Å; D137-R142 IonicContact OD1-NH2 3.26Å; D137-R142 PolarHBondContact OD1-NH2 3.45Å; D137-R142 IonicContact OD2-CZ 3.77Å; D137-R142 IonicContact OD2-NE 3.89Å; D137-R142 PolarHBondContact OD2-NE 3.34Å; D137-R142 IonicContact OD2-NH2 3.76Å; S139-R142 PolarHBondContact O-N 3.22Å; S139-R142 PolarHBondContact OG-N 3.3Å; R142-I144 VanDerWaalsContact C-N 3.3Å; R142-I144 PolarHBondContact O-N 2.89Å; R142-M145 WeakPolarHBondContact O-CB 3.35Å; R142-M145 PolarHBondContact O-N 3.34Å; R142-M145 VanDerWaalsContact O-N 3.08Å; R142-V146 HydrophobicContact CG-CG2 4.48Å; R142-V146 WeakPolarHBondContact O-CG2 3.49Å; R142-V146 PolarHBondContact O-N 3.37Å
143G97.1Very high95.9Very high4 Ų481.8 Ų81.84%0.04146%0.459CS..Hα-helixtrans-58.1-42.7176.900000112D137 S139 V140 M145 V146 T147D137-G143 PolarHBondContact OD2-N 3.06Å; S139-G143 PolarHBondContact O-N 3.48Å; V140-G143 PolarHBondContact O-N 3.04Å; G143-M145 PolarHBondContact O-N 3.34Å; G143-V146 PolarHBondContact O-N 3.3Å; G143-T147 WeakPolarHBondContact O-CB 3.46Å; G143-T147 VanDerWaalsContact O-CG2 3.25Å; G143-T147 WeakPolarHBondContact O-CG2 3.35Å; G143-T147 PolarHBondContact O-N 2.88Å; G143-T147 PolarHBondContact O-OG1 3.26Å
144I96.1Very high95.8Very high66 Ų6681.6 Ų81.634%0.33846%0.459SS..Hα-helixtrans-62.2-43.1174-72.8171.7000111.3V140 E141 R142 T147 R148V140-I144 HydrophobicContact CG1-CD1 3.6Å; V140-I144 HydrophobicContact CG1-CG1 4.25Å; V140-I144 WeakPolarHBondContact O-CB 3.22Å; V140-I144 WeakPolarHBondContact O-CG1 3.01Å; V140-I144 PolarHBondContact O-N 3.29Å; E141-I144 PolarHBondContact O-N 2.77Å; R142-I144 VanDerWaalsContact C-N 3.3Å; R142-I144 PolarHBondContact O-N 2.89Å; I144-T147 WeakPolarHBondContact CA-OG1 3.49Å; I144-T147 PolarHBondContact O-N 3.4Å; I144-T147 PolarHBondContact O-OG1 3.18Å; I144-R148 HydrophobicContact CG2-CG 4.37Å; I144-R148 WeakPolarHBondContact O-CB 3.28Å; I144-R148 VanDerWaalsContact O-CG 3.25Å; I144-R148 WeakPolarHBondContact O-CG 3.34Å; I144-R148 PolarHBondContact O-N 3.38Å
145M96.8Very high95.8Very high123 Ų12383.1 Ų83.161%0.60645%0.451SS*.Hα-helixtrans-61.4-47.1178.9-167.4-176.2-55.800111.6E141 R142 G143 R148 G149E141-M145 WeakPolarHBondContact O-CB 3.38Å; E141-M145 PolarHBondContact O-N 3.08Å; R142-M145 WeakPolarHBondContact O-CB 3.35Å; R142-M145 PolarHBondContact O-N 3.34Å; R142-M145 VanDerWaalsContact O-N 3.08Å; G143-M145 PolarHBondContact O-N 3.34Å; M145-R148 PolarHBondContact O-N 3.37Å; M145-G149 PolarHBondContact O-N 3.05Å
146V95.7Very high95.7Very high66 Ų6683.6 Ų83.640%0.445%0.448SS..Hα-helixtrans-64-46.4179176.70000111I133 R142 G143 R148 G149 I150I133-V146 HydrophobicContact CD1-CG1 3.87Å; R142-V146 HydrophobicContact CG-CG2 4.48Å; R142-V146 WeakPolarHBondContact O-CG2 3.49Å; R142-V146 PolarHBondContact O-N 3.37Å; G143-V146 PolarHBondContact O-N 3.3Å; V146-R148 VanDerWaalsContact C-N 3.34Å; V146-R148 PolarHBondContact O-N 3Å; V146-G149 PolarHBondContact O-N 3.38Å; V146-G149 VanDerWaalsContact O-N 3.15Å; V146-I150 HydrophobicContact CG1-CD1 4.01Å; V146-I150 HydrophobicContact CG1-CG1 4.49Å; V146-I150 WeakPolarHBondContact O-CG1 3.29Å; V146-I150 PolarHBondContact O-N 3.41Å
147T96.8Very high95.2Very high24 Ų2478 Ų7815%0.14743%0.43CS..Hα-helixtrans-65.4-35-179.653.40000113.1K130 I133 G143 I144 T151K130-T147 HydrophobicContact CB-CG2 3.81Å; K130-T147 HydrophobicContact CG-CG2 3.93Å; I133-T147 HydrophobicContact CB-CG2 4.26Å; I133-T147 HydrophobicContact CG2-CG2 4.13Å; G143-T147 WeakPolarHBondContact O-CB 3.46Å; G143-T147 VanDerWaalsContact O-CG2 3.25Å; G143-T147 WeakPolarHBondContact O-CG2 3.35Å; G143-T147 PolarHBondContact O-N 2.88Å; G143-T147 PolarHBondContact O-OG1 3.26Å; I144-T147 WeakPolarHBondContact CA-OG1 3.49Å; I144-T147 PolarHBondContact O-N 3.4Å; I144-T147 PolarHBondContact O-OG1 3.18Å; T147-T151 WeakPolarHBondContact O-CB 3.31Å; T147-T151 PolarHBondContact O-N 3.35Å; T147-T151 PolarHBondContact O-OG1 3.48Å
148R96.3Very high95Very high176 Ų17679.2 Ų79.266%0.66444%0.435SS*.Hα-helixtrans-65.2-44.5170.4-75.3174.2176.8160.81.5111.5I144 M145 V146 I150 T151 A152I144-R148 HydrophobicContact CG2-CG 4.37Å; I144-R148 WeakPolarHBondContact O-CB 3.28Å; I144-R148 VanDerWaalsContact O-CG 3.25Å; I144-R148 WeakPolarHBondContact O-CG 3.34Å; I144-R148 PolarHBondContact O-N 3.38Å; M145-R148 PolarHBondContact O-N 3.37Å; V146-R148 VanDerWaalsContact C-N 3.34Å; V146-R148 PolarHBondContact O-N 3Å; R148-I150 PolarHBondContact O-N 3.2Å; R148-T151 PolarHBondContact O-N 2.92Å; R148-T151 VanDerWaalsContact O-N 3.17Å; R148-A152 PolarHBondContact O-N 3.27Å
149G96.9Very high94.6Very high34 Ų3476.5 Ų76.535%0.35141%0.413SS..Hα-helixtrans-55.8-50.6174.400000112M145 V146 T151 A152 S153M145-G149 PolarHBondContact O-N 3.05Å; V146-G149 PolarHBondContact O-N 3.38Å; V146-G149 VanDerWaalsContact O-N 3.15Å; G149-T151 VanDerWaalsContact C-N 3.29Å; G149-T151 PolarHBondContact O-N 3.1Å; G149-A152 PolarHBondContact O-N 3.22Å; G149-S153 PolarHBondContact O-N 3.27Å; G149-S153 PolarHBondContact O-OG 2.87Å; G149-S153 VanDerWaalsContact O-OG 3.09Å
150I95.5Very high93.9Very high36 Ų3678.7 Ų78.719%0.18542%0.421CS..Hα-helixtrans-56.1-44.7175.6-67167.1000111.1S126 L129 K130 I133 V146 R148 S153 L154S126-I150 VanDerWaalsContact OG-CG2 3.29Å; S126-I150 WeakPolarHBondContact OG-CG2 3.25Å; L129-I150 HydrophobicContact CD2-CD1 4.13Å; L129-I150 HydrophobicContact CG-CD1 4.45Å; K130-I150 HydrophobicContact CD-CG2 4.26Å; K130-I150 HydrophobicContact CG-CD1 4.36Å; K130-I150 HydrophobicContact CG-CG2 4.22Å; I133-I150 HydrophobicContact CD1-CD1 3.78Å; V146-I150 HydrophobicContact CG1-CD1 4.01Å; V146-I150 HydrophobicContact CG1-CG1 4.49Å; V146-I150 WeakPolarHBondContact O-CG1 3.29Å; V146-I150 PolarHBondContact O-N 3.41Å; R148-I150 PolarHBondContact O-N 3.2Å; I150-S153 PolarHBondContact O-N 3.38Å; I150-L154 HydrophobicContact CG2-CD1 3.97Å; I150-L154 WeakPolarHBondContact O-CG 3.25Å; I150-L154 PolarHBondContact O-N 3.03Å
151T96Very high93.2Very high71 Ų7174.1 Ų74.144%0.43639%0.393SS..Hα-helixtrans-64.9-42.6-179.7-57.30000111.7T147 R148 G149 L154 K155T147-T151 WeakPolarHBondContact O-CB 3.31Å; T147-T151 PolarHBondContact O-N 3.35Å; T147-T151 PolarHBondContact O-OG1 3.48Å; R148-T151 PolarHBondContact O-N 2.92Å; R148-T151 VanDerWaalsContact O-N 3.17Å; G149-T151 VanDerWaalsContact C-N 3.29Å; G149-T151 PolarHBondContact O-N 3.1Å; T151-L154 PolarHBondContact O-N 3.35Å; T151-K155 PolarHBondContact O-N 3.19Å
152A96.6Very high92.6Very high67 Ų6769.8 Ų69.855%0.55438%0.375SS*.Hα-helixtrans-63.9-43.3175.800000111.6R148 G149 L154 K155R148-A152 PolarHBondContact O-N 3.27Å; G149-A152 PolarHBondContact O-N 3.22Å; A152-L154 VanDerWaalsContact C-N 3.28Å; A152-L154 PolarHBondContact O-N 2.88Å; A152-K155 VanDerWaalsContact O-CB 3.22Å; A152-K155 WeakPolarHBondContact O-CB 3.34Å; A152-K155 PolarHBondContact O-N 3.29Å
153S95.3Very high92Very high96 Ų9668.1 Ų68.167%0.67137%0.373SS*.Hα-helixtrans-65.9-27.8178-60.30000113.5G149 I150 P156G149-S153 PolarHBondContact O-N 3.27Å; G149-S153 PolarHBondContact O-OG 2.87Å; G149-S153 VanDerWaalsContact O-OG 3.09Å; I150-S153 PolarHBondContact O-N 3.38Å; S153-P156 WeakPolarHBondContact O-CD 3.5Å
154L93.6Very high90.9Very high31 Ų3169 Ų6916%0.16238%0.379CS..Hα-helixtrans-85.9-9.1176.5-70.7175.2000113.9F123 S126 I150 T151 A152 L157 Q158F123-L154 HydrophobicContact CE1-CB 4.12Å; S126-L154 VanDerWaalsContact CB-CD1 3.45Å; S126-L154 WeakPolarHBondContact OG-CD1 3.46Å; I150-L154 HydrophobicContact CG2-CD1 3.97Å; I150-L154 WeakPolarHBondContact O-CG 3.25Å; I150-L154 PolarHBondContact O-N 3.03Å; T151-L154 PolarHBondContact O-N 3.35Å; A152-L154 VanDerWaalsContact C-N 3.28Å; A152-L154 PolarHBondContact O-N 2.88Å; L154-L157 HydrophobicContact CD2-CD1 3.93Å; L154-L157 PolarHBondContact O-N 3.32Å; L154-L157 VanDerWaalsContact O-N 3.14Å; L154-Q158 PolarHBondContact O-N 3.39Å; L154-Q158 VanDerWaalsContact O-N 3.14Å
155K94Very high89.8Confident107 Ų10770.7 Ų70.747%0.46538%0.384SS..Hα-helixtrans-55.7-44.3-177.7-175.656.3173146.70113.6T151 A152 L157 Q158 D159T151-K155 PolarHBondContact O-N 3.19Å; A152-K155 VanDerWaalsContact O-CB 3.22Å; A152-K155 WeakPolarHBondContact O-CB 3.34Å; A152-K155 PolarHBondContact O-N 3.29Å; K155-L157 VanDerWaalsContact C-N 3.28Å; K155-L157 PolarHBondContact O-N 3.24Å; K155-Q158 WeakPolarHBondContact O-CB 3.42Å; K155-Q158 PolarHBondContact O-N 3.07Å; K155-D159 WeakPolarHBondContact CE-OD1 3.43Å; K155-D159 IonicContact NZ-OD1 2.59Å; K155-D159 PolarHBondContact NZ-OD1 3.18Å; K155-D159 PolarHBondContact O-N 2.94Å
156P91Very high89Confident86 Ų8669.7 Ų69.756%0.55838%0.377SS*.Hα-helixtrans-60.9-34.4178-24.335.7000113.7S153 D159 L160S153-P156 WeakPolarHBondContact O-CD 3.5Å; P156-D159 PolarHBondContact O-N 2.93Å; P156-L160 PolarHBondContact O-N 2.84Å
157L86.6Confident87.8Confident64 Ų6468.5 Ų68.534%0.33537%0.369SS..Hα-helixtrans-71.3-34.1176-65.5178.2000111.8L119 F123 L154 K155 L161L119-L157 HydrophobicContact CD2-CB 4.46Å; L119-L157 HydrophobicContact CD2-CD1 4.37Å; L119-L157 HydrophobicContact CD2-CD2 4.18Å; F123-L157 HydrophobicContact CE2-CB 4.3Å; F123-L157 HydrophobicContact CZ-CB 3.92Å; L154-L157 HydrophobicContact CD2-CD1 3.93Å; L154-L157 PolarHBondContact O-N 3.32Å; L154-L157 VanDerWaalsContact O-N 3.14Å; K155-L157 VanDerWaalsContact C-N 3.28Å; K155-L157 PolarHBondContact O-N 3.24Å; L157-L161 PolarHBondContact O-N 3.17Å; L157-L161 VanDerWaalsContact O-N 3.14Å
158Q88.3Confident86.4Confident59 Ų5972.4 Ų72.428%0.27639%0.386SS..Hα-helixtrans-67.2-43.2175.3-178.361.655.600110.4F123 L154 K155 L160 L161 D162F123-Q158 HydrophobicContact CE1-CB 4.2Å; F123-Q158 HydrophobicContact CZ-CB 3.95Å; L154-Q158 PolarHBondContact O-N 3.39Å; L154-Q158 VanDerWaalsContact O-N 3.14Å; K155-Q158 WeakPolarHBondContact O-CB 3.42Å; K155-Q158 PolarHBondContact O-N 3.07Å; Q158-L160 VanDerWaalsContact C-N 3.32Å; Q158-L160 PolarHBondContact O-N 2.71Å; Q158-L161 WeakPolarHBondContact O-CB 3.25Å; Q158-L161 PolarHBondContact O-N 3.05Å; Q158-L161 VanDerWaalsContact O-N 3.16Å; Q158-D162 PolarHBondContact NE2-OD1 2.87Å; Q158-D162 VanDerWaalsContact NE2-OD1 3.1Å; Q158-D162 PolarHBondContact NE2-OD2 3.09Å; Q158-D162 PolarHBondContact O-N 3.5Å
159D88.7Confident85.1Confident66 Ų6674.5 Ų74.535%0.35339%0.394SS..Hα-helixtrans-63-41.1177.8-62.7-24.1000110.6K155 P156 L161 D162 E163K155-D159 WeakPolarHBondContact CE-OD1 3.43Å; K155-D159 IonicContact NZ-OD1 2.59Å; K155-D159 PolarHBondContact NZ-OD1 3.18Å; K155-D159 PolarHBondContact O-N 2.94Å; P156-D159 PolarHBondContact O-N 2.93Å; D159-L161 VanDerWaalsContact C-N 3.32Å; D159-L161 PolarHBondContact O-N 3.32Å; D159-D162 PolarHBondContact O-N 2.9Å; D159-E163 WeakPolarHBondContact O-CG 3.33Å; D159-E163 PolarHBondContact O-N 2.88Å
160L82.3Confident83.6Confident87 Ų8780.3 Ų80.346%0.45541%0.412SS..Hα-helixtrans-58-41.7173.1-175.568.5000112.8L111 P156 Q158 A164L111-L160 HydrophobicContact CD1-CG 4.43Å; P156-L160 PolarHBondContact O-N 2.84Å; Q158-L160 VanDerWaalsContact C-N 3.32Å; Q158-L160 PolarHBondContact O-N 2.71Å; L160-A164 WeakPolarHBondContact O-CB 3.25Å; L160-A164 PolarHBondContact O-N 3.19Å
161L80.6Confident82.2Confident14 Ų1480.4 Ų80.47%0.07341%0.412CS..Hα-helixtrans-65.9-41.6176.1-77.5176.8000112.1L111 L116 L119 F123 L157 Q158 D159 A164 K165L111-L161 HydrophobicContact CD1-CD2 4.04Å; L116-L161 HydrophobicContact CD2-CD2 3.46Å; L116-L161 VanDerWaalsContact CD2-CD2 3.46Å; L119-L161 HydrophobicContact CB-CD1 4.27Å; L119-L161 HydrophobicContact CB-CD2 4.06Å; L119-L161 HydrophobicContact CB-CG 4.44Å; L119-L161 HydrophobicContact CD1-CD2 3.6Å; L119-L161 HydrophobicContact CD1-CG 4.04Å; L119-L161 HydrophobicContact CG-CD2 4.48Å; F123-L161 HydrophobicContact CD2-CD1 3.79Å; F123-L161 HydrophobicContact CE2-CD1 3.35Å; F123-L161 HydrophobicContact CE2-CG 4.42Å; F123-L161 HydrophobicContact CZ-CD1 4.24Å; L157-L161 PolarHBondContact O-N 3.17Å; L157-L161 VanDerWaalsContact O-N 3.14Å; Q158-L161 WeakPolarHBondContact O-CB 3.25Å; Q158-L161 PolarHBondContact O-N 3.05Å; Q158-L161 VanDerWaalsContact O-N 3.16Å; D159-L161 VanDerWaalsContact C-N 3.32Å; D159-L161 PolarHBondContact O-N 3.32Å; L161-A164 PolarHBondContact O-N 3.49Å; L161-K165 WeakPolarHBondContact O-CG 3.36Å; L161-K165 PolarHBondContact O-N 3.21Å
162D84.8Confident80.6Confident57 Ų5780.6 Ų80.631%0.30542%0.415SS..Hα-helixtrans-68.8-38.2-179.1-67.9-23.7000110.8Q158 D159 K165 K166Q158-D162 PolarHBondContact NE2-OD1 2.87Å; Q158-D162 VanDerWaalsContact NE2-OD1 3.1Å; Q158-D162 PolarHBondContact NE2-OD2 3.09Å; Q158-D162 PolarHBondContact O-N 3.5Å; D159-D162 PolarHBondContact O-N 2.9Å; D162-K165 PolarHBondContact O-N 3.47Å; D162-K166 WeakPolarHBondContact O-CG 3.39Å; D162-K166 PolarHBondContact O-N 3.21Å
163E82.7Confident79.1Confident96 Ų9683.7 Ų83.745%0.44942%0.421SS..Hα-helixtrans-63.9-45.1171.1-69.2-48.613000112D159 K165 K166 V167D159-E163 WeakPolarHBondContact O-CG 3.33Å; D159-E163 PolarHBondContact O-N 2.88Å; E163-K165 VanDerWaalsContact C-N 3.29Å; E163-K165 PolarHBondContact O-N 2.9Å; E163-K166 WeakPolarHBondContact O-CB 3.49Å; E163-K166 PolarHBondContact O-N 3Å; E163-K166 VanDerWaalsContact O-N 3.08Å; E163-K166 IonicContact OE1-NZ 3.93Å; E163-K166 PolarHBondContact OE1-NZ 3.05Å; E163-K166 IonicContact OE2-NZ 2.85Å; E163-V167 WeakPolarHBondContact O-CG2 3.19Å; E163-V167 PolarHBondContact O-N 2.59Å
164A74Confident77.6Confident22 Ų2283.6 Ų83.618%0.18242%0.417CS..Hα-helixtrans-59.1-40.6176.800000112.4L111 L160 L161 V167 E168L111-A164 HydrophobicContact CD1-CB 3.66Å; L111-A164 HydrophobicContact CG-CB 4.22Å; L160-A164 WeakPolarHBondContact O-CB 3.25Å; L160-A164 PolarHBondContact O-N 3.19Å; L161-A164 PolarHBondContact O-N 3.49Å; A164-V167 PolarHBondContact O-N 2.91Å; A164-E168 PolarHBondContact O-N 3.43Å
165K74.3Confident76.2Confident102 Ų10287.4 Ų87.444%0.44344%0.435SS..Hα-helixtrans-66.9-35175.1-74173-178.8171.10112.9L161 D162 E163 R169L161-K165 WeakPolarHBondContact O-CG 3.36Å; L161-K165 PolarHBondContact O-N 3.21Å; D162-K165 PolarHBondContact O-N 3.47Å; E163-K165 VanDerWaalsContact C-N 3.29Å; E163-K165 PolarHBondContact O-N 2.9Å; K165-R169 WeakPolarHBondContact O-CG 3.33Å; K165-R169 PolarHBondContact O-N 3Å; K165-R169 VanDerWaalsContact O-N 3.13Å
166K78.8Confident74.5Confident103 Ų10390.1 Ų90.145%0.44845%0.447SS..Hα-helixtrans-64.7-43.9174.6-74.1171.1-173.4172.20110.5D162 E163 E168 R169 Q170D162-K166 WeakPolarHBondContact O-CG 3.39Å; D162-K166 PolarHBondContact O-N 3.21Å; E163-K166 WeakPolarHBondContact O-CB 3.49Å; E163-K166 PolarHBondContact O-N 3Å; E163-K166 VanDerWaalsContact O-N 3.08Å; E163-K166 IonicContact OE1-NZ 3.93Å; E163-K166 PolarHBondContact OE1-NZ 3.05Å; E163-K166 IonicContact OE2-NZ 2.85Å; K166-E168 VanDerWaalsContact C-N 3.34Å; K166-E168 PolarHBondContact O-N 3.36Å; K166-R169 PolarHBondContact O-N 3.41Å; K166-Q170 WeakPolarHBondContact O-CB 3.38Å; K166-Q170 WeakPolarHBondContact O-CG 3.14Å; K166-Q170 PolarHBondContact O-N 3.48Å
167V70.5Confident72.8Confident40 Ų4092.2 Ų92.224%0.24245%0.453CS..Hα-helixtrans-60.8-44.2177.3174.10000111A108 E163 A164 R169 Q170 L171A108-V167 HydrophobicContact CB-CG1 4.02Å; E163-V167 WeakPolarHBondContact O-CG2 3.19Å; E163-V167 PolarHBondContact O-N 2.59Å; A164-V167 PolarHBondContact O-N 2.91Å; V167-R169 VanDerWaalsContact C-N 3.33Å; V167-R169 PolarHBondContact O-N 2.91Å; V167-Q170 PolarHBondContact O-N 2.97Å; V167-L171 PolarHBondContact O-N 3.5Å
168E68.4Low71.1Confident107 Ų10795.3 Ų95.350%0.547%0.47SS..Hα-helixtrans-59.2-42.4176.2-171.9-174.7-17900112.3A164 K166 L171A164-E168 PolarHBondContact O-N 3.43Å; K166-E168 VanDerWaalsContact C-N 3.34Å; K166-E168 PolarHBondContact O-N 3.36Å; E168-L171 WeakPolarHBondContact O-CB 3.42Å; E168-L171 WeakPolarHBondContact O-CG 3.21Å; E168-L171 PolarHBondContact O-N 2.93Å
169R68.4Low69.1Low219 Ų219101.7 Ų101.783%0.82650%0.497SS*.Hα-helixtrans-72.8-26.4177.9-69.9177.3-179-150.2-0.1113.8K165 K166 V167 L171K165-R169 WeakPolarHBondContact O-CG 3.33Å; K165-R169 PolarHBondContact O-N 3Å; K165-R169 VanDerWaalsContact O-N 3.13Å; K166-R169 PolarHBondContact O-N 3.41Å; V167-R169 VanDerWaalsContact C-N 3.33Å; V167-R169 PolarHBondContact O-N 2.91Å; R169-L171 VanDerWaalsContact C-N 3.27Å
170Q66.1Low67Low156 Ų156102.9 Ų102.973%0.72952%0.515SS*.Hα-helixtrans-81.8-5.8176.2-74.5-177.420.200112.8K166 V167K166-Q170 WeakPolarHBondContact O-CB 3.38Å; K166-Q170 WeakPolarHBondContact O-CG 3.14Å; K166-Q170 PolarHBondContact O-N 3.48Å; V167-Q170 PolarHBondContact O-N 2.97Å
171L64.5Low65.5Low38 Ų38104.3 Ų104.320%0.19953%0.53CS..SBendtrans-53.9131.1175.2-72.2174.1000109.6A108 V167 E168 R169 I173 M175A108-L171 HydrophobicContact CB-CD2 3.82Å; V167-L171 PolarHBondContact O-N 3.5Å; E168-L171 WeakPolarHBondContact O-CB 3.42Å; E168-L171 WeakPolarHBondContact O-CG 3.21Å; E168-L171 PolarHBondContact O-N 2.93Å; R169-L171 VanDerWaalsContact C-N 3.27Å; L171-I173 PolarHBondContact O-N 3.08Å; L171-M175 HydrophobicContact CB-SD 4.26Å; L171-M175 HydrophobicContact CD1-SD 4.38Å; L171-M175 HydrophobicContact CD2-SD 3.94Å; L171-M175 HydrophobicContact CG-SD 4.42Å
172P62.7Low63.7Low76 Ų76107.8 Ų107.849%0.49456%0.56SS.*  trans-51.5133.3-177.6-2834.6000110.9T174 M175P172-T174 WeakPolarHBondContact CB-OG1 3.49Å; P172-T174 PolarHBondContact O-N 3.39Å; P172-M175 PolarHBondContact O-N 2.89Å
173I64.9Low61.8Low132 Ų132111 Ų11168%0.67758%0.584SS**G310 helixtrans-49.8-26.6175.4-67.6168.7000111.3L171 M175 F176 L177L171-I173 PolarHBondContact O-N 3.08Å; I173-M175 PolarHBondContact O-N 2.98Å; I173-F176 PolarHBondContact O-N 3.45Å; I173-L177 HydrophobicContact CG2-CD1 4.28Å; I173-L177 HydrophobicContact CG2-CG 4.41Å; I173-L177 PolarHBondContact O-N 2.95Å
174T65.1Low59.9Low94 Ų94111 Ų11158%0.57760%0.601SS**G310 helixtrans-56.2-28.917560.40000113.6P172 F176 L177 N178P172-T174 WeakPolarHBondContact CB-OG1 3.49Å; P172-T174 PolarHBondContact O-N 3.39Å; T174-F176 VanDerWaalsContact C-N 3.28Å; T174-F176 PolarHBondContact O-N 3.15Å; T174-L177 PolarHBondContact O-N 3.41Å; T174-N178 PolarHBondContact O-ND2 3.37Å; T174-N178 PolarHBondContact O-OD1 3.44Å
175M62.8Low58.4Low111 Ų111118.6 Ų118.655%0.54763%0.633SS.*G310 helixtrans-67.1-28.5174-70.4-171.165.600112.8L171 P172 I173L171-M175 HydrophobicContact CB-SD 4.26Å; L171-M175 HydrophobicContact CD1-SD 4.38Å; L171-M175 HydrophobicContact CD2-SD 3.94Å; L171-M175 HydrophobicContact CG-SD 4.42Å; P172-M175 PolarHBondContact O-N 2.89Å; I173-M175 PolarHBondContact O-N 2.98Å
176F59.5Low56.6Low163 Ų163121.2 Ų121.272%0.71565%0.651SS**THydrogen-bonded Turntrans-85.8-13.3177.8-66.3-79.5000113.6I173 T174I173-F176 PolarHBondContact O-N 3.45Å; T174-F176 VanDerWaalsContact C-N 3.28Å; T174-F176 PolarHBondContact O-N 3.15Å
177L55.9Low54.6Low130 Ų130123.5 Ų123.568%0.68167%0.668SS**THydrogen-bonded Turntrans-94.811.9178.9-65.3178.9000114I173 T174 K179I173-L177 HydrophobicContact CG2-CD1 4.28Å; I173-L177 HydrophobicContact CG2-CG 4.41Å; I173-L177 PolarHBondContact O-N 2.95Å; T174-L177 PolarHBondContact O-N 3.41Å; L177-K179 PolarHBondContact O-N 2.94Å
178N49.1Very low53.1Low129 Ų129127.7 Ų127.769%0.6969%0.688SS**  trans-90.571.4-179.9-66.9-30.2000112.7T174T174-N178 PolarHBondContact O-ND2 3.37Å; T174-N178 PolarHBondContact O-OD1 3.44Å
179K47.9Very low51.5Low194 Ų194127.3 Ų127.384%0.84370%0.697SS**  trans177.184141.8-114.2175.9172.7176.80108.7L177 P181L177-K179 PolarHBondContact O-N 2.94Å; K179-P181 WeakPolarHBondContact O-CD 3.41Å
180A44.7Very low49.9Very low90 Ų90127.3 Ų127.374%0.74470%0.697SS**PPolyproline II helixtrans-64.5121.3149.800000106.3A182A180-A182 PolarHBondContact O-N 3.46Å
181P49Very low48.6Very low118 Ų118130.2 Ų130.277%0.76670%0.701SS**PPolyproline II helixtrans-57.9127.6170.5-15.828.7000107.1K179K179-P181 WeakPolarHBondContact O-CD 3.41Å
182A42.9Very low47.4Very low86 Ų86137 Ų13771%0.71173%0.731SS**PPolyproline II helixtrans-46.1136.1173.300000109.3A180 A184A180-A182 PolarHBondContact O-N 3.46Å; A182-A184 VanDerWaalsContact C-N 3.34Å; A182-A184 PolarHBondContact O-N 2.89Å
183P46.2Very low46.1Very low125 Ų125142.6 Ų142.681%0.81275%0.749SS**  trans-6892.9-173.327.4-33000109.4E185P183-E185 VanDerWaalsContact C-N 3.3Å; P183-E185 PolarHBondContact O-N 3.34Å; P183-E185 VanDerWaalsContact O-N 3.07Å
184A42Very low44.7Very low97 Ų97141.8 Ų141.880%0.80276%0.755SS**  trans-68.2101.5154.200000105.8A182 L186A182-A184 VanDerWaalsContact C-N 3.34Å; A182-A184 PolarHBondContact O-N 2.89Å; A184-L186 PolarHBondContact O-N 3.38Å
185E43.4Very low43.1Very low180 Ų180144.9 Ų144.984%0.84177%0.767SS**  trans8.4108.8165-63.2-175.7151.300115.6P183 N187P183-E185 VanDerWaalsContact C-N 3.3Å; P183-E185 PolarHBondContact O-N 3.34Å; P183-E185 VanDerWaalsContact O-N 3.07Å; E185-N187 VanDerWaalsContact C-N 3.28Å; E185-N187 PolarHBondContact O-N 3.44Å
186L35.1Very low41.7Very low157 Ų157145.3 Ų145.382%0.82278%0.778SS**  trans-50.384.6166-87.9161.1000111.4A184 I188A184-L186 PolarHBondContact O-N 3.38Å; L186-I188 VanDerWaalsContact C-N 3.31Å; L186-I188 HydrophobicContact CB-CG1 4.17Å; L186-I188 HydrophobicContact CD2-CD1 4.35Å; L186-I188 HydrophobicContact CD2-CG1 3.88Å; L186-I188 PolarHBondContact O-N 3.3Å
187N37.9Very low40.6Very low151 Ų151145.1 Ų145.181%0.80778%0.783SS**  trans-86.585.1157.9-154.8-28.2000107.8E185 S189E185-N187 VanDerWaalsContact C-N 3.28Å; E185-N187 PolarHBondContact O-N 3.44Å; N187-S189 PolarHBondContact O-N 3.35Å
188I38Very low39.6Very low129 Ų129144 Ų14466%0.66279%0.785SS**  trans-64.282.1176.4-58.5168.8000107.9L186 R190L186-I188 VanDerWaalsContact C-N 3.31Å; L186-I188 HydrophobicContact CB-CG1 4.17Å; L186-I188 HydrophobicContact CD2-CD1 4.35Å; L186-I188 HydrophobicContact CD2-CG1 3.88Å; L186-I188 PolarHBondContact O-N 3.3Å; I188-R190 VanDerWaalsContact C-N 3.29Å; I188-R190 PolarHBondContact O-N 2.95Å
189S36.4Very low39Very low98 Ų98142.2 Ų142.269%0.68578%0.783SS**  trans-85.385160.7-1560000107.6N187 R191N187-S189 PolarHBondContact O-N 3.35Å; S189-R191 VanDerWaalsContact C-N 3.35Å; S189-R191 PolarHBondContact O-N 2.84Å
190R34.3Very low38.5Very low220 Ų220143.5 Ų143.583%0.8378%0.783SS**  trans-48.995.2168.2177.8-168.5-104.3-176.4-5.6109.1I188I188-R190 VanDerWaalsContact C-N 3.29Å; I188-R190 PolarHBondContact O-N 2.95Å
191R38Very low38.1Very low217 Ų217145.2 Ų145.282%0.81978%0.779SS**  trans-117.8101.9159.4-80.9-172.5176.3-177.6-0.1108.1S189 F193S189-R191 VanDerWaalsContact C-N 3.35Å; S189-R191 PolarHBondContact O-N 2.84Å; R191-F193 PolarHBondContact O-N 3.17Å
192Q39.4Very low37.3Very low179 Ų179147.6 Ų147.684%0.83679%0.785SS**  trans-55116.1165.7-74.3169-39.600108.7
193F36.3Very low37Very low195 Ų195150 Ų15086%0.85579%0.791SS**  trans-135.2116.6155.8-94.4-83.8000108R191R191-F193 PolarHBondContact O-N 3.17Å
194S34.7Very low36.6Very low115 Ų115150 Ų15080%0.80479%0.789SS**  trans-60.7137.1-170.3-52.10000112.8
195L32.6Very low36.1Very low158 Ų158148.4 Ų148.483%0.82778%0.782SS**  trans-61.3127.4170.1-68.8163.4000110.6I197L195-I197 PolarHBondContact O-N 3.26Å
196P33.4Very low35.6Very low121 Ų121151.7 Ų151.779%0.78679%0.787SS**  trans-80.4104.3157.623.1-12.6000108.2S198P196-S198 PolarHBondContact O-N 2.64Å
197I36Very low35.9Very low158 Ų158150.1 Ų150.181%0.8179%0.789SS**  trans-64.698.3166.4-56.7167.9000106.8L195L195-I197 PolarHBondContact O-N 3.26Å
198S34.1Very low35.8Very low106 Ų106150.9 Ų150.974%0.74179%0.792SS**  trans-105.974.6168.9-175.40000109.7P196P196-S198 PolarHBondContact O-N 2.64Å
199S37.6Very low36Very low92 Ų92147.7 Ų147.764%0.64379%0.792SS**  trans-80.1106.7159.5-179.80000108.2
200R35.9Very low36.1Very low221 Ų221149.8 Ų149.883%0.83480%0.795SS**  trans-137.688.3160.5-74.6-171.7-174.3163.52.5106.8
201N36.8Very low36.1Very low126 Ų126146.2 Ų146.267%0.67479%0.792SS**  91.9100.788.5-79.6-35.9000110.8T203N201-T203 PolarHBondContact O-N 3.25Å; N201-T203 VanDerWaalsContact O-N 3.12Å
202L31.9Very low36.3Very low169 Ų169146.4 Ų146.489%0.88579%0.792SS**  trans-50.9101.7151.3-76.8141.5000108.9T204L202-T204 PolarHBondContact O-N 2.94Å
203T37.1Very low36.4Very low137 Ų137145.7 Ų145.784%0.8479%0.794SS**  trans-8690.8164.2-61.90000108.3N201N201-T203 PolarHBondContact O-N 3.25Å; N201-T203 VanDerWaalsContact O-N 3.12Å
204T37Very low37Very low123 Ų123141.8 Ų141.876%0.75579%0.787SS**  trans-48.5124.6161.5-60.40000112L202L202-T204 PolarHBondContact O-N 2.94Å
205G33.1Very low37.8Very low65 Ų65146.3 Ų146.367%0.6781%0.81SS**  69.2139.4117.300000120.3
206R32.6Very low38Very low248 Ų248145.7 Ų145.794%0.93681%0.81SS**  trans78.6109.4163.7-76.5-175.3170.1-163.9-2.8117.5
207S41.9Very low38.3Very low124 Ų124147 Ų14787%0.86781%0.811SS**  -146.175.8125.5-169.40000109.4
208L35.9Very low38.4Very low167 Ų167146.4 Ų146.487%0.87481%0.811SS**  trans-9894.3153.5-171.9117.7000104.9
209G40.4Very low38.6Very low63 Ų63148.8 Ų148.865%0.64982%0.815SS**  trans-135.497.8176.400000107.2
210D39.1Very low38.7Very low141 Ų141152.3 Ų152.375%0.75483%0.826SS**  trans-43.6141.7155.6-71-55.1000109.9
211L35.4Very low38.9Very low146 Ų146147.7 Ų147.776%0.76483%0.825SS**  161.5125.6118.5-85.8158.5000112.3
212R40.1Very low39Very low220 Ų220149.3 Ų149.383%0.8384%0.836SS**  trans95.7116.6141.7-72.8176.4175.7151.80.6120.2
213L43.1Very low39.6Very low165 Ų165147.8 Ų147.886%0.86483%0.832SS**  trans-33.6148.1143.8-85.6150.1000113.9
214P48.2Very low39.8Very low112 Ų112148.7 Ų148.773%0.72783%0.832SS**  -139.1130.112832.6-16.1000113.7
215T50.7Low40.1Very low210 Ų210151 Ų151100%1.28884%0.839SS**  trans74.70155.9-2.70000119.2

Retrieved 215 of 215 residues in 1268.4 ms (Link to these results)